USER MOD reduce.3.24.130724 H: found=0, std=0, add=1818, rem=0, adj=68 USER MOD reduce.3.24.130724 removed 1828 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 55 LYS NZ :NH3+ -116:sc= 0.343 (180deg=0.00411) USER MOD Set 1.2: Y 105 HIS : no HD1:sc= -3.89 K(o=-5.6,f=-13!) USER MOD Set 1.3: Y 109 MET CE :methyl -179:sc= -2.06 (180deg=0) USER MOD Set 2.1: A 55 LYS NZ :NH3+ -122:sc= 0.729 (180deg=0.0525) USER MOD Set 2.2: X 105 HIS : no HD1:sc= -3.04 K(o=-4.3,f=-12!) USER MOD Set 2.3: X 109 MET CE :methyl 177:sc= -2 (180deg=0) USER MOD Set 3.1: A 15 HIS : no HD1:sc= 0.896 K(o=0.14,f=-8.3!) USER MOD Set 3.2: B 85 HIS : no HE2:sc= -0.753 K(o=0.14,f=-3.7) USER MOD Set 4.1: B 41 SER OG : rot 88:sc= 0.454 USER MOD Set 4.2: B 42 HIS : no HD1:sc= 0.414 K(o=0.87,f=-0.97) USER MOD Set 5.1: B 17 TYR OH : rot -29:sc= -0.337 USER MOD Set 5.2: B 38 ASN : amide:sc= -0.0217 X(o=-0.36,f=-0.55) USER MOD Set 6.1: B 33 LYS NZ :NH3+ -110:sc= 0.698 (180deg=-0.000296) USER MOD Set 6.2: B 50 GLN : amide:sc= -3.46! C(o=-2.8!,f=-18!) USER MOD Set 7.1: B 28 LYS NZ :NH3+ 158:sc= -0.0907 (180deg=-0.758) USER MOD Set 7.2: B 29 LYS NZ :NH3+ -128:sc= -0.111 (180deg=-0.991) USER MOD Set 8.1: A 85 HIS : no HE2:sc= -1.71 K(o=-1,f=-5) USER MOD Set 8.2: B 15 HIS : no HD1:sc= 0.684 K(o=-1,f=-11!) USER MOD Set 9.1: A 81 THR OG1 : rot 111:sc= 0.84 USER MOD Set 9.2: B 7 MET CE :methyl 153:sc= -0.25 (180deg=-1.7!) USER MOD Set10.1: A 78 SER OG : rot 17:sc= 0.0487 USER MOD Set10.2: B 78 SER OG : rot 14:sc= 0.201 USER MOD Set11.1: A 41 SER OG : rot 89:sc= 0.429 USER MOD Set11.2: A 42 HIS : no HD1:sc= 0.387 K(o=0.82,f=-0.86) USER MOD Set12.1: A 33 LYS NZ :NH3+ -110:sc= 0.545 (180deg=0) USER MOD Set12.2: A 50 GLN : amide:sc= -3.47! C(o=-2.9!,f=-19!) USER MOD Set13.1: A 28 LYS NZ :NH3+ 158:sc= -0.161 (180deg=-0.87) USER MOD Set13.2: A 29 LYS NZ :NH3+ -129:sc= -0.0379 (180deg=-0.788) USER MOD Set14.1: A 17 TYR OH : rot -17:sc= -0.373 USER MOD Set14.2: A 38 ASN : amide:sc= 0.0444 X(o=-0.33,f=-0.53) USER MOD Set15.1: A 7 MET CE :methyl 154:sc= -0.224 (180deg=-1.88!) USER MOD Set15.2: B 81 THR OG1 : rot 114:sc= 0.739 USER MOD Single : A 0 MET CE :methyl -162:sc= -0.0158 (180deg=-0.407) USER MOD Single : A 0 MET N :NH3+ -160:sc= 0 (180deg=-0.534) USER MOD Single : A 1 SER OG : rot -36:sc= 1.17 USER MOD Single : A 5 LYS NZ :NH3+ -133:sc= -0.956 (180deg=-2.9!) USER MOD Single : A 16 GLN : amide:sc= 0.955 K(o=0.96,f=-9.6!) USER MOD Single : A 18 SER OG : rot -168:sc= 0.31! USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 HIS : no HD1:sc= -0.54 X(o=-0.54,f=-0.52) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 37 ASN :FLIP amide:sc= -6.01! C(o=-9.2!,f=-6!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 MET CE :methyl -108:sc= -4.46! (180deg=-8.96!) USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 CYS SG : rot 150:sc= -2.13 USER MOD Single : A 71 GLN : amide:sc= 0.159 K(o=0.16,f=-2.1!) USER MOD Single : A 74 MET CE :methyl 148:sc= -2.66 (180deg=-4.16) USER MOD Single : A 79 MET CE :methyl 158:sc= -0.126 (180deg=-1.19) USER MOD Single : A 82 THR OG1 : rot -18:sc= -0.139! USER MOD Single : A 84 CYS SG : rot 180:sc= -0.345 USER MOD Single : A 90 HIS : no HD1:sc=-0.00526 X(o=-0.0053,f=-0.24) USER MOD Single : B 0 MET CE :methyl -161:sc= -0.0383 (180deg=-0.469) USER MOD Single : B 0 MET N :NH3+ -160:sc= 0 (180deg=-0.533) USER MOD Single : B 1 SER OG : rot -39:sc= 1.13 USER MOD Single : B 5 LYS NZ :NH3+ -130:sc= -1 (180deg=-2.96!) USER MOD Single : B 16 GLN : amide:sc= 0.83 K(o=0.83,f=-9.3!) USER MOD Single : B 18 SER OG : rot -162:sc= 0.23 USER MOD Single : B 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 25 HIS : no HD1:sc= -0.438 X(o=-0.44,f=-0.44) USER MOD Single : B 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 30 SER OG : rot 180:sc= 0 USER MOD Single : B 37 ASN :FLIP amide:sc= -6.02! C(o=-9.3!,f=-6!) USER MOD Single : B 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 57 MET CE :methyl 134:sc= -4.32! (180deg=-8.76!) USER MOD Single : B 59 THR OG1 : rot 180:sc= 0 USER MOD Single : B 68 CYS SG : rot 150:sc= -1.98 USER MOD Single : B 71 GLN : amide:sc= 0.863 K(o=0.86,f=-2.1!) USER MOD Single : B 74 MET CE :methyl 149:sc= -3.07 (180deg=-4.38) USER MOD Single : B 79 MET CE :methyl 155:sc= -0.217 (180deg=-1.21) USER MOD Single : B 82 THR OG1 : rot -33:sc= -0.105! USER MOD Single : B 84 CYS SG : rot 180:sc= -0.0863 USER MOD Single : B 90 HIS : no HD1:sc=-0.00202 X(o=-0.002,f=-0.18) USER MOD Single : X 92 SER OG : rot 32:sc= 0.101 USER MOD Single : X 93 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : X 95 LYS NZ :NH3+ 161:sc= -0.0219 (180deg=-0.447) USER MOD Single : X 96 SER OG : rot 45:sc= 0.294! USER MOD Single : X 97 LYS NZ :NH3+ -163:sc= -0.0308 (180deg=-0.408) USER MOD Single : X 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : X 100 GLN : amide:sc= -0.196 K(o=-0.2,f=-0.88) USER MOD Single : X 101 SER OG : rot 180:sc= 0 USER MOD Single : X 102 THR OG1 : rot 180:sc= 0 USER MOD Single : X 103 SER OG : rot 81:sc= 0.0928 USER MOD Single : X 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : X 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : X 111 LYS NZ :NH3+ -139:sc= -3.27! (180deg=-5.98!) USER MOD Single : X 112 THR OG1 : rot -34:sc= 0.563 USER MOD Single : Y 92 SER OG : rot 35:sc= 0.124 USER MOD Single : Y 93 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : Y 95 LYS NZ :NH3+ 163:sc= -0.0337 (180deg=-0.355) USER MOD Single : Y 96 SER OG : rot 180:sc= 0.494! USER MOD Single : Y 97 LYS NZ :NH3+ -162:sc= -0.0527 (180deg=-0.479) USER MOD Single : Y 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : Y 100 GLN : amide:sc= -0.205 K(o=-0.21,f=-0.88) USER MOD Single : Y 101 SER OG : rot -140:sc= 0 USER MOD Single : Y 102 THR OG1 : rot 180:sc= 0 USER MOD Single : Y 103 SER OG : rot 82:sc= 0.0909 USER MOD Single : Y 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : Y 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : Y 111 LYS NZ :NH3+ -130:sc= -3.76! (180deg=-6.27!) USER MOD Single : Y 112 THR OG1 : rot -25:sc= 0.686 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 0 -0.880 -1.848 -12.269 1.00 0.00 N ATOM 2 CA MET A 0 -1.625 -2.136 -13.527 1.00 0.00 C ATOM 3 C MET A 0 -2.741 -1.108 -13.715 1.00 0.00 C ATOM 4 O MET A 0 -3.812 -1.233 -13.157 1.00 0.00 O ATOM 5 CB MET A 0 -2.244 -3.533 -13.450 1.00 0.00 C ATOM 6 CG MET A 0 -2.815 -3.910 -14.821 1.00 0.00 C ATOM 7 SD MET A 0 -3.686 -5.496 -14.710 1.00 0.00 S ATOM 8 CE MET A 0 -2.243 -6.580 -14.549 1.00 0.00 C ATOM 0 H1 MET A 0 0.053 -2.306 -12.306 1.00 0.00 H new ATOM 0 H2 MET A 0 -0.758 -0.820 -12.165 1.00 0.00 H new ATOM 0 H3 MET A 0 -1.415 -2.217 -11.457 1.00 0.00 H new ATOM 0 HA MET A 0 -0.933 -2.084 -14.368 1.00 0.00 H new ATOM 0 HB2 MET A 0 -1.492 -4.260 -13.144 1.00 0.00 H new ATOM 0 HB3 MET A 0 -3.032 -3.553 -12.697 1.00 0.00 H new ATOM 0 HG2 MET A 0 -3.497 -3.134 -15.167 1.00 0.00 H new ATOM 0 HG3 MET A 0 -2.011 -3.977 -15.554 1.00 0.00 H new ATOM 0 HE1 MET A 0 -2.530 -7.605 -14.785 1.00 0.00 H new ATOM 0 HE2 MET A 0 -1.464 -6.253 -15.238 1.00 0.00 H new ATOM 0 HE3 MET A 0 -1.866 -6.535 -13.527 1.00 0.00 H new ATOM 20 N SER A 1 -2.508 -0.097 -14.505 1.00 0.00 N ATOM 21 CA SER A 1 -3.572 0.924 -14.731 1.00 0.00 C ATOM 22 C SER A 1 -4.128 1.396 -13.387 1.00 0.00 C ATOM 23 O SER A 1 -5.212 1.937 -13.301 1.00 0.00 O ATOM 24 CB SER A 1 -4.694 0.313 -15.572 1.00 0.00 C ATOM 25 OG SER A 1 -5.707 1.287 -15.786 1.00 0.00 O ATOM 0 H SER A 1 -1.632 0.067 -15.002 1.00 0.00 H new ATOM 0 HA SER A 1 -3.149 1.778 -15.260 1.00 0.00 H new ATOM 0 HB2 SER A 1 -4.300 -0.034 -16.527 1.00 0.00 H new ATOM 0 HB3 SER A 1 -5.112 -0.557 -15.065 1.00 0.00 H new ATOM 0 HG SER A 1 -5.803 1.841 -14.983 1.00 0.00 H new ATOM 31 N GLU A 2 -3.382 1.195 -12.344 1.00 0.00 N ATOM 32 CA GLU A 2 -3.825 1.624 -10.988 1.00 0.00 C ATOM 33 C GLU A 2 -3.714 3.139 -10.864 1.00 0.00 C ATOM 34 O GLU A 2 -4.100 3.724 -9.872 1.00 0.00 O ATOM 35 CB GLU A 2 -2.938 0.950 -9.949 1.00 0.00 C ATOM 36 CG GLU A 2 -3.269 -0.536 -9.932 1.00 0.00 C ATOM 37 CD GLU A 2 -2.399 -1.250 -8.899 1.00 0.00 C ATOM 38 OE1 GLU A 2 -1.479 -0.626 -8.396 1.00 0.00 O ATOM 39 OE2 GLU A 2 -2.667 -2.409 -8.627 1.00 0.00 O ATOM 0 H GLU A 2 -2.468 0.744 -12.371 1.00 0.00 H new ATOM 0 HA GLU A 2 -4.864 1.336 -10.828 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -1.886 1.102 -10.191 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -3.105 1.388 -8.965 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -4.323 -0.680 -9.695 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -3.103 -0.966 -10.920 1.00 0.00 H new ATOM 46 N LEU A 3 -3.165 3.772 -11.857 1.00 0.00 N ATOM 47 CA LEU A 3 -2.991 5.251 -11.808 1.00 0.00 C ATOM 48 C LEU A 3 -4.260 5.920 -11.276 1.00 0.00 C ATOM 49 O LEU A 3 -4.210 7.010 -10.757 1.00 0.00 O ATOM 50 CB LEU A 3 -2.692 5.778 -13.219 1.00 0.00 C ATOM 51 CG LEU A 3 -2.489 7.305 -13.191 1.00 0.00 C ATOM 52 CD1 LEU A 3 -1.292 7.652 -12.290 1.00 0.00 C ATOM 53 CD2 LEU A 3 -2.237 7.817 -14.622 1.00 0.00 C ATOM 0 H LEU A 3 -2.825 3.327 -12.710 1.00 0.00 H new ATOM 0 HA LEU A 3 -2.161 5.485 -11.141 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -1.799 5.293 -13.613 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -3.514 5.526 -13.890 1.00 0.00 H new ATOM 0 HG LEU A 3 -3.384 7.783 -12.792 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -1.151 8.733 -12.272 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -1.483 7.294 -11.278 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -0.393 7.175 -12.680 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -2.093 8.897 -14.602 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -1.345 7.340 -15.027 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -3.094 7.577 -15.251 1.00 0.00 H new ATOM 65 N GLU A 4 -5.395 5.298 -11.399 1.00 0.00 N ATOM 66 CA GLU A 4 -6.635 5.951 -10.881 1.00 0.00 C ATOM 67 C GLU A 4 -6.560 6.025 -9.356 1.00 0.00 C ATOM 68 O GLU A 4 -6.930 7.010 -8.748 1.00 0.00 O ATOM 69 CB GLU A 4 -7.859 5.134 -11.312 1.00 0.00 C ATOM 70 CG GLU A 4 -9.137 5.813 -10.817 1.00 0.00 C ATOM 71 CD GLU A 4 -10.356 5.066 -11.363 1.00 0.00 C ATOM 72 OE1 GLU A 4 -10.168 4.193 -12.195 1.00 0.00 O ATOM 73 OE2 GLU A 4 -11.457 5.381 -10.942 1.00 0.00 O ATOM 0 H GLU A 4 -5.523 4.381 -11.827 1.00 0.00 H new ATOM 0 HA GLU A 4 -6.723 6.959 -11.286 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -7.882 5.043 -12.398 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -7.794 4.124 -10.908 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -9.159 5.820 -9.727 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -9.159 6.853 -11.143 1.00 0.00 H new ATOM 80 N LYS A 5 -6.068 4.992 -8.740 1.00 0.00 N ATOM 81 CA LYS A 5 -5.941 4.982 -7.256 1.00 0.00 C ATOM 82 C LYS A 5 -4.843 5.948 -6.819 1.00 0.00 C ATOM 83 O LYS A 5 -4.961 6.623 -5.823 1.00 0.00 O ATOM 84 CB LYS A 5 -5.577 3.573 -6.806 1.00 0.00 C ATOM 85 CG LYS A 5 -6.775 2.645 -7.014 1.00 0.00 C ATOM 86 CD LYS A 5 -6.409 1.227 -6.562 1.00 0.00 C ATOM 87 CE LYS A 5 -5.271 0.676 -7.437 1.00 0.00 C ATOM 88 NZ LYS A 5 -5.341 -0.811 -7.462 1.00 0.00 N ATOM 0 H LYS A 5 -5.744 4.143 -9.204 1.00 0.00 H new ATOM 0 HA LYS A 5 -6.885 5.291 -6.808 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -4.719 3.209 -7.372 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -5.286 3.579 -5.755 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -7.632 3.008 -6.448 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -7.066 2.639 -8.064 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -6.103 1.237 -5.516 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -7.281 0.577 -6.633 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -5.352 1.072 -8.449 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -4.307 0.999 -7.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -4.394 -1.206 -7.292 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -5.991 -1.140 -6.720 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -5.687 -1.127 -8.391 1.00 0.00 H new ATOM 102 N ALA A 6 -3.760 5.989 -7.543 1.00 0.00 N ATOM 103 CA ALA A 6 -2.633 6.884 -7.158 1.00 0.00 C ATOM 104 C ALA A 6 -3.041 8.350 -7.250 1.00 0.00 C ATOM 105 O ALA A 6 -2.672 9.149 -6.424 1.00 0.00 O ATOM 106 CB ALA A 6 -1.437 6.627 -8.076 1.00 0.00 C ATOM 0 H ALA A 6 -3.606 5.439 -8.388 1.00 0.00 H new ATOM 0 HA ALA A 6 -2.361 6.667 -6.125 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -0.614 7.283 -7.793 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -1.122 5.588 -7.981 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -1.722 6.827 -9.109 1.00 0.00 H new ATOM 112 N MET A 7 -3.780 8.715 -8.248 1.00 0.00 N ATOM 113 CA MET A 7 -4.198 10.134 -8.380 1.00 0.00 C ATOM 114 C MET A 7 -5.147 10.504 -7.251 1.00 0.00 C ATOM 115 O MET A 7 -5.092 11.589 -6.706 1.00 0.00 O ATOM 116 CB MET A 7 -4.882 10.350 -9.735 1.00 0.00 C ATOM 117 CG MET A 7 -3.840 10.272 -10.853 1.00 0.00 C ATOM 118 SD MET A 7 -4.588 10.790 -12.418 1.00 0.00 S ATOM 119 CE MET A 7 -3.047 11.190 -13.280 1.00 0.00 C ATOM 0 H MET A 7 -4.116 8.092 -8.983 1.00 0.00 H new ATOM 0 HA MET A 7 -3.316 10.772 -8.321 1.00 0.00 H new ATOM 0 HB2 MET A 7 -5.653 9.595 -9.889 1.00 0.00 H new ATOM 0 HB3 MET A 7 -5.378 11.320 -9.753 1.00 0.00 H new ATOM 0 HG2 MET A 7 -2.989 10.911 -10.616 1.00 0.00 H new ATOM 0 HG3 MET A 7 -3.460 9.254 -10.939 1.00 0.00 H new ATOM 0 HE1 MET A 7 -3.194 11.088 -14.355 1.00 0.00 H new ATOM 0 HE2 MET A 7 -2.756 12.215 -13.049 1.00 0.00 H new ATOM 0 HE3 MET A 7 -2.261 10.508 -12.955 1.00 0.00 H new ATOM 129 N VAL A 8 -6.026 9.620 -6.907 1.00 0.00 N ATOM 130 CA VAL A 8 -6.995 9.928 -5.820 1.00 0.00 C ATOM 131 C VAL A 8 -6.258 10.091 -4.480 1.00 0.00 C ATOM 132 O VAL A 8 -6.594 10.936 -3.674 1.00 0.00 O ATOM 133 CB VAL A 8 -8.022 8.797 -5.719 1.00 0.00 C ATOM 134 CG1 VAL A 8 -8.903 9.006 -4.483 1.00 0.00 C ATOM 135 CG2 VAL A 8 -8.895 8.796 -6.979 1.00 0.00 C ATOM 0 H VAL A 8 -6.121 8.696 -7.327 1.00 0.00 H new ATOM 0 HA VAL A 8 -7.506 10.863 -6.050 1.00 0.00 H new ATOM 0 HB VAL A 8 -7.505 7.842 -5.630 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -9.632 8.199 -4.415 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -8.280 9.008 -3.588 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -9.424 9.960 -4.565 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -9.628 7.992 -6.913 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -9.411 9.752 -7.065 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -8.267 8.643 -7.857 1.00 0.00 H new ATOM 145 N ALA A 9 -5.279 9.266 -4.230 1.00 0.00 N ATOM 146 CA ALA A 9 -4.532 9.334 -2.931 1.00 0.00 C ATOM 147 C ALA A 9 -3.616 10.558 -2.877 1.00 0.00 C ATOM 148 O ALA A 9 -3.433 11.161 -1.839 1.00 0.00 O ATOM 149 CB ALA A 9 -3.693 8.068 -2.763 1.00 0.00 C ATOM 0 H ALA A 9 -4.958 8.541 -4.871 1.00 0.00 H new ATOM 0 HA ALA A 9 -5.260 9.417 -2.124 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -3.149 8.115 -1.820 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -4.347 7.196 -2.762 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -2.984 7.989 -3.587 1.00 0.00 H new ATOM 155 N LEU A 10 -3.029 10.920 -3.975 1.00 0.00 N ATOM 156 CA LEU A 10 -2.115 12.091 -3.978 1.00 0.00 C ATOM 157 C LEU A 10 -2.929 13.303 -3.536 1.00 0.00 C ATOM 158 O LEU A 10 -2.481 14.141 -2.779 1.00 0.00 O ATOM 159 CB LEU A 10 -1.579 12.292 -5.413 1.00 0.00 C ATOM 160 CG LEU A 10 -0.122 12.798 -5.387 1.00 0.00 C ATOM 161 CD1 LEU A 10 0.836 11.605 -5.233 1.00 0.00 C ATOM 162 CD2 LEU A 10 0.191 13.543 -6.698 1.00 0.00 C ATOM 0 H LEU A 10 -3.142 10.455 -4.876 1.00 0.00 H new ATOM 0 HA LEU A 10 -1.269 11.947 -3.306 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -1.632 11.351 -5.961 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -2.208 13.007 -5.944 1.00 0.00 H new ATOM 0 HG LEU A 10 0.008 13.478 -4.545 1.00 0.00 H new ATOM 0 HD11 LEU A 10 1.865 11.965 -5.215 1.00 0.00 H new ATOM 0 HD12 LEU A 10 0.618 11.081 -4.302 1.00 0.00 H new ATOM 0 HD13 LEU A 10 0.705 10.922 -6.073 1.00 0.00 H new ATOM 0 HD21 LEU A 10 1.221 13.899 -6.677 1.00 0.00 H new ATOM 0 HD22 LEU A 10 0.058 12.866 -7.542 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -0.485 14.392 -6.804 1.00 0.00 H new ATOM 174 N ILE A 11 -4.135 13.372 -4.006 1.00 0.00 N ATOM 175 CA ILE A 11 -5.039 14.487 -3.641 1.00 0.00 C ATOM 176 C ILE A 11 -5.433 14.390 -2.158 1.00 0.00 C ATOM 177 O ILE A 11 -5.585 15.389 -1.485 1.00 0.00 O ATOM 178 CB ILE A 11 -6.284 14.421 -4.541 1.00 0.00 C ATOM 179 CG1 ILE A 11 -5.894 14.881 -5.959 1.00 0.00 C ATOM 180 CG2 ILE A 11 -7.402 15.311 -3.978 1.00 0.00 C ATOM 181 CD1 ILE A 11 -7.029 14.602 -6.955 1.00 0.00 C ATOM 0 H ILE A 11 -4.542 12.687 -4.643 1.00 0.00 H new ATOM 0 HA ILE A 11 -4.533 15.441 -3.789 1.00 0.00 H new ATOM 0 HB ILE A 11 -6.656 13.397 -4.576 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -5.666 15.947 -5.950 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -4.989 14.364 -6.278 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -8.276 15.252 -4.627 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -7.670 14.970 -2.978 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -7.055 16.343 -3.929 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -6.731 14.935 -7.949 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -7.238 13.532 -6.978 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -7.925 15.140 -6.646 1.00 0.00 H new ATOM 193 N ASP A 12 -5.633 13.202 -1.653 1.00 0.00 N ATOM 194 CA ASP A 12 -6.055 13.061 -0.226 1.00 0.00 C ATOM 195 C ASP A 12 -5.012 13.670 0.723 1.00 0.00 C ATOM 196 O ASP A 12 -5.346 14.400 1.635 1.00 0.00 O ATOM 197 CB ASP A 12 -6.218 11.577 0.100 1.00 0.00 C ATOM 198 CG ASP A 12 -6.650 11.417 1.559 1.00 0.00 C ATOM 199 OD1 ASP A 12 -5.891 11.810 2.428 1.00 0.00 O ATOM 200 OD2 ASP A 12 -7.735 10.905 1.781 1.00 0.00 O ATOM 0 H ASP A 12 -5.523 12.326 -2.163 1.00 0.00 H new ATOM 0 HA ASP A 12 -6.998 13.591 -0.090 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -6.960 11.128 -0.561 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -5.279 11.051 -0.072 1.00 0.00 H new ATOM 205 N VAL A 13 -3.758 13.371 0.530 1.00 0.00 N ATOM 206 CA VAL A 13 -2.707 13.931 1.439 1.00 0.00 C ATOM 207 C VAL A 13 -2.666 15.463 1.302 1.00 0.00 C ATOM 208 O VAL A 13 -2.490 16.176 2.267 1.00 0.00 O ATOM 209 CB VAL A 13 -1.332 13.273 1.101 1.00 0.00 C ATOM 210 CG1 VAL A 13 -0.264 14.318 0.741 1.00 0.00 C ATOM 211 CG2 VAL A 13 -0.825 12.467 2.306 1.00 0.00 C ATOM 0 H VAL A 13 -3.411 12.765 -0.214 1.00 0.00 H new ATOM 0 HA VAL A 13 -2.942 13.703 2.479 1.00 0.00 H new ATOM 0 HB VAL A 13 -1.494 12.625 0.239 1.00 0.00 H new ATOM 0 HG11 VAL A 13 0.676 13.814 0.513 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -0.591 14.887 -0.129 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -0.118 14.994 1.583 1.00 0.00 H new ATOM 0 HG21 VAL A 13 0.135 12.012 2.061 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -0.704 13.130 3.162 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -1.545 11.686 2.551 1.00 0.00 H new ATOM 221 N PHE A 14 -2.816 15.979 0.122 1.00 0.00 N ATOM 222 CA PHE A 14 -2.769 17.457 -0.024 1.00 0.00 C ATOM 223 C PHE A 14 -3.821 18.070 0.894 1.00 0.00 C ATOM 224 O PHE A 14 -3.592 19.078 1.521 1.00 0.00 O ATOM 225 CB PHE A 14 -3.065 17.854 -1.471 1.00 0.00 C ATOM 226 CG PHE A 14 -3.042 19.360 -1.592 1.00 0.00 C ATOM 227 CD1 PHE A 14 -4.174 20.103 -1.236 1.00 0.00 C ATOM 228 CD2 PHE A 14 -1.896 20.013 -2.062 1.00 0.00 C ATOM 229 CE1 PHE A 14 -4.160 21.498 -1.349 1.00 0.00 C ATOM 230 CE2 PHE A 14 -1.884 21.409 -2.175 1.00 0.00 C ATOM 231 CZ PHE A 14 -3.015 22.151 -1.818 1.00 0.00 C ATOM 0 H PHE A 14 -2.967 15.453 -0.739 1.00 0.00 H new ATOM 0 HA PHE A 14 -1.776 17.818 0.243 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -2.326 17.413 -2.139 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -4.039 17.468 -1.774 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -5.058 19.600 -0.874 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -1.022 19.441 -2.337 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -5.033 22.071 -1.074 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -1.001 21.913 -2.538 1.00 0.00 H new ATOM 0 HZ PHE A 14 -3.004 23.227 -1.904 1.00 0.00 H new ATOM 241 N HIS A 15 -4.970 17.467 0.982 1.00 0.00 N ATOM 242 CA HIS A 15 -6.031 18.014 1.870 1.00 0.00 C ATOM 243 C HIS A 15 -5.616 17.821 3.329 1.00 0.00 C ATOM 244 O HIS A 15 -6.106 18.490 4.217 1.00 0.00 O ATOM 245 CB HIS A 15 -7.344 17.265 1.622 1.00 0.00 C ATOM 246 CG HIS A 15 -7.897 17.624 0.269 1.00 0.00 C ATOM 247 ND1 HIS A 15 -8.535 16.689 -0.535 1.00 0.00 N ATOM 248 CD2 HIS A 15 -7.931 18.806 -0.431 1.00 0.00 C ATOM 249 CE1 HIS A 15 -8.923 17.318 -1.660 1.00 0.00 C ATOM 250 NE2 HIS A 15 -8.579 18.606 -1.645 1.00 0.00 N ATOM 0 H HIS A 15 -5.222 16.617 0.477 1.00 0.00 H new ATOM 0 HA HIS A 15 -6.168 19.075 1.659 1.00 0.00 H new ATOM 0 HB2 HIS A 15 -7.175 16.190 1.681 1.00 0.00 H new ATOM 0 HB3 HIS A 15 -8.067 17.517 2.398 1.00 0.00 H new ATOM 0 HD2 HIS A 15 -7.519 19.744 -0.091 1.00 0.00 H new ATOM 0 HE1 HIS A 15 -9.448 16.839 -2.473 1.00 0.00 H new ATOM 0 HE2 HIS A 15 -8.754 19.300 -2.372 1.00 0.00 H new ATOM 259 N GLN A 16 -4.734 16.896 3.589 1.00 0.00 N ATOM 260 CA GLN A 16 -4.313 16.644 4.994 1.00 0.00 C ATOM 261 C GLN A 16 -3.691 17.911 5.603 1.00 0.00 C ATOM 262 O GLN A 16 -3.965 18.254 6.736 1.00 0.00 O ATOM 263 CB GLN A 16 -3.283 15.507 5.001 1.00 0.00 C ATOM 264 CG GLN A 16 -2.942 15.119 6.433 1.00 0.00 C ATOM 265 CD GLN A 16 -1.981 13.930 6.424 1.00 0.00 C ATOM 266 OE1 GLN A 16 -1.820 13.272 5.416 1.00 0.00 O ATOM 267 NE2 GLN A 16 -1.331 13.625 7.514 1.00 0.00 N ATOM 0 H GLN A 16 -4.287 16.304 2.889 1.00 0.00 H new ATOM 0 HA GLN A 16 -5.183 16.367 5.590 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -3.679 14.644 4.467 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -2.381 15.820 4.476 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -2.488 15.963 6.951 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -3.851 14.862 6.978 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -1.467 14.178 8.360 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -0.687 12.834 7.519 1.00 0.00 H new ATOM 276 N TYR A 17 -2.845 18.604 4.877 1.00 0.00 N ATOM 277 CA TYR A 17 -2.199 19.842 5.446 1.00 0.00 C ATOM 278 C TYR A 17 -2.924 21.121 5.019 1.00 0.00 C ATOM 279 O TYR A 17 -2.991 22.074 5.766 1.00 0.00 O ATOM 280 CB TYR A 17 -0.753 19.911 4.952 1.00 0.00 C ATOM 281 CG TYR A 17 0.051 18.877 5.682 1.00 0.00 C ATOM 282 CD1 TYR A 17 0.021 17.554 5.250 1.00 0.00 C ATOM 283 CD2 TYR A 17 0.800 19.239 6.804 1.00 0.00 C ATOM 284 CE1 TYR A 17 0.744 16.581 5.935 1.00 0.00 C ATOM 285 CE2 TYR A 17 1.524 18.272 7.501 1.00 0.00 C ATOM 286 CZ TYR A 17 1.499 16.934 7.068 1.00 0.00 C ATOM 287 OH TYR A 17 2.213 15.971 7.751 1.00 0.00 O ATOM 0 H TYR A 17 -2.572 18.372 3.922 1.00 0.00 H new ATOM 0 HA TYR A 17 -2.247 19.776 6.533 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -0.711 19.733 3.877 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -0.340 20.904 5.127 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -0.563 17.282 4.383 1.00 0.00 H new ATOM 0 HD2 TYR A 17 0.818 20.268 7.132 1.00 0.00 H new ATOM 0 HE1 TYR A 17 0.725 15.556 5.596 1.00 0.00 H new ATOM 0 HE2 TYR A 17 2.102 18.550 8.370 1.00 0.00 H new ATOM 0 HH TYR A 17 1.884 15.082 7.502 1.00 0.00 H new ATOM 297 N SER A 18 -3.422 21.175 3.823 1.00 0.00 N ATOM 298 CA SER A 18 -4.084 22.428 3.353 1.00 0.00 C ATOM 299 C SER A 18 -5.276 22.788 4.241 1.00 0.00 C ATOM 300 O SER A 18 -5.500 23.940 4.549 1.00 0.00 O ATOM 301 CB SER A 18 -4.566 22.226 1.918 1.00 0.00 C ATOM 302 OG SER A 18 -3.439 22.150 1.058 1.00 0.00 O ATOM 0 H SER A 18 -3.403 20.411 3.147 1.00 0.00 H new ATOM 0 HA SER A 18 -3.362 23.243 3.402 1.00 0.00 H new ATOM 0 HB2 SER A 18 -5.158 21.314 1.845 1.00 0.00 H new ATOM 0 HB3 SER A 18 -5.213 23.050 1.619 1.00 0.00 H new ATOM 0 HG SER A 18 -3.734 22.214 0.126 1.00 0.00 H new ATOM 308 N GLY A 19 -6.040 21.825 4.653 1.00 0.00 N ATOM 309 CA GLY A 19 -7.220 22.127 5.511 1.00 0.00 C ATOM 310 C GLY A 19 -6.776 22.475 6.933 1.00 0.00 C ATOM 311 O GLY A 19 -7.586 22.817 7.771 1.00 0.00 O ATOM 0 H GLY A 19 -5.902 20.838 4.435 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -7.782 22.958 5.086 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -7.890 21.267 5.533 1.00 0.00 H new ATOM 315 N ARG A 20 -5.507 22.385 7.227 1.00 0.00 N ATOM 316 CA ARG A 20 -5.058 22.709 8.610 1.00 0.00 C ATOM 317 C ARG A 20 -5.184 24.210 8.877 1.00 0.00 C ATOM 318 O ARG A 20 -5.650 24.623 9.920 1.00 0.00 O ATOM 319 CB ARG A 20 -3.604 22.284 8.788 1.00 0.00 C ATOM 320 CG ARG A 20 -3.156 22.585 10.220 1.00 0.00 C ATOM 321 CD ARG A 20 -1.710 22.153 10.393 1.00 0.00 C ATOM 322 NE ARG A 20 -1.657 20.664 10.439 1.00 0.00 N ATOM 323 CZ ARG A 20 -0.514 20.048 10.356 1.00 0.00 C ATOM 324 NH1 ARG A 20 0.585 20.735 10.244 1.00 0.00 N ATOM 325 NH2 ARG A 20 -0.469 18.745 10.389 1.00 0.00 N ATOM 0 H ARG A 20 -4.771 22.105 6.579 1.00 0.00 H new ATOM 0 HA ARG A 20 -5.690 22.171 9.317 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -3.497 21.220 8.578 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -2.969 22.814 8.078 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -3.257 23.650 10.429 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -3.793 22.059 10.931 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -1.103 22.527 9.569 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -1.297 22.574 11.310 1.00 0.00 H new ATOM 0 HE ARG A 20 -2.519 20.127 10.536 1.00 0.00 H new ATOM 0 HH11 ARG A 20 0.549 21.754 10.221 1.00 0.00 H new ATOM 0 HH12 ARG A 20 1.482 20.255 10.179 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -1.331 18.207 10.480 1.00 0.00 H new ATOM 0 HH22 ARG A 20 0.428 18.264 10.324 1.00 0.00 H new ATOM 339 N GLU A 21 -4.745 25.027 7.952 1.00 0.00 N ATOM 340 CA GLU A 21 -4.802 26.514 8.153 1.00 0.00 C ATOM 341 C GLU A 21 -5.783 27.145 7.163 1.00 0.00 C ATOM 342 O GLU A 21 -6.141 26.559 6.160 1.00 0.00 O ATOM 343 CB GLU A 21 -3.409 27.104 7.918 1.00 0.00 C ATOM 344 CG GLU A 21 -2.475 26.682 9.054 1.00 0.00 C ATOM 345 CD GLU A 21 -1.084 27.272 8.817 1.00 0.00 C ATOM 346 OE1 GLU A 21 -0.860 27.796 7.739 1.00 0.00 O ATOM 347 OE2 GLU A 21 -0.265 27.187 9.717 1.00 0.00 O ATOM 0 H GLU A 21 -4.347 24.730 7.061 1.00 0.00 H new ATOM 0 HA GLU A 21 -5.136 26.723 9.169 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -3.014 26.760 6.962 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -3.467 28.191 7.866 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -2.869 27.026 10.010 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -2.416 25.595 9.106 1.00 0.00 H new ATOM 354 N GLY A 22 -6.225 28.340 7.453 1.00 0.00 N ATOM 355 CA GLY A 22 -7.192 29.031 6.554 1.00 0.00 C ATOM 356 C GLY A 22 -6.744 28.901 5.098 1.00 0.00 C ATOM 357 O GLY A 22 -7.544 28.991 4.188 1.00 0.00 O ATOM 0 H GLY A 22 -5.955 28.870 8.281 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -8.186 28.600 6.676 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -7.265 30.084 6.827 1.00 0.00 H new ATOM 361 N ASP A 23 -5.480 28.686 4.861 1.00 0.00 N ATOM 362 CA ASP A 23 -5.013 28.549 3.459 1.00 0.00 C ATOM 363 C ASP A 23 -5.502 27.200 2.914 1.00 0.00 C ATOM 364 O ASP A 23 -4.729 26.360 2.509 1.00 0.00 O ATOM 365 CB ASP A 23 -3.484 28.612 3.437 1.00 0.00 C ATOM 366 CG ASP A 23 -3.027 30.023 3.813 1.00 0.00 C ATOM 367 OD1 ASP A 23 -3.838 30.930 3.726 1.00 0.00 O ATOM 368 OD2 ASP A 23 -1.871 30.173 4.176 1.00 0.00 O ATOM 0 H ASP A 23 -4.756 28.600 5.575 1.00 0.00 H new ATOM 0 HA ASP A 23 -5.408 29.353 2.838 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -3.069 27.885 4.136 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -3.113 28.350 2.446 1.00 0.00 H new ATOM 373 N LYS A 24 -6.792 26.990 2.928 1.00 0.00 N ATOM 374 CA LYS A 24 -7.366 25.698 2.441 1.00 0.00 C ATOM 375 C LYS A 24 -7.142 25.534 0.931 1.00 0.00 C ATOM 376 O LYS A 24 -6.873 24.451 0.451 1.00 0.00 O ATOM 377 CB LYS A 24 -8.874 25.692 2.718 1.00 0.00 C ATOM 378 CG LYS A 24 -9.122 25.826 4.225 1.00 0.00 C ATOM 379 CD LYS A 24 -10.600 25.562 4.542 1.00 0.00 C ATOM 380 CE LYS A 24 -11.468 26.714 4.030 1.00 0.00 C ATOM 381 NZ LYS A 24 -12.836 26.592 4.610 1.00 0.00 N ATOM 0 H LYS A 24 -7.481 27.665 3.259 1.00 0.00 H new ATOM 0 HA LYS A 24 -6.872 24.877 2.961 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -9.355 26.513 2.186 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -9.318 24.768 2.347 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -8.494 25.121 4.769 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -8.843 26.825 4.560 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -10.916 24.627 4.080 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -10.733 25.448 5.618 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -11.026 27.670 4.309 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -11.518 26.691 2.941 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -13.430 27.373 4.265 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -13.255 25.685 4.323 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -12.778 26.633 5.648 1.00 0.00 H new ATOM 395 N HIS A 25 -7.288 26.590 0.176 1.00 0.00 N ATOM 396 CA HIS A 25 -7.125 26.489 -1.310 1.00 0.00 C ATOM 397 C HIS A 25 -5.663 26.682 -1.728 1.00 0.00 C ATOM 398 O HIS A 25 -5.319 26.509 -2.880 1.00 0.00 O ATOM 399 CB HIS A 25 -7.983 27.565 -1.977 1.00 0.00 C ATOM 400 CG HIS A 25 -7.790 27.517 -3.469 1.00 0.00 C ATOM 401 ND1 HIS A 25 -8.251 26.461 -4.244 1.00 0.00 N ATOM 402 CD2 HIS A 25 -7.193 28.391 -4.344 1.00 0.00 C ATOM 403 CE1 HIS A 25 -7.928 26.726 -5.524 1.00 0.00 C ATOM 404 NE2 HIS A 25 -7.284 27.888 -5.637 1.00 0.00 N ATOM 0 H HIS A 25 -7.514 27.522 0.522 1.00 0.00 H new ATOM 0 HA HIS A 25 -7.440 25.494 -1.624 1.00 0.00 H new ATOM 0 HB2 HIS A 25 -9.034 27.410 -1.732 1.00 0.00 H new ATOM 0 HB3 HIS A 25 -7.709 28.549 -1.597 1.00 0.00 H new ATOM 0 HD2 HIS A 25 -6.725 29.325 -4.070 1.00 0.00 H new ATOM 0 HE1 HIS A 25 -8.162 26.078 -6.356 1.00 0.00 H new ATOM 0 HE2 HIS A 25 -6.932 28.318 -6.492 1.00 0.00 H new ATOM 413 N LYS A 26 -4.800 27.051 -0.821 1.00 0.00 N ATOM 414 CA LYS A 26 -3.366 27.265 -1.198 1.00 0.00 C ATOM 415 C LYS A 26 -2.462 26.832 -0.050 1.00 0.00 C ATOM 416 O LYS A 26 -2.909 26.593 1.049 1.00 0.00 O ATOM 417 CB LYS A 26 -3.140 28.750 -1.499 1.00 0.00 C ATOM 418 CG LYS A 26 -3.332 29.574 -0.220 1.00 0.00 C ATOM 419 CD LYS A 26 -3.372 31.075 -0.555 1.00 0.00 C ATOM 420 CE LYS A 26 -4.774 31.485 -1.025 1.00 0.00 C ATOM 421 NZ LYS A 26 -4.851 32.970 -1.100 1.00 0.00 N ATOM 0 H LYS A 26 -5.021 27.214 0.161 1.00 0.00 H new ATOM 0 HA LYS A 26 -3.129 26.672 -2.082 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -2.135 28.902 -1.893 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -3.837 29.085 -2.267 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -4.257 29.280 0.275 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -2.519 29.371 0.477 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -3.092 31.657 0.323 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -2.642 31.299 -1.332 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -4.985 31.048 -2.001 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -5.527 31.104 -0.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -5.800 33.253 -1.418 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -4.666 33.375 -0.160 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -4.141 33.321 -1.774 1.00 0.00 H new ATOM 435 N LEU A 27 -1.187 26.723 -0.309 1.00 0.00 N ATOM 436 CA LEU A 27 -0.214 26.311 0.749 1.00 0.00 C ATOM 437 C LEU A 27 0.819 27.418 0.928 1.00 0.00 C ATOM 438 O LEU A 27 1.442 27.847 -0.015 1.00 0.00 O ATOM 439 CB LEU A 27 0.495 25.017 0.318 1.00 0.00 C ATOM 440 CG LEU A 27 -0.378 23.794 0.652 1.00 0.00 C ATOM 441 CD1 LEU A 27 0.241 22.541 0.014 1.00 0.00 C ATOM 442 CD2 LEU A 27 -0.474 23.605 2.186 1.00 0.00 C ATOM 0 H LEU A 27 -0.770 26.904 -1.222 1.00 0.00 H new ATOM 0 HA LEU A 27 -0.740 26.139 1.688 1.00 0.00 H new ATOM 0 HB2 LEU A 27 0.699 25.045 -0.752 1.00 0.00 H new ATOM 0 HB3 LEU A 27 1.457 24.935 0.824 1.00 0.00 H new ATOM 0 HG LEU A 27 -1.381 23.952 0.256 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -0.374 21.672 0.248 1.00 0.00 H new ATOM 0 HD12 LEU A 27 0.291 22.670 -1.067 1.00 0.00 H new ATOM 0 HD13 LEU A 27 1.246 22.391 0.408 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -1.094 22.737 2.407 1.00 0.00 H new ATOM 0 HD22 LEU A 27 0.524 23.452 2.597 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -0.919 24.493 2.635 1.00 0.00 H new ATOM 454 N LYS A 28 1.022 27.872 2.132 1.00 0.00 N ATOM 455 CA LYS A 28 2.036 28.931 2.363 1.00 0.00 C ATOM 456 C LYS A 28 3.353 28.247 2.704 1.00 0.00 C ATOM 457 O LYS A 28 3.365 27.170 3.268 1.00 0.00 O ATOM 458 CB LYS A 28 1.580 29.820 3.530 1.00 0.00 C ATOM 459 CG LYS A 28 2.611 30.920 3.795 1.00 0.00 C ATOM 460 CD LYS A 28 2.139 31.797 4.956 1.00 0.00 C ATOM 461 CE LYS A 28 3.173 32.895 5.217 1.00 0.00 C ATOM 462 NZ LYS A 28 3.410 33.663 3.961 1.00 0.00 N ATOM 0 H LYS A 28 0.528 27.554 2.966 1.00 0.00 H new ATOM 0 HA LYS A 28 2.159 29.555 1.478 1.00 0.00 H new ATOM 0 HB2 LYS A 28 0.613 30.267 3.299 1.00 0.00 H new ATOM 0 HB3 LYS A 28 1.446 29.214 4.426 1.00 0.00 H new ATOM 0 HG2 LYS A 28 3.578 30.476 4.031 1.00 0.00 H new ATOM 0 HG3 LYS A 28 2.748 31.527 2.900 1.00 0.00 H new ATOM 0 HD2 LYS A 28 1.172 32.241 4.721 1.00 0.00 H new ATOM 0 HD3 LYS A 28 2.002 31.191 5.852 1.00 0.00 H new ATOM 0 HE2 LYS A 28 2.820 33.563 6.003 1.00 0.00 H new ATOM 0 HE3 LYS A 28 4.106 32.455 5.568 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 3.796 34.600 4.195 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 4.088 33.149 3.362 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 2.512 33.776 3.449 1.00 0.00 H new ATOM 476 N LYS A 29 4.462 28.845 2.360 1.00 0.00 N ATOM 477 CA LYS A 29 5.776 28.206 2.665 1.00 0.00 C ATOM 478 C LYS A 29 5.750 27.682 4.099 1.00 0.00 C ATOM 479 O LYS A 29 6.483 26.785 4.469 1.00 0.00 O ATOM 480 CB LYS A 29 6.899 29.240 2.510 1.00 0.00 C ATOM 481 CG LYS A 29 6.832 30.287 3.626 1.00 0.00 C ATOM 482 CD LYS A 29 7.799 31.427 3.299 1.00 0.00 C ATOM 483 CE LYS A 29 7.925 32.355 4.508 1.00 0.00 C ATOM 484 NZ LYS A 29 6.610 33.005 4.768 1.00 0.00 N ATOM 0 H LYS A 29 4.516 29.745 1.883 1.00 0.00 H new ATOM 0 HA LYS A 29 5.956 27.381 1.976 1.00 0.00 H new ATOM 0 HB2 LYS A 29 7.867 28.739 2.533 1.00 0.00 H new ATOM 0 HB3 LYS A 29 6.817 29.730 1.540 1.00 0.00 H new ATOM 0 HG2 LYS A 29 5.816 30.671 3.722 1.00 0.00 H new ATOM 0 HG3 LYS A 29 7.093 29.835 4.583 1.00 0.00 H new ATOM 0 HD2 LYS A 29 8.776 31.024 3.034 1.00 0.00 H new ATOM 0 HD3 LYS A 29 7.440 31.986 2.435 1.00 0.00 H new ATOM 0 HE2 LYS A 29 8.244 31.789 5.384 1.00 0.00 H new ATOM 0 HE3 LYS A 29 8.687 33.112 4.322 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 6.741 34.034 4.846 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 5.959 32.797 3.984 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 6.211 32.638 5.656 1.00 0.00 H new ATOM 498 N SER A 30 4.893 28.244 4.896 1.00 0.00 N ATOM 499 CA SER A 30 4.778 27.800 6.317 1.00 0.00 C ATOM 500 C SER A 30 3.939 26.522 6.392 1.00 0.00 C ATOM 501 O SER A 30 4.335 25.543 6.993 1.00 0.00 O ATOM 502 CB SER A 30 4.107 28.899 7.142 1.00 0.00 C ATOM 503 OG SER A 30 3.998 28.472 8.493 1.00 0.00 O ATOM 0 H SER A 30 4.260 28.998 4.627 1.00 0.00 H new ATOM 0 HA SER A 30 5.773 27.602 6.714 1.00 0.00 H new ATOM 0 HB2 SER A 30 4.689 29.819 7.085 1.00 0.00 H new ATOM 0 HB3 SER A 30 3.119 29.121 6.738 1.00 0.00 H new ATOM 0 HG SER A 30 3.570 29.175 9.025 1.00 0.00 H new ATOM 509 N GLU A 31 2.788 26.517 5.774 1.00 0.00 N ATOM 510 CA GLU A 31 1.937 25.301 5.800 1.00 0.00 C ATOM 511 C GLU A 31 2.647 24.226 4.978 1.00 0.00 C ATOM 512 O GLU A 31 2.593 23.050 5.281 1.00 0.00 O ATOM 513 CB GLU A 31 0.562 25.630 5.200 1.00 0.00 C ATOM 514 CG GLU A 31 -0.420 24.488 5.459 1.00 0.00 C ATOM 515 CD GLU A 31 -1.815 24.928 5.008 1.00 0.00 C ATOM 516 OE1 GLU A 31 -1.891 25.817 4.176 1.00 0.00 O ATOM 517 OE2 GLU A 31 -2.781 24.374 5.500 1.00 0.00 O ATOM 0 H GLU A 31 2.404 27.305 5.253 1.00 0.00 H new ATOM 0 HA GLU A 31 1.783 24.946 6.819 1.00 0.00 H new ATOM 0 HB2 GLU A 31 0.179 26.553 5.636 1.00 0.00 H new ATOM 0 HB3 GLU A 31 0.657 25.800 4.128 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -0.112 23.594 4.916 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -0.429 24.230 6.518 1.00 0.00 H new ATOM 524 N LEU A 32 3.328 24.637 3.939 1.00 0.00 N ATOM 525 CA LEU A 32 4.068 23.668 3.086 1.00 0.00 C ATOM 526 C LEU A 32 5.109 22.933 3.926 1.00 0.00 C ATOM 527 O LEU A 32 5.305 21.750 3.777 1.00 0.00 O ATOM 528 CB LEU A 32 4.771 24.431 1.959 1.00 0.00 C ATOM 529 CG LEU A 32 5.610 23.477 1.091 1.00 0.00 C ATOM 530 CD1 LEU A 32 4.713 22.404 0.461 1.00 0.00 C ATOM 531 CD2 LEU A 32 6.298 24.287 -0.014 1.00 0.00 C ATOM 0 H LEU A 32 3.402 25.611 3.645 1.00 0.00 H new ATOM 0 HA LEU A 32 3.370 22.944 2.665 1.00 0.00 H new ATOM 0 HB2 LEU A 32 4.030 24.937 1.339 1.00 0.00 H new ATOM 0 HB3 LEU A 32 5.413 25.203 2.383 1.00 0.00 H new ATOM 0 HG LEU A 32 6.357 22.985 1.713 1.00 0.00 H new ATOM 0 HD11 LEU A 32 5.319 21.736 -0.150 1.00 0.00 H new ATOM 0 HD12 LEU A 32 4.223 21.831 1.248 1.00 0.00 H new ATOM 0 HD13 LEU A 32 3.958 22.882 -0.163 1.00 0.00 H new ATOM 0 HD21 LEU A 32 6.896 23.620 -0.635 1.00 0.00 H new ATOM 0 HD22 LEU A 32 5.544 24.777 -0.629 1.00 0.00 H new ATOM 0 HD23 LEU A 32 6.945 25.040 0.436 1.00 0.00 H new ATOM 543 N LYS A 33 5.792 23.630 4.792 1.00 0.00 N ATOM 544 CA LYS A 33 6.837 22.967 5.626 1.00 0.00 C ATOM 545 C LYS A 33 6.202 21.862 6.469 1.00 0.00 C ATOM 546 O LYS A 33 6.765 20.800 6.646 1.00 0.00 O ATOM 547 CB LYS A 33 7.478 24.004 6.552 1.00 0.00 C ATOM 548 CG LYS A 33 8.569 23.343 7.402 1.00 0.00 C ATOM 549 CD LYS A 33 9.195 24.391 8.317 1.00 0.00 C ATOM 550 CE LYS A 33 10.280 23.742 9.177 1.00 0.00 C ATOM 551 NZ LYS A 33 10.961 24.788 9.992 1.00 0.00 N ATOM 0 H LYS A 33 5.673 24.629 4.959 1.00 0.00 H new ATOM 0 HA LYS A 33 7.596 22.533 4.975 1.00 0.00 H new ATOM 0 HB2 LYS A 33 7.906 24.815 5.963 1.00 0.00 H new ATOM 0 HB3 LYS A 33 6.719 24.445 7.198 1.00 0.00 H new ATOM 0 HG2 LYS A 33 8.144 22.533 7.994 1.00 0.00 H new ATOM 0 HG3 LYS A 33 9.331 22.902 6.759 1.00 0.00 H new ATOM 0 HD2 LYS A 33 9.623 25.198 7.722 1.00 0.00 H new ATOM 0 HD3 LYS A 33 8.430 24.835 8.954 1.00 0.00 H new ATOM 0 HE2 LYS A 33 9.839 22.988 9.829 1.00 0.00 H new ATOM 0 HE3 LYS A 33 11.005 23.231 8.543 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 11.930 24.925 9.641 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 10.436 25.683 9.918 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 10.993 24.487 10.987 1.00 0.00 H new ATOM 565 N GLU A 34 5.037 22.102 6.995 1.00 0.00 N ATOM 566 CA GLU A 34 4.377 21.072 7.827 1.00 0.00 C ATOM 567 C GLU A 34 4.145 19.841 6.969 1.00 0.00 C ATOM 568 O GLU A 34 4.303 18.726 7.403 1.00 0.00 O ATOM 569 CB GLU A 34 3.042 21.605 8.342 1.00 0.00 C ATOM 570 CG GLU A 34 3.294 22.747 9.328 1.00 0.00 C ATOM 571 CD GLU A 34 3.904 22.192 10.616 1.00 0.00 C ATOM 572 OE1 GLU A 34 3.735 21.011 10.869 1.00 0.00 O ATOM 573 OE2 GLU A 34 4.531 22.959 11.329 1.00 0.00 O ATOM 0 H GLU A 34 4.514 22.971 6.882 1.00 0.00 H new ATOM 0 HA GLU A 34 5.005 20.819 8.681 1.00 0.00 H new ATOM 0 HB2 GLU A 34 2.433 21.957 7.509 1.00 0.00 H new ATOM 0 HB3 GLU A 34 2.483 20.806 8.830 1.00 0.00 H new ATOM 0 HG2 GLU A 34 3.965 23.482 8.884 1.00 0.00 H new ATOM 0 HG3 GLU A 34 2.359 23.262 9.550 1.00 0.00 H new ATOM 580 N LEU A 35 3.763 20.038 5.750 1.00 0.00 N ATOM 581 CA LEU A 35 3.531 18.880 4.862 1.00 0.00 C ATOM 582 C LEU A 35 4.833 18.095 4.713 1.00 0.00 C ATOM 583 O LEU A 35 4.866 16.895 4.831 1.00 0.00 O ATOM 584 CB LEU A 35 3.061 19.382 3.496 1.00 0.00 C ATOM 585 CG LEU A 35 2.809 18.186 2.556 1.00 0.00 C ATOM 586 CD1 LEU A 35 1.892 18.636 1.414 1.00 0.00 C ATOM 587 CD2 LEU A 35 4.141 17.624 1.989 1.00 0.00 C ATOM 0 H LEU A 35 3.601 20.952 5.328 1.00 0.00 H new ATOM 0 HA LEU A 35 2.767 18.229 5.286 1.00 0.00 H new ATOM 0 HB2 LEU A 35 2.148 19.966 3.608 1.00 0.00 H new ATOM 0 HB3 LEU A 35 3.812 20.044 3.064 1.00 0.00 H new ATOM 0 HG LEU A 35 2.331 17.386 3.122 1.00 0.00 H new ATOM 0 HD11 LEU A 35 1.708 17.797 0.743 1.00 0.00 H new ATOM 0 HD12 LEU A 35 0.945 18.987 1.824 1.00 0.00 H new ATOM 0 HD13 LEU A 35 2.370 19.444 0.861 1.00 0.00 H new ATOM 0 HD21 LEU A 35 3.929 16.782 1.330 1.00 0.00 H new ATOM 0 HD22 LEU A 35 4.655 18.404 1.427 1.00 0.00 H new ATOM 0 HD23 LEU A 35 4.775 17.291 2.811 1.00 0.00 H new ATOM 599 N ILE A 36 5.899 18.773 4.423 1.00 0.00 N ATOM 600 CA ILE A 36 7.202 18.086 4.217 1.00 0.00 C ATOM 601 C ILE A 36 7.820 17.610 5.541 1.00 0.00 C ATOM 602 O ILE A 36 8.332 16.512 5.633 1.00 0.00 O ATOM 603 CB ILE A 36 8.163 19.076 3.555 1.00 0.00 C ATOM 604 CG1 ILE A 36 7.561 19.571 2.238 1.00 0.00 C ATOM 605 CG2 ILE A 36 9.496 18.386 3.266 1.00 0.00 C ATOM 606 CD1 ILE A 36 8.418 20.707 1.676 1.00 0.00 C ATOM 0 H ILE A 36 5.927 19.787 4.318 1.00 0.00 H new ATOM 0 HA ILE A 36 7.033 17.208 3.594 1.00 0.00 H new ATOM 0 HB ILE A 36 8.325 19.919 4.226 1.00 0.00 H new ATOM 0 HG12 ILE A 36 7.509 18.752 1.520 1.00 0.00 H new ATOM 0 HG13 ILE A 36 6.541 19.918 2.401 1.00 0.00 H new ATOM 0 HG21 ILE A 36 10.178 19.094 2.795 1.00 0.00 H new ATOM 0 HG22 ILE A 36 9.931 18.030 4.200 1.00 0.00 H new ATOM 0 HG23 ILE A 36 9.331 17.541 2.597 1.00 0.00 H new ATOM 0 HD11 ILE A 36 7.987 21.058 0.738 1.00 0.00 H new ATOM 0 HD12 ILE A 36 8.448 21.529 2.392 1.00 0.00 H new ATOM 0 HD13 ILE A 36 9.430 20.345 1.497 1.00 0.00 H new ATOM 618 N ASN A 37 7.839 18.447 6.540 1.00 0.00 N ATOM 619 CA ASN A 37 8.499 18.064 7.829 1.00 0.00 C ATOM 620 C ASN A 37 7.725 16.984 8.588 1.00 0.00 C ATOM 621 O ASN A 37 8.302 16.115 9.210 1.00 0.00 O ATOM 622 CB ASN A 37 8.610 19.305 8.716 1.00 0.00 C ATOM 623 CG ASN A 37 9.640 20.264 8.123 1.00 0.00 C ATOM 624 OD1 ASN A 37 9.592 20.540 6.848 1.00 0.00 O flip ATOM 625 ND2 ASN A 37 10.495 20.767 8.824 1.00 0.00 N flip ATOM 0 H ASN A 37 7.428 19.380 6.524 1.00 0.00 H new ATOM 0 HA ASN A 37 9.481 17.658 7.587 1.00 0.00 H new ATOM 0 HB2 ASN A 37 7.641 19.798 8.793 1.00 0.00 H new ATOM 0 HB3 ASN A 37 8.903 19.018 9.726 1.00 0.00 H new ATOM 0 HD21 ASN A 37 10.531 20.550 9.820 1.00 0.00 H new ATOM 0 HD22 ASN A 37 11.177 21.406 8.417 1.00 0.00 H new ATOM 632 N ASN A 38 6.433 17.070 8.598 1.00 0.00 N ATOM 633 CA ASN A 38 5.612 16.089 9.383 1.00 0.00 C ATOM 634 C ASN A 38 5.095 14.935 8.520 1.00 0.00 C ATOM 635 O ASN A 38 5.035 13.808 8.970 1.00 0.00 O ATOM 636 CB ASN A 38 4.416 16.824 9.988 1.00 0.00 C ATOM 637 CG ASN A 38 3.617 15.862 10.867 1.00 0.00 C ATOM 638 OD1 ASN A 38 3.748 15.873 12.075 1.00 0.00 O ATOM 639 ND2 ASN A 38 2.791 15.021 10.308 1.00 0.00 N ATOM 0 H ASN A 38 5.896 17.778 8.097 1.00 0.00 H new ATOM 0 HA ASN A 38 6.253 15.663 10.155 1.00 0.00 H new ATOM 0 HB2 ASN A 38 4.759 17.674 10.579 1.00 0.00 H new ATOM 0 HB3 ASN A 38 3.782 17.222 9.196 1.00 0.00 H new ATOM 0 HD21 ASN A 38 2.255 14.373 10.885 1.00 0.00 H new ATOM 0 HD22 ASN A 38 2.681 15.012 9.294 1.00 0.00 H new ATOM 646 N GLU A 39 4.694 15.183 7.306 1.00 0.00 N ATOM 647 CA GLU A 39 4.163 14.057 6.488 1.00 0.00 C ATOM 648 C GLU A 39 5.302 13.087 6.183 1.00 0.00 C ATOM 649 O GLU A 39 5.134 11.884 6.207 1.00 0.00 O ATOM 650 CB GLU A 39 3.559 14.584 5.175 1.00 0.00 C ATOM 651 CG GLU A 39 2.572 13.559 4.620 1.00 0.00 C ATOM 652 CD GLU A 39 2.041 14.047 3.273 1.00 0.00 C ATOM 653 OE1 GLU A 39 1.524 15.151 3.229 1.00 0.00 O ATOM 654 OE2 GLU A 39 2.162 13.311 2.309 1.00 0.00 O ATOM 0 H GLU A 39 4.709 16.096 6.851 1.00 0.00 H new ATOM 0 HA GLU A 39 3.378 13.545 7.045 1.00 0.00 H new ATOM 0 HB2 GLU A 39 3.053 15.533 5.350 1.00 0.00 H new ATOM 0 HB3 GLU A 39 4.350 14.773 4.449 1.00 0.00 H new ATOM 0 HG2 GLU A 39 3.062 12.592 4.502 1.00 0.00 H new ATOM 0 HG3 GLU A 39 1.748 13.416 5.319 1.00 0.00 H new ATOM 661 N LEU A 40 6.464 13.610 5.895 1.00 0.00 N ATOM 662 CA LEU A 40 7.635 12.740 5.583 1.00 0.00 C ATOM 663 C LEU A 40 8.512 12.634 6.834 1.00 0.00 C ATOM 664 O LEU A 40 9.643 13.077 6.852 1.00 0.00 O ATOM 665 CB LEU A 40 8.440 13.369 4.435 1.00 0.00 C ATOM 666 CG LEU A 40 7.486 13.994 3.412 1.00 0.00 C ATOM 667 CD1 LEU A 40 8.289 14.535 2.230 1.00 0.00 C ATOM 668 CD2 LEU A 40 6.503 12.938 2.908 1.00 0.00 C ATOM 0 H LEU A 40 6.653 14.612 5.862 1.00 0.00 H new ATOM 0 HA LEU A 40 7.300 11.747 5.283 1.00 0.00 H new ATOM 0 HB2 LEU A 40 9.116 14.129 4.827 1.00 0.00 H new ATOM 0 HB3 LEU A 40 9.058 12.611 3.954 1.00 0.00 H new ATOM 0 HG LEU A 40 6.935 14.806 3.887 1.00 0.00 H new ATOM 0 HD11 LEU A 40 7.610 14.980 1.502 1.00 0.00 H new ATOM 0 HD12 LEU A 40 8.990 15.292 2.582 1.00 0.00 H new ATOM 0 HD13 LEU A 40 8.840 13.720 1.761 1.00 0.00 H new ATOM 0 HD21 LEU A 40 5.827 13.388 2.181 1.00 0.00 H new ATOM 0 HD22 LEU A 40 7.054 12.124 2.437 1.00 0.00 H new ATOM 0 HD23 LEU A 40 5.926 12.548 3.747 1.00 0.00 H new ATOM 680 N SER A 41 7.990 12.063 7.884 1.00 0.00 N ATOM 681 CA SER A 41 8.784 11.946 9.140 1.00 0.00 C ATOM 682 C SER A 41 10.055 11.134 8.882 1.00 0.00 C ATOM 683 O SER A 41 11.113 11.453 9.386 1.00 0.00 O ATOM 684 CB SER A 41 7.940 11.242 10.203 1.00 0.00 C ATOM 685 OG SER A 41 7.597 9.941 9.742 1.00 0.00 O ATOM 0 H SER A 41 7.049 11.672 7.927 1.00 0.00 H new ATOM 0 HA SER A 41 9.061 12.942 9.485 1.00 0.00 H new ATOM 0 HB2 SER A 41 8.495 11.175 11.139 1.00 0.00 H new ATOM 0 HB3 SER A 41 7.038 11.818 10.408 1.00 0.00 H new ATOM 0 HG SER A 41 8.295 9.306 10.005 1.00 0.00 H new ATOM 691 N HIS A 42 9.962 10.086 8.101 1.00 0.00 N ATOM 692 CA HIS A 42 11.170 9.246 7.807 1.00 0.00 C ATOM 693 C HIS A 42 11.222 8.909 6.311 1.00 0.00 C ATOM 694 O HIS A 42 12.244 8.502 5.794 1.00 0.00 O ATOM 695 CB HIS A 42 11.088 7.947 8.614 1.00 0.00 C ATOM 696 CG HIS A 42 11.233 8.250 10.083 1.00 0.00 C ATOM 697 ND1 HIS A 42 10.139 8.530 10.893 1.00 0.00 N ATOM 698 CD2 HIS A 42 12.333 8.313 10.905 1.00 0.00 C ATOM 699 CE1 HIS A 42 10.601 8.746 12.139 1.00 0.00 C ATOM 700 NE2 HIS A 42 11.928 8.626 12.199 1.00 0.00 N ATOM 0 H HIS A 42 9.101 9.774 7.652 1.00 0.00 H new ATOM 0 HA HIS A 42 12.068 9.799 8.082 1.00 0.00 H new ATOM 0 HB2 HIS A 42 10.135 7.452 8.428 1.00 0.00 H new ATOM 0 HB3 HIS A 42 11.872 7.260 8.296 1.00 0.00 H new ATOM 0 HD2 HIS A 42 13.354 8.145 10.595 1.00 0.00 H new ATOM 0 HE1 HIS A 42 9.975 8.987 12.985 1.00 0.00 H new ATOM 0 HE2 HIS A 42 12.521 8.740 13.021 1.00 0.00 H new ATOM 709 N PHE A 43 10.129 9.064 5.613 1.00 0.00 N ATOM 710 CA PHE A 43 10.114 8.739 4.157 1.00 0.00 C ATOM 711 C PHE A 43 11.110 9.639 3.408 1.00 0.00 C ATOM 712 O PHE A 43 11.827 9.192 2.536 1.00 0.00 O ATOM 713 CB PHE A 43 8.686 8.954 3.630 1.00 0.00 C ATOM 714 CG PHE A 43 8.554 8.715 2.126 1.00 0.00 C ATOM 715 CD1 PHE A 43 9.497 7.965 1.389 1.00 0.00 C ATOM 716 CD2 PHE A 43 7.441 9.256 1.464 1.00 0.00 C ATOM 717 CE1 PHE A 43 9.314 7.770 0.013 1.00 0.00 C ATOM 718 CE2 PHE A 43 7.267 9.058 0.090 1.00 0.00 C ATOM 719 CZ PHE A 43 8.202 8.316 -0.635 1.00 0.00 C ATOM 0 H PHE A 43 9.243 9.403 5.989 1.00 0.00 H new ATOM 0 HA PHE A 43 10.412 7.703 3.997 1.00 0.00 H new ATOM 0 HB2 PHE A 43 8.007 8.285 4.158 1.00 0.00 H new ATOM 0 HB3 PHE A 43 8.372 9.972 3.858 1.00 0.00 H new ATOM 0 HD1 PHE A 43 10.358 7.542 1.885 1.00 0.00 H new ATOM 0 HD2 PHE A 43 6.713 9.829 2.019 1.00 0.00 H new ATOM 0 HE1 PHE A 43 10.035 7.195 -0.549 1.00 0.00 H new ATOM 0 HE2 PHE A 43 6.408 9.480 -0.411 1.00 0.00 H new ATOM 0 HZ PHE A 43 8.066 8.164 -1.696 1.00 0.00 H new ATOM 729 N LEU A 44 11.168 10.903 3.753 1.00 0.00 N ATOM 730 CA LEU A 44 12.122 11.842 3.077 1.00 0.00 C ATOM 731 C LEU A 44 12.867 12.603 4.166 1.00 0.00 C ATOM 732 O LEU A 44 12.368 12.769 5.261 1.00 0.00 O ATOM 733 CB LEU A 44 11.325 12.821 2.190 1.00 0.00 C ATOM 734 CG LEU A 44 12.243 13.523 1.145 1.00 0.00 C ATOM 735 CD1 LEU A 44 11.469 13.734 -0.165 1.00 0.00 C ATOM 736 CD2 LEU A 44 12.709 14.892 1.676 1.00 0.00 C ATOM 0 H LEU A 44 10.592 11.328 4.479 1.00 0.00 H new ATOM 0 HA LEU A 44 12.829 11.301 2.448 1.00 0.00 H new ATOM 0 HB2 LEU A 44 10.531 12.282 1.674 1.00 0.00 H new ATOM 0 HB3 LEU A 44 10.845 13.572 2.817 1.00 0.00 H new ATOM 0 HG LEU A 44 13.112 12.890 0.966 1.00 0.00 H new ATOM 0 HD11 LEU A 44 12.114 14.225 -0.894 1.00 0.00 H new ATOM 0 HD12 LEU A 44 11.148 12.769 -0.557 1.00 0.00 H new ATOM 0 HD13 LEU A 44 10.595 14.358 0.025 1.00 0.00 H new ATOM 0 HD21 LEU A 44 13.350 15.371 0.935 1.00 0.00 H new ATOM 0 HD22 LEU A 44 11.841 15.523 1.867 1.00 0.00 H new ATOM 0 HD23 LEU A 44 13.267 14.752 2.602 1.00 0.00 H new ATOM 748 N GLU A 45 14.054 13.057 3.899 1.00 0.00 N ATOM 749 CA GLU A 45 14.792 13.784 4.960 1.00 0.00 C ATOM 750 C GLU A 45 13.979 15.002 5.387 1.00 0.00 C ATOM 751 O GLU A 45 13.786 15.935 4.633 1.00 0.00 O ATOM 752 CB GLU A 45 16.152 14.237 4.423 1.00 0.00 C ATOM 753 CG GLU A 45 16.939 14.961 5.524 1.00 0.00 C ATOM 754 CD GLU A 45 17.256 13.984 6.659 1.00 0.00 C ATOM 755 OE1 GLU A 45 17.169 12.789 6.429 1.00 0.00 O ATOM 756 OE2 GLU A 45 17.589 14.447 7.738 1.00 0.00 O ATOM 0 H GLU A 45 14.539 12.959 3.007 1.00 0.00 H new ATOM 0 HA GLU A 45 14.947 13.127 5.816 1.00 0.00 H new ATOM 0 HB2 GLU A 45 16.717 13.375 4.068 1.00 0.00 H new ATOM 0 HB3 GLU A 45 16.012 14.900 3.569 1.00 0.00 H new ATOM 0 HG2 GLU A 45 17.863 15.370 5.115 1.00 0.00 H new ATOM 0 HG3 GLU A 45 16.360 15.802 5.906 1.00 0.00 H new ATOM 763 N GLU A 46 13.512 15.002 6.602 1.00 0.00 N ATOM 764 CA GLU A 46 12.721 16.159 7.099 1.00 0.00 C ATOM 765 C GLU A 46 13.535 17.437 6.955 1.00 0.00 C ATOM 766 O GLU A 46 14.726 17.412 6.718 1.00 0.00 O ATOM 767 CB GLU A 46 12.361 15.946 8.573 1.00 0.00 C ATOM 768 CG GLU A 46 11.158 15.017 8.663 1.00 0.00 C ATOM 769 CD GLU A 46 10.830 14.740 10.131 1.00 0.00 C ATOM 770 OE1 GLU A 46 11.366 13.783 10.666 1.00 0.00 O ATOM 771 OE2 GLU A 46 10.055 15.493 10.696 1.00 0.00 O ATOM 0 H GLU A 46 13.645 14.247 7.275 1.00 0.00 H new ATOM 0 HA GLU A 46 11.806 16.244 6.513 1.00 0.00 H new ATOM 0 HB2 GLU A 46 13.208 15.517 9.109 1.00 0.00 H new ATOM 0 HB3 GLU A 46 12.135 16.901 9.047 1.00 0.00 H new ATOM 0 HG2 GLU A 46 10.299 15.469 8.167 1.00 0.00 H new ATOM 0 HG3 GLU A 46 11.369 14.082 8.145 1.00 0.00 H new ATOM 778 N ILE A 47 12.886 18.558 7.089 1.00 0.00 N ATOM 779 CA ILE A 47 13.590 19.860 6.954 1.00 0.00 C ATOM 780 C ILE A 47 13.984 20.352 8.347 1.00 0.00 C ATOM 781 O ILE A 47 13.241 20.210 9.298 1.00 0.00 O ATOM 782 CB ILE A 47 12.657 20.889 6.295 1.00 0.00 C ATOM 783 CG1 ILE A 47 11.911 20.273 5.089 1.00 0.00 C ATOM 784 CG2 ILE A 47 13.478 22.086 5.830 1.00 0.00 C ATOM 785 CD1 ILE A 47 12.827 20.176 3.862 1.00 0.00 C ATOM 0 H ILE A 47 11.888 18.628 7.288 1.00 0.00 H new ATOM 0 HA ILE A 47 14.479 19.736 6.335 1.00 0.00 H new ATOM 0 HB ILE A 47 11.916 21.205 7.029 1.00 0.00 H new ATOM 0 HG12 ILE A 47 11.545 19.281 5.352 1.00 0.00 H new ATOM 0 HG13 ILE A 47 11.039 20.881 4.848 1.00 0.00 H new ATOM 0 HG21 ILE A 47 12.820 22.818 5.362 1.00 0.00 H new ATOM 0 HG22 ILE A 47 13.976 22.540 6.686 1.00 0.00 H new ATOM 0 HG23 ILE A 47 14.226 21.756 5.109 1.00 0.00 H new ATOM 0 HD11 ILE A 47 12.275 19.739 3.030 1.00 0.00 H new ATOM 0 HD12 ILE A 47 13.172 21.172 3.586 1.00 0.00 H new ATOM 0 HD13 ILE A 47 13.686 19.547 4.098 1.00 0.00 H new ATOM 797 N LYS A 48 15.158 20.913 8.476 1.00 0.00 N ATOM 798 CA LYS A 48 15.631 21.400 9.810 1.00 0.00 C ATOM 799 C LYS A 48 15.635 22.933 9.837 1.00 0.00 C ATOM 800 O LYS A 48 15.744 23.535 10.887 1.00 0.00 O ATOM 801 CB LYS A 48 17.057 20.880 10.044 1.00 0.00 C ATOM 802 CG LYS A 48 17.185 19.430 9.545 1.00 0.00 C ATOM 803 CD LYS A 48 16.229 18.509 10.308 1.00 0.00 C ATOM 804 CE LYS A 48 16.374 17.085 9.774 1.00 0.00 C ATOM 805 NZ LYS A 48 15.721 16.131 10.715 1.00 0.00 N ATOM 0 H LYS A 48 15.816 21.057 7.710 1.00 0.00 H new ATOM 0 HA LYS A 48 14.964 21.036 10.592 1.00 0.00 H new ATOM 0 HB2 LYS A 48 17.773 21.516 9.523 1.00 0.00 H new ATOM 0 HB3 LYS A 48 17.300 20.929 11.105 1.00 0.00 H new ATOM 0 HG2 LYS A 48 16.966 19.387 8.478 1.00 0.00 H new ATOM 0 HG3 LYS A 48 18.211 19.085 9.674 1.00 0.00 H new ATOM 0 HD2 LYS A 48 16.453 18.535 11.374 1.00 0.00 H new ATOM 0 HD3 LYS A 48 15.201 18.852 10.189 1.00 0.00 H new ATOM 0 HE2 LYS A 48 15.918 17.008 8.787 1.00 0.00 H new ATOM 0 HE3 LYS A 48 17.429 16.834 9.659 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 15.820 15.162 10.351 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 16.175 16.198 11.648 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 14.712 16.366 10.803 1.00 0.00 H new ATOM 819 N GLU A 49 15.526 23.571 8.696 1.00 0.00 N ATOM 820 CA GLU A 49 15.535 25.070 8.663 1.00 0.00 C ATOM 821 C GLU A 49 14.467 25.598 7.708 1.00 0.00 C ATOM 822 O GLU A 49 14.141 24.988 6.710 1.00 0.00 O ATOM 823 CB GLU A 49 16.909 25.554 8.200 1.00 0.00 C ATOM 824 CG GLU A 49 17.924 25.307 9.310 1.00 0.00 C ATOM 825 CD GLU A 49 19.318 25.731 8.846 1.00 0.00 C ATOM 826 OE1 GLU A 49 19.472 25.999 7.668 1.00 0.00 O ATOM 827 OE2 GLU A 49 20.210 25.773 9.678 1.00 0.00 O ATOM 0 H GLU A 49 15.431 23.120 7.786 1.00 0.00 H new ATOM 0 HA GLU A 49 15.321 25.443 9.665 1.00 0.00 H new ATOM 0 HB2 GLU A 49 17.207 25.028 7.293 1.00 0.00 H new ATOM 0 HB3 GLU A 49 16.871 26.615 7.954 1.00 0.00 H new ATOM 0 HG2 GLU A 49 17.643 25.866 10.202 1.00 0.00 H new ATOM 0 HG3 GLU A 49 17.928 24.252 9.583 1.00 0.00 H new ATOM 834 N GLN A 50 13.940 26.751 8.011 1.00 0.00 N ATOM 835 CA GLN A 50 12.905 27.369 7.139 1.00 0.00 C ATOM 836 C GLN A 50 13.565 27.809 5.837 1.00 0.00 C ATOM 837 O GLN A 50 12.920 27.944 4.822 1.00 0.00 O ATOM 838 CB GLN A 50 12.336 28.613 7.832 1.00 0.00 C ATOM 839 CG GLN A 50 11.511 28.220 9.063 1.00 0.00 C ATOM 840 CD GLN A 50 10.183 27.586 8.641 1.00 0.00 C ATOM 841 OE1 GLN A 50 9.625 26.793 9.373 1.00 0.00 O ATOM 842 NE2 GLN A 50 9.643 27.905 7.495 1.00 0.00 N ATOM 0 H GLN A 50 14.186 27.298 8.836 1.00 0.00 H new ATOM 0 HA GLN A 50 12.109 26.650 6.946 1.00 0.00 H new ATOM 0 HB2 GLN A 50 13.150 29.273 8.130 1.00 0.00 H new ATOM 0 HB3 GLN A 50 11.712 29.171 7.133 1.00 0.00 H new ATOM 0 HG2 GLN A 50 12.076 27.519 9.678 1.00 0.00 H new ATOM 0 HG3 GLN A 50 11.321 29.101 9.677 1.00 0.00 H new ATOM 0 HE21 GLN A 50 10.110 28.571 6.879 1.00 0.00 H new ATOM 0 HE22 GLN A 50 8.755 27.489 7.216 1.00 0.00 H new ATOM 851 N GLU A 51 14.846 28.062 5.869 1.00 0.00 N ATOM 852 CA GLU A 51 15.545 28.525 4.634 1.00 0.00 C ATOM 853 C GLU A 51 15.438 27.478 3.527 1.00 0.00 C ATOM 854 O GLU A 51 15.261 27.807 2.377 1.00 0.00 O ATOM 855 CB GLU A 51 17.019 28.798 4.952 1.00 0.00 C ATOM 856 CG GLU A 51 17.776 27.475 5.096 1.00 0.00 C ATOM 857 CD GLU A 51 19.131 27.736 5.754 1.00 0.00 C ATOM 858 OE1 GLU A 51 19.170 28.509 6.697 1.00 0.00 O ATOM 859 OE2 GLU A 51 20.108 27.161 5.303 1.00 0.00 O ATOM 0 H GLU A 51 15.438 27.969 6.694 1.00 0.00 H new ATOM 0 HA GLU A 51 15.070 29.442 4.286 1.00 0.00 H new ATOM 0 HB2 GLU A 51 17.466 29.398 4.159 1.00 0.00 H new ATOM 0 HB3 GLU A 51 17.100 29.375 5.873 1.00 0.00 H new ATOM 0 HG2 GLU A 51 17.196 26.775 5.697 1.00 0.00 H new ATOM 0 HG3 GLU A 51 17.917 27.015 4.118 1.00 0.00 H new ATOM 866 N VAL A 52 15.556 26.224 3.856 1.00 0.00 N ATOM 867 CA VAL A 52 15.464 25.179 2.803 1.00 0.00 C ATOM 868 C VAL A 52 14.109 25.275 2.144 1.00 0.00 C ATOM 869 O VAL A 52 13.970 25.127 0.951 1.00 0.00 O ATOM 870 CB VAL A 52 15.618 23.801 3.434 1.00 0.00 C ATOM 871 CG1 VAL A 52 15.444 22.721 2.364 1.00 0.00 C ATOM 872 CG2 VAL A 52 17.000 23.682 4.073 1.00 0.00 C ATOM 0 H VAL A 52 15.711 25.879 4.803 1.00 0.00 H new ATOM 0 HA VAL A 52 16.253 25.327 2.066 1.00 0.00 H new ATOM 0 HB VAL A 52 14.856 23.668 4.202 1.00 0.00 H new ATOM 0 HG11 VAL A 52 15.555 21.737 2.819 1.00 0.00 H new ATOM 0 HG12 VAL A 52 14.452 22.806 1.919 1.00 0.00 H new ATOM 0 HG13 VAL A 52 16.201 22.850 1.590 1.00 0.00 H new ATOM 0 HG21 VAL A 52 17.109 22.696 4.524 1.00 0.00 H new ATOM 0 HG22 VAL A 52 17.767 23.819 3.310 1.00 0.00 H new ATOM 0 HG23 VAL A 52 17.113 24.447 4.842 1.00 0.00 H new ATOM 882 N VAL A 53 13.110 25.511 2.924 1.00 0.00 N ATOM 883 CA VAL A 53 11.746 25.614 2.373 1.00 0.00 C ATOM 884 C VAL A 53 11.643 26.839 1.476 1.00 0.00 C ATOM 885 O VAL A 53 10.961 26.821 0.487 1.00 0.00 O ATOM 886 CB VAL A 53 10.756 25.726 3.522 1.00 0.00 C ATOM 887 CG1 VAL A 53 9.338 25.783 2.962 1.00 0.00 C ATOM 888 CG2 VAL A 53 10.915 24.508 4.439 1.00 0.00 C ATOM 0 H VAL A 53 13.179 25.639 3.934 1.00 0.00 H new ATOM 0 HA VAL A 53 11.520 24.727 1.781 1.00 0.00 H new ATOM 0 HB VAL A 53 10.947 26.634 4.095 1.00 0.00 H new ATOM 0 HG11 VAL A 53 8.626 25.863 3.783 1.00 0.00 H new ATOM 0 HG12 VAL A 53 9.239 26.651 2.310 1.00 0.00 H new ATOM 0 HG13 VAL A 53 9.135 24.876 2.393 1.00 0.00 H new ATOM 0 HG21 VAL A 53 10.209 24.580 5.266 1.00 0.00 H new ATOM 0 HG22 VAL A 53 10.718 23.598 3.872 1.00 0.00 H new ATOM 0 HG23 VAL A 53 11.931 24.478 4.832 1.00 0.00 H new ATOM 898 N ASP A 54 12.303 27.904 1.823 1.00 0.00 N ATOM 899 CA ASP A 54 12.229 29.136 0.988 1.00 0.00 C ATOM 900 C ASP A 54 12.906 28.894 -0.357 1.00 0.00 C ATOM 901 O ASP A 54 12.484 29.399 -1.376 1.00 0.00 O ATOM 902 CB ASP A 54 12.925 30.291 1.710 1.00 0.00 C ATOM 903 CG ASP A 54 12.687 31.592 0.940 1.00 0.00 C ATOM 904 OD1 ASP A 54 12.268 31.513 -0.203 1.00 0.00 O ATOM 905 OD2 ASP A 54 12.927 32.645 1.507 1.00 0.00 O ATOM 0 H ASP A 54 12.893 27.977 2.652 1.00 0.00 H new ATOM 0 HA ASP A 54 11.182 29.390 0.822 1.00 0.00 H new ATOM 0 HB2 ASP A 54 12.542 30.382 2.726 1.00 0.00 H new ATOM 0 HB3 ASP A 54 13.994 30.093 1.789 1.00 0.00 H new ATOM 910 N LYS A 55 13.950 28.123 -0.363 1.00 0.00 N ATOM 911 CA LYS A 55 14.662 27.833 -1.635 1.00 0.00 C ATOM 912 C LYS A 55 13.747 26.977 -2.492 1.00 0.00 C ATOM 913 O LYS A 55 13.628 27.164 -3.687 1.00 0.00 O ATOM 914 CB LYS A 55 15.969 27.086 -1.348 1.00 0.00 C ATOM 915 CG LYS A 55 16.705 26.825 -2.665 1.00 0.00 C ATOM 916 CD LYS A 55 18.033 26.120 -2.385 1.00 0.00 C ATOM 917 CE LYS A 55 18.758 25.865 -3.707 1.00 0.00 C ATOM 918 NZ LYS A 55 20.144 25.396 -3.432 1.00 0.00 N ATOM 0 H LYS A 55 14.346 27.677 0.464 1.00 0.00 H new ATOM 0 HA LYS A 55 14.910 28.760 -2.153 1.00 0.00 H new ATOM 0 HB2 LYS A 55 16.597 27.673 -0.678 1.00 0.00 H new ATOM 0 HB3 LYS A 55 15.759 26.143 -0.843 1.00 0.00 H new ATOM 0 HG2 LYS A 55 16.088 26.211 -3.322 1.00 0.00 H new ATOM 0 HG3 LYS A 55 16.885 27.766 -3.185 1.00 0.00 H new ATOM 0 HD2 LYS A 55 18.652 26.733 -1.730 1.00 0.00 H new ATOM 0 HD3 LYS A 55 17.856 25.178 -1.867 1.00 0.00 H new ATOM 0 HE2 LYS A 55 18.220 25.119 -4.291 1.00 0.00 H new ATOM 0 HE3 LYS A 55 18.783 26.778 -4.302 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 20.824 26.040 -3.884 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 20.309 25.383 -2.405 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 20.268 24.437 -3.815 1.00 0.00 H new ATOM 932 N VAL A 56 13.072 26.056 -1.871 1.00 0.00 N ATOM 933 CA VAL A 56 12.127 25.199 -2.621 1.00 0.00 C ATOM 934 C VAL A 56 11.029 26.105 -3.160 1.00 0.00 C ATOM 935 O VAL A 56 10.510 25.909 -4.240 1.00 0.00 O ATOM 936 CB VAL A 56 11.539 24.137 -1.675 1.00 0.00 C ATOM 937 CG1 VAL A 56 10.243 23.555 -2.252 1.00 0.00 C ATOM 938 CG2 VAL A 56 12.555 23.007 -1.496 1.00 0.00 C ATOM 0 H VAL A 56 13.136 25.861 -0.872 1.00 0.00 H new ATOM 0 HA VAL A 56 12.624 24.681 -3.441 1.00 0.00 H new ATOM 0 HB VAL A 56 11.319 24.606 -0.716 1.00 0.00 H new ATOM 0 HG11 VAL A 56 9.844 22.806 -1.568 1.00 0.00 H new ATOM 0 HG12 VAL A 56 9.512 24.353 -2.383 1.00 0.00 H new ATOM 0 HG13 VAL A 56 10.450 23.091 -3.216 1.00 0.00 H new ATOM 0 HG21 VAL A 56 12.144 22.251 -0.827 1.00 0.00 H new ATOM 0 HG22 VAL A 56 12.771 22.555 -2.464 1.00 0.00 H new ATOM 0 HG23 VAL A 56 13.474 23.408 -1.069 1.00 0.00 H new ATOM 948 N MET A 57 10.680 27.104 -2.402 1.00 0.00 N ATOM 949 CA MET A 57 9.620 28.040 -2.850 1.00 0.00 C ATOM 950 C MET A 57 10.138 28.880 -4.011 1.00 0.00 C ATOM 951 O MET A 57 9.389 29.322 -4.840 1.00 0.00 O ATOM 952 CB MET A 57 9.161 28.922 -1.690 1.00 0.00 C ATOM 953 CG MET A 57 8.378 28.056 -0.697 1.00 0.00 C ATOM 954 SD MET A 57 6.763 27.621 -1.397 1.00 0.00 S ATOM 955 CE MET A 57 5.866 29.122 -0.926 1.00 0.00 C ATOM 0 H MET A 57 11.085 27.312 -1.489 1.00 0.00 H new ATOM 0 HA MET A 57 8.756 27.470 -3.193 1.00 0.00 H new ATOM 0 HB2 MET A 57 10.020 29.378 -1.198 1.00 0.00 H new ATOM 0 HB3 MET A 57 8.535 29.735 -2.058 1.00 0.00 H new ATOM 0 HG2 MET A 57 8.941 27.151 -0.468 1.00 0.00 H new ATOM 0 HG3 MET A 57 8.244 28.594 0.241 1.00 0.00 H new ATOM 0 HE1 MET A 57 5.168 28.891 -0.121 1.00 0.00 H new ATOM 0 HE2 MET A 57 6.574 29.878 -0.587 1.00 0.00 H new ATOM 0 HE3 MET A 57 5.315 29.501 -1.786 1.00 0.00 H new ATOM 965 N GLU A 58 11.416 29.087 -4.117 1.00 0.00 N ATOM 966 CA GLU A 58 11.900 29.878 -5.276 1.00 0.00 C ATOM 967 C GLU A 58 11.463 29.112 -6.522 1.00 0.00 C ATOM 968 O GLU A 58 11.016 29.674 -7.502 1.00 0.00 O ATOM 969 CB GLU A 58 13.426 30.002 -5.234 1.00 0.00 C ATOM 970 CG GLU A 58 13.903 30.838 -6.423 1.00 0.00 C ATOM 971 CD GLU A 58 15.427 30.962 -6.379 1.00 0.00 C ATOM 972 OE1 GLU A 58 16.014 30.484 -5.423 1.00 0.00 O ATOM 973 OE2 GLU A 58 15.982 31.532 -7.304 1.00 0.00 O ATOM 0 H GLU A 58 12.131 28.753 -3.470 1.00 0.00 H new ATOM 0 HA GLU A 58 11.493 30.889 -5.268 1.00 0.00 H new ATOM 0 HB2 GLU A 58 13.738 30.468 -4.299 1.00 0.00 H new ATOM 0 HB3 GLU A 58 13.883 29.013 -5.265 1.00 0.00 H new ATOM 0 HG2 GLU A 58 13.592 30.371 -7.358 1.00 0.00 H new ATOM 0 HG3 GLU A 58 13.446 31.827 -6.393 1.00 0.00 H new ATOM 980 N THR A 59 11.571 27.815 -6.459 1.00 0.00 N ATOM 981 CA THR A 59 11.148 26.952 -7.592 1.00 0.00 C ATOM 982 C THR A 59 9.628 26.705 -7.540 1.00 0.00 C ATOM 983 O THR A 59 8.971 26.629 -8.559 1.00 0.00 O ATOM 984 CB THR A 59 11.893 25.615 -7.487 1.00 0.00 C ATOM 985 OG1 THR A 59 13.269 25.817 -7.777 1.00 0.00 O ATOM 986 CG2 THR A 59 11.307 24.600 -8.471 1.00 0.00 C ATOM 0 H THR A 59 11.942 27.309 -5.655 1.00 0.00 H new ATOM 0 HA THR A 59 11.384 27.444 -8.536 1.00 0.00 H new ATOM 0 HB THR A 59 11.782 25.227 -6.474 1.00 0.00 H new ATOM 0 HG1 THR A 59 13.746 24.964 -7.709 1.00 0.00 H new ATOM 0 HG21 THR A 59 11.846 23.657 -8.385 1.00 0.00 H new ATOM 0 HG22 THR A 59 10.254 24.438 -8.243 1.00 0.00 H new ATOM 0 HG23 THR A 59 11.404 24.981 -9.488 1.00 0.00 H new ATOM 994 N LEU A 60 9.073 26.540 -6.362 1.00 0.00 N ATOM 995 CA LEU A 60 7.607 26.251 -6.246 1.00 0.00 C ATOM 996 C LEU A 60 6.798 27.553 -6.194 1.00 0.00 C ATOM 997 O LEU A 60 5.610 27.558 -6.447 1.00 0.00 O ATOM 998 CB LEU A 60 7.366 25.413 -4.964 1.00 0.00 C ATOM 999 CG LEU A 60 6.579 24.133 -5.296 1.00 0.00 C ATOM 1000 CD1 LEU A 60 7.501 23.126 -6.011 1.00 0.00 C ATOM 1001 CD2 LEU A 60 6.037 23.511 -3.999 1.00 0.00 C ATOM 0 H LEU A 60 9.573 26.593 -5.474 1.00 0.00 H new ATOM 0 HA LEU A 60 7.277 25.691 -7.121 1.00 0.00 H new ATOM 0 HB2 LEU A 60 8.321 25.152 -4.509 1.00 0.00 H new ATOM 0 HB3 LEU A 60 6.816 26.006 -4.233 1.00 0.00 H new ATOM 0 HG LEU A 60 5.745 24.382 -5.952 1.00 0.00 H new ATOM 0 HD11 LEU A 60 6.940 22.221 -6.244 1.00 0.00 H new ATOM 0 HD12 LEU A 60 7.877 23.568 -6.934 1.00 0.00 H new ATOM 0 HD13 LEU A 60 8.340 22.876 -5.361 1.00 0.00 H new ATOM 0 HD21 LEU A 60 5.480 22.605 -4.235 1.00 0.00 H new ATOM 0 HD22 LEU A 60 6.868 23.264 -3.339 1.00 0.00 H new ATOM 0 HD23 LEU A 60 5.378 24.223 -3.502 1.00 0.00 H new ATOM 1013 N ASP A 61 7.418 28.654 -5.895 1.00 0.00 N ATOM 1014 CA ASP A 61 6.656 29.933 -5.871 1.00 0.00 C ATOM 1015 C ASP A 61 6.554 30.387 -7.319 1.00 0.00 C ATOM 1016 O ASP A 61 7.069 31.413 -7.715 1.00 0.00 O ATOM 1017 CB ASP A 61 7.390 30.981 -5.027 1.00 0.00 C ATOM 1018 CG ASP A 61 6.486 32.192 -4.814 1.00 0.00 C ATOM 1019 OD1 ASP A 61 5.429 32.231 -5.420 1.00 0.00 O ATOM 1020 OD2 ASP A 61 6.869 33.064 -4.051 1.00 0.00 O ATOM 0 H ASP A 61 8.410 28.728 -5.668 1.00 0.00 H new ATOM 0 HA ASP A 61 5.670 29.801 -5.425 1.00 0.00 H new ATOM 0 HB2 ASP A 61 7.675 30.554 -4.066 1.00 0.00 H new ATOM 0 HB3 ASP A 61 8.310 31.285 -5.526 1.00 0.00 H new ATOM 1025 N GLU A 62 5.922 29.576 -8.115 1.00 0.00 N ATOM 1026 CA GLU A 62 5.795 29.867 -9.566 1.00 0.00 C ATOM 1027 C GLU A 62 5.063 31.189 -9.790 1.00 0.00 C ATOM 1028 O GLU A 62 5.420 31.962 -10.656 1.00 0.00 O ATOM 1029 CB GLU A 62 5.000 28.738 -10.215 1.00 0.00 C ATOM 1030 CG GLU A 62 5.598 27.388 -9.799 1.00 0.00 C ATOM 1031 CD GLU A 62 4.961 26.269 -10.625 1.00 0.00 C ATOM 1032 OE1 GLU A 62 4.005 26.550 -11.329 1.00 0.00 O ATOM 1033 OE2 GLU A 62 5.442 25.151 -10.542 1.00 0.00 O ATOM 0 H GLU A 62 5.480 28.707 -7.815 1.00 0.00 H new ATOM 0 HA GLU A 62 6.789 29.944 -10.006 1.00 0.00 H new ATOM 0 HB2 GLU A 62 3.955 28.794 -9.912 1.00 0.00 H new ATOM 0 HB3 GLU A 62 5.023 28.839 -11.300 1.00 0.00 H new ATOM 0 HG2 GLU A 62 6.678 27.395 -9.949 1.00 0.00 H new ATOM 0 HG3 GLU A 62 5.425 27.214 -8.737 1.00 0.00 H new ATOM 1040 N ASP A 63 4.046 31.463 -9.024 1.00 0.00 N ATOM 1041 CA ASP A 63 3.305 32.744 -9.211 1.00 0.00 C ATOM 1042 C ASP A 63 4.018 33.847 -8.430 1.00 0.00 C ATOM 1043 O ASP A 63 3.644 35.002 -8.483 1.00 0.00 O ATOM 1044 CB ASP A 63 1.867 32.590 -8.709 1.00 0.00 C ATOM 1045 CG ASP A 63 1.868 32.349 -7.200 1.00 0.00 C ATOM 1046 OD1 ASP A 63 2.899 31.953 -6.682 1.00 0.00 O ATOM 1047 OD2 ASP A 63 0.835 32.561 -6.588 1.00 0.00 O ATOM 0 H ASP A 63 3.695 30.860 -8.280 1.00 0.00 H new ATOM 0 HA ASP A 63 3.279 33.005 -10.269 1.00 0.00 H new ATOM 0 HB2 ASP A 63 1.293 33.486 -8.943 1.00 0.00 H new ATOM 0 HB3 ASP A 63 1.381 31.758 -9.219 1.00 0.00 H new ATOM 1052 N GLY A 64 5.058 33.501 -7.722 1.00 0.00 N ATOM 1053 CA GLY A 64 5.814 34.533 -6.954 1.00 0.00 C ATOM 1054 C GLY A 64 4.948 35.096 -5.821 1.00 0.00 C ATOM 1055 O GLY A 64 5.037 36.263 -5.494 1.00 0.00 O ATOM 0 H GLY A 64 5.417 32.550 -7.642 1.00 0.00 H new ATOM 0 HA2 GLY A 64 6.723 34.095 -6.542 1.00 0.00 H new ATOM 0 HA3 GLY A 64 6.121 35.339 -7.620 1.00 0.00 H new ATOM 1059 N ASP A 65 4.107 34.285 -5.220 1.00 0.00 N ATOM 1060 CA ASP A 65 3.231 34.788 -4.111 1.00 0.00 C ATOM 1061 C ASP A 65 3.757 34.295 -2.760 1.00 0.00 C ATOM 1062 O ASP A 65 3.201 34.593 -1.723 1.00 0.00 O ATOM 1063 CB ASP A 65 1.809 34.263 -4.321 1.00 0.00 C ATOM 1064 CG ASP A 65 1.796 32.741 -4.161 1.00 0.00 C ATOM 1065 OD1 ASP A 65 2.868 32.160 -4.118 1.00 0.00 O ATOM 1066 OD2 ASP A 65 0.714 32.183 -4.084 1.00 0.00 O ATOM 0 H ASP A 65 3.989 33.298 -5.449 1.00 0.00 H new ATOM 0 HA ASP A 65 3.233 35.878 -4.117 1.00 0.00 H new ATOM 0 HB2 ASP A 65 1.131 34.721 -3.600 1.00 0.00 H new ATOM 0 HB3 ASP A 65 1.452 34.538 -5.313 1.00 0.00 H new ATOM 1071 N GLY A 66 4.820 33.540 -2.763 1.00 0.00 N ATOM 1072 CA GLY A 66 5.372 33.027 -1.476 1.00 0.00 C ATOM 1073 C GLY A 66 4.530 31.841 -1.008 1.00 0.00 C ATOM 1074 O GLY A 66 4.731 31.301 0.062 1.00 0.00 O ATOM 0 H GLY A 66 5.330 33.256 -3.599 1.00 0.00 H new ATOM 0 HA2 GLY A 66 6.410 32.722 -1.607 1.00 0.00 H new ATOM 0 HA3 GLY A 66 5.363 33.815 -0.723 1.00 0.00 H new ATOM 1078 N GLU A 67 3.583 31.438 -1.811 1.00 0.00 N ATOM 1079 CA GLU A 67 2.702 30.291 -1.448 1.00 0.00 C ATOM 1080 C GLU A 67 2.508 29.415 -2.688 1.00 0.00 C ATOM 1081 O GLU A 67 2.223 29.909 -3.760 1.00 0.00 O ATOM 1082 CB GLU A 67 1.343 30.836 -0.997 1.00 0.00 C ATOM 1083 CG GLU A 67 1.563 32.038 -0.078 1.00 0.00 C ATOM 1084 CD GLU A 67 0.237 32.445 0.566 1.00 0.00 C ATOM 1085 OE1 GLU A 67 -0.780 31.890 0.185 1.00 0.00 O ATOM 1086 OE2 GLU A 67 0.261 33.309 1.428 1.00 0.00 O ATOM 0 H GLU A 67 3.380 31.861 -2.716 1.00 0.00 H new ATOM 0 HA GLU A 67 3.150 29.706 -0.644 1.00 0.00 H new ATOM 0 HB2 GLU A 67 0.750 31.129 -1.863 1.00 0.00 H new ATOM 0 HB3 GLU A 67 0.782 30.061 -0.474 1.00 0.00 H new ATOM 0 HG2 GLU A 67 2.292 31.789 0.694 1.00 0.00 H new ATOM 0 HG3 GLU A 67 1.973 32.872 -0.647 1.00 0.00 H new ATOM 1093 N CYS A 68 2.641 28.120 -2.556 1.00 0.00 N ATOM 1094 CA CYS A 68 2.445 27.223 -3.742 1.00 0.00 C ATOM 1095 C CYS A 68 1.005 26.709 -3.736 1.00 0.00 C ATOM 1096 O CYS A 68 0.545 26.116 -2.788 1.00 0.00 O ATOM 1097 CB CYS A 68 3.426 26.046 -3.696 1.00 0.00 C ATOM 1098 SG CYS A 68 3.433 25.326 -2.035 1.00 0.00 S ATOM 0 H CYS A 68 2.875 27.644 -1.685 1.00 0.00 H new ATOM 0 HA CYS A 68 2.635 27.784 -4.657 1.00 0.00 H new ATOM 0 HB2 CYS A 68 3.140 25.292 -4.429 1.00 0.00 H new ATOM 0 HB3 CYS A 68 4.428 26.384 -3.961 1.00 0.00 H new ATOM 0 HG CYS A 68 3.701 24.056 -2.113 1.00 0.00 H new ATOM 1104 N ASP A 69 0.290 26.965 -4.788 1.00 0.00 N ATOM 1105 CA ASP A 69 -1.136 26.537 -4.870 1.00 0.00 C ATOM 1106 C ASP A 69 -1.240 25.048 -5.193 1.00 0.00 C ATOM 1107 O ASP A 69 -0.266 24.395 -5.515 1.00 0.00 O ATOM 1108 CB ASP A 69 -1.838 27.339 -5.966 1.00 0.00 C ATOM 1109 CG ASP A 69 -1.988 28.792 -5.516 1.00 0.00 C ATOM 1110 OD1 ASP A 69 -2.022 29.020 -4.318 1.00 0.00 O ATOM 1111 OD2 ASP A 69 -2.063 29.654 -6.377 1.00 0.00 O ATOM 0 H ASP A 69 0.635 27.460 -5.610 1.00 0.00 H new ATOM 0 HA ASP A 69 -1.610 26.717 -3.905 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -1.264 27.291 -6.891 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -2.817 26.909 -6.176 1.00 0.00 H new ATOM 1116 N PHE A 70 -2.431 24.511 -5.104 1.00 0.00 N ATOM 1117 CA PHE A 70 -2.644 23.065 -5.397 1.00 0.00 C ATOM 1118 C PHE A 70 -1.884 22.701 -6.676 1.00 0.00 C ATOM 1119 O PHE A 70 -1.223 21.690 -6.747 1.00 0.00 O ATOM 1120 CB PHE A 70 -4.153 22.829 -5.601 1.00 0.00 C ATOM 1121 CG PHE A 70 -4.512 21.392 -5.285 1.00 0.00 C ATOM 1122 CD1 PHE A 70 -4.105 20.360 -6.138 1.00 0.00 C ATOM 1123 CD2 PHE A 70 -5.250 21.094 -4.134 1.00 0.00 C ATOM 1124 CE1 PHE A 70 -4.434 19.033 -5.839 1.00 0.00 C ATOM 1125 CE2 PHE A 70 -5.578 19.769 -3.834 1.00 0.00 C ATOM 1126 CZ PHE A 70 -5.170 18.738 -4.686 1.00 0.00 C ATOM 0 H PHE A 70 -3.273 25.021 -4.837 1.00 0.00 H new ATOM 0 HA PHE A 70 -2.281 22.448 -4.575 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -4.722 23.502 -4.960 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -4.428 23.061 -6.630 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -3.537 20.588 -7.028 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -5.567 21.890 -3.476 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -4.120 18.237 -6.498 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -6.146 19.541 -2.944 1.00 0.00 H new ATOM 0 HZ PHE A 70 -5.423 17.714 -4.454 1.00 0.00 H new ATOM 1136 N GLN A 71 -1.972 23.530 -7.679 1.00 0.00 N ATOM 1137 CA GLN A 71 -1.248 23.253 -8.954 1.00 0.00 C ATOM 1138 C GLN A 71 0.265 23.221 -8.711 1.00 0.00 C ATOM 1139 O GLN A 71 0.958 22.322 -9.136 1.00 0.00 O ATOM 1140 CB GLN A 71 -1.585 24.369 -9.958 1.00 0.00 C ATOM 1141 CG GLN A 71 -0.577 24.375 -11.115 1.00 0.00 C ATOM 1142 CD GLN A 71 -1.100 25.261 -12.247 1.00 0.00 C ATOM 1143 OE1 GLN A 71 -2.245 25.668 -12.238 1.00 0.00 O ATOM 1144 NE2 GLN A 71 -0.303 25.579 -13.231 1.00 0.00 N ATOM 0 H GLN A 71 -2.517 24.392 -7.671 1.00 0.00 H new ATOM 0 HA GLN A 71 -1.556 22.284 -9.346 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -2.593 24.224 -10.347 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -1.574 25.335 -9.454 1.00 0.00 H new ATOM 0 HG2 GLN A 71 0.388 24.743 -10.768 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -0.419 23.359 -11.478 1.00 0.00 H new ATOM 0 HE21 GLN A 71 0.658 25.238 -13.239 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -0.642 26.169 -13.991 1.00 0.00 H new ATOM 1153 N GLU A 72 0.779 24.217 -8.061 1.00 0.00 N ATOM 1154 CA GLU A 72 2.245 24.276 -7.816 1.00 0.00 C ATOM 1155 C GLU A 72 2.701 23.080 -6.976 1.00 0.00 C ATOM 1156 O GLU A 72 3.742 22.502 -7.221 1.00 0.00 O ATOM 1157 CB GLU A 72 2.561 25.591 -7.106 1.00 0.00 C ATOM 1158 CG GLU A 72 2.362 26.750 -8.086 1.00 0.00 C ATOM 1159 CD GLU A 72 2.667 28.076 -7.387 1.00 0.00 C ATOM 1160 OE1 GLU A 72 1.786 28.583 -6.711 1.00 0.00 O ATOM 1161 OE2 GLU A 72 3.773 28.564 -7.542 1.00 0.00 O ATOM 0 H GLU A 72 0.246 25.001 -7.684 1.00 0.00 H new ATOM 0 HA GLU A 72 2.782 24.231 -8.764 1.00 0.00 H new ATOM 0 HB2 GLU A 72 1.912 25.716 -6.239 1.00 0.00 H new ATOM 0 HB3 GLU A 72 3.587 25.582 -6.737 1.00 0.00 H new ATOM 0 HG2 GLU A 72 3.015 26.625 -8.950 1.00 0.00 H new ATOM 0 HG3 GLU A 72 1.338 26.752 -8.459 1.00 0.00 H new ATOM 1168 N PHE A 73 1.937 22.695 -5.997 1.00 0.00 N ATOM 1169 CA PHE A 73 2.342 21.531 -5.163 1.00 0.00 C ATOM 1170 C PHE A 73 2.262 20.261 -5.995 1.00 0.00 C ATOM 1171 O PHE A 73 2.976 19.310 -5.758 1.00 0.00 O ATOM 1172 CB PHE A 73 1.425 21.387 -3.949 1.00 0.00 C ATOM 1173 CG PHE A 73 1.863 20.173 -3.161 1.00 0.00 C ATOM 1174 CD1 PHE A 73 1.312 18.918 -3.449 1.00 0.00 C ATOM 1175 CD2 PHE A 73 2.836 20.298 -2.163 1.00 0.00 C ATOM 1176 CE1 PHE A 73 1.733 17.788 -2.737 1.00 0.00 C ATOM 1177 CE2 PHE A 73 3.254 19.168 -1.450 1.00 0.00 C ATOM 1178 CZ PHE A 73 2.704 17.913 -1.738 1.00 0.00 C ATOM 0 H PHE A 73 1.053 23.133 -5.738 1.00 0.00 H new ATOM 0 HA PHE A 73 3.363 21.694 -4.817 1.00 0.00 H new ATOM 0 HB2 PHE A 73 1.476 22.281 -3.327 1.00 0.00 H new ATOM 0 HB3 PHE A 73 0.388 21.278 -4.268 1.00 0.00 H new ATOM 0 HD1 PHE A 73 0.562 18.822 -4.220 1.00 0.00 H new ATOM 0 HD2 PHE A 73 3.264 21.265 -1.943 1.00 0.00 H new ATOM 0 HE1 PHE A 73 1.308 16.820 -2.959 1.00 0.00 H new ATOM 0 HE2 PHE A 73 4.002 19.264 -0.677 1.00 0.00 H new ATOM 0 HZ PHE A 73 3.029 17.042 -1.189 1.00 0.00 H new ATOM 1188 N MET A 74 1.387 20.230 -6.956 1.00 0.00 N ATOM 1189 CA MET A 74 1.252 19.010 -7.785 1.00 0.00 C ATOM 1190 C MET A 74 2.576 18.720 -8.475 1.00 0.00 C ATOM 1191 O MET A 74 2.985 17.584 -8.608 1.00 0.00 O ATOM 1192 CB MET A 74 0.143 19.193 -8.833 1.00 0.00 C ATOM 1193 CG MET A 74 -1.250 19.220 -8.153 1.00 0.00 C ATOM 1194 SD MET A 74 -2.249 17.810 -8.710 1.00 0.00 S ATOM 1195 CE MET A 74 -1.200 16.487 -8.058 1.00 0.00 C ATOM 0 H MET A 74 0.761 20.997 -7.202 1.00 0.00 H new ATOM 0 HA MET A 74 0.984 18.171 -7.143 1.00 0.00 H new ATOM 0 HB2 MET A 74 0.304 20.121 -9.382 1.00 0.00 H new ATOM 0 HB3 MET A 74 0.184 18.381 -9.559 1.00 0.00 H new ATOM 0 HG2 MET A 74 -1.134 19.187 -7.070 1.00 0.00 H new ATOM 0 HG3 MET A 74 -1.761 20.153 -8.391 1.00 0.00 H new ATOM 0 HE1 MET A 74 -1.821 15.638 -7.772 1.00 0.00 H new ATOM 0 HE2 MET A 74 -0.489 16.175 -8.824 1.00 0.00 H new ATOM 0 HE3 MET A 74 -0.657 16.850 -7.185 1.00 0.00 H new ATOM 1205 N ALA A 75 3.251 19.728 -8.933 1.00 0.00 N ATOM 1206 CA ALA A 75 4.542 19.468 -9.619 1.00 0.00 C ATOM 1207 C ALA A 75 5.593 18.994 -8.604 1.00 0.00 C ATOM 1208 O ALA A 75 6.450 18.195 -8.918 1.00 0.00 O ATOM 1209 CB ALA A 75 5.010 20.738 -10.341 1.00 0.00 C ATOM 0 H ALA A 75 2.973 20.707 -8.865 1.00 0.00 H new ATOM 0 HA ALA A 75 4.406 18.680 -10.359 1.00 0.00 H new ATOM 0 HB1 ALA A 75 5.958 20.543 -10.843 1.00 0.00 H new ATOM 0 HB2 ALA A 75 4.263 21.034 -11.078 1.00 0.00 H new ATOM 0 HB3 ALA A 75 5.142 21.541 -9.616 1.00 0.00 H new ATOM 1215 N PHE A 76 5.537 19.473 -7.395 1.00 0.00 N ATOM 1216 CA PHE A 76 6.536 19.035 -6.369 1.00 0.00 C ATOM 1217 C PHE A 76 6.456 17.525 -6.151 1.00 0.00 C ATOM 1218 O PHE A 76 7.450 16.858 -5.978 1.00 0.00 O ATOM 1219 CB PHE A 76 6.247 19.749 -5.048 1.00 0.00 C ATOM 1220 CG PHE A 76 7.235 19.303 -3.995 1.00 0.00 C ATOM 1221 CD1 PHE A 76 8.558 19.759 -4.035 1.00 0.00 C ATOM 1222 CD2 PHE A 76 6.826 18.434 -2.975 1.00 0.00 C ATOM 1223 CE1 PHE A 76 9.469 19.349 -3.056 1.00 0.00 C ATOM 1224 CE2 PHE A 76 7.737 18.025 -1.996 1.00 0.00 C ATOM 1225 CZ PHE A 76 9.059 18.483 -2.036 1.00 0.00 C ATOM 0 H PHE A 76 4.846 20.148 -7.068 1.00 0.00 H new ATOM 0 HA PHE A 76 7.536 19.287 -6.723 1.00 0.00 H new ATOM 0 HB2 PHE A 76 6.312 20.828 -5.186 1.00 0.00 H new ATOM 0 HB3 PHE A 76 5.230 19.530 -4.721 1.00 0.00 H new ATOM 0 HD1 PHE A 76 8.875 20.427 -4.822 1.00 0.00 H new ATOM 0 HD2 PHE A 76 5.806 18.080 -2.945 1.00 0.00 H new ATOM 0 HE1 PHE A 76 10.490 19.701 -3.087 1.00 0.00 H new ATOM 0 HE2 PHE A 76 7.421 17.356 -1.209 1.00 0.00 H new ATOM 0 HZ PHE A 76 9.763 18.168 -1.280 1.00 0.00 H new ATOM 1235 N VAL A 77 5.274 16.997 -6.131 1.00 0.00 N ATOM 1236 CA VAL A 77 5.090 15.529 -5.895 1.00 0.00 C ATOM 1237 C VAL A 77 5.684 14.734 -7.056 1.00 0.00 C ATOM 1238 O VAL A 77 6.193 13.651 -6.878 1.00 0.00 O ATOM 1239 CB VAL A 77 3.581 15.207 -5.751 1.00 0.00 C ATOM 1240 CG1 VAL A 77 3.342 14.235 -4.590 1.00 0.00 C ATOM 1241 CG2 VAL A 77 2.808 16.495 -5.487 1.00 0.00 C ATOM 0 H VAL A 77 4.409 17.519 -6.269 1.00 0.00 H new ATOM 0 HA VAL A 77 5.605 15.249 -4.976 1.00 0.00 H new ATOM 0 HB VAL A 77 3.237 14.745 -6.676 1.00 0.00 H new ATOM 0 HG11 VAL A 77 2.276 14.023 -4.507 1.00 0.00 H new ATOM 0 HG12 VAL A 77 3.884 13.307 -4.775 1.00 0.00 H new ATOM 0 HG13 VAL A 77 3.696 14.683 -3.662 1.00 0.00 H new ATOM 0 HG21 VAL A 77 1.747 16.268 -5.386 1.00 0.00 H new ATOM 0 HG22 VAL A 77 3.170 16.955 -4.567 1.00 0.00 H new ATOM 0 HG23 VAL A 77 2.954 17.184 -6.319 1.00 0.00 H new ATOM 1251 N SER A 78 5.604 15.251 -8.241 1.00 0.00 N ATOM 1252 CA SER A 78 6.155 14.513 -9.408 1.00 0.00 C ATOM 1253 C SER A 78 7.679 14.476 -9.312 1.00 0.00 C ATOM 1254 O SER A 78 8.314 13.495 -9.643 1.00 0.00 O ATOM 1255 CB SER A 78 5.724 15.215 -10.699 1.00 0.00 C ATOM 1256 OG SER A 78 5.801 16.621 -10.522 1.00 0.00 O ATOM 0 H SER A 78 5.181 16.154 -8.457 1.00 0.00 H new ATOM 0 HA SER A 78 5.775 13.491 -9.413 1.00 0.00 H new ATOM 0 HB2 SER A 78 6.365 14.906 -11.525 1.00 0.00 H new ATOM 0 HB3 SER A 78 4.706 14.926 -10.960 1.00 0.00 H new ATOM 0 HG SER A 78 6.355 16.822 -9.739 1.00 0.00 H new ATOM 1262 N MET A 79 8.265 15.554 -8.889 1.00 0.00 N ATOM 1263 CA MET A 79 9.747 15.622 -8.794 1.00 0.00 C ATOM 1264 C MET A 79 10.283 14.685 -7.709 1.00 0.00 C ATOM 1265 O MET A 79 11.251 13.969 -7.905 1.00 0.00 O ATOM 1266 CB MET A 79 10.116 17.062 -8.439 1.00 0.00 C ATOM 1267 CG MET A 79 9.832 17.978 -9.634 1.00 0.00 C ATOM 1268 SD MET A 79 10.005 19.705 -9.119 1.00 0.00 S ATOM 1269 CE MET A 79 11.771 19.645 -8.749 1.00 0.00 C ATOM 0 H MET A 79 7.777 16.402 -8.601 1.00 0.00 H new ATOM 0 HA MET A 79 10.186 15.314 -9.743 1.00 0.00 H new ATOM 0 HB2 MET A 79 9.543 17.391 -7.572 1.00 0.00 H new ATOM 0 HB3 MET A 79 11.170 17.121 -8.166 1.00 0.00 H new ATOM 0 HG2 MET A 79 10.523 17.758 -10.448 1.00 0.00 H new ATOM 0 HG3 MET A 79 8.826 17.799 -10.013 1.00 0.00 H new ATOM 0 HE1 MET A 79 12.185 20.652 -8.788 1.00 0.00 H new ATOM 0 HE2 MET A 79 11.920 19.230 -7.752 1.00 0.00 H new ATOM 0 HE3 MET A 79 12.275 19.017 -9.483 1.00 0.00 H new ATOM 1279 N VAL A 80 9.680 14.693 -6.564 1.00 0.00 N ATOM 1280 CA VAL A 80 10.172 13.824 -5.464 1.00 0.00 C ATOM 1281 C VAL A 80 9.886 12.360 -5.783 1.00 0.00 C ATOM 1282 O VAL A 80 10.652 11.478 -5.447 1.00 0.00 O ATOM 1283 CB VAL A 80 9.483 14.199 -4.158 1.00 0.00 C ATOM 1284 CG1 VAL A 80 10.078 13.361 -3.032 1.00 0.00 C ATOM 1285 CG2 VAL A 80 9.702 15.686 -3.859 1.00 0.00 C ATOM 0 H VAL A 80 8.865 15.264 -6.337 1.00 0.00 H new ATOM 0 HA VAL A 80 11.248 13.967 -5.362 1.00 0.00 H new ATOM 0 HB VAL A 80 8.413 14.010 -4.241 1.00 0.00 H new ATOM 0 HG11 VAL A 80 9.593 13.620 -2.091 1.00 0.00 H new ATOM 0 HG12 VAL A 80 9.920 12.303 -3.243 1.00 0.00 H new ATOM 0 HG13 VAL A 80 11.147 13.560 -2.956 1.00 0.00 H new ATOM 0 HG21 VAL A 80 9.206 15.946 -2.924 1.00 0.00 H new ATOM 0 HG22 VAL A 80 10.770 15.886 -3.771 1.00 0.00 H new ATOM 0 HG23 VAL A 80 9.286 16.285 -4.669 1.00 0.00 H new ATOM 1295 N THR A 81 8.785 12.093 -6.417 1.00 0.00 N ATOM 1296 CA THR A 81 8.446 10.681 -6.744 1.00 0.00 C ATOM 1297 C THR A 81 9.550 10.119 -7.626 1.00 0.00 C ATOM 1298 O THR A 81 9.969 8.989 -7.482 1.00 0.00 O ATOM 1299 CB THR A 81 7.106 10.608 -7.471 1.00 0.00 C ATOM 1300 OG1 THR A 81 6.093 11.173 -6.650 1.00 0.00 O ATOM 1301 CG2 THR A 81 6.771 9.140 -7.747 1.00 0.00 C ATOM 0 H THR A 81 8.104 12.788 -6.724 1.00 0.00 H new ATOM 0 HA THR A 81 8.363 10.098 -5.826 1.00 0.00 H new ATOM 0 HB THR A 81 7.164 11.160 -8.409 1.00 0.00 H new ATOM 0 HG1 THR A 81 5.786 12.017 -7.043 1.00 0.00 H new ATOM 0 HG21 THR A 81 5.815 9.076 -8.266 1.00 0.00 H new ATOM 0 HG22 THR A 81 7.551 8.699 -8.368 1.00 0.00 H new ATOM 0 HG23 THR A 81 6.708 8.598 -6.804 1.00 0.00 H new ATOM 1309 N THR A 82 10.031 10.912 -8.536 1.00 0.00 N ATOM 1310 CA THR A 82 11.118 10.445 -9.428 1.00 0.00 C ATOM 1311 C THR A 82 12.261 9.943 -8.544 1.00 0.00 C ATOM 1312 O THR A 82 12.907 8.959 -8.841 1.00 0.00 O ATOM 1313 CB THR A 82 11.597 11.622 -10.285 1.00 0.00 C ATOM 1314 OG1 THR A 82 10.473 12.366 -10.730 1.00 0.00 O ATOM 1315 CG2 THR A 82 12.366 11.104 -11.499 1.00 0.00 C ATOM 0 H THR A 82 9.716 11.868 -8.700 1.00 0.00 H new ATOM 0 HA THR A 82 10.773 9.646 -10.085 1.00 0.00 H new ATOM 0 HB THR A 82 12.251 12.257 -9.687 1.00 0.00 H new ATOM 0 HG1 THR A 82 9.664 11.820 -10.643 1.00 0.00 H new ATOM 0 HG21 THR A 82 12.703 11.947 -12.103 1.00 0.00 H new ATOM 0 HG22 THR A 82 13.229 10.529 -11.165 1.00 0.00 H new ATOM 0 HG23 THR A 82 11.715 10.466 -12.097 1.00 0.00 H new ATOM 1323 N ALA A 83 12.500 10.611 -7.446 1.00 0.00 N ATOM 1324 CA ALA A 83 13.586 10.165 -6.525 1.00 0.00 C ATOM 1325 C ALA A 83 13.288 8.743 -6.037 1.00 0.00 C ATOM 1326 O ALA A 83 14.173 7.919 -5.926 1.00 0.00 O ATOM 1327 CB ALA A 83 13.662 11.118 -5.327 1.00 0.00 C ATOM 0 H ALA A 83 11.992 11.444 -7.148 1.00 0.00 H new ATOM 0 HA ALA A 83 14.540 10.173 -7.053 1.00 0.00 H new ATOM 0 HB1 ALA A 83 14.455 10.793 -4.653 1.00 0.00 H new ATOM 0 HB2 ALA A 83 13.875 12.128 -5.678 1.00 0.00 H new ATOM 0 HB3 ALA A 83 12.710 11.112 -4.796 1.00 0.00 H new ATOM 1333 N CYS A 84 12.049 8.451 -5.747 1.00 0.00 N ATOM 1334 CA CYS A 84 11.695 7.083 -5.269 1.00 0.00 C ATOM 1335 C CYS A 84 12.070 6.055 -6.338 1.00 0.00 C ATOM 1336 O CYS A 84 12.535 4.975 -6.034 1.00 0.00 O ATOM 1337 CB CYS A 84 10.195 7.000 -4.983 1.00 0.00 C ATOM 1338 SG CYS A 84 9.739 5.280 -4.651 1.00 0.00 S ATOM 0 H CYS A 84 11.266 9.101 -5.820 1.00 0.00 H new ATOM 0 HA CYS A 84 12.245 6.873 -4.351 1.00 0.00 H new ATOM 0 HB2 CYS A 84 9.942 7.626 -4.128 1.00 0.00 H new ATOM 0 HB3 CYS A 84 9.630 7.380 -5.834 1.00 0.00 H new ATOM 0 HG CYS A 84 8.464 5.209 -4.406 1.00 0.00 H new ATOM 1344 N HIS A 85 11.870 6.375 -7.589 1.00 0.00 N ATOM 1345 CA HIS A 85 12.217 5.397 -8.658 1.00 0.00 C ATOM 1346 C HIS A 85 13.706 5.075 -8.580 1.00 0.00 C ATOM 1347 O HIS A 85 14.113 3.940 -8.729 1.00 0.00 O ATOM 1348 CB HIS A 85 11.909 6.006 -10.028 1.00 0.00 C ATOM 1349 CG HIS A 85 12.347 5.058 -11.112 1.00 0.00 C ATOM 1350 ND1 HIS A 85 13.637 5.071 -11.626 1.00 0.00 N ATOM 1351 CD2 HIS A 85 11.683 4.068 -11.792 1.00 0.00 C ATOM 1352 CE1 HIS A 85 13.707 4.116 -12.572 1.00 0.00 C ATOM 1353 NE2 HIS A 85 12.544 3.478 -12.711 1.00 0.00 N ATOM 0 H HIS A 85 11.485 7.262 -7.914 1.00 0.00 H new ATOM 0 HA HIS A 85 11.632 4.487 -8.522 1.00 0.00 H new ATOM 0 HB2 HIS A 85 10.841 6.207 -10.116 1.00 0.00 H new ATOM 0 HB3 HIS A 85 12.423 6.961 -10.137 1.00 0.00 H new ATOM 0 HD1 HIS A 85 14.394 5.691 -11.339 1.00 0.00 H new ATOM 0 HD2 HIS A 85 10.651 3.790 -11.637 1.00 0.00 H new ATOM 0 HE1 HIS A 85 14.594 3.894 -13.147 1.00 0.00 H new ATOM 1362 N GLU A 86 14.524 6.057 -8.333 1.00 0.00 N ATOM 1363 CA GLU A 86 15.979 5.784 -8.231 1.00 0.00 C ATOM 1364 C GLU A 86 16.216 4.818 -7.068 1.00 0.00 C ATOM 1365 O GLU A 86 17.000 3.895 -7.161 1.00 0.00 O ATOM 1366 CB GLU A 86 16.724 7.098 -7.985 1.00 0.00 C ATOM 1367 CG GLU A 86 18.231 6.840 -7.936 1.00 0.00 C ATOM 1368 CD GLU A 86 18.964 8.161 -7.698 1.00 0.00 C ATOM 1369 OE1 GLU A 86 18.319 9.195 -7.768 1.00 0.00 O ATOM 1370 OE2 GLU A 86 20.159 8.119 -7.457 1.00 0.00 O ATOM 0 H GLU A 86 14.249 7.030 -8.198 1.00 0.00 H new ATOM 0 HA GLU A 86 16.347 5.338 -9.155 1.00 0.00 H new ATOM 0 HB2 GLU A 86 16.494 7.811 -8.777 1.00 0.00 H new ATOM 0 HB3 GLU A 86 16.392 7.545 -7.048 1.00 0.00 H new ATOM 0 HG2 GLU A 86 18.465 6.133 -7.140 1.00 0.00 H new ATOM 0 HG3 GLU A 86 18.565 6.389 -8.871 1.00 0.00 H new ATOM 1377 N PHE A 87 15.525 5.019 -5.977 1.00 0.00 N ATOM 1378 CA PHE A 87 15.689 4.106 -4.807 1.00 0.00 C ATOM 1379 C PHE A 87 14.931 2.807 -5.063 1.00 0.00 C ATOM 1380 O PHE A 87 15.393 1.729 -4.743 1.00 0.00 O ATOM 1381 CB PHE A 87 15.142 4.774 -3.545 1.00 0.00 C ATOM 1382 CG PHE A 87 16.086 5.866 -3.100 1.00 0.00 C ATOM 1383 CD1 PHE A 87 17.326 5.530 -2.543 1.00 0.00 C ATOM 1384 CD2 PHE A 87 15.723 7.212 -3.235 1.00 0.00 C ATOM 1385 CE1 PHE A 87 18.202 6.537 -2.122 1.00 0.00 C ATOM 1386 CE2 PHE A 87 16.600 8.219 -2.815 1.00 0.00 C ATOM 1387 CZ PHE A 87 17.839 7.882 -2.258 1.00 0.00 C ATOM 0 H PHE A 87 14.854 5.776 -5.845 1.00 0.00 H new ATOM 0 HA PHE A 87 16.748 3.890 -4.669 1.00 0.00 H new ATOM 0 HB2 PHE A 87 14.154 5.191 -3.741 1.00 0.00 H new ATOM 0 HB3 PHE A 87 15.025 4.035 -2.752 1.00 0.00 H new ATOM 0 HD1 PHE A 87 17.607 4.492 -2.438 1.00 0.00 H new ATOM 0 HD2 PHE A 87 14.766 7.473 -3.663 1.00 0.00 H new ATOM 0 HE1 PHE A 87 19.158 6.276 -1.692 1.00 0.00 H new ATOM 0 HE2 PHE A 87 16.320 9.257 -2.921 1.00 0.00 H new ATOM 0 HZ PHE A 87 18.515 8.659 -1.933 1.00 0.00 H new ATOM 1397 N PHE A 88 13.765 2.905 -5.641 1.00 0.00 N ATOM 1398 CA PHE A 88 12.958 1.687 -5.929 1.00 0.00 C ATOM 1399 C PHE A 88 13.325 1.199 -7.332 1.00 0.00 C ATOM 1400 O PHE A 88 12.500 1.149 -8.223 1.00 0.00 O ATOM 1401 CB PHE A 88 11.457 2.056 -5.851 1.00 0.00 C ATOM 1402 CG PHE A 88 10.633 0.871 -5.371 1.00 0.00 C ATOM 1403 CD1 PHE A 88 10.744 -0.372 -6.011 1.00 0.00 C ATOM 1404 CD2 PHE A 88 9.750 1.022 -4.290 1.00 0.00 C ATOM 1405 CE1 PHE A 88 9.977 -1.459 -5.570 1.00 0.00 C ATOM 1406 CE2 PHE A 88 8.985 -0.067 -3.851 1.00 0.00 C ATOM 1407 CZ PHE A 88 9.099 -1.306 -4.490 1.00 0.00 C ATOM 0 H PHE A 88 13.334 3.784 -5.928 1.00 0.00 H new ATOM 0 HA PHE A 88 13.160 0.896 -5.207 1.00 0.00 H new ATOM 0 HB2 PHE A 88 11.320 2.898 -5.173 1.00 0.00 H new ATOM 0 HB3 PHE A 88 11.105 2.376 -6.832 1.00 0.00 H new ATOM 0 HD1 PHE A 88 11.421 -0.492 -6.844 1.00 0.00 H new ATOM 0 HD2 PHE A 88 9.660 1.978 -3.796 1.00 0.00 H new ATOM 0 HE1 PHE A 88 10.063 -2.416 -6.064 1.00 0.00 H new ATOM 0 HE2 PHE A 88 8.307 0.050 -3.019 1.00 0.00 H new ATOM 0 HZ PHE A 88 8.510 -2.145 -4.150 1.00 0.00 H new ATOM 1417 N GLU A 89 14.562 0.842 -7.538 1.00 0.00 N ATOM 1418 CA GLU A 89 14.970 0.369 -8.881 1.00 0.00 C ATOM 1419 C GLU A 89 14.413 -1.031 -9.088 1.00 0.00 C ATOM 1420 O GLU A 89 14.875 -1.996 -8.514 1.00 0.00 O ATOM 1421 CB GLU A 89 16.497 0.341 -8.984 1.00 0.00 C ATOM 1422 CG GLU A 89 16.907 0.046 -10.429 1.00 0.00 C ATOM 1423 CD GLU A 89 18.433 0.022 -10.530 1.00 0.00 C ATOM 1424 OE1 GLU A 89 19.077 0.410 -9.570 1.00 0.00 O ATOM 1425 OE2 GLU A 89 18.932 -0.381 -11.568 1.00 0.00 O ATOM 0 H GLU A 89 15.302 0.859 -6.836 1.00 0.00 H new ATOM 0 HA GLU A 89 14.583 1.043 -9.646 1.00 0.00 H new ATOM 0 HB2 GLU A 89 16.911 1.298 -8.666 1.00 0.00 H new ATOM 0 HB3 GLU A 89 16.903 -0.420 -8.317 1.00 0.00 H new ATOM 0 HG2 GLU A 89 16.496 -0.912 -10.747 1.00 0.00 H new ATOM 0 HG3 GLU A 89 16.499 0.805 -11.096 1.00 0.00 H new ATOM 1432 N HIS A 90 13.415 -1.137 -9.905 1.00 0.00 N ATOM 1433 CA HIS A 90 12.797 -2.463 -10.167 1.00 0.00 C ATOM 1434 C HIS A 90 13.856 -3.398 -10.748 1.00 0.00 C ATOM 1435 O HIS A 90 13.903 -4.570 -10.433 1.00 0.00 O ATOM 1436 CB HIS A 90 11.642 -2.305 -11.157 1.00 0.00 C ATOM 1437 CG HIS A 90 10.969 -3.634 -11.353 1.00 0.00 C ATOM 1438 ND1 HIS A 90 11.317 -4.500 -12.380 1.00 0.00 N ATOM 1439 CD2 HIS A 90 9.965 -4.262 -10.657 1.00 0.00 C ATOM 1440 CE1 HIS A 90 10.535 -5.590 -12.274 1.00 0.00 C ATOM 1441 NE2 HIS A 90 9.695 -5.493 -11.242 1.00 0.00 N ATOM 0 H HIS A 90 12.994 -0.357 -10.410 1.00 0.00 H new ATOM 0 HA HIS A 90 12.411 -2.882 -9.238 1.00 0.00 H new ATOM 0 HB2 HIS A 90 10.925 -1.573 -10.783 1.00 0.00 H new ATOM 0 HB3 HIS A 90 12.014 -1.929 -12.110 1.00 0.00 H new ATOM 0 HD2 HIS A 90 9.463 -3.861 -9.789 1.00 0.00 H new ATOM 0 HE1 HIS A 90 10.582 -6.438 -12.941 1.00 0.00 H new ATOM 0 HE2 HIS A 90 9.001 -6.178 -10.945 1.00 0.00 H new ATOM 1450 N GLU A 91 14.700 -2.882 -11.600 1.00 0.00 N ATOM 1451 CA GLU A 91 15.767 -3.723 -12.217 1.00 0.00 C ATOM 1452 CB GLU A 91 16.724 -4.234 -11.133 1.00 0.00 C ATOM 1453 CG GLU A 91 17.855 -5.029 -11.787 1.00 0.00 C ATOM 1454 CD GLU A 91 18.888 -5.411 -10.726 1.00 0.00 C ATOM 1455 OE1 GLU A 91 18.750 -4.955 -9.603 1.00 0.00 O ATOM 1456 OE2 GLU A 91 19.801 -6.151 -11.054 1.00 0.00 O ATOM 0 H GLU A 91 14.696 -1.906 -11.898 1.00 0.00 H new ATOM 0 HB2 GLU A 91 17.133 -3.396 -10.569 1.00 0.00 H new ATOM 0 HB3 GLU A 91 16.185 -4.863 -10.424 1.00 0.00 H new ATOM 0 HG2 GLU A 91 17.457 -5.926 -12.262 1.00 0.00 H new ATOM 0 HG3 GLU A 91 18.325 -4.435 -12.571 1.00 0.00 H new TER 1463 GLU A 91 ATOM 1464 N MET B 0 -3.900 9.838 4.658 1.00 0.00 N ATOM 1465 CA MET B 0 -3.114 10.214 5.868 1.00 0.00 C ATOM 1466 C MET B 0 -1.639 9.860 5.662 1.00 0.00 C ATOM 1467 O MET B 0 -1.233 8.731 5.851 1.00 0.00 O ATOM 1468 CB MET B 0 -3.645 9.451 7.085 1.00 0.00 C ATOM 1469 CG MET B 0 -2.992 10.002 8.354 1.00 0.00 C ATOM 1470 SD MET B 0 -3.488 9.001 9.781 1.00 0.00 S ATOM 1471 CE MET B 0 -5.202 9.573 9.901 1.00 0.00 C ATOM 0 H1 MET B 0 -4.796 10.365 4.649 1.00 0.00 H new ATOM 0 H2 MET B 0 -3.354 10.069 3.804 1.00 0.00 H new ATOM 0 H3 MET B 0 -4.099 8.817 4.677 1.00 0.00 H new ATOM 0 HA MET B 0 -3.212 11.287 6.033 1.00 0.00 H new ATOM 0 HB2 MET B 0 -4.729 9.552 7.147 1.00 0.00 H new ATOM 0 HB3 MET B 0 -3.429 8.387 6.984 1.00 0.00 H new ATOM 0 HG2 MET B 0 -1.907 9.992 8.250 1.00 0.00 H new ATOM 0 HG3 MET B 0 -3.288 11.040 8.505 1.00 0.00 H new ATOM 0 HE1 MET B 0 -5.591 9.350 10.894 1.00 0.00 H new ATOM 0 HE2 MET B 0 -5.239 10.649 9.730 1.00 0.00 H new ATOM 0 HE3 MET B 0 -5.808 9.065 9.151 1.00 0.00 H new ATOM 1483 N SER B 1 -0.828 10.813 5.287 1.00 0.00 N ATOM 1484 CA SER B 1 0.621 10.513 5.088 1.00 0.00 C ATOM 1485 C SER B 1 0.774 9.275 4.202 1.00 0.00 C ATOM 1486 O SER B 1 1.803 8.630 4.182 1.00 0.00 O ATOM 1487 CB SER B 1 1.280 10.267 6.447 1.00 0.00 C ATOM 1488 OG SER B 1 2.659 9.981 6.256 1.00 0.00 O ATOM 0 H SER B 1 -1.103 11.779 5.111 1.00 0.00 H new ATOM 0 HA SER B 1 1.105 11.359 4.601 1.00 0.00 H new ATOM 0 HB2 SER B 1 1.164 11.144 7.084 1.00 0.00 H new ATOM 0 HB3 SER B 1 0.792 9.436 6.956 1.00 0.00 H new ATOM 0 HG SER B 1 2.769 9.415 5.464 1.00 0.00 H new ATOM 1494 N GLU B 2 -0.247 8.951 3.468 1.00 0.00 N ATOM 1495 CA GLU B 2 -0.196 7.769 2.564 1.00 0.00 C ATOM 1496 C GLU B 2 0.666 8.084 1.346 1.00 0.00 C ATOM 1497 O GLU B 2 0.917 7.237 0.512 1.00 0.00 O ATOM 1498 CB GLU B 2 -1.615 7.432 2.124 1.00 0.00 C ATOM 1499 CG GLU B 2 -2.369 6.877 3.326 1.00 0.00 C ATOM 1500 CD GLU B 2 -3.802 6.526 2.923 1.00 0.00 C ATOM 1501 OE1 GLU B 2 -4.195 6.891 1.827 1.00 0.00 O ATOM 1502 OE2 GLU B 2 -4.481 5.892 3.715 1.00 0.00 O ATOM 0 H GLU B 2 -1.130 9.461 3.454 1.00 0.00 H new ATOM 0 HA GLU B 2 0.241 6.919 3.088 1.00 0.00 H new ATOM 0 HB2 GLU B 2 -2.115 8.321 1.740 1.00 0.00 H new ATOM 0 HB3 GLU B 2 -1.598 6.701 1.315 1.00 0.00 H new ATOM 0 HG2 GLU B 2 -1.862 5.991 3.707 1.00 0.00 H new ATOM 0 HG3 GLU B 2 -2.378 7.611 4.132 1.00 0.00 H new ATOM 1509 N LEU B 3 1.098 9.305 1.230 1.00 0.00 N ATOM 1510 CA LEU B 3 1.925 9.706 0.057 1.00 0.00 C ATOM 1511 C LEU B 3 2.986 8.643 -0.234 1.00 0.00 C ATOM 1512 O LEU B 3 3.459 8.532 -1.340 1.00 0.00 O ATOM 1513 CB LEU B 3 2.614 11.048 0.347 1.00 0.00 C ATOM 1514 CG LEU B 3 3.466 11.488 -0.859 1.00 0.00 C ATOM 1515 CD1 LEU B 3 2.564 11.683 -2.090 1.00 0.00 C ATOM 1516 CD2 LEU B 3 4.184 12.804 -0.524 1.00 0.00 C ATOM 0 H LEU B 3 0.913 10.050 1.902 1.00 0.00 H new ATOM 0 HA LEU B 3 1.275 9.806 -0.812 1.00 0.00 H new ATOM 0 HB2 LEU B 3 1.865 11.808 0.567 1.00 0.00 H new ATOM 0 HB3 LEU B 3 3.245 10.956 1.231 1.00 0.00 H new ATOM 0 HG LEU B 3 4.206 10.719 -1.080 1.00 0.00 H new ATOM 0 HD11 LEU B 3 3.171 11.994 -2.940 1.00 0.00 H new ATOM 0 HD12 LEU B 3 2.063 10.744 -2.326 1.00 0.00 H new ATOM 0 HD13 LEU B 3 1.818 12.449 -1.877 1.00 0.00 H new ATOM 0 HD21 LEU B 3 4.787 13.117 -1.376 1.00 0.00 H new ATOM 0 HD22 LEU B 3 3.446 13.574 -0.300 1.00 0.00 H new ATOM 0 HD23 LEU B 3 4.829 12.656 0.342 1.00 0.00 H new ATOM 1528 N GLU B 4 3.375 7.865 0.733 1.00 0.00 N ATOM 1529 CA GLU B 4 4.412 6.826 0.449 1.00 0.00 C ATOM 1530 C GLU B 4 3.825 5.777 -0.495 1.00 0.00 C ATOM 1531 O GLU B 4 4.475 5.311 -1.409 1.00 0.00 O ATOM 1532 CB GLU B 4 4.848 6.166 1.763 1.00 0.00 C ATOM 1533 CG GLU B 4 5.956 5.147 1.489 1.00 0.00 C ATOM 1534 CD GLU B 4 6.463 4.578 2.817 1.00 0.00 C ATOM 1535 OE1 GLU B 4 6.089 5.111 3.848 1.00 0.00 O ATOM 1536 OE2 GLU B 4 7.222 3.623 2.779 1.00 0.00 O ATOM 0 H GLU B 4 3.031 7.897 1.693 1.00 0.00 H new ATOM 0 HA GLU B 4 5.281 7.288 -0.021 1.00 0.00 H new ATOM 0 HB2 GLU B 4 5.203 6.924 2.461 1.00 0.00 H new ATOM 0 HB3 GLU B 4 3.997 5.674 2.233 1.00 0.00 H new ATOM 0 HG2 GLU B 4 5.578 4.343 0.857 1.00 0.00 H new ATOM 0 HG3 GLU B 4 6.775 5.620 0.947 1.00 0.00 H new ATOM 1543 N LYS B 5 2.594 5.417 -0.282 1.00 0.00 N ATOM 1544 CA LYS B 5 1.934 4.411 -1.161 1.00 0.00 C ATOM 1545 C LYS B 5 1.675 5.012 -2.540 1.00 0.00 C ATOM 1546 O LYS B 5 1.807 4.354 -3.546 1.00 0.00 O ATOM 1547 CB LYS B 5 0.605 4.008 -0.533 1.00 0.00 C ATOM 1548 CG LYS B 5 0.870 3.184 0.728 1.00 0.00 C ATOM 1549 CD LYS B 5 -0.462 2.774 1.366 1.00 0.00 C ATOM 1550 CE LYS B 5 -1.236 4.026 1.809 1.00 0.00 C ATOM 1551 NZ LYS B 5 -2.145 3.673 2.935 1.00 0.00 N ATOM 0 H LYS B 5 2.009 5.779 0.471 1.00 0.00 H new ATOM 0 HA LYS B 5 2.582 3.541 -1.268 1.00 0.00 H new ATOM 0 HB2 LYS B 5 0.023 4.896 -0.285 1.00 0.00 H new ATOM 0 HB3 LYS B 5 0.015 3.428 -1.243 1.00 0.00 H new ATOM 0 HG2 LYS B 5 1.453 2.297 0.479 1.00 0.00 H new ATOM 0 HG3 LYS B 5 1.460 3.765 1.437 1.00 0.00 H new ATOM 0 HD2 LYS B 5 -1.056 2.202 0.653 1.00 0.00 H new ATOM 0 HD3 LYS B 5 -0.281 2.126 2.223 1.00 0.00 H new ATOM 0 HE2 LYS B 5 -0.541 4.806 2.119 1.00 0.00 H new ATOM 0 HE3 LYS B 5 -1.812 4.426 0.974 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 -3.102 4.024 2.731 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 -2.172 2.640 3.048 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 -1.796 4.108 3.813 1.00 0.00 H new ATOM 1565 N ALA B 6 1.270 6.251 -2.585 1.00 0.00 N ATOM 1566 CA ALA B 6 0.963 6.895 -3.894 1.00 0.00 C ATOM 1567 C ALA B 6 2.219 7.022 -4.748 1.00 0.00 C ATOM 1568 O ALA B 6 2.179 6.830 -5.939 1.00 0.00 O ATOM 1569 CB ALA B 6 0.359 8.281 -3.658 1.00 0.00 C ATOM 0 H ALA B 6 1.138 6.848 -1.768 1.00 0.00 H new ATOM 0 HA ALA B 6 0.248 6.268 -4.426 1.00 0.00 H new ATOM 0 HB1 ALA B 6 0.136 8.749 -4.617 1.00 0.00 H new ATOM 0 HB2 ALA B 6 -0.560 8.184 -3.079 1.00 0.00 H new ATOM 0 HB3 ALA B 6 1.070 8.899 -3.110 1.00 0.00 H new ATOM 1575 N MET B 7 3.325 7.356 -4.162 1.00 0.00 N ATOM 1576 CA MET B 7 4.571 7.495 -4.960 1.00 0.00 C ATOM 1577 C MET B 7 5.000 6.137 -5.493 1.00 0.00 C ATOM 1578 O MET B 7 5.454 6.010 -6.613 1.00 0.00 O ATOM 1579 CB MET B 7 5.685 8.096 -4.094 1.00 0.00 C ATOM 1580 CG MET B 7 5.380 9.570 -3.816 1.00 0.00 C ATOM 1581 SD MET B 7 6.800 10.336 -2.993 1.00 0.00 S ATOM 1582 CE MET B 7 6.400 12.055 -3.396 1.00 0.00 C ATOM 0 H MET B 7 3.424 7.540 -3.164 1.00 0.00 H new ATOM 0 HA MET B 7 4.380 8.161 -5.801 1.00 0.00 H new ATOM 0 HB2 MET B 7 5.766 7.548 -3.155 1.00 0.00 H new ATOM 0 HB3 MET B 7 6.645 8.002 -4.602 1.00 0.00 H new ATOM 0 HG2 MET B 7 5.163 10.090 -4.749 1.00 0.00 H new ATOM 0 HG3 MET B 7 4.493 9.657 -3.189 1.00 0.00 H new ATOM 0 HE1 MET B 7 6.822 12.714 -2.637 1.00 0.00 H new ATOM 0 HE2 MET B 7 6.819 12.307 -4.370 1.00 0.00 H new ATOM 0 HE3 MET B 7 5.318 12.180 -3.424 1.00 0.00 H new ATOM 1592 N VAL B 8 4.875 5.123 -4.699 1.00 0.00 N ATOM 1593 CA VAL B 8 5.291 3.769 -5.160 1.00 0.00 C ATOM 1594 C VAL B 8 4.397 3.303 -6.321 1.00 0.00 C ATOM 1595 O VAL B 8 4.855 2.684 -7.260 1.00 0.00 O ATOM 1596 CB VAL B 8 5.191 2.782 -3.993 1.00 0.00 C ATOM 1597 CG1 VAL B 8 5.418 1.355 -4.501 1.00 0.00 C ATOM 1598 CG2 VAL B 8 6.257 3.129 -2.948 1.00 0.00 C ATOM 0 H VAL B 8 4.504 5.166 -3.750 1.00 0.00 H new ATOM 0 HA VAL B 8 6.322 3.812 -5.512 1.00 0.00 H new ATOM 0 HB VAL B 8 4.200 2.848 -3.544 1.00 0.00 H new ATOM 0 HG11 VAL B 8 5.346 0.656 -3.667 1.00 0.00 H new ATOM 0 HG12 VAL B 8 4.662 1.110 -5.247 1.00 0.00 H new ATOM 0 HG13 VAL B 8 6.408 1.282 -4.951 1.00 0.00 H new ATOM 0 HG21 VAL B 8 6.191 2.430 -2.115 1.00 0.00 H new ATOM 0 HG22 VAL B 8 7.246 3.061 -3.401 1.00 0.00 H new ATOM 0 HG23 VAL B 8 6.093 4.143 -2.584 1.00 0.00 H new ATOM 1608 N ALA B 9 3.123 3.571 -6.243 1.00 0.00 N ATOM 1609 CA ALA B 9 2.177 3.122 -7.318 1.00 0.00 C ATOM 1610 C ALA B 9 2.353 3.942 -8.596 1.00 0.00 C ATOM 1611 O ALA B 9 2.224 3.434 -9.692 1.00 0.00 O ATOM 1612 CB ALA B 9 0.742 3.271 -6.821 1.00 0.00 C ATOM 0 H ALA B 9 2.688 4.085 -5.477 1.00 0.00 H new ATOM 0 HA ALA B 9 2.395 2.079 -7.548 1.00 0.00 H new ATOM 0 HB1 ALA B 9 0.052 2.946 -7.599 1.00 0.00 H new ATOM 0 HB2 ALA B 9 0.600 2.658 -5.931 1.00 0.00 H new ATOM 0 HB3 ALA B 9 0.548 4.316 -6.577 1.00 0.00 H new ATOM 1618 N LEU B 10 2.626 5.204 -8.468 1.00 0.00 N ATOM 1619 CA LEU B 10 2.788 6.055 -9.675 1.00 0.00 C ATOM 1620 C LEU B 10 3.941 5.472 -10.490 1.00 0.00 C ATOM 1621 O LEU B 10 3.899 5.392 -11.702 1.00 0.00 O ATOM 1622 CB LEU B 10 3.116 7.494 -9.220 1.00 0.00 C ATOM 1623 CG LEU B 10 2.484 8.528 -10.178 1.00 0.00 C ATOM 1624 CD1 LEU B 10 1.019 8.774 -9.774 1.00 0.00 C ATOM 1625 CD2 LEU B 10 3.273 9.854 -10.115 1.00 0.00 C ATOM 0 H LEU B 10 2.745 5.687 -7.577 1.00 0.00 H new ATOM 0 HA LEU B 10 1.882 6.079 -10.281 1.00 0.00 H new ATOM 0 HB2 LEU B 10 2.744 7.654 -8.208 1.00 0.00 H new ATOM 0 HB3 LEU B 10 4.197 7.633 -9.189 1.00 0.00 H new ATOM 0 HG LEU B 10 2.519 8.143 -11.197 1.00 0.00 H new ATOM 0 HD11 LEU B 10 0.573 9.504 -10.450 1.00 0.00 H new ATOM 0 HD12 LEU B 10 0.463 7.838 -9.832 1.00 0.00 H new ATOM 0 HD13 LEU B 10 0.982 9.155 -8.753 1.00 0.00 H new ATOM 0 HD21 LEU B 10 2.822 10.578 -10.793 1.00 0.00 H new ATOM 0 HD22 LEU B 10 3.248 10.244 -9.098 1.00 0.00 H new ATOM 0 HD23 LEU B 10 4.307 9.676 -10.410 1.00 0.00 H new ATOM 1637 N ILE B 11 4.959 5.051 -9.805 1.00 0.00 N ATOM 1638 CA ILE B 11 6.136 4.443 -10.469 1.00 0.00 C ATOM 1639 C ILE B 11 5.762 3.083 -11.080 1.00 0.00 C ATOM 1640 O ILE B 11 6.253 2.714 -12.129 1.00 0.00 O ATOM 1641 CB ILE B 11 7.257 4.285 -9.428 1.00 0.00 C ATOM 1642 CG1 ILE B 11 7.843 5.675 -9.119 1.00 0.00 C ATOM 1643 CG2 ILE B 11 8.351 3.344 -9.955 1.00 0.00 C ATOM 1644 CD1 ILE B 11 8.790 5.604 -7.917 1.00 0.00 C ATOM 0 H ILE B 11 5.026 5.104 -8.789 1.00 0.00 H new ATOM 0 HA ILE B 11 6.480 5.086 -11.279 1.00 0.00 H new ATOM 0 HB ILE B 11 6.852 3.847 -8.516 1.00 0.00 H new ATOM 0 HG12 ILE B 11 8.379 6.052 -9.990 1.00 0.00 H new ATOM 0 HG13 ILE B 11 7.036 6.378 -8.913 1.00 0.00 H new ATOM 0 HG21 ILE B 11 9.136 3.243 -9.206 1.00 0.00 H new ATOM 0 HG22 ILE B 11 7.920 2.365 -10.162 1.00 0.00 H new ATOM 0 HG23 ILE B 11 8.774 3.755 -10.871 1.00 0.00 H new ATOM 0 HD11 ILE B 11 9.195 6.595 -7.713 1.00 0.00 H new ATOM 0 HD12 ILE B 11 8.243 5.249 -7.044 1.00 0.00 H new ATOM 0 HD13 ILE B 11 9.607 4.917 -8.138 1.00 0.00 H new ATOM 1656 N ASP B 12 4.927 2.323 -10.424 1.00 0.00 N ATOM 1657 CA ASP B 12 4.562 0.976 -10.963 1.00 0.00 C ATOM 1658 C ASP B 12 3.906 1.093 -12.348 1.00 0.00 C ATOM 1659 O ASP B 12 4.249 0.372 -13.264 1.00 0.00 O ATOM 1660 CB ASP B 12 3.580 0.306 -10.002 1.00 0.00 C ATOM 1661 CG ASP B 12 3.199 -1.073 -10.542 1.00 0.00 C ATOM 1662 OD1 ASP B 12 2.625 -1.128 -11.618 1.00 0.00 O ATOM 1663 OD2 ASP B 12 3.491 -2.050 -9.873 1.00 0.00 O ATOM 0 H ASP B 12 4.482 2.573 -9.541 1.00 0.00 H new ATOM 0 HA ASP B 12 5.471 0.383 -11.060 1.00 0.00 H new ATOM 0 HB2 ASP B 12 4.030 0.210 -9.014 1.00 0.00 H new ATOM 0 HB3 ASP B 12 2.688 0.923 -9.888 1.00 0.00 H new ATOM 1668 N VAL B 13 2.965 1.980 -12.510 1.00 0.00 N ATOM 1669 CA VAL B 13 2.291 2.120 -13.842 1.00 0.00 C ATOM 1670 C VAL B 13 3.314 2.583 -14.892 1.00 0.00 C ATOM 1671 O VAL B 13 3.292 2.149 -16.026 1.00 0.00 O ATOM 1672 CB VAL B 13 1.096 3.115 -13.709 1.00 0.00 C ATOM 1673 CG1 VAL B 13 1.210 4.289 -14.694 1.00 0.00 C ATOM 1674 CG2 VAL B 13 -0.229 2.390 -13.985 1.00 0.00 C ATOM 0 H VAL B 13 2.631 2.614 -11.784 1.00 0.00 H new ATOM 0 HA VAL B 13 1.894 1.160 -14.172 1.00 0.00 H new ATOM 0 HB VAL B 13 1.122 3.504 -12.691 1.00 0.00 H new ATOM 0 HG11 VAL B 13 0.357 4.956 -14.566 1.00 0.00 H new ATOM 0 HG12 VAL B 13 2.132 4.838 -14.501 1.00 0.00 H new ATOM 0 HG13 VAL B 13 1.222 3.907 -15.715 1.00 0.00 H new ATOM 0 HG21 VAL B 13 -1.056 3.094 -13.889 1.00 0.00 H new ATOM 0 HG22 VAL B 13 -0.216 1.980 -14.995 1.00 0.00 H new ATOM 0 HG23 VAL B 13 -0.357 1.580 -13.267 1.00 0.00 H new ATOM 1684 N PHE B 14 4.202 3.461 -14.542 1.00 0.00 N ATOM 1685 CA PHE B 14 5.187 3.922 -15.553 1.00 0.00 C ATOM 1686 C PHE B 14 5.922 2.707 -16.104 1.00 0.00 C ATOM 1687 O PHE B 14 6.185 2.616 -17.280 1.00 0.00 O ATOM 1688 CB PHE B 14 6.192 4.880 -14.910 1.00 0.00 C ATOM 1689 CG PHE B 14 7.202 5.314 -15.946 1.00 0.00 C ATOM 1690 CD1 PHE B 14 8.292 4.486 -16.245 1.00 0.00 C ATOM 1691 CD2 PHE B 14 7.055 6.540 -16.604 1.00 0.00 C ATOM 1692 CE1 PHE B 14 9.232 4.884 -17.203 1.00 0.00 C ATOM 1693 CE2 PHE B 14 7.997 6.937 -17.562 1.00 0.00 C ATOM 1694 CZ PHE B 14 9.084 6.109 -17.861 1.00 0.00 C ATOM 0 H PHE B 14 4.291 3.876 -13.614 1.00 0.00 H new ATOM 0 HA PHE B 14 4.670 4.446 -16.357 1.00 0.00 H new ATOM 0 HB2 PHE B 14 5.675 5.749 -14.504 1.00 0.00 H new ATOM 0 HB3 PHE B 14 6.696 4.391 -14.077 1.00 0.00 H new ATOM 0 HD1 PHE B 14 8.407 3.540 -15.736 1.00 0.00 H new ATOM 0 HD2 PHE B 14 6.216 7.180 -16.374 1.00 0.00 H new ATOM 0 HE1 PHE B 14 10.071 4.245 -17.434 1.00 0.00 H new ATOM 0 HE2 PHE B 14 7.884 7.883 -18.070 1.00 0.00 H new ATOM 0 HZ PHE B 14 9.809 6.416 -18.600 1.00 0.00 H new ATOM 1704 N HIS B 15 6.250 1.769 -15.266 1.00 0.00 N ATOM 1705 CA HIS B 15 6.959 0.556 -15.753 1.00 0.00 C ATOM 1706 C HIS B 15 6.001 -0.284 -16.602 1.00 0.00 C ATOM 1707 O HIS B 15 6.419 -1.100 -17.400 1.00 0.00 O ATOM 1708 CB HIS B 15 7.429 -0.278 -14.558 1.00 0.00 C ATOM 1709 CG HIS B 15 8.545 0.431 -13.840 1.00 0.00 C ATOM 1710 ND1 HIS B 15 8.666 0.398 -12.457 1.00 0.00 N ATOM 1711 CD2 HIS B 15 9.603 1.186 -14.290 1.00 0.00 C ATOM 1712 CE1 HIS B 15 9.758 1.112 -12.127 1.00 0.00 C ATOM 1713 NE2 HIS B 15 10.362 1.612 -13.206 1.00 0.00 N ATOM 0 H HIS B 15 6.058 1.789 -14.264 1.00 0.00 H new ATOM 0 HA HIS B 15 7.819 0.856 -16.351 1.00 0.00 H new ATOM 0 HB2 HIS B 15 6.597 -0.449 -13.875 1.00 0.00 H new ATOM 0 HB3 HIS B 15 7.769 -1.256 -14.898 1.00 0.00 H new ATOM 0 HD2 HIS B 15 9.812 1.413 -15.325 1.00 0.00 H new ATOM 0 HE1 HIS B 15 10.102 1.262 -11.114 1.00 0.00 H new ATOM 0 HE2 HIS B 15 11.204 2.187 -13.231 1.00 0.00 H new ATOM 1722 N GLN B 16 4.719 -0.113 -16.420 1.00 0.00 N ATOM 1723 CA GLN B 16 3.743 -0.925 -17.195 1.00 0.00 C ATOM 1724 C GLN B 16 3.924 -0.685 -18.703 1.00 0.00 C ATOM 1725 O GLN B 16 3.895 -1.613 -19.486 1.00 0.00 O ATOM 1726 CB GLN B 16 2.326 -0.519 -16.770 1.00 0.00 C ATOM 1727 CG GLN B 16 1.300 -1.422 -17.440 1.00 0.00 C ATOM 1728 CD GLN B 16 -0.098 -1.061 -16.939 1.00 0.00 C ATOM 1729 OE1 GLN B 16 -0.242 -0.360 -15.957 1.00 0.00 O ATOM 1730 NE2 GLN B 16 -1.143 -1.510 -17.579 1.00 0.00 N ATOM 0 H GLN B 16 4.308 0.554 -15.768 1.00 0.00 H new ATOM 0 HA GLN B 16 3.907 -1.984 -16.995 1.00 0.00 H new ATOM 0 HB2 GLN B 16 2.229 -0.587 -15.686 1.00 0.00 H new ATOM 0 HB3 GLN B 16 2.140 0.520 -17.042 1.00 0.00 H new ATOM 0 HG2 GLN B 16 1.351 -1.308 -18.523 1.00 0.00 H new ATOM 0 HG3 GLN B 16 1.519 -2.467 -17.219 1.00 0.00 H new ATOM 0 HE21 GLN B 16 -1.022 -2.098 -18.403 1.00 0.00 H new ATOM 0 HE22 GLN B 16 -2.080 -1.272 -17.255 1.00 0.00 H new ATOM 1739 N TYR B 17 4.097 0.545 -19.126 1.00 0.00 N ATOM 1740 CA TYR B 17 4.261 0.820 -20.598 1.00 0.00 C ATOM 1741 C TYR B 17 5.731 0.945 -21.005 1.00 0.00 C ATOM 1742 O TYR B 17 6.107 0.564 -22.093 1.00 0.00 O ATOM 1743 CB TYR B 17 3.550 2.130 -20.936 1.00 0.00 C ATOM 1744 CG TYR B 17 2.071 1.888 -20.910 1.00 0.00 C ATOM 1745 CD1 TYR B 17 1.395 1.890 -19.692 1.00 0.00 C ATOM 1746 CD2 TYR B 17 1.384 1.635 -22.100 1.00 0.00 C ATOM 1747 CE1 TYR B 17 0.026 1.643 -19.654 1.00 0.00 C ATOM 1748 CE2 TYR B 17 0.013 1.381 -22.074 1.00 0.00 C ATOM 1749 CZ TYR B 17 -0.675 1.384 -20.846 1.00 0.00 C ATOM 1750 OH TYR B 17 -2.032 1.135 -20.811 1.00 0.00 O ATOM 0 H TYR B 17 4.132 1.368 -18.524 1.00 0.00 H new ATOM 0 HA TYR B 17 3.831 -0.021 -21.143 1.00 0.00 H new ATOM 0 HB2 TYR B 17 3.820 2.904 -20.218 1.00 0.00 H new ATOM 0 HB3 TYR B 17 3.859 2.486 -21.919 1.00 0.00 H new ATOM 0 HD1 TYR B 17 1.934 2.083 -18.776 1.00 0.00 H new ATOM 0 HD2 TYR B 17 1.915 1.636 -23.040 1.00 0.00 H new ATOM 0 HE1 TYR B 17 -0.498 1.650 -18.710 1.00 0.00 H new ATOM 0 HE2 TYR B 17 -0.519 1.183 -22.993 1.00 0.00 H new ATOM 0 HH TYR B 17 -2.267 0.725 -19.953 1.00 0.00 H new ATOM 1760 N SER B 18 6.552 1.510 -20.175 1.00 0.00 N ATOM 1761 CA SER B 18 7.980 1.702 -20.564 1.00 0.00 C ATOM 1762 C SER B 18 8.656 0.364 -20.863 1.00 0.00 C ATOM 1763 O SER B 18 9.433 0.248 -21.788 1.00 0.00 O ATOM 1764 CB SER B 18 8.716 2.393 -19.419 1.00 0.00 C ATOM 1765 OG SER B 18 8.262 3.734 -19.322 1.00 0.00 O ATOM 0 H SER B 18 6.303 1.848 -19.245 1.00 0.00 H new ATOM 0 HA SER B 18 8.016 2.312 -21.466 1.00 0.00 H new ATOM 0 HB2 SER B 18 8.535 1.865 -18.482 1.00 0.00 H new ATOM 0 HB3 SER B 18 9.791 2.371 -19.595 1.00 0.00 H new ATOM 0 HG SER B 18 8.904 4.260 -18.801 1.00 0.00 H new ATOM 1771 N GLY B 19 8.374 -0.642 -20.095 1.00 0.00 N ATOM 1772 CA GLY B 19 9.013 -1.965 -20.335 1.00 0.00 C ATOM 1773 C GLY B 19 8.404 -2.644 -21.565 1.00 0.00 C ATOM 1774 O GLY B 19 8.836 -3.706 -21.967 1.00 0.00 O ATOM 0 H GLY B 19 7.727 -0.609 -19.307 1.00 0.00 H new ATOM 0 HA2 GLY B 19 10.086 -1.836 -20.478 1.00 0.00 H new ATOM 0 HA3 GLY B 19 8.883 -2.602 -19.460 1.00 0.00 H new ATOM 1778 N ARG B 20 7.401 -2.061 -22.164 1.00 0.00 N ATOM 1779 CA ARG B 20 6.787 -2.712 -23.355 1.00 0.00 C ATOM 1780 C ARG B 20 7.742 -2.656 -24.549 1.00 0.00 C ATOM 1781 O ARG B 20 7.918 -3.629 -25.255 1.00 0.00 O ATOM 1782 CB ARG B 20 5.484 -2.000 -23.709 1.00 0.00 C ATOM 1783 CG ARG B 20 4.841 -2.679 -24.921 1.00 0.00 C ATOM 1784 CD ARG B 20 3.545 -1.963 -25.265 1.00 0.00 C ATOM 1785 NE ARG B 20 2.521 -2.298 -24.233 1.00 0.00 N ATOM 1786 CZ ARG B 20 1.403 -1.634 -24.181 1.00 0.00 C ATOM 1787 NH1 ARG B 20 1.173 -0.685 -25.042 1.00 0.00 N ATOM 1788 NH2 ARG B 20 0.512 -1.921 -23.271 1.00 0.00 N ATOM 0 H ARG B 20 6.985 -1.173 -21.884 1.00 0.00 H new ATOM 0 HA ARG B 20 6.584 -3.756 -23.119 1.00 0.00 H new ATOM 0 HB2 ARG B 20 4.801 -2.026 -22.860 1.00 0.00 H new ATOM 0 HB3 ARG B 20 5.679 -0.950 -23.929 1.00 0.00 H new ATOM 0 HG2 ARG B 20 5.522 -2.653 -25.772 1.00 0.00 H new ATOM 0 HG3 ARG B 20 4.644 -3.729 -24.703 1.00 0.00 H new ATOM 0 HD2 ARG B 20 3.707 -0.886 -25.300 1.00 0.00 H new ATOM 0 HD3 ARG B 20 3.198 -2.265 -26.253 1.00 0.00 H new ATOM 0 HE ARG B 20 2.698 -3.050 -23.566 1.00 0.00 H new ATOM 0 HH11 ARG B 20 1.868 -0.464 -25.755 1.00 0.00 H new ATOM 0 HH12 ARG B 20 0.298 -0.163 -25.004 1.00 0.00 H new ATOM 0 HH21 ARG B 20 0.691 -2.667 -22.599 1.00 0.00 H new ATOM 0 HH22 ARG B 20 -0.364 -1.399 -23.232 1.00 0.00 H new ATOM 1802 N GLU B 21 8.339 -1.516 -24.793 1.00 0.00 N ATOM 1803 CA GLU B 21 9.267 -1.371 -25.965 1.00 0.00 C ATOM 1804 C GLU B 21 10.701 -1.142 -25.482 1.00 0.00 C ATOM 1805 O GLU B 21 10.940 -0.773 -24.349 1.00 0.00 O ATOM 1806 CB GLU B 21 8.830 -0.171 -26.807 1.00 0.00 C ATOM 1807 CG GLU B 21 7.503 -0.488 -27.500 1.00 0.00 C ATOM 1808 CD GLU B 21 7.067 0.712 -28.342 1.00 0.00 C ATOM 1809 OE1 GLU B 21 7.679 1.759 -28.207 1.00 0.00 O ATOM 1810 OE2 GLU B 21 6.128 0.565 -29.106 1.00 0.00 O ATOM 0 H GLU B 21 8.225 -0.673 -24.230 1.00 0.00 H new ATOM 0 HA GLU B 21 9.231 -2.284 -26.560 1.00 0.00 H new ATOM 0 HB2 GLU B 21 8.720 0.710 -26.174 1.00 0.00 H new ATOM 0 HB3 GLU B 21 9.593 0.063 -27.549 1.00 0.00 H new ATOM 0 HG2 GLU B 21 7.612 -1.369 -28.133 1.00 0.00 H new ATOM 0 HG3 GLU B 21 6.740 -0.721 -26.758 1.00 0.00 H new ATOM 1817 N GLY B 22 11.656 -1.374 -26.343 1.00 0.00 N ATOM 1818 CA GLY B 22 13.085 -1.189 -25.959 1.00 0.00 C ATOM 1819 C GLY B 22 13.265 0.135 -25.219 1.00 0.00 C ATOM 1820 O GLY B 22 14.199 0.305 -24.461 1.00 0.00 O ATOM 0 H GLY B 22 11.506 -1.686 -27.302 1.00 0.00 H new ATOM 0 HA2 GLY B 22 13.409 -2.015 -25.326 1.00 0.00 H new ATOM 0 HA3 GLY B 22 13.713 -1.205 -26.849 1.00 0.00 H new ATOM 1824 N ASP B 23 12.385 1.076 -25.421 1.00 0.00 N ATOM 1825 CA ASP B 23 12.529 2.373 -24.714 1.00 0.00 C ATOM 1826 C ASP B 23 12.183 2.157 -23.235 1.00 0.00 C ATOM 1827 O ASP B 23 11.282 2.765 -22.696 1.00 0.00 O ATOM 1828 CB ASP B 23 11.575 3.390 -25.344 1.00 0.00 C ATOM 1829 CG ASP B 23 12.050 3.725 -26.760 1.00 0.00 C ATOM 1830 OD1 ASP B 23 13.206 3.472 -27.052 1.00 0.00 O ATOM 1831 OD2 ASP B 23 11.249 4.235 -27.526 1.00 0.00 O ATOM 0 H ASP B 23 11.579 1.002 -26.041 1.00 0.00 H new ATOM 0 HA ASP B 23 13.548 2.750 -24.796 1.00 0.00 H new ATOM 0 HB2 ASP B 23 10.563 2.986 -25.374 1.00 0.00 H new ATOM 0 HB3 ASP B 23 11.538 4.295 -24.737 1.00 0.00 H new ATOM 1836 N LYS B 24 12.890 1.269 -22.587 1.00 0.00 N ATOM 1837 CA LYS B 24 12.614 0.968 -21.149 1.00 0.00 C ATOM 1838 C LYS B 24 12.941 2.180 -20.266 1.00 0.00 C ATOM 1839 O LYS B 24 12.245 2.468 -19.312 1.00 0.00 O ATOM 1840 CB LYS B 24 13.492 -0.211 -20.711 1.00 0.00 C ATOM 1841 CG LYS B 24 13.158 -1.447 -21.553 1.00 0.00 C ATOM 1842 CD LYS B 24 13.843 -2.687 -20.963 1.00 0.00 C ATOM 1843 CE LYS B 24 15.356 -2.617 -21.185 1.00 0.00 C ATOM 1844 NZ LYS B 24 15.951 -3.956 -20.914 1.00 0.00 N ATOM 0 H LYS B 24 13.655 0.733 -22.996 1.00 0.00 H new ATOM 0 HA LYS B 24 11.557 0.726 -21.039 1.00 0.00 H new ATOM 0 HB2 LYS B 24 14.545 0.045 -20.826 1.00 0.00 H new ATOM 0 HB3 LYS B 24 13.330 -0.425 -19.655 1.00 0.00 H new ATOM 0 HG2 LYS B 24 12.079 -1.597 -21.581 1.00 0.00 H new ATOM 0 HG3 LYS B 24 13.486 -1.296 -22.581 1.00 0.00 H new ATOM 0 HD2 LYS B 24 13.628 -2.756 -19.897 1.00 0.00 H new ATOM 0 HD3 LYS B 24 13.442 -3.588 -21.428 1.00 0.00 H new ATOM 0 HE2 LYS B 24 15.572 -2.310 -22.208 1.00 0.00 H new ATOM 0 HE3 LYS B 24 15.798 -1.869 -20.527 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 16.979 -3.915 -21.063 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 15.754 -4.231 -19.930 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 15.535 -4.658 -21.559 1.00 0.00 H new ATOM 1858 N HIS B 25 14.014 2.871 -20.550 1.00 0.00 N ATOM 1859 CA HIS B 25 14.409 4.039 -19.701 1.00 0.00 C ATOM 1860 C HIS B 25 13.737 5.332 -20.179 1.00 0.00 C ATOM 1861 O HIS B 25 13.844 6.359 -19.538 1.00 0.00 O ATOM 1862 CB HIS B 25 15.928 4.207 -19.765 1.00 0.00 C ATOM 1863 CG HIS B 25 16.341 5.415 -18.967 1.00 0.00 C ATOM 1864 ND1 HIS B 25 16.252 5.455 -17.582 1.00 0.00 N ATOM 1865 CD2 HIS B 25 16.856 6.631 -19.345 1.00 0.00 C ATOM 1866 CE1 HIS B 25 16.703 6.658 -17.181 1.00 0.00 C ATOM 1867 NE2 HIS B 25 17.083 7.410 -18.216 1.00 0.00 N ATOM 0 H HIS B 25 14.636 2.678 -21.335 1.00 0.00 H new ATOM 0 HA HIS B 25 14.086 3.847 -18.678 1.00 0.00 H new ATOM 0 HB2 HIS B 25 16.419 3.316 -19.373 1.00 0.00 H new ATOM 0 HB3 HIS B 25 16.248 4.317 -20.801 1.00 0.00 H new ATOM 0 HD2 HIS B 25 17.054 6.935 -20.362 1.00 0.00 H new ATOM 0 HE1 HIS B 25 16.751 6.975 -16.150 1.00 0.00 H new ATOM 0 HE2 HIS B 25 17.461 8.357 -18.185 1.00 0.00 H new ATOM 1876 N LYS B 26 13.059 5.308 -21.294 1.00 0.00 N ATOM 1877 CA LYS B 26 12.404 6.557 -21.796 1.00 0.00 C ATOM 1878 C LYS B 26 11.087 6.207 -22.480 1.00 0.00 C ATOM 1879 O LYS B 26 10.802 5.062 -22.750 1.00 0.00 O ATOM 1880 CB LYS B 26 13.335 7.251 -22.796 1.00 0.00 C ATOM 1881 CG LYS B 26 13.510 6.369 -24.037 1.00 0.00 C ATOM 1882 CD LYS B 26 14.638 6.919 -24.927 1.00 0.00 C ATOM 1883 CE LYS B 26 16.008 6.476 -24.395 1.00 0.00 C ATOM 1884 NZ LYS B 26 17.049 6.769 -25.420 1.00 0.00 N ATOM 0 H LYS B 26 12.929 4.483 -21.879 1.00 0.00 H new ATOM 0 HA LYS B 26 12.206 7.225 -20.958 1.00 0.00 H new ATOM 0 HB2 LYS B 26 12.922 8.219 -23.081 1.00 0.00 H new ATOM 0 HB3 LYS B 26 14.304 7.442 -22.334 1.00 0.00 H new ATOM 0 HG2 LYS B 26 13.740 5.347 -23.736 1.00 0.00 H new ATOM 0 HG3 LYS B 26 12.578 6.333 -24.600 1.00 0.00 H new ATOM 0 HD2 LYS B 26 14.507 6.566 -25.950 1.00 0.00 H new ATOM 0 HD3 LYS B 26 14.588 8.007 -24.957 1.00 0.00 H new ATOM 0 HE2 LYS B 26 16.237 6.999 -23.466 1.00 0.00 H new ATOM 0 HE3 LYS B 26 15.996 5.410 -24.166 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 17.980 6.471 -25.065 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 16.830 6.251 -26.295 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 17.065 7.790 -25.617 1.00 0.00 H new ATOM 1898 N LEU B 27 10.280 7.195 -22.753 1.00 0.00 N ATOM 1899 CA LEU B 27 8.967 6.958 -23.428 1.00 0.00 C ATOM 1900 C LEU B 27 8.940 7.738 -24.738 1.00 0.00 C ATOM 1901 O LEU B 27 9.170 8.925 -24.762 1.00 0.00 O ATOM 1902 CB LEU B 27 7.828 7.449 -22.520 1.00 0.00 C ATOM 1903 CG LEU B 27 7.471 6.369 -21.482 1.00 0.00 C ATOM 1904 CD1 LEU B 27 6.497 6.957 -20.452 1.00 0.00 C ATOM 1905 CD2 LEU B 27 6.819 5.149 -22.178 1.00 0.00 C ATOM 0 H LEU B 27 10.476 8.172 -22.535 1.00 0.00 H new ATOM 0 HA LEU B 27 8.839 5.894 -23.625 1.00 0.00 H new ATOM 0 HB2 LEU B 27 8.127 8.366 -22.013 1.00 0.00 H new ATOM 0 HB3 LEU B 27 6.951 7.689 -23.122 1.00 0.00 H new ATOM 0 HG LEU B 27 8.382 6.041 -20.982 1.00 0.00 H new ATOM 0 HD11 LEU B 27 6.242 6.195 -19.716 1.00 0.00 H new ATOM 0 HD12 LEU B 27 6.965 7.804 -19.950 1.00 0.00 H new ATOM 0 HD13 LEU B 27 5.591 7.291 -20.957 1.00 0.00 H new ATOM 0 HD21 LEU B 27 6.572 4.394 -21.432 1.00 0.00 H new ATOM 0 HD22 LEU B 27 5.910 5.465 -22.689 1.00 0.00 H new ATOM 0 HD23 LEU B 27 7.516 4.729 -22.903 1.00 0.00 H new ATOM 1917 N LYS B 28 8.642 7.090 -25.828 1.00 0.00 N ATOM 1918 CA LYS B 28 8.577 7.813 -27.123 1.00 0.00 C ATOM 1919 C LYS B 28 7.137 8.263 -27.332 1.00 0.00 C ATOM 1920 O LYS B 28 6.214 7.621 -26.871 1.00 0.00 O ATOM 1921 CB LYS B 28 9.009 6.865 -28.251 1.00 0.00 C ATOM 1922 CG LYS B 28 8.930 7.579 -29.602 1.00 0.00 C ATOM 1923 CD LYS B 28 9.371 6.627 -30.712 1.00 0.00 C ATOM 1924 CE LYS B 28 9.288 7.348 -32.057 1.00 0.00 C ATOM 1925 NZ LYS B 28 10.161 8.556 -32.030 1.00 0.00 N ATOM 0 H LYS B 28 8.441 6.091 -25.876 1.00 0.00 H new ATOM 0 HA LYS B 28 9.240 8.678 -27.123 1.00 0.00 H new ATOM 0 HB2 LYS B 28 10.027 6.518 -28.074 1.00 0.00 H new ATOM 0 HB3 LYS B 28 8.369 5.983 -28.260 1.00 0.00 H new ATOM 0 HG2 LYS B 28 7.911 7.920 -29.785 1.00 0.00 H new ATOM 0 HG3 LYS B 28 9.566 8.464 -29.594 1.00 0.00 H new ATOM 0 HD2 LYS B 28 10.390 6.286 -30.531 1.00 0.00 H new ATOM 0 HD3 LYS B 28 8.736 5.741 -30.721 1.00 0.00 H new ATOM 0 HE2 LYS B 28 9.599 6.679 -32.860 1.00 0.00 H new ATOM 0 HE3 LYS B 28 8.257 7.636 -32.264 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 10.404 8.830 -33.003 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 9.657 9.338 -31.565 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 11.032 8.343 -31.502 1.00 0.00 H new ATOM 1939 N LYS B 29 6.930 9.362 -28.006 1.00 0.00 N ATOM 1940 CA LYS B 29 5.535 9.846 -28.227 1.00 0.00 C ATOM 1941 C LYS B 29 4.662 8.665 -28.646 1.00 0.00 C ATOM 1942 O LYS B 29 3.456 8.670 -28.491 1.00 0.00 O ATOM 1943 CB LYS B 29 5.531 10.913 -29.331 1.00 0.00 C ATOM 1944 CG LYS B 29 5.828 10.284 -30.695 1.00 0.00 C ATOM 1945 CD LYS B 29 6.062 11.396 -31.719 1.00 0.00 C ATOM 1946 CE LYS B 29 6.112 10.796 -33.123 1.00 0.00 C ATOM 1947 NZ LYS B 29 7.297 9.898 -33.232 1.00 0.00 N ATOM 0 H LYS B 29 7.663 9.944 -28.412 1.00 0.00 H new ATOM 0 HA LYS B 29 5.144 10.283 -27.308 1.00 0.00 H new ATOM 0 HB2 LYS B 29 4.562 11.411 -29.358 1.00 0.00 H new ATOM 0 HB3 LYS B 29 6.276 11.677 -29.108 1.00 0.00 H new ATOM 0 HG2 LYS B 29 6.707 9.642 -30.630 1.00 0.00 H new ATOM 0 HG3 LYS B 29 4.995 9.654 -31.008 1.00 0.00 H new ATOM 0 HD2 LYS B 29 5.264 12.136 -31.657 1.00 0.00 H new ATOM 0 HD3 LYS B 29 6.995 11.915 -31.501 1.00 0.00 H new ATOM 0 HE2 LYS B 29 5.198 10.238 -33.325 1.00 0.00 H new ATOM 0 HE3 LYS B 29 6.172 11.589 -33.868 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 7.856 10.161 -34.069 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 7.885 9.994 -32.379 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 6.978 8.912 -33.324 1.00 0.00 H new ATOM 1961 N SER B 30 5.284 7.653 -29.169 1.00 0.00 N ATOM 1962 CA SER B 30 4.527 6.442 -29.604 1.00 0.00 C ATOM 1963 C SER B 30 4.212 5.565 -28.390 1.00 0.00 C ATOM 1964 O SER B 30 3.084 5.167 -28.175 1.00 0.00 O ATOM 1965 CB SER B 30 5.368 5.643 -30.599 1.00 0.00 C ATOM 1966 OG SER B 30 4.633 4.502 -31.022 1.00 0.00 O ATOM 0 H SER B 30 6.292 7.607 -29.317 1.00 0.00 H new ATOM 0 HA SER B 30 3.596 6.753 -30.078 1.00 0.00 H new ATOM 0 HB2 SER B 30 5.625 6.264 -31.457 1.00 0.00 H new ATOM 0 HB3 SER B 30 6.306 5.335 -30.136 1.00 0.00 H new ATOM 0 HG SER B 30 5.168 3.987 -31.662 1.00 0.00 H new ATOM 1972 N GLU B 31 5.200 5.270 -27.588 1.00 0.00 N ATOM 1973 CA GLU B 31 4.955 4.433 -26.386 1.00 0.00 C ATOM 1974 C GLU B 31 4.109 5.258 -25.416 1.00 0.00 C ATOM 1975 O GLU B 31 3.264 4.744 -24.710 1.00 0.00 O ATOM 1976 CB GLU B 31 6.301 4.054 -25.752 1.00 0.00 C ATOM 1977 CG GLU B 31 6.105 2.985 -24.677 1.00 0.00 C ATOM 1978 CD GLU B 31 7.481 2.508 -24.204 1.00 0.00 C ATOM 1979 OE1 GLU B 31 8.429 3.260 -24.356 1.00 0.00 O ATOM 1980 OE2 GLU B 31 7.565 1.402 -23.701 1.00 0.00 O ATOM 0 H GLU B 31 6.165 5.574 -27.716 1.00 0.00 H new ATOM 0 HA GLU B 31 4.430 3.513 -26.642 1.00 0.00 H new ATOM 0 HB2 GLU B 31 6.980 3.685 -26.520 1.00 0.00 H new ATOM 0 HB3 GLU B 31 6.765 4.938 -25.314 1.00 0.00 H new ATOM 0 HG2 GLU B 31 5.537 3.391 -23.840 1.00 0.00 H new ATOM 0 HG3 GLU B 31 5.531 2.148 -25.076 1.00 0.00 H new ATOM 1987 N LEU B 32 4.328 6.549 -25.397 1.00 0.00 N ATOM 1988 CA LEU B 32 3.540 7.440 -24.502 1.00 0.00 C ATOM 1989 C LEU B 32 2.058 7.335 -24.847 1.00 0.00 C ATOM 1990 O LEU B 32 1.217 7.311 -23.980 1.00 0.00 O ATOM 1991 CB LEU B 32 4.001 8.885 -24.707 1.00 0.00 C ATOM 1992 CG LEU B 32 3.183 9.849 -23.830 1.00 0.00 C ATOM 1993 CD1 LEU B 32 3.346 9.483 -22.347 1.00 0.00 C ATOM 1994 CD2 LEU B 32 3.671 11.289 -24.076 1.00 0.00 C ATOM 0 H LEU B 32 5.026 7.024 -25.969 1.00 0.00 H new ATOM 0 HA LEU B 32 3.692 7.141 -23.465 1.00 0.00 H new ATOM 0 HB2 LEU B 32 5.059 8.972 -24.461 1.00 0.00 H new ATOM 0 HB3 LEU B 32 3.893 9.160 -25.756 1.00 0.00 H new ATOM 0 HG LEU B 32 2.127 9.771 -24.091 1.00 0.00 H new ATOM 0 HD11 LEU B 32 2.763 10.172 -21.736 1.00 0.00 H new ATOM 0 HD12 LEU B 32 2.994 8.465 -22.183 1.00 0.00 H new ATOM 0 HD13 LEU B 32 4.398 9.552 -22.069 1.00 0.00 H new ATOM 0 HD21 LEU B 32 3.096 11.979 -23.458 1.00 0.00 H new ATOM 0 HD22 LEU B 32 4.727 11.364 -23.818 1.00 0.00 H new ATOM 0 HD23 LEU B 32 3.536 11.545 -25.127 1.00 0.00 H new ATOM 2006 N LYS B 33 1.732 7.293 -26.109 1.00 0.00 N ATOM 2007 CA LYS B 33 0.297 7.209 -26.508 1.00 0.00 C ATOM 2008 C LYS B 33 -0.328 5.942 -25.930 1.00 0.00 C ATOM 2009 O LYS B 33 -1.457 5.943 -25.480 1.00 0.00 O ATOM 2010 CB LYS B 33 0.196 7.169 -28.034 1.00 0.00 C ATOM 2011 CG LYS B 33 -1.276 7.125 -28.456 1.00 0.00 C ATOM 2012 CD LYS B 33 -1.359 7.086 -29.978 1.00 0.00 C ATOM 2013 CE LYS B 33 -2.824 7.031 -30.413 1.00 0.00 C ATOM 2014 NZ LYS B 33 -2.900 7.075 -31.900 1.00 0.00 N ATOM 0 H LYS B 33 2.397 7.313 -26.882 1.00 0.00 H new ATOM 0 HA LYS B 33 -0.233 8.081 -26.125 1.00 0.00 H new ATOM 0 HB2 LYS B 33 0.681 8.046 -28.463 1.00 0.00 H new ATOM 0 HB3 LYS B 33 0.721 6.295 -28.419 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -1.763 6.247 -28.030 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -1.803 7.999 -28.073 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -0.877 7.967 -30.401 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -0.824 6.216 -30.359 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -3.291 6.119 -30.041 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -3.374 7.869 -29.985 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -3.295 7.989 -32.201 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -1.947 6.962 -32.300 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -3.511 6.305 -32.239 1.00 0.00 H new ATOM 2028 N GLU B 34 0.392 4.859 -25.942 1.00 0.00 N ATOM 2029 CA GLU B 34 -0.163 3.599 -25.403 1.00 0.00 C ATOM 2030 C GLU B 34 -0.481 3.805 -23.932 1.00 0.00 C ATOM 2031 O GLU B 34 -1.475 3.344 -23.426 1.00 0.00 O ATOM 2032 CB GLU B 34 0.860 2.478 -25.563 1.00 0.00 C ATOM 2033 CG GLU B 34 1.058 2.170 -27.049 1.00 0.00 C ATOM 2034 CD GLU B 34 -0.201 1.507 -27.610 1.00 0.00 C ATOM 2035 OE1 GLU B 34 -0.955 0.955 -26.827 1.00 0.00 O ATOM 2036 OE2 GLU B 34 -0.388 1.563 -28.814 1.00 0.00 O ATOM 0 H GLU B 34 1.344 4.796 -26.304 1.00 0.00 H new ATOM 0 HA GLU B 34 -1.069 3.325 -25.944 1.00 0.00 H new ATOM 0 HB2 GLU B 34 1.808 2.771 -25.113 1.00 0.00 H new ATOM 0 HB3 GLU B 34 0.520 1.585 -25.038 1.00 0.00 H new ATOM 0 HG2 GLU B 34 1.271 3.089 -27.595 1.00 0.00 H new ATOM 0 HG3 GLU B 34 1.917 1.513 -27.183 1.00 0.00 H new ATOM 2043 N LEU B 35 0.365 4.493 -23.237 1.00 0.00 N ATOM 2044 CA LEU B 35 0.103 4.736 -21.804 1.00 0.00 C ATOM 2045 C LEU B 35 -1.205 5.510 -21.661 1.00 0.00 C ATOM 2046 O LEU B 35 -2.056 5.175 -20.876 1.00 0.00 O ATOM 2047 CB LEU B 35 1.257 5.546 -21.212 1.00 0.00 C ATOM 2048 CG LEU B 35 1.001 5.804 -19.714 1.00 0.00 C ATOM 2049 CD1 LEU B 35 2.331 6.135 -19.032 1.00 0.00 C ATOM 2050 CD2 LEU B 35 -0.010 6.966 -19.506 1.00 0.00 C ATOM 0 H LEU B 35 1.228 4.898 -23.599 1.00 0.00 H new ATOM 0 HA LEU B 35 0.021 3.788 -21.272 1.00 0.00 H new ATOM 0 HB2 LEU B 35 2.196 5.007 -21.342 1.00 0.00 H new ATOM 0 HB3 LEU B 35 1.357 6.493 -21.741 1.00 0.00 H new ATOM 0 HG LEU B 35 0.568 4.907 -19.272 1.00 0.00 H new ATOM 0 HD11 LEU B 35 2.160 6.319 -17.971 1.00 0.00 H new ATOM 0 HD12 LEU B 35 3.018 5.297 -19.149 1.00 0.00 H new ATOM 0 HD13 LEU B 35 2.763 7.025 -19.490 1.00 0.00 H new ATOM 0 HD21 LEU B 35 -0.169 7.123 -18.439 1.00 0.00 H new ATOM 0 HD22 LEU B 35 0.387 7.878 -19.952 1.00 0.00 H new ATOM 0 HD23 LEU B 35 -0.958 6.713 -19.981 1.00 0.00 H new ATOM 2062 N ILE B 36 -1.349 6.564 -22.402 1.00 0.00 N ATOM 2063 CA ILE B 36 -2.573 7.404 -22.297 1.00 0.00 C ATOM 2064 C ILE B 36 -3.794 6.732 -22.942 1.00 0.00 C ATOM 2065 O ILE B 36 -4.880 6.754 -22.397 1.00 0.00 O ATOM 2066 CB ILE B 36 -2.307 8.728 -23.018 1.00 0.00 C ATOM 2067 CG1 ILE B 36 -1.085 9.410 -22.398 1.00 0.00 C ATOM 2068 CG2 ILE B 36 -3.524 9.643 -22.872 1.00 0.00 C ATOM 2069 CD1 ILE B 36 -0.694 10.627 -23.237 1.00 0.00 C ATOM 0 H ILE B 36 -0.664 6.887 -23.086 1.00 0.00 H new ATOM 0 HA ILE B 36 -2.794 7.555 -21.240 1.00 0.00 H new ATOM 0 HB ILE B 36 -2.121 8.533 -24.074 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -1.307 9.717 -21.376 1.00 0.00 H new ATOM 0 HG13 ILE B 36 -0.252 8.709 -22.346 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -3.334 10.586 -23.385 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -4.397 9.160 -23.311 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -3.709 9.836 -21.815 1.00 0.00 H new ATOM 0 HD11 ILE B 36 0.176 11.111 -22.793 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -0.454 10.308 -24.251 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -1.525 11.331 -23.266 1.00 0.00 H new ATOM 2081 N ASN B 37 -3.645 6.198 -24.122 1.00 0.00 N ATOM 2082 CA ASN B 37 -4.820 5.597 -24.828 1.00 0.00 C ATOM 2083 C ASN B 37 -5.306 4.305 -24.170 1.00 0.00 C ATOM 2084 O ASN B 37 -6.488 4.032 -24.114 1.00 0.00 O ATOM 2085 CB ASN B 37 -4.427 5.294 -26.275 1.00 0.00 C ATOM 2086 CG ASN B 37 -4.253 6.604 -27.042 1.00 0.00 C ATOM 2087 OD1 ASN B 37 -3.547 7.565 -26.510 1.00 0.00 O flip ATOM 2088 ND2 ASN B 37 -4.760 6.754 -28.136 1.00 0.00 N flip ATOM 0 H ASN B 37 -2.762 6.150 -24.631 1.00 0.00 H new ATOM 0 HA ASN B 37 -5.635 6.319 -24.779 1.00 0.00 H new ATOM 0 HB2 ASN B 37 -3.500 4.721 -26.299 1.00 0.00 H new ATOM 0 HB3 ASN B 37 -5.193 4.681 -26.750 1.00 0.00 H new ATOM 0 HD21 ASN B 37 -5.311 6.002 -28.550 1.00 0.00 H new ATOM 0 HD22 ASN B 37 -4.634 7.632 -28.640 1.00 0.00 H new ATOM 2095 N ASN B 38 -4.407 3.482 -23.734 1.00 0.00 N ATOM 2096 CA ASN B 38 -4.809 2.164 -23.145 1.00 0.00 C ATOM 2097 C ASN B 38 -4.889 2.206 -21.617 1.00 0.00 C ATOM 2098 O ASN B 38 -5.752 1.587 -21.028 1.00 0.00 O ATOM 2099 CB ASN B 38 -3.782 1.111 -23.557 1.00 0.00 C ATOM 2100 CG ASN B 38 -4.219 -0.259 -23.039 1.00 0.00 C ATOM 2101 OD1 ASN B 38 -4.765 -1.055 -23.777 1.00 0.00 O ATOM 2102 ND2 ASN B 38 -4.006 -0.566 -21.790 1.00 0.00 N ATOM 0 H ASN B 38 -3.402 3.657 -23.756 1.00 0.00 H new ATOM 0 HA ASN B 38 -5.803 1.921 -23.520 1.00 0.00 H new ATOM 0 HB2 ASN B 38 -3.686 1.087 -24.642 1.00 0.00 H new ATOM 0 HB3 ASN B 38 -2.802 1.367 -23.155 1.00 0.00 H new ATOM 0 HD21 ASN B 38 -4.298 -1.475 -21.431 1.00 0.00 H new ATOM 0 HD22 ASN B 38 -3.548 0.103 -21.171 1.00 0.00 H new ATOM 2109 N GLU B 39 -4.000 2.892 -20.956 1.00 0.00 N ATOM 2110 CA GLU B 39 -4.068 2.899 -19.468 1.00 0.00 C ATOM 2111 C GLU B 39 -5.329 3.643 -19.034 1.00 0.00 C ATOM 2112 O GLU B 39 -6.010 3.251 -18.107 1.00 0.00 O ATOM 2113 CB GLU B 39 -2.826 3.585 -18.876 1.00 0.00 C ATOM 2114 CG GLU B 39 -2.641 3.139 -17.430 1.00 0.00 C ATOM 2115 CD GLU B 39 -1.452 3.877 -16.816 1.00 0.00 C ATOM 2116 OE1 GLU B 39 -0.378 3.812 -17.391 1.00 0.00 O ATOM 2117 OE2 GLU B 39 -1.636 4.498 -15.783 1.00 0.00 O ATOM 0 H GLU B 39 -3.244 3.438 -21.370 1.00 0.00 H new ATOM 0 HA GLU B 39 -4.099 1.872 -19.103 1.00 0.00 H new ATOM 0 HB2 GLU B 39 -1.943 3.331 -19.462 1.00 0.00 H new ATOM 0 HB3 GLU B 39 -2.939 4.668 -18.922 1.00 0.00 H new ATOM 0 HG2 GLU B 39 -3.545 3.344 -16.857 1.00 0.00 H new ATOM 0 HG3 GLU B 39 -2.475 2.063 -17.389 1.00 0.00 H new ATOM 2124 N LEU B 40 -5.642 4.719 -19.706 1.00 0.00 N ATOM 2125 CA LEU B 40 -6.857 5.512 -19.354 1.00 0.00 C ATOM 2126 C LEU B 40 -7.980 5.139 -20.325 1.00 0.00 C ATOM 2127 O LEU B 40 -8.442 5.953 -21.100 1.00 0.00 O ATOM 2128 CB LEU B 40 -6.534 7.009 -19.480 1.00 0.00 C ATOM 2129 CG LEU B 40 -5.109 7.276 -18.983 1.00 0.00 C ATOM 2130 CD1 LEU B 40 -4.823 8.777 -19.025 1.00 0.00 C ATOM 2131 CD2 LEU B 40 -4.960 6.777 -17.547 1.00 0.00 C ATOM 0 H LEU B 40 -5.103 5.086 -20.491 1.00 0.00 H new ATOM 0 HA LEU B 40 -7.169 5.298 -18.332 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -6.632 7.325 -20.518 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -7.247 7.594 -18.900 1.00 0.00 H new ATOM 0 HG LEU B 40 -4.404 6.750 -19.626 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -3.809 8.964 -18.671 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -4.922 9.138 -20.049 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -5.533 9.301 -18.385 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -3.945 6.969 -17.198 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -5.669 7.299 -16.905 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -5.159 5.706 -17.512 1.00 0.00 H new ATOM 2143 N SER B 41 -8.410 3.909 -20.299 1.00 0.00 N ATOM 2144 CA SER B 41 -9.490 3.476 -21.230 1.00 0.00 C ATOM 2145 C SER B 41 -10.754 4.306 -20.989 1.00 0.00 C ATOM 2146 O SER B 41 -11.436 4.690 -21.918 1.00 0.00 O ATOM 2147 CB SER B 41 -9.798 1.998 -20.988 1.00 0.00 C ATOM 2148 OG SER B 41 -10.256 1.828 -19.653 1.00 0.00 O ATOM 0 H SER B 41 -8.060 3.184 -19.673 1.00 0.00 H new ATOM 0 HA SER B 41 -9.160 3.623 -22.258 1.00 0.00 H new ATOM 0 HB2 SER B 41 -10.555 1.652 -21.692 1.00 0.00 H new ATOM 0 HB3 SER B 41 -8.906 1.396 -21.158 1.00 0.00 H new ATOM 0 HG SER B 41 -11.228 1.950 -19.623 1.00 0.00 H new ATOM 2154 N HIS B 42 -11.074 4.587 -19.749 1.00 0.00 N ATOM 2155 CA HIS B 42 -12.300 5.397 -19.442 1.00 0.00 C ATOM 2156 C HIS B 42 -11.978 6.452 -18.374 1.00 0.00 C ATOM 2157 O HIS B 42 -12.714 7.399 -18.184 1.00 0.00 O ATOM 2158 CB HIS B 42 -13.403 4.467 -18.920 1.00 0.00 C ATOM 2159 CG HIS B 42 -13.863 3.555 -20.027 1.00 0.00 C ATOM 2160 ND1 HIS B 42 -13.272 2.321 -20.265 1.00 0.00 N ATOM 2161 CD2 HIS B 42 -14.861 3.679 -20.963 1.00 0.00 C ATOM 2162 CE1 HIS B 42 -13.914 1.757 -21.306 1.00 0.00 C ATOM 2163 NE2 HIS B 42 -14.888 2.544 -21.765 1.00 0.00 N ATOM 0 H HIS B 42 -10.539 4.291 -18.933 1.00 0.00 H new ATOM 0 HA HIS B 42 -12.636 5.898 -20.350 1.00 0.00 H new ATOM 0 HB2 HIS B 42 -13.030 3.878 -18.082 1.00 0.00 H new ATOM 0 HB3 HIS B 42 -14.242 5.055 -18.548 1.00 0.00 H new ATOM 0 HD2 HIS B 42 -15.522 4.527 -21.061 1.00 0.00 H new ATOM 0 HE1 HIS B 42 -13.671 0.789 -21.718 1.00 0.00 H new ATOM 0 HE2 HIS B 42 -15.520 2.353 -22.542 1.00 0.00 H new ATOM 2172 N PHE B 43 -10.891 6.291 -17.668 1.00 0.00 N ATOM 2173 CA PHE B 43 -10.531 7.275 -16.605 1.00 0.00 C ATOM 2174 C PHE B 43 -10.310 8.664 -17.225 1.00 0.00 C ATOM 2175 O PHE B 43 -10.732 9.668 -16.685 1.00 0.00 O ATOM 2176 CB PHE B 43 -9.254 6.782 -15.904 1.00 0.00 C ATOM 2177 CG PHE B 43 -8.748 7.741 -14.828 1.00 0.00 C ATOM 2178 CD1 PHE B 43 -9.573 8.723 -14.236 1.00 0.00 C ATOM 2179 CD2 PHE B 43 -7.414 7.626 -14.414 1.00 0.00 C ATOM 2180 CE1 PHE B 43 -9.052 9.568 -13.247 1.00 0.00 C ATOM 2181 CE2 PHE B 43 -6.901 8.473 -13.427 1.00 0.00 C ATOM 2182 CZ PHE B 43 -7.719 9.444 -12.844 1.00 0.00 C ATOM 0 H PHE B 43 -10.235 5.518 -17.782 1.00 0.00 H new ATOM 0 HA PHE B 43 -11.339 7.359 -15.878 1.00 0.00 H new ATOM 0 HB2 PHE B 43 -9.448 5.809 -15.452 1.00 0.00 H new ATOM 0 HB3 PHE B 43 -8.472 6.637 -16.649 1.00 0.00 H new ATOM 0 HD1 PHE B 43 -10.603 8.822 -14.545 1.00 0.00 H new ATOM 0 HD2 PHE B 43 -6.777 6.877 -14.861 1.00 0.00 H new ATOM 0 HE1 PHE B 43 -9.683 10.318 -12.794 1.00 0.00 H new ATOM 0 HE2 PHE B 43 -5.872 8.377 -13.115 1.00 0.00 H new ATOM 0 HZ PHE B 43 -7.322 10.099 -12.082 1.00 0.00 H new ATOM 2192 N LEU B 44 -9.665 8.729 -18.365 1.00 0.00 N ATOM 2193 CA LEU B 44 -9.421 10.045 -19.039 1.00 0.00 C ATOM 2194 C LEU B 44 -9.836 9.896 -20.496 1.00 0.00 C ATOM 2195 O LEU B 44 -9.817 8.810 -21.041 1.00 0.00 O ATOM 2196 CB LEU B 44 -7.920 10.395 -18.946 1.00 0.00 C ATOM 2197 CG LEU B 44 -7.663 11.911 -19.211 1.00 0.00 C ATOM 2198 CD1 LEU B 44 -6.529 12.413 -18.305 1.00 0.00 C ATOM 2199 CD2 LEU B 44 -7.252 12.145 -20.675 1.00 0.00 C ATOM 0 H LEU B 44 -9.294 7.920 -18.862 1.00 0.00 H new ATOM 0 HA LEU B 44 -9.992 10.842 -18.563 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -7.545 10.130 -17.957 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -7.362 9.800 -19.669 1.00 0.00 H new ATOM 0 HG LEU B 44 -8.586 12.452 -19.000 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -6.354 13.472 -18.494 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -6.808 12.272 -17.261 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -5.619 11.851 -18.516 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -7.078 13.208 -20.838 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -6.339 11.590 -20.890 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -8.048 11.802 -21.336 1.00 0.00 H new ATOM 2211 N GLU B 45 -10.220 10.956 -21.138 1.00 0.00 N ATOM 2212 CA GLU B 45 -10.635 10.818 -22.552 1.00 0.00 C ATOM 2213 C GLU B 45 -9.470 10.249 -23.358 1.00 0.00 C ATOM 2214 O GLU B 45 -8.448 10.881 -23.531 1.00 0.00 O ATOM 2215 CB GLU B 45 -11.023 12.187 -23.118 1.00 0.00 C ATOM 2216 CG GLU B 45 -11.484 12.033 -24.572 1.00 0.00 C ATOM 2217 CD GLU B 45 -12.772 11.208 -24.621 1.00 0.00 C ATOM 2218 OE1 GLU B 45 -13.401 11.064 -23.586 1.00 0.00 O ATOM 2219 OE2 GLU B 45 -13.109 10.739 -25.695 1.00 0.00 O ATOM 0 H GLU B 45 -10.264 11.899 -20.752 1.00 0.00 H new ATOM 0 HA GLU B 45 -11.494 10.150 -22.615 1.00 0.00 H new ATOM 0 HB2 GLU B 45 -11.820 12.627 -22.518 1.00 0.00 H new ATOM 0 HB3 GLU B 45 -10.173 12.867 -23.066 1.00 0.00 H new ATOM 0 HG2 GLU B 45 -11.652 13.014 -25.016 1.00 0.00 H new ATOM 0 HG3 GLU B 45 -10.706 11.546 -25.160 1.00 0.00 H new ATOM 2226 N GLU B 46 -9.631 9.062 -23.865 1.00 0.00 N ATOM 2227 CA GLU B 46 -8.552 8.441 -24.678 1.00 0.00 C ATOM 2228 C GLU B 46 -8.201 9.352 -25.845 1.00 0.00 C ATOM 2229 O GLU B 46 -8.906 10.291 -26.157 1.00 0.00 O ATOM 2230 CB GLU B 46 -9.024 7.085 -25.213 1.00 0.00 C ATOM 2231 CG GLU B 46 -8.866 6.035 -24.122 1.00 0.00 C ATOM 2232 CD GLU B 46 -9.397 4.691 -24.622 1.00 0.00 C ATOM 2233 OE1 GLU B 46 -8.618 3.942 -25.188 1.00 0.00 O ATOM 2234 OE2 GLU B 46 -10.574 4.434 -24.430 1.00 0.00 O ATOM 0 H GLU B 46 -10.469 8.491 -23.751 1.00 0.00 H new ATOM 0 HA GLU B 46 -7.671 8.297 -24.053 1.00 0.00 H new ATOM 0 HB2 GLU B 46 -10.066 7.147 -25.527 1.00 0.00 H new ATOM 0 HB3 GLU B 46 -8.443 6.805 -26.091 1.00 0.00 H new ATOM 0 HG2 GLU B 46 -7.817 5.942 -23.843 1.00 0.00 H new ATOM 0 HG3 GLU B 46 -9.408 6.341 -23.227 1.00 0.00 H new ATOM 2241 N ILE B 47 -7.098 9.082 -26.483 1.00 0.00 N ATOM 2242 CA ILE B 47 -6.662 9.921 -27.629 1.00 0.00 C ATOM 2243 C ILE B 47 -7.135 9.267 -28.928 1.00 0.00 C ATOM 2244 O ILE B 47 -7.106 8.060 -29.070 1.00 0.00 O ATOM 2245 CB ILE B 47 -5.128 10.029 -27.641 1.00 0.00 C ATOM 2246 CG1 ILE B 47 -4.578 10.290 -26.219 1.00 0.00 C ATOM 2247 CG2 ILE B 47 -4.709 11.167 -28.567 1.00 0.00 C ATOM 2248 CD1 ILE B 47 -4.766 11.759 -25.809 1.00 0.00 C ATOM 0 H ILE B 47 -6.474 8.307 -26.256 1.00 0.00 H new ATOM 0 HA ILE B 47 -7.089 10.919 -27.536 1.00 0.00 H new ATOM 0 HB ILE B 47 -4.717 9.085 -27.999 1.00 0.00 H new ATOM 0 HG12 ILE B 47 -5.088 9.643 -25.505 1.00 0.00 H new ATOM 0 HG13 ILE B 47 -3.519 10.033 -26.183 1.00 0.00 H new ATOM 0 HG21 ILE B 47 -3.622 11.246 -28.578 1.00 0.00 H new ATOM 0 HG22 ILE B 47 -5.068 10.966 -29.576 1.00 0.00 H new ATOM 0 HG23 ILE B 47 -5.137 12.103 -28.210 1.00 0.00 H new ATOM 0 HD11 ILE B 47 -4.369 11.910 -24.805 1.00 0.00 H new ATOM 0 HD12 ILE B 47 -4.235 12.403 -26.510 1.00 0.00 H new ATOM 0 HD13 ILE B 47 -5.827 12.007 -25.821 1.00 0.00 H new ATOM 2260 N LYS B 48 -7.590 10.055 -29.866 1.00 0.00 N ATOM 2261 CA LYS B 48 -8.094 9.493 -31.157 1.00 0.00 C ATOM 2262 C LYS B 48 -7.110 9.814 -32.288 1.00 0.00 C ATOM 2263 O LYS B 48 -7.190 9.247 -33.360 1.00 0.00 O ATOM 2264 CB LYS B 48 -9.458 10.127 -31.470 1.00 0.00 C ATOM 2265 CG LYS B 48 -10.292 10.255 -30.183 1.00 0.00 C ATOM 2266 CD LYS B 48 -10.549 8.878 -29.562 1.00 0.00 C ATOM 2267 CE LYS B 48 -11.373 9.052 -28.287 1.00 0.00 C ATOM 2268 NZ LYS B 48 -11.922 7.731 -27.867 1.00 0.00 N ATOM 0 H LYS B 48 -7.635 11.071 -29.794 1.00 0.00 H new ATOM 0 HA LYS B 48 -8.193 8.411 -31.072 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -9.316 11.110 -31.919 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -9.992 9.517 -32.199 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -9.770 10.890 -29.467 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -11.242 10.741 -30.407 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -11.079 8.240 -30.269 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -9.604 8.385 -29.335 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -10.752 9.469 -27.494 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -12.186 9.758 -28.460 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -12.483 7.848 -26.999 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -12.528 7.351 -28.622 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -11.139 7.071 -27.686 1.00 0.00 H new ATOM 2282 N GLU B 49 -6.188 10.723 -32.068 1.00 0.00 N ATOM 2283 CA GLU B 49 -5.207 11.080 -33.144 1.00 0.00 C ATOM 2284 C GLU B 49 -3.795 11.205 -32.574 1.00 0.00 C ATOM 2285 O GLU B 49 -3.593 11.593 -31.441 1.00 0.00 O ATOM 2286 CB GLU B 49 -5.614 12.411 -33.775 1.00 0.00 C ATOM 2287 CG GLU B 49 -6.865 12.199 -34.621 1.00 0.00 C ATOM 2288 CD GLU B 49 -7.328 13.533 -35.207 1.00 0.00 C ATOM 2289 OE1 GLU B 49 -6.806 14.553 -34.792 1.00 0.00 O ATOM 2290 OE2 GLU B 49 -8.204 13.513 -36.056 1.00 0.00 O ATOM 0 H GLU B 49 -6.073 11.232 -31.192 1.00 0.00 H new ATOM 0 HA GLU B 49 -5.211 10.289 -33.894 1.00 0.00 H new ATOM 0 HB2 GLU B 49 -5.806 13.152 -32.999 1.00 0.00 H new ATOM 0 HB3 GLU B 49 -4.803 12.798 -34.392 1.00 0.00 H new ATOM 0 HG2 GLU B 49 -6.656 11.492 -35.424 1.00 0.00 H new ATOM 0 HG3 GLU B 49 -7.658 11.765 -34.012 1.00 0.00 H new ATOM 2297 N GLN B 50 -2.816 10.892 -33.376 1.00 0.00 N ATOM 2298 CA GLN B 50 -1.401 10.998 -32.928 1.00 0.00 C ATOM 2299 C GLN B 50 -1.049 12.474 -32.769 1.00 0.00 C ATOM 2300 O GLN B 50 -0.146 12.828 -32.045 1.00 0.00 O ATOM 2301 CB GLN B 50 -0.483 10.400 -34.001 1.00 0.00 C ATOM 2302 CG GLN B 50 -0.665 8.881 -34.089 1.00 0.00 C ATOM 2303 CD GLN B 50 -0.052 8.193 -32.867 1.00 0.00 C ATOM 2304 OE1 GLN B 50 -0.478 7.119 -32.491 1.00 0.00 O ATOM 2305 NE2 GLN B 50 0.938 8.759 -32.230 1.00 0.00 N ATOM 0 H GLN B 50 -2.938 10.563 -34.334 1.00 0.00 H new ATOM 0 HA GLN B 50 -1.273 10.466 -31.985 1.00 0.00 H new ATOM 0 HB2 GLN B 50 -0.703 10.854 -34.968 1.00 0.00 H new ATOM 0 HB3 GLN B 50 0.556 10.633 -33.768 1.00 0.00 H new ATOM 0 HG2 GLN B 50 -1.726 8.640 -34.155 1.00 0.00 H new ATOM 0 HG3 GLN B 50 -0.196 8.505 -34.998 1.00 0.00 H new ATOM 0 HE21 GLN B 50 1.297 9.661 -32.544 1.00 0.00 H new ATOM 0 HE22 GLN B 50 1.352 8.299 -31.419 1.00 0.00 H new ATOM 2314 N GLU B 51 -1.740 13.336 -33.469 1.00 0.00 N ATOM 2315 CA GLU B 51 -1.423 14.793 -33.381 1.00 0.00 C ATOM 2316 C GLU B 51 -1.608 15.300 -31.953 1.00 0.00 C ATOM 2317 O GLU B 51 -0.835 16.098 -31.475 1.00 0.00 O ATOM 2318 CB GLU B 51 -2.331 15.578 -34.333 1.00 0.00 C ATOM 2319 CG GLU B 51 -3.747 15.663 -33.755 1.00 0.00 C ATOM 2320 CD GLU B 51 -4.717 16.113 -34.847 1.00 0.00 C ATOM 2321 OE1 GLU B 51 -4.599 15.619 -35.957 1.00 0.00 O ATOM 2322 OE2 GLU B 51 -5.560 16.945 -34.558 1.00 0.00 O ATOM 0 H GLU B 51 -2.508 13.095 -34.096 1.00 0.00 H new ATOM 0 HA GLU B 51 -0.382 14.940 -33.668 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -1.931 16.580 -34.486 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -2.356 15.092 -35.308 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -4.050 14.692 -33.362 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -3.770 16.365 -32.922 1.00 0.00 H new ATOM 2329 N VAL B 52 -2.626 14.859 -31.273 1.00 0.00 N ATOM 2330 CA VAL B 52 -2.839 15.337 -29.883 1.00 0.00 C ATOM 2331 C VAL B 52 -1.632 14.963 -29.055 1.00 0.00 C ATOM 2332 O VAL B 52 -1.179 15.711 -28.218 1.00 0.00 O ATOM 2333 CB VAL B 52 -4.077 14.671 -29.295 1.00 0.00 C ATOM 2334 CG1 VAL B 52 -4.251 15.105 -27.839 1.00 0.00 C ATOM 2335 CG2 VAL B 52 -5.308 15.071 -30.107 1.00 0.00 C ATOM 0 H VAL B 52 -3.316 14.192 -31.618 1.00 0.00 H new ATOM 0 HA VAL B 52 -2.979 16.418 -29.881 1.00 0.00 H new ATOM 0 HB VAL B 52 -3.959 13.588 -29.333 1.00 0.00 H new ATOM 0 HG11 VAL B 52 -5.137 14.628 -27.420 1.00 0.00 H new ATOM 0 HG12 VAL B 52 -3.374 14.809 -27.264 1.00 0.00 H new ATOM 0 HG13 VAL B 52 -4.367 16.188 -27.793 1.00 0.00 H new ATOM 0 HG21 VAL B 52 -6.193 14.594 -29.685 1.00 0.00 H new ATOM 0 HG22 VAL B 52 -5.429 16.154 -30.074 1.00 0.00 H new ATOM 0 HG23 VAL B 52 -5.181 14.751 -31.141 1.00 0.00 H new ATOM 2345 N VAL B 53 -1.121 13.799 -29.278 1.00 0.00 N ATOM 2346 CA VAL B 53 0.054 13.346 -28.510 1.00 0.00 C ATOM 2347 C VAL B 53 1.259 14.210 -28.856 1.00 0.00 C ATOM 2348 O VAL B 53 2.076 14.486 -28.020 1.00 0.00 O ATOM 2349 CB VAL B 53 0.340 11.893 -28.856 1.00 0.00 C ATOM 2350 CG1 VAL B 53 1.511 11.385 -28.024 1.00 0.00 C ATOM 2351 CG2 VAL B 53 -0.904 11.059 -28.560 1.00 0.00 C ATOM 0 H VAL B 53 -1.471 13.133 -29.967 1.00 0.00 H new ATOM 0 HA VAL B 53 -0.146 13.435 -27.442 1.00 0.00 H new ATOM 0 HB VAL B 53 0.596 11.810 -29.912 1.00 0.00 H new ATOM 0 HG11 VAL B 53 1.712 10.344 -28.276 1.00 0.00 H new ATOM 0 HG12 VAL B 53 2.395 11.986 -28.235 1.00 0.00 H new ATOM 0 HG13 VAL B 53 1.265 11.461 -26.965 1.00 0.00 H new ATOM 0 HG21 VAL B 53 -0.709 10.015 -28.805 1.00 0.00 H new ATOM 0 HG22 VAL B 53 -1.155 11.143 -27.503 1.00 0.00 H new ATOM 0 HG23 VAL B 53 -1.737 11.423 -29.161 1.00 0.00 H new ATOM 2361 N ASP B 54 1.383 14.619 -30.085 1.00 0.00 N ATOM 2362 CA ASP B 54 2.553 15.454 -30.481 1.00 0.00 C ATOM 2363 C ASP B 54 2.468 16.820 -29.808 1.00 0.00 C ATOM 2364 O ASP B 54 3.464 17.405 -29.439 1.00 0.00 O ATOM 2365 CB ASP B 54 2.568 15.637 -32.000 1.00 0.00 C ATOM 2366 CG ASP B 54 3.871 16.321 -32.416 1.00 0.00 C ATOM 2367 OD1 ASP B 54 4.536 16.862 -31.549 1.00 0.00 O ATOM 2368 OD2 ASP B 54 4.180 16.295 -33.596 1.00 0.00 O ATOM 0 H ASP B 54 0.724 14.412 -30.836 1.00 0.00 H new ATOM 0 HA ASP B 54 3.468 14.953 -30.166 1.00 0.00 H new ATOM 0 HB2 ASP B 54 2.478 14.670 -32.495 1.00 0.00 H new ATOM 0 HB3 ASP B 54 1.713 16.236 -32.314 1.00 0.00 H new ATOM 2373 N LYS B 55 1.284 17.326 -29.648 1.00 0.00 N ATOM 2374 CA LYS B 55 1.116 18.651 -28.996 1.00 0.00 C ATOM 2375 C LYS B 55 1.489 18.497 -27.533 1.00 0.00 C ATOM 2376 O LYS B 55 2.147 19.333 -26.947 1.00 0.00 O ATOM 2377 CB LYS B 55 -0.335 19.122 -29.128 1.00 0.00 C ATOM 2378 CG LYS B 55 -0.483 20.504 -28.486 1.00 0.00 C ATOM 2379 CD LYS B 55 -1.925 20.990 -28.632 1.00 0.00 C ATOM 2380 CE LYS B 55 -2.062 22.370 -27.987 1.00 0.00 C ATOM 2381 NZ LYS B 55 -3.379 22.961 -28.354 1.00 0.00 N ATOM 0 H LYS B 55 0.417 16.877 -29.943 1.00 0.00 H new ATOM 0 HA LYS B 55 1.755 19.395 -29.472 1.00 0.00 H new ATOM 0 HB2 LYS B 55 -0.620 19.165 -30.179 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -1.005 18.411 -28.645 1.00 0.00 H new ATOM 0 HG2 LYS B 55 -0.210 20.457 -27.432 1.00 0.00 H new ATOM 0 HG3 LYS B 55 0.198 21.210 -28.960 1.00 0.00 H new ATOM 0 HD2 LYS B 55 -2.199 21.040 -29.686 1.00 0.00 H new ATOM 0 HD3 LYS B 55 -2.608 20.285 -28.158 1.00 0.00 H new ATOM 0 HE2 LYS B 55 -1.978 22.287 -26.903 1.00 0.00 H new ATOM 0 HE3 LYS B 55 -1.254 23.021 -28.320 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 -3.228 23.819 -28.922 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 -3.927 22.271 -28.907 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 -3.903 23.206 -27.489 1.00 0.00 H new ATOM 2395 N VAL B 56 1.095 17.404 -26.952 1.00 0.00 N ATOM 2396 CA VAL B 56 1.447 17.152 -25.536 1.00 0.00 C ATOM 2397 C VAL B 56 2.962 17.034 -25.464 1.00 0.00 C ATOM 2398 O VAL B 56 3.591 17.444 -24.509 1.00 0.00 O ATOM 2399 CB VAL B 56 0.776 15.849 -25.068 1.00 0.00 C ATOM 2400 CG1 VAL B 56 1.466 15.308 -23.811 1.00 0.00 C ATOM 2401 CG2 VAL B 56 -0.694 16.131 -24.748 1.00 0.00 C ATOM 0 H VAL B 56 0.543 16.673 -27.400 1.00 0.00 H new ATOM 0 HA VAL B 56 1.103 17.959 -24.889 1.00 0.00 H new ATOM 0 HB VAL B 56 0.857 15.106 -25.862 1.00 0.00 H new ATOM 0 HG11 VAL B 56 0.977 14.386 -23.496 1.00 0.00 H new ATOM 0 HG12 VAL B 56 2.515 15.106 -24.030 1.00 0.00 H new ATOM 0 HG13 VAL B 56 1.398 16.046 -23.012 1.00 0.00 H new ATOM 0 HG21 VAL B 56 -1.177 15.212 -24.415 1.00 0.00 H new ATOM 0 HG22 VAL B 56 -0.757 16.880 -23.959 1.00 0.00 H new ATOM 0 HG23 VAL B 56 -1.196 16.502 -25.642 1.00 0.00 H new ATOM 2411 N MET B 57 3.550 16.475 -26.483 1.00 0.00 N ATOM 2412 CA MET B 57 5.026 16.325 -26.497 1.00 0.00 C ATOM 2413 C MET B 57 5.677 17.693 -26.654 1.00 0.00 C ATOM 2414 O MET B 57 6.772 17.914 -26.211 1.00 0.00 O ATOM 2415 CB MET B 57 5.456 15.377 -27.614 1.00 0.00 C ATOM 2416 CG MET B 57 5.027 13.952 -27.241 1.00 0.00 C ATOM 2417 SD MET B 57 6.064 13.324 -25.892 1.00 0.00 S ATOM 2418 CE MET B 57 7.453 12.734 -26.891 1.00 0.00 C ATOM 0 H MET B 57 3.069 16.115 -27.308 1.00 0.00 H new ATOM 0 HA MET B 57 5.353 15.892 -25.552 1.00 0.00 H new ATOM 0 HB2 MET B 57 5.000 15.674 -28.558 1.00 0.00 H new ATOM 0 HB3 MET B 57 6.536 15.422 -27.753 1.00 0.00 H new ATOM 0 HG2 MET B 57 3.980 13.946 -26.938 1.00 0.00 H new ATOM 0 HG3 MET B 57 5.111 13.299 -28.110 1.00 0.00 H new ATOM 0 HE1 MET B 57 8.390 13.061 -26.440 1.00 0.00 H new ATOM 0 HE2 MET B 57 7.432 11.645 -26.936 1.00 0.00 H new ATOM 0 HE3 MET B 57 7.374 13.140 -27.899 1.00 0.00 H new ATOM 2428 N GLU B 58 5.016 18.641 -27.243 1.00 0.00 N ATOM 2429 CA GLU B 58 5.656 19.975 -27.350 1.00 0.00 C ATOM 2430 C GLU B 58 5.918 20.435 -25.918 1.00 0.00 C ATOM 2431 O GLU B 58 6.951 20.989 -25.598 1.00 0.00 O ATOM 2432 CB GLU B 58 4.719 20.956 -28.060 1.00 0.00 C ATOM 2433 CG GLU B 58 5.407 22.317 -28.190 1.00 0.00 C ATOM 2434 CD GLU B 58 4.471 23.297 -28.899 1.00 0.00 C ATOM 2435 OE1 GLU B 58 3.407 22.871 -29.318 1.00 0.00 O ATOM 2436 OE2 GLU B 58 4.832 24.457 -29.009 1.00 0.00 O ATOM 0 H GLU B 58 4.083 18.557 -27.647 1.00 0.00 H new ATOM 0 HA GLU B 58 6.579 19.930 -27.928 1.00 0.00 H new ATOM 0 HB2 GLU B 58 4.455 20.574 -29.046 1.00 0.00 H new ATOM 0 HB3 GLU B 58 3.790 21.058 -27.499 1.00 0.00 H new ATOM 0 HG2 GLU B 58 5.671 22.699 -27.204 1.00 0.00 H new ATOM 0 HG3 GLU B 58 6.336 22.215 -28.751 1.00 0.00 H new ATOM 2443 N THR B 59 4.980 20.171 -25.053 1.00 0.00 N ATOM 2444 CA THR B 59 5.131 20.537 -23.619 1.00 0.00 C ATOM 2445 C THR B 59 5.951 19.464 -22.879 1.00 0.00 C ATOM 2446 O THR B 59 6.728 19.768 -21.996 1.00 0.00 O ATOM 2447 CB THR B 59 3.733 20.643 -22.995 1.00 0.00 C ATOM 2448 OG1 THR B 59 3.070 21.785 -23.518 1.00 0.00 O ATOM 2449 CG2 THR B 59 3.831 20.765 -21.472 1.00 0.00 C ATOM 0 H THR B 59 4.100 19.709 -25.284 1.00 0.00 H new ATOM 0 HA THR B 59 5.654 21.490 -23.535 1.00 0.00 H new ATOM 0 HB THR B 59 3.171 19.742 -23.238 1.00 0.00 H new ATOM 0 HG1 THR B 59 2.176 21.854 -23.122 1.00 0.00 H new ATOM 0 HG21 THR B 59 2.830 20.839 -21.048 1.00 0.00 H new ATOM 0 HG22 THR B 59 4.332 19.885 -21.068 1.00 0.00 H new ATOM 0 HG23 THR B 59 4.401 21.658 -21.214 1.00 0.00 H new ATOM 2457 N LEU B 60 5.753 18.208 -23.205 1.00 0.00 N ATOM 2458 CA LEU B 60 6.486 17.112 -22.490 1.00 0.00 C ATOM 2459 C LEU B 60 7.842 16.840 -23.152 1.00 0.00 C ATOM 2460 O LEU B 60 8.721 16.258 -22.550 1.00 0.00 O ATOM 2461 CB LEU B 60 5.611 15.832 -22.509 1.00 0.00 C ATOM 2462 CG LEU B 60 5.420 15.288 -21.084 1.00 0.00 C ATOM 2463 CD1 LEU B 60 4.431 16.184 -20.314 1.00 0.00 C ATOM 2464 CD2 LEU B 60 4.877 13.852 -21.155 1.00 0.00 C ATOM 0 H LEU B 60 5.115 17.894 -23.936 1.00 0.00 H new ATOM 0 HA LEU B 60 6.675 17.416 -21.460 1.00 0.00 H new ATOM 0 HB2 LEU B 60 4.641 16.055 -22.953 1.00 0.00 H new ATOM 0 HB3 LEU B 60 6.081 15.073 -23.134 1.00 0.00 H new ATOM 0 HG LEU B 60 6.378 15.287 -20.563 1.00 0.00 H new ATOM 0 HD11 LEU B 60 4.298 15.795 -19.304 1.00 0.00 H new ATOM 0 HD12 LEU B 60 4.824 17.199 -20.263 1.00 0.00 H new ATOM 0 HD13 LEU B 60 3.470 16.192 -20.829 1.00 0.00 H new ATOM 0 HD21 LEU B 60 4.741 13.464 -20.145 1.00 0.00 H new ATOM 0 HD22 LEU B 60 3.920 13.850 -21.677 1.00 0.00 H new ATOM 0 HD23 LEU B 60 5.585 13.222 -21.693 1.00 0.00 H new ATOM 2476 N ASP B 61 8.035 17.265 -24.363 1.00 0.00 N ATOM 2477 CA ASP B 61 9.357 17.036 -25.011 1.00 0.00 C ATOM 2478 C ASP B 61 10.276 18.126 -24.485 1.00 0.00 C ATOM 2479 O ASP B 61 10.759 18.973 -25.209 1.00 0.00 O ATOM 2480 CB ASP B 61 9.232 17.125 -26.536 1.00 0.00 C ATOM 2481 CG ASP B 61 10.529 16.650 -27.183 1.00 0.00 C ATOM 2482 OD1 ASP B 61 11.481 16.416 -26.457 1.00 0.00 O ATOM 2483 OD2 ASP B 61 10.553 16.532 -28.398 1.00 0.00 O ATOM 0 H ASP B 61 7.345 17.757 -24.931 1.00 0.00 H new ATOM 0 HA ASP B 61 9.746 16.044 -24.782 1.00 0.00 H new ATOM 0 HB2 ASP B 61 8.397 16.514 -26.879 1.00 0.00 H new ATOM 0 HB3 ASP B 61 9.019 18.152 -26.835 1.00 0.00 H new ATOM 2488 N GLU B 62 10.467 18.121 -23.199 1.00 0.00 N ATOM 2489 CA GLU B 62 11.294 19.164 -22.543 1.00 0.00 C ATOM 2490 C GLU B 62 12.720 19.146 -23.091 1.00 0.00 C ATOM 2491 O GLU B 62 13.319 20.180 -23.309 1.00 0.00 O ATOM 2492 CB GLU B 62 11.332 18.878 -21.045 1.00 0.00 C ATOM 2493 CG GLU B 62 9.904 18.655 -20.530 1.00 0.00 C ATOM 2494 CD GLU B 62 9.914 18.607 -19.000 1.00 0.00 C ATOM 2495 OE1 GLU B 62 10.994 18.567 -18.435 1.00 0.00 O ATOM 2496 OE2 GLU B 62 8.840 18.611 -18.421 1.00 0.00 O ATOM 0 H GLU B 62 10.077 17.425 -22.564 1.00 0.00 H new ATOM 0 HA GLU B 62 10.859 20.144 -22.740 1.00 0.00 H new ATOM 0 HB2 GLU B 62 11.943 17.997 -20.848 1.00 0.00 H new ATOM 0 HB3 GLU B 62 11.795 19.712 -20.516 1.00 0.00 H new ATOM 0 HG2 GLU B 62 9.252 19.458 -20.875 1.00 0.00 H new ATOM 0 HG3 GLU B 62 9.503 17.724 -20.931 1.00 0.00 H new ATOM 2503 N ASP B 63 13.273 17.990 -23.320 1.00 0.00 N ATOM 2504 CA ASP B 63 14.662 17.933 -23.858 1.00 0.00 C ATOM 2505 C ASP B 63 14.611 18.065 -25.380 1.00 0.00 C ATOM 2506 O ASP B 63 15.627 18.117 -26.045 1.00 0.00 O ATOM 2507 CB ASP B 63 15.315 16.604 -23.470 1.00 0.00 C ATOM 2508 CG ASP B 63 14.580 15.446 -24.144 1.00 0.00 C ATOM 2509 OD1 ASP B 63 13.447 15.644 -24.552 1.00 0.00 O ATOM 2510 OD2 ASP B 63 15.162 14.377 -24.236 1.00 0.00 O ATOM 0 H ASP B 63 12.828 17.086 -23.160 1.00 0.00 H new ATOM 0 HA ASP B 63 15.252 18.748 -23.440 1.00 0.00 H new ATOM 0 HB2 ASP B 63 16.363 16.603 -23.768 1.00 0.00 H new ATOM 0 HB3 ASP B 63 15.292 16.480 -22.387 1.00 0.00 H new ATOM 2515 N GLY B 64 13.432 18.142 -25.935 1.00 0.00 N ATOM 2516 CA GLY B 64 13.314 18.295 -27.415 1.00 0.00 C ATOM 2517 C GLY B 64 13.816 17.032 -28.124 1.00 0.00 C ATOM 2518 O GLY B 64 14.393 17.108 -29.191 1.00 0.00 O ATOM 0 H GLY B 64 12.547 18.106 -25.430 1.00 0.00 H new ATOM 0 HA2 GLY B 64 12.275 18.483 -27.686 1.00 0.00 H new ATOM 0 HA3 GLY B 64 13.891 19.159 -27.745 1.00 0.00 H new ATOM 2522 N ASP B 65 13.609 15.870 -27.546 1.00 0.00 N ATOM 2523 CA ASP B 65 14.086 14.604 -28.196 1.00 0.00 C ATOM 2524 C ASP B 65 12.901 13.849 -28.804 1.00 0.00 C ATOM 2525 O ASP B 65 13.060 12.794 -29.385 1.00 0.00 O ATOM 2526 CB ASP B 65 14.758 13.722 -27.142 1.00 0.00 C ATOM 2527 CG ASP B 65 13.718 13.269 -26.115 1.00 0.00 C ATOM 2528 OD1 ASP B 65 12.623 13.807 -26.134 1.00 0.00 O ATOM 2529 OD2 ASP B 65 14.034 12.391 -25.329 1.00 0.00 O ATOM 0 H ASP B 65 13.131 15.744 -26.654 1.00 0.00 H new ATOM 0 HA ASP B 65 14.796 14.850 -28.985 1.00 0.00 H new ATOM 0 HB2 ASP B 65 15.217 12.855 -27.617 1.00 0.00 H new ATOM 0 HB3 ASP B 65 15.557 14.274 -26.647 1.00 0.00 H new ATOM 2534 N GLY B 66 11.716 14.374 -28.673 1.00 0.00 N ATOM 2535 CA GLY B 66 10.526 13.677 -29.241 1.00 0.00 C ATOM 2536 C GLY B 66 10.127 12.528 -28.312 1.00 0.00 C ATOM 2537 O GLY B 66 9.234 11.758 -28.601 1.00 0.00 O ATOM 0 H GLY B 66 11.518 15.255 -28.198 1.00 0.00 H new ATOM 0 HA2 GLY B 66 9.697 14.377 -29.351 1.00 0.00 H new ATOM 0 HA3 GLY B 66 10.754 13.294 -30.236 1.00 0.00 H new ATOM 2541 N GLU B 67 10.795 12.413 -27.195 1.00 0.00 N ATOM 2542 CA GLU B 67 10.488 11.325 -26.222 1.00 0.00 C ATOM 2543 C GLU B 67 10.523 11.914 -24.809 1.00 0.00 C ATOM 2544 O GLU B 67 11.442 12.624 -24.454 1.00 0.00 O ATOM 2545 CB GLU B 67 11.561 10.238 -26.342 1.00 0.00 C ATOM 2546 CG GLU B 67 11.838 9.971 -27.820 1.00 0.00 C ATOM 2547 CD GLU B 67 12.731 8.738 -27.963 1.00 0.00 C ATOM 2548 OE1 GLU B 67 13.181 8.236 -26.946 1.00 0.00 O ATOM 2549 OE2 GLU B 67 12.953 8.319 -29.087 1.00 0.00 O ATOM 0 H GLU B 67 11.551 13.036 -26.912 1.00 0.00 H new ATOM 0 HA GLU B 67 9.506 10.897 -26.425 1.00 0.00 H new ATOM 0 HB2 GLU B 67 12.475 10.554 -25.839 1.00 0.00 H new ATOM 0 HB3 GLU B 67 11.227 9.324 -25.851 1.00 0.00 H new ATOM 0 HG2 GLU B 67 10.900 9.816 -28.353 1.00 0.00 H new ATOM 0 HG3 GLU B 67 12.322 10.837 -28.271 1.00 0.00 H new ATOM 2556 N CYS B 68 9.543 11.618 -23.994 1.00 0.00 N ATOM 2557 CA CYS B 68 9.544 12.162 -22.595 1.00 0.00 C ATOM 2558 C CYS B 68 10.150 11.114 -21.662 1.00 0.00 C ATOM 2559 O CYS B 68 9.701 9.994 -21.588 1.00 0.00 O ATOM 2560 CB CYS B 68 8.117 12.505 -22.151 1.00 0.00 C ATOM 2561 SG CYS B 68 7.008 11.136 -22.565 1.00 0.00 S ATOM 0 H CYS B 68 8.746 11.028 -24.231 1.00 0.00 H new ATOM 0 HA CYS B 68 10.137 13.076 -22.560 1.00 0.00 H new ATOM 0 HB2 CYS B 68 8.094 12.693 -21.078 1.00 0.00 H new ATOM 0 HB3 CYS B 68 7.782 13.419 -22.642 1.00 0.00 H new ATOM 0 HG CYS B 68 6.035 11.090 -21.704 1.00 0.00 H new ATOM 2567 N ASP B 69 11.189 11.477 -20.975 1.00 0.00 N ATOM 2568 CA ASP B 69 11.878 10.520 -20.062 1.00 0.00 C ATOM 2569 C ASP B 69 11.102 10.360 -18.756 1.00 0.00 C ATOM 2570 O ASP B 69 10.162 11.079 -18.480 1.00 0.00 O ATOM 2571 CB ASP B 69 13.283 11.042 -19.752 1.00 0.00 C ATOM 2572 CG ASP B 69 14.153 10.937 -21.005 1.00 0.00 C ATOM 2573 OD1 ASP B 69 13.863 10.089 -21.833 1.00 0.00 O ATOM 2574 OD2 ASP B 69 15.092 11.707 -21.117 1.00 0.00 O ATOM 0 H ASP B 69 11.600 12.410 -21.005 1.00 0.00 H new ATOM 0 HA ASP B 69 11.936 9.549 -20.554 1.00 0.00 H new ATOM 0 HB2 ASP B 69 13.232 12.078 -19.417 1.00 0.00 H new ATOM 0 HB3 ASP B 69 13.726 10.466 -18.939 1.00 0.00 H new ATOM 2579 N PHE B 70 11.500 9.407 -17.952 1.00 0.00 N ATOM 2580 CA PHE B 70 10.812 9.165 -16.653 1.00 0.00 C ATOM 2581 C PHE B 70 10.569 10.511 -15.961 1.00 0.00 C ATOM 2582 O PHE B 70 9.507 10.767 -15.440 1.00 0.00 O ATOM 2583 CB PHE B 70 11.726 8.285 -15.779 1.00 0.00 C ATOM 2584 CG PHE B 70 10.905 7.506 -14.773 1.00 0.00 C ATOM 2585 CD1 PHE B 70 10.290 8.167 -13.705 1.00 0.00 C ATOM 2586 CD2 PHE B 70 10.758 6.120 -14.913 1.00 0.00 C ATOM 2587 CE1 PHE B 70 9.530 7.445 -12.778 1.00 0.00 C ATOM 2588 CE2 PHE B 70 9.998 5.399 -13.989 1.00 0.00 C ATOM 2589 CZ PHE B 70 9.383 6.060 -12.921 1.00 0.00 C ATOM 0 H PHE B 70 12.282 8.781 -18.145 1.00 0.00 H new ATOM 0 HA PHE B 70 9.856 8.665 -16.809 1.00 0.00 H new ATOM 0 HB2 PHE B 70 12.289 7.597 -16.409 1.00 0.00 H new ATOM 0 HB3 PHE B 70 12.453 8.909 -15.259 1.00 0.00 H new ATOM 0 HD1 PHE B 70 10.402 9.236 -13.596 1.00 0.00 H new ATOM 0 HD2 PHE B 70 11.233 5.608 -15.737 1.00 0.00 H new ATOM 0 HE1 PHE B 70 9.057 7.956 -11.952 1.00 0.00 H new ATOM 0 HE2 PHE B 70 9.885 4.331 -14.099 1.00 0.00 H new ATOM 0 HZ PHE B 70 8.795 5.502 -12.207 1.00 0.00 H new ATOM 2599 N GLN B 71 11.550 11.370 -15.967 1.00 0.00 N ATOM 2600 CA GLN B 71 11.387 12.709 -15.330 1.00 0.00 C ATOM 2601 C GLN B 71 10.279 13.502 -16.034 1.00 0.00 C ATOM 2602 O GLN B 71 9.404 14.063 -15.410 1.00 0.00 O ATOM 2603 CB GLN B 71 12.718 13.470 -15.447 1.00 0.00 C ATOM 2604 CG GLN B 71 12.506 14.966 -15.180 1.00 0.00 C ATOM 2605 CD GLN B 71 13.859 15.652 -14.983 1.00 0.00 C ATOM 2606 OE1 GLN B 71 14.871 14.996 -14.840 1.00 0.00 O ATOM 2607 NE2 GLN B 71 13.918 16.955 -14.969 1.00 0.00 N ATOM 0 H GLN B 71 12.464 11.202 -16.388 1.00 0.00 H new ATOM 0 HA GLN B 71 11.112 12.585 -14.283 1.00 0.00 H new ATOM 0 HB2 GLN B 71 13.439 13.066 -14.736 1.00 0.00 H new ATOM 0 HB3 GLN B 71 13.139 13.328 -16.442 1.00 0.00 H new ATOM 0 HG2 GLN B 71 11.974 15.422 -16.015 1.00 0.00 H new ATOM 0 HG3 GLN B 71 11.886 15.103 -14.294 1.00 0.00 H new ATOM 0 HE21 GLN B 71 13.068 17.505 -15.089 1.00 0.00 H new ATOM 0 HE22 GLN B 71 14.814 17.424 -14.838 1.00 0.00 H new ATOM 2616 N GLU B 72 10.337 13.578 -17.326 1.00 0.00 N ATOM 2617 CA GLU B 72 9.320 14.358 -18.079 1.00 0.00 C ATOM 2618 C GLU B 72 7.922 13.774 -17.861 1.00 0.00 C ATOM 2619 O GLU B 72 6.957 14.498 -17.709 1.00 0.00 O ATOM 2620 CB GLU B 72 9.696 14.334 -19.560 1.00 0.00 C ATOM 2621 CG GLU B 72 10.956 15.177 -19.772 1.00 0.00 C ATOM 2622 CD GLU B 72 11.350 15.157 -21.250 1.00 0.00 C ATOM 2623 OE1 GLU B 72 11.999 14.207 -21.656 1.00 0.00 O ATOM 2624 OE2 GLU B 72 11.001 16.093 -21.948 1.00 0.00 O ATOM 0 H GLU B 72 11.050 13.130 -17.901 1.00 0.00 H new ATOM 0 HA GLU B 72 9.301 15.388 -17.721 1.00 0.00 H new ATOM 0 HB2 GLU B 72 9.870 13.309 -19.887 1.00 0.00 H new ATOM 0 HB3 GLU B 72 8.876 14.726 -20.162 1.00 0.00 H new ATOM 0 HG2 GLU B 72 10.778 16.202 -19.448 1.00 0.00 H new ATOM 0 HG3 GLU B 72 11.772 14.787 -19.163 1.00 0.00 H new ATOM 2631 N PHE B 73 7.797 12.481 -17.835 1.00 0.00 N ATOM 2632 CA PHE B 73 6.454 11.878 -17.618 1.00 0.00 C ATOM 2633 C PHE B 73 6.001 12.155 -16.191 1.00 0.00 C ATOM 2634 O PHE B 73 4.823 12.233 -15.911 1.00 0.00 O ATOM 2635 CB PHE B 73 6.497 10.366 -17.838 1.00 0.00 C ATOM 2636 CG PHE B 73 5.120 9.806 -17.570 1.00 0.00 C ATOM 2637 CD1 PHE B 73 4.182 9.730 -18.605 1.00 0.00 C ATOM 2638 CD2 PHE B 73 4.776 9.385 -16.280 1.00 0.00 C ATOM 2639 CE1 PHE B 73 2.900 9.230 -18.351 1.00 0.00 C ATOM 2640 CE2 PHE B 73 3.493 8.888 -16.025 1.00 0.00 C ATOM 2641 CZ PHE B 73 2.556 8.810 -17.060 1.00 0.00 C ATOM 0 H PHE B 73 8.561 11.816 -17.954 1.00 0.00 H new ATOM 0 HA PHE B 73 5.757 12.320 -18.330 1.00 0.00 H new ATOM 0 HB2 PHE B 73 6.806 10.140 -18.858 1.00 0.00 H new ATOM 0 HB3 PHE B 73 7.229 9.907 -17.174 1.00 0.00 H new ATOM 0 HD1 PHE B 73 4.447 10.057 -19.600 1.00 0.00 H new ATOM 0 HD2 PHE B 73 5.501 9.444 -15.482 1.00 0.00 H new ATOM 0 HE1 PHE B 73 2.176 9.168 -19.150 1.00 0.00 H new ATOM 0 HE2 PHE B 73 3.227 8.565 -15.029 1.00 0.00 H new ATOM 0 HZ PHE B 73 1.566 8.425 -16.864 1.00 0.00 H new ATOM 2651 N MET B 74 6.924 12.286 -15.285 1.00 0.00 N ATOM 2652 CA MET B 74 6.539 12.538 -13.878 1.00 0.00 C ATOM 2653 C MET B 74 5.748 13.832 -13.793 1.00 0.00 C ATOM 2654 O MET B 74 4.792 13.944 -13.051 1.00 0.00 O ATOM 2655 CB MET B 74 7.787 12.629 -12.987 1.00 0.00 C ATOM 2656 CG MET B 74 8.459 11.238 -12.843 1.00 0.00 C ATOM 2657 SD MET B 74 8.397 10.687 -11.112 1.00 0.00 S ATOM 2658 CE MET B 74 6.595 10.598 -10.948 1.00 0.00 C ATOM 0 H MET B 74 7.927 12.229 -15.460 1.00 0.00 H new ATOM 0 HA MET B 74 5.923 11.710 -13.527 1.00 0.00 H new ATOM 0 HB2 MET B 74 8.495 13.338 -13.415 1.00 0.00 H new ATOM 0 HB3 MET B 74 7.511 13.009 -12.003 1.00 0.00 H new ATOM 0 HG2 MET B 74 7.953 10.514 -13.481 1.00 0.00 H new ATOM 0 HG3 MET B 74 9.495 11.290 -13.179 1.00 0.00 H new ATOM 0 HE1 MET B 74 6.332 9.812 -10.240 1.00 0.00 H new ATOM 0 HE2 MET B 74 6.215 11.554 -10.587 1.00 0.00 H new ATOM 0 HE3 MET B 74 6.152 10.374 -11.918 1.00 0.00 H new ATOM 2668 N ALA B 75 6.135 14.825 -14.531 1.00 0.00 N ATOM 2669 CA ALA B 75 5.384 16.103 -14.458 1.00 0.00 C ATOM 2670 C ALA B 75 3.997 15.936 -15.095 1.00 0.00 C ATOM 2671 O ALA B 75 3.036 16.541 -14.670 1.00 0.00 O ATOM 2672 CB ALA B 75 6.178 17.214 -15.158 1.00 0.00 C ATOM 0 H ALA B 75 6.927 14.811 -15.174 1.00 0.00 H new ATOM 0 HA ALA B 75 5.248 16.382 -13.413 1.00 0.00 H new ATOM 0 HB1 ALA B 75 5.622 18.150 -15.101 1.00 0.00 H new ATOM 0 HB2 ALA B 75 7.144 17.336 -14.667 1.00 0.00 H new ATOM 0 HB3 ALA B 75 6.333 16.947 -16.203 1.00 0.00 H new ATOM 2678 N PHE B 76 3.881 15.123 -16.105 1.00 0.00 N ATOM 2679 CA PHE B 76 2.547 14.923 -16.753 1.00 0.00 C ATOM 2680 C PHE B 76 1.537 14.377 -15.746 1.00 0.00 C ATOM 2681 O PHE B 76 0.385 14.745 -15.746 1.00 0.00 O ATOM 2682 CB PHE B 76 2.693 13.934 -17.911 1.00 0.00 C ATOM 2683 CG PHE B 76 1.352 13.701 -18.563 1.00 0.00 C ATOM 2684 CD1 PHE B 76 0.794 14.681 -19.391 1.00 0.00 C ATOM 2685 CD2 PHE B 76 0.667 12.499 -18.344 1.00 0.00 C ATOM 2686 CE1 PHE B 76 -0.444 14.460 -19.999 1.00 0.00 C ATOM 2687 CE2 PHE B 76 -0.572 12.278 -18.955 1.00 0.00 C ATOM 2688 CZ PHE B 76 -1.127 13.259 -19.783 1.00 0.00 C ATOM 0 H PHE B 76 4.647 14.587 -16.513 1.00 0.00 H new ATOM 0 HA PHE B 76 2.188 15.883 -17.123 1.00 0.00 H new ATOM 0 HB2 PHE B 76 3.401 14.322 -18.644 1.00 0.00 H new ATOM 0 HB3 PHE B 76 3.098 12.990 -17.545 1.00 0.00 H new ATOM 0 HD1 PHE B 76 1.321 15.609 -19.560 1.00 0.00 H new ATOM 0 HD2 PHE B 76 1.095 11.743 -17.703 1.00 0.00 H new ATOM 0 HE1 PHE B 76 -0.874 15.218 -20.637 1.00 0.00 H new ATOM 0 HE2 PHE B 76 -1.099 11.351 -18.787 1.00 0.00 H new ATOM 0 HZ PHE B 76 -2.083 13.089 -20.256 1.00 0.00 H new ATOM 2698 N VAL B 77 1.961 13.482 -14.913 1.00 0.00 N ATOM 2699 CA VAL B 77 1.036 12.868 -13.908 1.00 0.00 C ATOM 2700 C VAL B 77 0.574 13.925 -12.907 1.00 0.00 C ATOM 2701 O VAL B 77 -0.533 13.884 -12.419 1.00 0.00 O ATOM 2702 CB VAL B 77 1.758 11.713 -13.168 1.00 0.00 C ATOM 2703 CG1 VAL B 77 0.838 10.498 -13.038 1.00 0.00 C ATOM 2704 CG2 VAL B 77 3.004 11.308 -13.949 1.00 0.00 C ATOM 0 H VAL B 77 2.921 13.138 -14.877 1.00 0.00 H new ATOM 0 HA VAL B 77 0.163 12.469 -14.424 1.00 0.00 H new ATOM 0 HB VAL B 77 2.034 12.060 -12.172 1.00 0.00 H new ATOM 0 HG11 VAL B 77 1.363 9.698 -12.516 1.00 0.00 H new ATOM 0 HG12 VAL B 77 -0.053 10.775 -12.475 1.00 0.00 H new ATOM 0 HG13 VAL B 77 0.547 10.154 -14.031 1.00 0.00 H new ATOM 0 HG21 VAL B 77 3.512 10.496 -13.429 1.00 0.00 H new ATOM 0 HG22 VAL B 77 2.716 10.976 -14.947 1.00 0.00 H new ATOM 0 HG23 VAL B 77 3.676 12.162 -14.031 1.00 0.00 H new ATOM 2714 N SER B 78 1.417 14.854 -12.583 1.00 0.00 N ATOM 2715 CA SER B 78 1.024 15.900 -11.603 1.00 0.00 C ATOM 2716 C SER B 78 -0.036 16.808 -12.225 1.00 0.00 C ATOM 2717 O SER B 78 -0.960 17.248 -11.571 1.00 0.00 O ATOM 2718 CB SER B 78 2.258 16.722 -11.214 1.00 0.00 C ATOM 2719 OG SER B 78 3.057 16.952 -12.365 1.00 0.00 O ATOM 0 H SER B 78 2.364 14.938 -12.953 1.00 0.00 H new ATOM 0 HA SER B 78 0.611 15.431 -10.710 1.00 0.00 H new ATOM 0 HB2 SER B 78 1.952 17.672 -10.775 1.00 0.00 H new ATOM 0 HB3 SER B 78 2.836 16.193 -10.457 1.00 0.00 H new ATOM 0 HG SER B 78 2.541 16.736 -13.170 1.00 0.00 H new ATOM 2725 N MET B 79 0.114 17.112 -13.479 1.00 0.00 N ATOM 2726 CA MET B 79 -0.851 18.017 -14.157 1.00 0.00 C ATOM 2727 C MET B 79 -2.229 17.363 -14.299 1.00 0.00 C ATOM 2728 O MET B 79 -3.252 17.975 -14.041 1.00 0.00 O ATOM 2729 CB MET B 79 -0.297 18.330 -15.549 1.00 0.00 C ATOM 2730 CG MET B 79 0.948 19.211 -15.421 1.00 0.00 C ATOM 2731 SD MET B 79 1.762 19.332 -17.033 1.00 0.00 S ATOM 2732 CE MET B 79 0.414 20.171 -17.893 1.00 0.00 C ATOM 0 H MET B 79 0.871 16.769 -14.070 1.00 0.00 H new ATOM 0 HA MET B 79 -0.973 18.922 -13.562 1.00 0.00 H new ATOM 0 HB2 MET B 79 -0.048 17.405 -16.069 1.00 0.00 H new ATOM 0 HB3 MET B 79 -1.054 18.838 -16.147 1.00 0.00 H new ATOM 0 HG2 MET B 79 0.671 20.203 -15.065 1.00 0.00 H new ATOM 0 HG3 MET B 79 1.633 18.789 -14.686 1.00 0.00 H new ATOM 0 HE1 MET B 79 0.815 20.735 -18.735 1.00 0.00 H new ATOM 0 HE2 MET B 79 -0.300 19.433 -18.258 1.00 0.00 H new ATOM 0 HE3 MET B 79 -0.088 20.852 -17.206 1.00 0.00 H new ATOM 2742 N VAL B 80 -2.269 16.137 -14.719 1.00 0.00 N ATOM 2743 CA VAL B 80 -3.582 15.458 -14.897 1.00 0.00 C ATOM 2744 C VAL B 80 -4.221 15.188 -13.539 1.00 0.00 C ATOM 2745 O VAL B 80 -5.425 15.244 -13.384 1.00 0.00 O ATOM 2746 CB VAL B 80 -3.392 14.137 -15.638 1.00 0.00 C ATOM 2747 CG1 VAL B 80 -4.762 13.523 -15.925 1.00 0.00 C ATOM 2748 CG2 VAL B 80 -2.665 14.392 -16.959 1.00 0.00 C ATOM 0 H VAL B 80 -1.452 15.572 -14.948 1.00 0.00 H new ATOM 0 HA VAL B 80 -4.234 16.109 -15.479 1.00 0.00 H new ATOM 0 HB VAL B 80 -2.802 13.455 -15.026 1.00 0.00 H new ATOM 0 HG11 VAL B 80 -4.634 12.579 -16.454 1.00 0.00 H new ATOM 0 HG12 VAL B 80 -5.285 13.344 -14.985 1.00 0.00 H new ATOM 0 HG13 VAL B 80 -5.346 14.208 -16.540 1.00 0.00 H new ATOM 0 HG21 VAL B 80 -2.530 13.449 -17.488 1.00 0.00 H new ATOM 0 HG22 VAL B 80 -3.255 15.071 -17.574 1.00 0.00 H new ATOM 0 HG23 VAL B 80 -1.691 14.838 -16.758 1.00 0.00 H new ATOM 2758 N THR B 81 -3.427 14.881 -12.559 1.00 0.00 N ATOM 2759 CA THR B 81 -3.992 14.591 -11.212 1.00 0.00 C ATOM 2760 C THR B 81 -4.742 15.825 -10.737 1.00 0.00 C ATOM 2761 O THR B 81 -5.805 15.743 -10.158 1.00 0.00 O ATOM 2762 CB THR B 81 -2.875 14.246 -10.229 1.00 0.00 C ATOM 2763 OG1 THR B 81 -2.162 13.113 -10.704 1.00 0.00 O ATOM 2764 CG2 THR B 81 -3.493 13.917 -8.867 1.00 0.00 C ATOM 0 H THR B 81 -2.411 14.817 -12.629 1.00 0.00 H new ATOM 0 HA THR B 81 -4.667 13.737 -11.268 1.00 0.00 H new ATOM 0 HB THR B 81 -2.194 15.092 -10.134 1.00 0.00 H new ATOM 0 HG1 THR B 81 -1.246 13.375 -10.933 1.00 0.00 H new ATOM 0 HG21 THR B 81 -2.702 13.669 -8.159 1.00 0.00 H new ATOM 0 HG22 THR B 81 -4.050 14.780 -8.502 1.00 0.00 H new ATOM 0 HG23 THR B 81 -4.168 13.067 -8.969 1.00 0.00 H new ATOM 2772 N THR B 82 -4.194 16.976 -10.992 1.00 0.00 N ATOM 2773 CA THR B 82 -4.868 18.228 -10.574 1.00 0.00 C ATOM 2774 C THR B 82 -6.283 18.209 -11.155 1.00 0.00 C ATOM 2775 O THR B 82 -7.233 18.627 -10.524 1.00 0.00 O ATOM 2776 CB THR B 82 -4.085 19.425 -11.132 1.00 0.00 C ATOM 2777 OG1 THR B 82 -2.694 19.188 -10.976 1.00 0.00 O ATOM 2778 CG2 THR B 82 -4.463 20.697 -10.373 1.00 0.00 C ATOM 0 H THR B 82 -3.304 17.103 -11.474 1.00 0.00 H new ATOM 0 HA THR B 82 -4.910 18.310 -9.488 1.00 0.00 H new ATOM 0 HB THR B 82 -4.327 19.550 -12.187 1.00 0.00 H new ATOM 0 HG1 THR B 82 -2.540 18.673 -10.157 1.00 0.00 H new ATOM 0 HG21 THR B 82 -3.903 21.541 -10.776 1.00 0.00 H new ATOM 0 HG22 THR B 82 -5.531 20.884 -10.485 1.00 0.00 H new ATOM 0 HG23 THR B 82 -4.225 20.574 -9.316 1.00 0.00 H new ATOM 2786 N ALA B 83 -6.428 17.704 -12.351 1.00 0.00 N ATOM 2787 CA ALA B 83 -7.782 17.630 -12.972 1.00 0.00 C ATOM 2788 C ALA B 83 -8.699 16.772 -12.094 1.00 0.00 C ATOM 2789 O ALA B 83 -9.858 17.081 -11.905 1.00 0.00 O ATOM 2790 CB ALA B 83 -7.667 17.002 -14.366 1.00 0.00 C ATOM 0 H ALA B 83 -5.667 17.340 -12.925 1.00 0.00 H new ATOM 0 HA ALA B 83 -8.201 18.632 -13.059 1.00 0.00 H new ATOM 0 HB1 ALA B 83 -8.655 16.946 -14.823 1.00 0.00 H new ATOM 0 HB2 ALA B 83 -7.014 17.614 -14.988 1.00 0.00 H new ATOM 0 HB3 ALA B 83 -7.250 15.999 -14.280 1.00 0.00 H new ATOM 2796 N CYS B 84 -8.185 15.699 -11.557 1.00 0.00 N ATOM 2797 CA CYS B 84 -9.021 14.821 -10.688 1.00 0.00 C ATOM 2798 C CYS B 84 -9.529 15.621 -9.490 1.00 0.00 C ATOM 2799 O CYS B 84 -10.653 15.458 -9.058 1.00 0.00 O ATOM 2800 CB CYS B 84 -8.193 13.637 -10.184 1.00 0.00 C ATOM 2801 SG CYS B 84 -9.167 12.692 -8.985 1.00 0.00 S ATOM 0 H CYS B 84 -7.221 15.392 -11.683 1.00 0.00 H new ATOM 0 HA CYS B 84 -9.864 14.450 -11.270 1.00 0.00 H new ATOM 0 HB2 CYS B 84 -7.904 12.999 -11.019 1.00 0.00 H new ATOM 0 HB3 CYS B 84 -7.272 13.993 -9.722 1.00 0.00 H new ATOM 0 HG CYS B 84 -8.467 11.684 -8.556 1.00 0.00 H new ATOM 2807 N HIS B 85 -8.711 16.479 -8.938 1.00 0.00 N ATOM 2808 CA HIS B 85 -9.165 17.266 -7.760 1.00 0.00 C ATOM 2809 C HIS B 85 -10.381 18.096 -8.154 1.00 0.00 C ATOM 2810 O HIS B 85 -11.331 18.213 -7.406 1.00 0.00 O ATOM 2811 CB HIS B 85 -8.043 18.205 -7.311 1.00 0.00 C ATOM 2812 CG HIS B 85 -8.530 19.066 -6.179 1.00 0.00 C ATOM 2813 ND1 HIS B 85 -9.173 20.277 -6.399 1.00 0.00 N ATOM 2814 CD2 HIS B 85 -8.475 18.914 -4.817 1.00 0.00 C ATOM 2815 CE1 HIS B 85 -9.475 20.800 -5.197 1.00 0.00 C ATOM 2816 NE2 HIS B 85 -9.070 20.009 -4.203 1.00 0.00 N ATOM 0 H HIS B 85 -7.758 16.666 -9.250 1.00 0.00 H new ATOM 0 HA HIS B 85 -9.424 16.589 -6.946 1.00 0.00 H new ATOM 0 HB2 HIS B 85 -7.175 17.626 -6.994 1.00 0.00 H new ATOM 0 HB3 HIS B 85 -7.722 18.830 -8.145 1.00 0.00 H new ATOM 0 HD1 HIS B 85 -9.379 20.694 -7.307 1.00 0.00 H new ATOM 0 HD2 HIS B 85 -8.037 18.073 -4.301 1.00 0.00 H new ATOM 0 HE1 HIS B 85 -9.982 21.743 -5.055 1.00 0.00 H new ATOM 2825 N GLU B 86 -10.372 18.663 -9.325 1.00 0.00 N ATOM 2826 CA GLU B 86 -11.544 19.466 -9.754 1.00 0.00 C ATOM 2827 C GLU B 86 -12.772 18.555 -9.799 1.00 0.00 C ATOM 2828 O GLU B 86 -13.851 18.926 -9.380 1.00 0.00 O ATOM 2829 CB GLU B 86 -11.275 20.054 -11.141 1.00 0.00 C ATOM 2830 CG GLU B 86 -12.446 20.944 -11.560 1.00 0.00 C ATOM 2831 CD GLU B 86 -12.164 21.532 -12.944 1.00 0.00 C ATOM 2832 OE1 GLU B 86 -11.045 21.388 -13.409 1.00 0.00 O ATOM 2833 OE2 GLU B 86 -13.069 22.117 -13.514 1.00 0.00 O ATOM 0 H GLU B 86 -9.609 18.605 -9.999 1.00 0.00 H new ATOM 0 HA GLU B 86 -11.720 20.282 -9.053 1.00 0.00 H new ATOM 0 HB2 GLU B 86 -10.352 20.633 -11.128 1.00 0.00 H new ATOM 0 HB3 GLU B 86 -11.138 19.252 -11.866 1.00 0.00 H new ATOM 0 HG2 GLU B 86 -13.369 20.365 -11.579 1.00 0.00 H new ATOM 0 HG3 GLU B 86 -12.587 21.745 -10.834 1.00 0.00 H new ATOM 2840 N PHE B 87 -12.608 17.356 -10.292 1.00 0.00 N ATOM 2841 CA PHE B 87 -13.758 16.406 -10.352 1.00 0.00 C ATOM 2842 C PHE B 87 -14.008 15.815 -8.966 1.00 0.00 C ATOM 2843 O PHE B 87 -15.134 15.644 -8.543 1.00 0.00 O ATOM 2844 CB PHE B 87 -13.450 15.276 -11.337 1.00 0.00 C ATOM 2845 CG PHE B 87 -13.532 15.801 -12.752 1.00 0.00 C ATOM 2846 CD1 PHE B 87 -14.778 16.122 -13.303 1.00 0.00 C ATOM 2847 CD2 PHE B 87 -12.368 15.960 -13.515 1.00 0.00 C ATOM 2848 CE1 PHE B 87 -14.861 16.603 -14.615 1.00 0.00 C ATOM 2849 CE2 PHE B 87 -12.451 16.441 -14.827 1.00 0.00 C ATOM 2850 CZ PHE B 87 -13.698 16.763 -15.377 1.00 0.00 C ATOM 0 H PHE B 87 -11.727 16.993 -10.656 1.00 0.00 H new ATOM 0 HA PHE B 87 -14.646 16.943 -10.686 1.00 0.00 H new ATOM 0 HB2 PHE B 87 -12.456 14.873 -11.145 1.00 0.00 H new ATOM 0 HB3 PHE B 87 -14.157 14.458 -11.200 1.00 0.00 H new ATOM 0 HD1 PHE B 87 -15.676 15.999 -12.716 1.00 0.00 H new ATOM 0 HD2 PHE B 87 -11.406 15.711 -13.091 1.00 0.00 H new ATOM 0 HE1 PHE B 87 -15.823 16.851 -15.039 1.00 0.00 H new ATOM 0 HE2 PHE B 87 -11.553 16.564 -15.415 1.00 0.00 H new ATOM 0 HZ PHE B 87 -13.762 17.135 -16.389 1.00 0.00 H new ATOM 2860 N PHE B 88 -12.958 15.505 -8.256 1.00 0.00 N ATOM 2861 CA PHE B 88 -13.112 14.926 -6.893 1.00 0.00 C ATOM 2862 C PHE B 88 -13.131 16.082 -5.890 1.00 0.00 C ATOM 2863 O PHE B 88 -12.280 16.191 -5.029 1.00 0.00 O ATOM 2864 CB PHE B 88 -11.918 13.981 -6.618 1.00 0.00 C ATOM 2865 CG PHE B 88 -12.331 12.837 -5.706 1.00 0.00 C ATOM 2866 CD1 PHE B 88 -12.967 13.102 -4.485 1.00 0.00 C ATOM 2867 CD2 PHE B 88 -12.069 11.509 -6.080 1.00 0.00 C ATOM 2868 CE1 PHE B 88 -13.339 12.046 -3.643 1.00 0.00 C ATOM 2869 CE2 PHE B 88 -12.443 10.455 -5.238 1.00 0.00 C ATOM 2870 CZ PHE B 88 -13.078 10.723 -4.020 1.00 0.00 C ATOM 0 H PHE B 88 -11.994 15.629 -8.565 1.00 0.00 H new ATOM 0 HA PHE B 88 -14.036 14.355 -6.805 1.00 0.00 H new ATOM 0 HB2 PHE B 88 -11.540 13.583 -7.560 1.00 0.00 H new ATOM 0 HB3 PHE B 88 -11.104 14.541 -6.159 1.00 0.00 H new ATOM 0 HD1 PHE B 88 -13.170 14.122 -4.193 1.00 0.00 H new ATOM 0 HD2 PHE B 88 -11.578 11.300 -7.019 1.00 0.00 H new ATOM 0 HE1 PHE B 88 -13.828 12.253 -2.702 1.00 0.00 H new ATOM 0 HE2 PHE B 88 -12.241 9.435 -5.529 1.00 0.00 H new ATOM 0 HZ PHE B 88 -13.367 9.909 -3.371 1.00 0.00 H new ATOM 2880 N GLU B 89 -14.097 16.952 -5.995 1.00 0.00 N ATOM 2881 CA GLU B 89 -14.154 18.093 -5.052 1.00 0.00 C ATOM 2882 C GLU B 89 -14.620 17.576 -3.701 1.00 0.00 C ATOM 2883 O GLU B 89 -15.772 17.244 -3.503 1.00 0.00 O ATOM 2884 CB GLU B 89 -15.131 19.151 -5.570 1.00 0.00 C ATOM 2885 CG GLU B 89 -15.038 20.405 -4.698 1.00 0.00 C ATOM 2886 CD GLU B 89 -16.015 21.460 -5.219 1.00 0.00 C ATOM 2887 OE1 GLU B 89 -16.554 21.260 -6.295 1.00 0.00 O ATOM 2888 OE2 GLU B 89 -16.208 22.451 -4.534 1.00 0.00 O ATOM 0 H GLU B 89 -14.843 16.919 -6.690 1.00 0.00 H new ATOM 0 HA GLU B 89 -13.168 18.549 -4.958 1.00 0.00 H new ATOM 0 HB2 GLU B 89 -14.900 19.398 -6.606 1.00 0.00 H new ATOM 0 HB3 GLU B 89 -16.148 18.760 -5.555 1.00 0.00 H new ATOM 0 HG2 GLU B 89 -15.270 20.159 -3.662 1.00 0.00 H new ATOM 0 HG3 GLU B 89 -14.021 20.797 -4.712 1.00 0.00 H new ATOM 2895 N HIS B 90 -13.720 17.501 -2.774 1.00 0.00 N ATOM 2896 CA HIS B 90 -14.076 17.001 -1.421 1.00 0.00 C ATOM 2897 C HIS B 90 -15.152 17.906 -0.824 1.00 0.00 C ATOM 2898 O HIS B 90 -16.065 17.448 -0.167 1.00 0.00 O ATOM 2899 CB HIS B 90 -12.834 17.008 -0.529 1.00 0.00 C ATOM 2900 CG HIS B 90 -13.182 16.429 0.815 1.00 0.00 C ATOM 2901 ND1 HIS B 90 -13.556 17.221 1.892 1.00 0.00 N ATOM 2902 CD2 HIS B 90 -13.220 15.134 1.269 1.00 0.00 C ATOM 2903 CE1 HIS B 90 -13.801 16.401 2.932 1.00 0.00 C ATOM 2904 NE2 HIS B 90 -13.610 15.122 2.603 1.00 0.00 N ATOM 0 H HIS B 90 -12.742 17.766 -2.893 1.00 0.00 H new ATOM 0 HA HIS B 90 -14.455 15.982 -1.490 1.00 0.00 H new ATOM 0 HB2 HIS B 90 -12.037 16.427 -0.992 1.00 0.00 H new ATOM 0 HB3 HIS B 90 -12.461 18.026 -0.414 1.00 0.00 H new ATOM 0 HD2 HIS B 90 -12.983 14.260 0.681 1.00 0.00 H new ATOM 0 HE1 HIS B 90 -14.113 16.737 3.910 1.00 0.00 H new ATOM 0 HE2 HIS B 90 -13.726 14.306 3.204 1.00 0.00 H new ATOM 2913 N GLU B 91 -15.044 19.188 -1.048 1.00 0.00 N ATOM 2914 CA GLU B 91 -16.052 20.143 -0.503 1.00 0.00 C ATOM 2915 CB GLU B 91 -17.430 19.853 -1.110 1.00 0.00 C ATOM 2916 CG GLU B 91 -18.432 20.901 -0.622 1.00 0.00 C ATOM 2917 CD GLU B 91 -19.772 20.699 -1.332 1.00 0.00 C ATOM 2918 OE1 GLU B 91 -19.822 19.887 -2.241 1.00 0.00 O ATOM 2919 OE2 GLU B 91 -20.725 21.362 -0.958 1.00 0.00 O ATOM 0 H GLU B 91 -14.294 19.618 -1.590 1.00 0.00 H new ATOM 0 HB2 GLU B 91 -17.371 19.870 -2.198 1.00 0.00 H new ATOM 0 HB3 GLU B 91 -17.763 18.855 -0.824 1.00 0.00 H new ATOM 0 HG2 GLU B 91 -18.564 20.818 0.457 1.00 0.00 H new ATOM 0 HG3 GLU B 91 -18.051 21.903 -0.820 1.00 0.00 H new TER 2926 GLU B 91 ATOM 2927 N SER X 92 39.766 9.612 4.028 1.00 0.00 N ATOM 2928 CA SER X 92 40.583 9.638 5.274 1.00 0.00 C ATOM 2929 C SER X 92 40.804 11.088 5.708 1.00 0.00 C ATOM 2930 O SER X 92 41.588 11.369 6.593 1.00 0.00 O ATOM 2931 CB SER X 92 41.934 8.971 5.011 1.00 0.00 C ATOM 2932 OG SER X 92 41.721 7.627 4.600 1.00 0.00 O ATOM 0 HA SER X 92 40.060 9.099 6.064 1.00 0.00 H new ATOM 0 HB2 SER X 92 42.479 9.517 4.241 1.00 0.00 H new ATOM 0 HB3 SER X 92 42.546 8.995 5.912 1.00 0.00 H new ATOM 0 HG SER X 92 40.882 7.568 4.097 1.00 0.00 H new ATOM 2940 N HIS X 93 40.118 12.013 5.092 1.00 0.00 N ATOM 2941 CA HIS X 93 40.284 13.446 5.470 1.00 0.00 C ATOM 2942 C HIS X 93 39.385 13.773 6.662 1.00 0.00 C ATOM 2943 O HIS X 93 38.250 13.345 6.733 1.00 0.00 O ATOM 2944 CB HIS X 93 39.902 14.337 4.286 1.00 0.00 C ATOM 2945 CG HIS X 93 40.961 14.242 3.223 1.00 0.00 C ATOM 2946 ND1 HIS X 93 42.134 14.981 3.283 1.00 0.00 N ATOM 2947 CD2 HIS X 93 41.041 13.502 2.069 1.00 0.00 C ATOM 2948 CE1 HIS X 93 42.864 14.672 2.196 1.00 0.00 C ATOM 2949 NE2 HIS X 93 42.243 13.776 1.427 1.00 0.00 N ATOM 0 H HIS X 93 39.449 11.838 4.342 1.00 0.00 H new ATOM 0 HA HIS X 93 41.324 13.627 5.741 1.00 0.00 H new ATOM 0 HB2 HIS X 93 38.938 14.029 3.882 1.00 0.00 H new ATOM 0 HB3 HIS X 93 39.794 15.370 4.615 1.00 0.00 H new ATOM 0 HD2 HIS X 93 40.287 12.814 1.715 1.00 0.00 H new ATOM 0 HE1 HIS X 93 43.832 15.096 1.974 1.00 0.00 H new ATOM 0 HE2 HIS X 93 42.580 13.376 0.551 1.00 0.00 H new ATOM 2958 N LEU X 94 39.883 14.534 7.600 1.00 0.00 N ATOM 2959 CA LEU X 94 39.064 14.900 8.793 1.00 0.00 C ATOM 2960 C LEU X 94 38.402 16.256 8.541 1.00 0.00 C ATOM 2961 O LEU X 94 38.979 17.135 7.933 1.00 0.00 O ATOM 2962 CB LEU X 94 39.972 14.992 10.023 1.00 0.00 C ATOM 2963 CG LEU X 94 40.693 13.655 10.244 1.00 0.00 C ATOM 2964 CD1 LEU X 94 41.633 13.782 11.446 1.00 0.00 C ATOM 2965 CD2 LEU X 94 39.670 12.537 10.508 1.00 0.00 C ATOM 0 H LEU X 94 40.827 14.920 7.591 1.00 0.00 H new ATOM 0 HA LEU X 94 38.299 14.143 8.967 1.00 0.00 H new ATOM 0 HB2 LEU X 94 40.702 15.790 9.888 1.00 0.00 H new ATOM 0 HB3 LEU X 94 39.381 15.246 10.903 1.00 0.00 H new ATOM 0 HG LEU X 94 41.266 13.405 9.351 1.00 0.00 H new ATOM 0 HD11 LEU X 94 42.148 12.835 11.607 1.00 0.00 H new ATOM 0 HD12 LEU X 94 42.366 14.565 11.253 1.00 0.00 H new ATOM 0 HD13 LEU X 94 41.055 14.037 12.334 1.00 0.00 H new ATOM 0 HD21 LEU X 94 40.194 11.594 10.663 1.00 0.00 H new ATOM 0 HD22 LEU X 94 39.088 12.779 11.397 1.00 0.00 H new ATOM 0 HD23 LEU X 94 39.003 12.445 9.651 1.00 0.00 H new ATOM 2977 N LYS X 95 37.187 16.428 8.993 1.00 0.00 N ATOM 2978 CA LYS X 95 36.472 17.722 8.770 1.00 0.00 C ATOM 2979 C LYS X 95 35.629 18.064 9.999 1.00 0.00 C ATOM 2980 O LYS X 95 35.314 17.212 10.806 1.00 0.00 O ATOM 2981 CB LYS X 95 35.564 17.588 7.546 1.00 0.00 C ATOM 2982 CG LYS X 95 34.614 16.406 7.745 1.00 0.00 C ATOM 2983 CD LYS X 95 33.851 16.141 6.447 1.00 0.00 C ATOM 2984 CE LYS X 95 32.916 14.947 6.644 1.00 0.00 C ATOM 2985 NZ LYS X 95 31.863 15.300 7.637 1.00 0.00 N ATOM 0 H LYS X 95 36.657 15.726 9.509 1.00 0.00 H new ATOM 0 HA LYS X 95 37.199 18.517 8.603 1.00 0.00 H new ATOM 0 HB2 LYS X 95 34.995 18.506 7.400 1.00 0.00 H new ATOM 0 HB3 LYS X 95 36.164 17.439 6.649 1.00 0.00 H new ATOM 0 HG2 LYS X 95 35.176 15.519 8.036 1.00 0.00 H new ATOM 0 HG3 LYS X 95 33.915 16.620 8.553 1.00 0.00 H new ATOM 0 HD2 LYS X 95 33.278 17.023 6.162 1.00 0.00 H new ATOM 0 HD3 LYS X 95 34.550 15.940 5.635 1.00 0.00 H new ATOM 0 HE2 LYS X 95 32.458 14.670 5.695 1.00 0.00 H new ATOM 0 HE3 LYS X 95 33.482 14.082 6.990 1.00 0.00 H new ATOM 0 HZ1 LYS X 95 31.061 14.644 7.541 1.00 0.00 H new ATOM 0 HZ2 LYS X 95 32.255 15.230 8.598 1.00 0.00 H new ATOM 0 HZ3 LYS X 95 31.537 16.273 7.466 1.00 0.00 H new ATOM 2999 N SER X 96 35.267 19.312 10.150 1.00 0.00 N ATOM 3000 CA SER X 96 34.449 19.729 11.328 1.00 0.00 C ATOM 3001 C SER X 96 32.971 19.799 10.931 1.00 0.00 C ATOM 3002 O SER X 96 32.558 19.236 9.937 1.00 0.00 O ATOM 3003 CB SER X 96 34.915 21.105 11.802 1.00 0.00 C ATOM 3004 OG SER X 96 34.135 21.506 12.921 1.00 0.00 O ATOM 0 H SER X 96 35.505 20.065 9.504 1.00 0.00 H new ATOM 0 HA SER X 96 34.571 19.003 12.131 1.00 0.00 H new ATOM 0 HB2 SER X 96 35.970 21.071 12.073 1.00 0.00 H new ATOM 0 HB3 SER X 96 34.817 21.832 10.996 1.00 0.00 H new ATOM 0 HG SER X 96 34.047 20.755 13.545 1.00 0.00 H new ATOM 3010 N LYS X 97 32.173 20.478 11.708 1.00 0.00 N ATOM 3011 CA LYS X 97 30.719 20.579 11.389 1.00 0.00 C ATOM 3012 C LYS X 97 30.497 21.595 10.264 1.00 0.00 C ATOM 3013 O LYS X 97 29.452 22.208 10.170 1.00 0.00 O ATOM 3014 CB LYS X 97 29.956 21.017 12.644 1.00 0.00 C ATOM 3015 CG LYS X 97 30.480 22.375 13.122 1.00 0.00 C ATOM 3016 CD LYS X 97 29.717 22.806 14.377 1.00 0.00 C ATOM 3017 CE LYS X 97 30.194 24.194 14.811 1.00 0.00 C ATOM 3018 NZ LYS X 97 31.631 24.128 15.201 1.00 0.00 N ATOM 0 H LYS X 97 32.465 20.969 12.553 1.00 0.00 H new ATOM 0 HA LYS X 97 30.353 19.607 11.060 1.00 0.00 H new ATOM 0 HB2 LYS X 97 28.890 21.084 12.428 1.00 0.00 H new ATOM 0 HB3 LYS X 97 30.075 20.273 13.432 1.00 0.00 H new ATOM 0 HG2 LYS X 97 31.547 22.310 13.337 1.00 0.00 H new ATOM 0 HG3 LYS X 97 30.358 23.120 12.336 1.00 0.00 H new ATOM 0 HD2 LYS X 97 28.646 22.824 14.176 1.00 0.00 H new ATOM 0 HD3 LYS X 97 29.879 22.086 15.179 1.00 0.00 H new ATOM 0 HE2 LYS X 97 30.060 24.907 13.997 1.00 0.00 H new ATOM 0 HE3 LYS X 97 29.595 24.550 15.649 1.00 0.00 H new ATOM 0 HZ1 LYS X 97 31.879 24.971 15.757 1.00 0.00 H new ATOM 0 HZ2 LYS X 97 31.797 23.275 15.773 1.00 0.00 H new ATOM 0 HZ3 LYS X 97 32.222 24.092 14.346 1.00 0.00 H new ATOM 3032 N LYS X 98 31.468 21.781 9.412 1.00 0.00 N ATOM 3033 CA LYS X 98 31.299 22.759 8.299 1.00 0.00 C ATOM 3034 C LYS X 98 30.114 22.332 7.436 1.00 0.00 C ATOM 3035 O LYS X 98 29.331 23.145 6.990 1.00 0.00 O ATOM 3036 CB LYS X 98 32.561 22.780 7.435 1.00 0.00 C ATOM 3037 CG LYS X 98 33.710 23.417 8.216 1.00 0.00 C ATOM 3038 CD LYS X 98 34.965 23.433 7.344 1.00 0.00 C ATOM 3039 CE LYS X 98 36.119 24.069 8.119 1.00 0.00 C ATOM 3040 NZ LYS X 98 37.401 23.779 7.419 1.00 0.00 N ATOM 0 H LYS X 98 32.367 21.301 9.438 1.00 0.00 H new ATOM 0 HA LYS X 98 31.124 23.752 8.712 1.00 0.00 H new ATOM 0 HB2 LYS X 98 32.828 21.765 7.140 1.00 0.00 H new ATOM 0 HB3 LYS X 98 32.377 23.341 6.519 1.00 0.00 H new ATOM 0 HG2 LYS X 98 33.445 24.432 8.511 1.00 0.00 H new ATOM 0 HG3 LYS X 98 33.897 22.857 9.132 1.00 0.00 H new ATOM 0 HD2 LYS X 98 35.228 22.417 7.049 1.00 0.00 H new ATOM 0 HD3 LYS X 98 34.777 23.993 6.428 1.00 0.00 H new ATOM 0 HE2 LYS X 98 35.970 25.146 8.197 1.00 0.00 H new ATOM 0 HE3 LYS X 98 36.150 23.677 9.135 1.00 0.00 H new ATOM 0 HZ1 LYS X 98 38.188 24.210 7.944 1.00 0.00 H new ATOM 0 HZ2 LYS X 98 37.543 22.750 7.366 1.00 0.00 H new ATOM 0 HZ3 LYS X 98 37.368 24.174 6.457 1.00 0.00 H new ATOM 3054 N GLY X 99 29.976 21.057 7.200 1.00 0.00 N ATOM 3055 CA GLY X 99 28.841 20.577 6.368 1.00 0.00 C ATOM 3056 C GLY X 99 27.532 20.801 7.121 1.00 0.00 C ATOM 3057 O GLY X 99 27.505 20.863 8.335 1.00 0.00 O ATOM 0 H GLY X 99 30.600 20.329 7.547 1.00 0.00 H new ATOM 0 HA2 GLY X 99 28.822 21.109 5.417 1.00 0.00 H new ATOM 0 HA3 GLY X 99 28.965 19.519 6.139 1.00 0.00 H new ATOM 3061 N GLN X 100 26.445 20.923 6.404 1.00 0.00 N ATOM 3062 CA GLN X 100 25.114 21.143 7.051 1.00 0.00 C ATOM 3063 C GLN X 100 24.118 20.144 6.460 1.00 0.00 C ATOM 3064 O GLN X 100 24.333 19.603 5.394 1.00 0.00 O ATOM 3065 CB GLN X 100 24.643 22.572 6.764 1.00 0.00 C ATOM 3066 CG GLN X 100 25.659 23.568 7.329 1.00 0.00 C ATOM 3067 CD GLN X 100 25.700 23.451 8.855 1.00 0.00 C ATOM 3068 OE1 GLN X 100 24.677 23.294 9.491 1.00 0.00 O ATOM 3069 NE2 GLN X 100 26.847 23.523 9.473 1.00 0.00 N ATOM 0 H GLN X 100 26.421 20.879 5.385 1.00 0.00 H new ATOM 0 HA GLN X 100 25.188 21.001 8.129 1.00 0.00 H new ATOM 0 HB2 GLN X 100 24.531 22.720 5.690 1.00 0.00 H new ATOM 0 HB3 GLN X 100 23.664 22.741 7.213 1.00 0.00 H new ATOM 0 HG2 GLN X 100 26.647 23.371 6.913 1.00 0.00 H new ATOM 0 HG3 GLN X 100 25.388 24.583 7.039 1.00 0.00 H new ATOM 0 HE21 GLN X 100 27.706 23.655 8.940 1.00 0.00 H new ATOM 0 HE22 GLN X 100 26.884 23.447 10.490 1.00 0.00 H new ATOM 3078 N SER X 101 23.034 19.887 7.137 1.00 0.00 N ATOM 3079 CA SER X 101 22.046 18.913 6.593 1.00 0.00 C ATOM 3080 C SER X 101 21.611 19.362 5.200 1.00 0.00 C ATOM 3081 O SER X 101 21.226 18.560 4.372 1.00 0.00 O ATOM 3082 CB SER X 101 20.826 18.829 7.505 1.00 0.00 C ATOM 3083 OG SER X 101 21.233 18.403 8.799 1.00 0.00 O ATOM 0 H SER X 101 22.790 20.304 8.035 1.00 0.00 H new ATOM 0 HA SER X 101 22.511 17.929 6.537 1.00 0.00 H new ATOM 0 HB2 SER X 101 20.337 19.801 7.567 1.00 0.00 H new ATOM 0 HB3 SER X 101 20.097 18.131 7.093 1.00 0.00 H new ATOM 0 HG SER X 101 20.451 18.350 9.387 1.00 0.00 H new ATOM 3089 N THR X 102 21.669 20.642 4.935 1.00 0.00 N ATOM 3090 CA THR X 102 21.264 21.157 3.593 1.00 0.00 C ATOM 3091 C THR X 102 21.852 20.256 2.505 1.00 0.00 C ATOM 3092 O THR X 102 21.339 20.174 1.407 1.00 0.00 O ATOM 3093 CB THR X 102 21.776 22.596 3.417 1.00 0.00 C ATOM 3094 OG1 THR X 102 21.136 23.183 2.292 1.00 0.00 O ATOM 3095 CG2 THR X 102 23.300 22.610 3.200 1.00 0.00 C ATOM 0 H THR X 102 21.981 21.356 5.594 1.00 0.00 H new ATOM 0 HA THR X 102 20.177 21.155 3.513 1.00 0.00 H new ATOM 0 HB THR X 102 21.548 23.163 4.320 1.00 0.00 H new ATOM 0 HG1 THR X 102 21.457 24.101 2.175 1.00 0.00 H new ATOM 0 HG21 THR X 102 23.641 23.638 3.078 1.00 0.00 H new ATOM 0 HG22 THR X 102 23.794 22.164 4.063 1.00 0.00 H new ATOM 0 HG23 THR X 102 23.545 22.038 2.305 1.00 0.00 H new ATOM 3103 N SER X 103 22.926 19.576 2.804 1.00 0.00 N ATOM 3104 CA SER X 103 23.538 18.681 1.787 1.00 0.00 C ATOM 3105 C SER X 103 22.516 17.619 1.376 1.00 0.00 C ATOM 3106 O SER X 103 22.391 17.284 0.218 1.00 0.00 O ATOM 3107 CB SER X 103 24.770 17.999 2.384 1.00 0.00 C ATOM 3108 OG SER X 103 25.756 18.980 2.678 1.00 0.00 O ATOM 0 H SER X 103 23.403 19.603 3.705 1.00 0.00 H new ATOM 0 HA SER X 103 23.835 19.263 0.915 1.00 0.00 H new ATOM 0 HB2 SER X 103 24.497 17.459 3.290 1.00 0.00 H new ATOM 0 HB3 SER X 103 25.169 17.265 1.683 1.00 0.00 H new ATOM 0 HG SER X 103 25.543 19.412 3.531 1.00 0.00 H new ATOM 3114 N ARG X 104 21.762 17.097 2.305 1.00 0.00 N ATOM 3115 CA ARG X 104 20.742 16.081 1.923 1.00 0.00 C ATOM 3116 C ARG X 104 19.767 16.725 0.934 1.00 0.00 C ATOM 3117 O ARG X 104 19.347 16.124 -0.044 1.00 0.00 O ATOM 3118 CB ARG X 104 19.976 15.601 3.160 1.00 0.00 C ATOM 3119 CG ARG X 104 20.863 14.677 4.012 1.00 0.00 C ATOM 3120 CD ARG X 104 21.901 15.497 4.784 1.00 0.00 C ATOM 3121 NE ARG X 104 22.478 14.660 5.874 1.00 0.00 N ATOM 3122 CZ ARG X 104 23.575 15.035 6.475 1.00 0.00 C ATOM 3123 NH1 ARG X 104 24.182 16.129 6.106 1.00 0.00 N ATOM 3124 NH2 ARG X 104 24.066 14.312 7.444 1.00 0.00 N ATOM 0 H ARG X 104 21.807 17.326 3.298 1.00 0.00 H new ATOM 0 HA ARG X 104 21.234 15.221 1.468 1.00 0.00 H new ATOM 0 HB2 ARG X 104 19.656 16.458 3.753 1.00 0.00 H new ATOM 0 HB3 ARG X 104 19.074 15.070 2.855 1.00 0.00 H new ATOM 0 HG2 ARG X 104 20.245 14.111 4.709 1.00 0.00 H new ATOM 0 HG3 ARG X 104 21.366 13.953 3.371 1.00 0.00 H new ATOM 0 HD2 ARG X 104 22.690 15.833 4.111 1.00 0.00 H new ATOM 0 HD3 ARG X 104 21.438 16.390 5.202 1.00 0.00 H new ATOM 0 HE ARG X 104 22.016 13.794 6.151 1.00 0.00 H new ATOM 0 HH11 ARG X 104 23.800 16.693 5.347 1.00 0.00 H new ATOM 0 HH12 ARG X 104 25.039 16.420 6.577 1.00 0.00 H new ATOM 0 HH21 ARG X 104 23.593 13.455 7.731 1.00 0.00 H new ATOM 0 HH22 ARG X 104 24.923 14.604 7.914 1.00 0.00 H new ATOM 3138 N HIS X 105 19.416 17.958 1.176 1.00 0.00 N ATOM 3139 CA HIS X 105 18.485 18.659 0.257 1.00 0.00 C ATOM 3140 C HIS X 105 19.114 18.690 -1.133 1.00 0.00 C ATOM 3141 O HIS X 105 18.428 18.674 -2.132 1.00 0.00 O ATOM 3142 CB HIS X 105 18.241 20.086 0.753 1.00 0.00 C ATOM 3143 CG HIS X 105 17.079 20.686 0.007 1.00 0.00 C ATOM 3144 ND1 HIS X 105 17.161 21.920 -0.624 1.00 0.00 N ATOM 3145 CD2 HIS X 105 15.800 20.235 -0.218 1.00 0.00 C ATOM 3146 CE1 HIS X 105 15.965 22.167 -1.190 1.00 0.00 C ATOM 3147 NE2 HIS X 105 15.104 21.172 -0.972 1.00 0.00 N ATOM 0 H HIS X 105 19.736 18.509 1.973 1.00 0.00 H new ATOM 0 HA HIS X 105 17.529 18.137 0.222 1.00 0.00 H new ATOM 0 HB2 HIS X 105 18.035 20.080 1.823 1.00 0.00 H new ATOM 0 HB3 HIS X 105 19.135 20.692 0.603 1.00 0.00 H new ATOM 0 HD2 HIS X 105 15.398 19.297 0.136 1.00 0.00 H new ATOM 0 HE1 HIS X 105 15.732 23.060 -1.751 1.00 0.00 H new ATOM 0 HE2 HIS X 105 14.137 21.112 -1.292 1.00 0.00 H new ATOM 3156 N LYS X 106 20.419 18.723 -1.203 1.00 0.00 N ATOM 3157 CA LYS X 106 21.091 18.745 -2.532 1.00 0.00 C ATOM 3158 C LYS X 106 20.698 17.487 -3.302 1.00 0.00 C ATOM 3159 O LYS X 106 20.549 17.510 -4.506 1.00 0.00 O ATOM 3160 CB LYS X 106 22.611 18.779 -2.368 1.00 0.00 C ATOM 3161 CG LYS X 106 23.256 18.958 -3.742 1.00 0.00 C ATOM 3162 CD LYS X 106 24.776 18.993 -3.598 1.00 0.00 C ATOM 3163 CE LYS X 106 25.402 19.127 -4.984 1.00 0.00 C ATOM 3164 NZ LYS X 106 26.883 19.230 -4.854 1.00 0.00 N ATOM 0 H LYS X 106 21.046 18.736 -0.398 1.00 0.00 H new ATOM 0 HA LYS X 106 20.779 19.638 -3.073 1.00 0.00 H new ATOM 0 HB2 LYS X 106 22.900 19.596 -1.707 1.00 0.00 H new ATOM 0 HB3 LYS X 106 22.960 17.856 -1.905 1.00 0.00 H new ATOM 0 HG2 LYS X 106 22.962 18.141 -4.401 1.00 0.00 H new ATOM 0 HG3 LYS X 106 22.904 19.881 -4.202 1.00 0.00 H new ATOM 0 HD2 LYS X 106 25.075 19.830 -2.967 1.00 0.00 H new ATOM 0 HD3 LYS X 106 25.129 18.084 -3.111 1.00 0.00 H new ATOM 0 HE2 LYS X 106 25.139 18.265 -5.598 1.00 0.00 H new ATOM 0 HE3 LYS X 106 25.009 20.010 -5.488 1.00 0.00 H new ATOM 0 HZ1 LYS X 106 27.309 19.321 -5.798 1.00 0.00 H new ATOM 0 HZ2 LYS X 106 27.124 20.065 -4.283 1.00 0.00 H new ATOM 0 HZ3 LYS X 106 27.251 18.375 -4.389 1.00 0.00 H new ATOM 3178 N LYS X 107 20.512 16.386 -2.629 1.00 0.00 N ATOM 3179 CA LYS X 107 20.116 15.161 -3.367 1.00 0.00 C ATOM 3180 C LYS X 107 18.792 15.455 -4.068 1.00 0.00 C ATOM 3181 O LYS X 107 18.579 15.060 -5.193 1.00 0.00 O ATOM 3182 CB LYS X 107 19.939 13.978 -2.407 1.00 0.00 C ATOM 3183 CG LYS X 107 21.302 13.541 -1.862 1.00 0.00 C ATOM 3184 CD LYS X 107 21.163 12.188 -1.154 1.00 0.00 C ATOM 3185 CE LYS X 107 20.226 12.316 0.050 1.00 0.00 C ATOM 3186 NZ LYS X 107 20.430 11.152 0.959 1.00 0.00 N ATOM 0 H LYS X 107 20.615 16.284 -1.619 1.00 0.00 H new ATOM 0 HA LYS X 107 20.891 14.894 -4.086 1.00 0.00 H new ATOM 0 HB2 LYS X 107 19.282 14.261 -1.584 1.00 0.00 H new ATOM 0 HB3 LYS X 107 19.461 13.146 -2.925 1.00 0.00 H new ATOM 0 HG2 LYS X 107 22.023 13.465 -2.676 1.00 0.00 H new ATOM 0 HG3 LYS X 107 21.684 14.289 -1.167 1.00 0.00 H new ATOM 0 HD2 LYS X 107 20.774 11.444 -1.849 1.00 0.00 H new ATOM 0 HD3 LYS X 107 22.142 11.838 -0.827 1.00 0.00 H new ATOM 0 HE2 LYS X 107 20.424 13.247 0.582 1.00 0.00 H new ATOM 0 HE3 LYS X 107 19.189 12.354 -0.284 1.00 0.00 H new ATOM 0 HZ1 LYS X 107 19.795 11.236 1.778 1.00 0.00 H new ATOM 0 HZ2 LYS X 107 20.221 10.271 0.447 1.00 0.00 H new ATOM 0 HZ3 LYS X 107 21.417 11.136 1.286 1.00 0.00 H new ATOM 3200 N LEU X 108 17.909 16.165 -3.414 1.00 0.00 N ATOM 3201 CA LEU X 108 16.599 16.510 -4.052 1.00 0.00 C ATOM 3202 C LEU X 108 16.825 17.527 -5.184 1.00 0.00 C ATOM 3203 O LEU X 108 16.050 17.624 -6.121 1.00 0.00 O ATOM 3204 CB LEU X 108 15.661 17.109 -2.995 1.00 0.00 C ATOM 3205 CG LEU X 108 14.369 17.626 -3.647 1.00 0.00 C ATOM 3206 CD1 LEU X 108 13.677 16.497 -4.422 1.00 0.00 C ATOM 3207 CD2 LEU X 108 13.431 18.136 -2.548 1.00 0.00 C ATOM 0 H LEU X 108 18.036 16.521 -2.467 1.00 0.00 H new ATOM 0 HA LEU X 108 16.148 15.609 -4.468 1.00 0.00 H new ATOM 0 HB2 LEU X 108 15.420 16.355 -2.246 1.00 0.00 H new ATOM 0 HB3 LEU X 108 16.164 17.925 -2.475 1.00 0.00 H new ATOM 0 HG LEU X 108 14.611 18.431 -4.340 1.00 0.00 H new ATOM 0 HD11 LEU X 108 12.763 16.876 -4.879 1.00 0.00 H new ATOM 0 HD12 LEU X 108 14.345 16.127 -5.200 1.00 0.00 H new ATOM 0 HD13 LEU X 108 13.431 15.684 -3.739 1.00 0.00 H new ATOM 0 HD21 LEU X 108 12.510 18.506 -2.998 1.00 0.00 H new ATOM 0 HD22 LEU X 108 13.198 17.322 -1.862 1.00 0.00 H new ATOM 0 HD23 LEU X 108 13.917 18.944 -2.001 1.00 0.00 H new ATOM 3219 N MET X 109 17.875 18.289 -5.107 1.00 0.00 N ATOM 3220 CA MET X 109 18.147 19.299 -6.165 1.00 0.00 C ATOM 3221 C MET X 109 18.464 18.599 -7.491 1.00 0.00 C ATOM 3222 O MET X 109 18.290 19.165 -8.551 1.00 0.00 O ATOM 3223 CB MET X 109 19.303 20.198 -5.727 1.00 0.00 C ATOM 3224 CG MET X 109 18.831 21.029 -4.531 1.00 0.00 C ATOM 3225 SD MET X 109 20.166 22.090 -3.931 1.00 0.00 S ATOM 3226 CE MET X 109 19.431 22.442 -2.314 1.00 0.00 C ATOM 0 H MET X 109 18.561 18.257 -4.353 1.00 0.00 H new ATOM 0 HA MET X 109 17.263 19.919 -6.315 1.00 0.00 H new ATOM 0 HB2 MET X 109 20.171 19.597 -5.455 1.00 0.00 H new ATOM 0 HB3 MET X 109 19.610 20.849 -6.545 1.00 0.00 H new ATOM 0 HG2 MET X 109 17.975 21.639 -4.820 1.00 0.00 H new ATOM 0 HG3 MET X 109 18.496 20.369 -3.731 1.00 0.00 H new ATOM 0 HE1 MET X 109 20.117 23.053 -1.728 1.00 0.00 H new ATOM 0 HE2 MET X 109 18.492 22.979 -2.450 1.00 0.00 H new ATOM 0 HE3 MET X 109 19.241 21.506 -1.789 1.00 0.00 H new ATOM 3236 N PHE X 110 18.932 17.374 -7.451 1.00 0.00 N ATOM 3237 CA PHE X 110 19.254 16.659 -8.720 1.00 0.00 C ATOM 3238 C PHE X 110 18.094 16.840 -9.697 1.00 0.00 C ATOM 3239 O PHE X 110 18.284 16.966 -10.890 1.00 0.00 O ATOM 3240 CB PHE X 110 19.515 15.165 -8.429 1.00 0.00 C ATOM 3241 CG PHE X 110 18.221 14.366 -8.267 1.00 0.00 C ATOM 3242 CD1 PHE X 110 17.178 14.835 -7.453 1.00 0.00 C ATOM 3243 CD2 PHE X 110 18.081 13.131 -8.920 1.00 0.00 C ATOM 3244 CE1 PHE X 110 16.010 14.082 -7.298 1.00 0.00 C ATOM 3245 CE2 PHE X 110 16.909 12.378 -8.760 1.00 0.00 C ATOM 3246 CZ PHE X 110 15.875 12.855 -7.948 1.00 0.00 C ATOM 0 H PHE X 110 19.103 16.843 -6.597 1.00 0.00 H new ATOM 0 HA PHE X 110 20.157 17.073 -9.168 1.00 0.00 H new ATOM 0 HB2 PHE X 110 20.103 14.737 -9.241 1.00 0.00 H new ATOM 0 HB3 PHE X 110 20.111 15.074 -7.521 1.00 0.00 H new ATOM 0 HD1 PHE X 110 17.278 15.782 -6.944 1.00 0.00 H new ATOM 0 HD2 PHE X 110 18.878 12.760 -9.547 1.00 0.00 H new ATOM 0 HE1 PHE X 110 15.210 14.451 -6.673 1.00 0.00 H new ATOM 0 HE2 PHE X 110 16.805 11.429 -9.264 1.00 0.00 H new ATOM 0 HZ PHE X 110 14.973 12.274 -7.824 1.00 0.00 H new ATOM 3256 N LYS X 111 16.897 16.889 -9.192 1.00 0.00 N ATOM 3257 CA LYS X 111 15.730 17.104 -10.077 1.00 0.00 C ATOM 3258 C LYS X 111 15.717 18.567 -10.524 1.00 0.00 C ATOM 3259 O LYS X 111 15.419 18.878 -11.660 1.00 0.00 O ATOM 3260 CB LYS X 111 14.437 16.757 -9.310 1.00 0.00 C ATOM 3261 CG LYS X 111 13.388 16.130 -10.264 1.00 0.00 C ATOM 3262 CD LYS X 111 13.433 14.602 -10.169 1.00 0.00 C ATOM 3263 CE LYS X 111 14.819 14.083 -10.573 1.00 0.00 C ATOM 3264 NZ LYS X 111 14.826 12.595 -10.496 1.00 0.00 N ATOM 0 H LYS X 111 16.678 16.789 -8.201 1.00 0.00 H new ATOM 0 HA LYS X 111 15.794 16.462 -10.956 1.00 0.00 H new ATOM 0 HB2 LYS X 111 14.663 16.062 -8.502 1.00 0.00 H new ATOM 0 HB3 LYS X 111 14.027 17.657 -8.851 1.00 0.00 H new ATOM 0 HG2 LYS X 111 12.391 16.488 -10.006 1.00 0.00 H new ATOM 0 HG3 LYS X 111 13.585 16.444 -11.289 1.00 0.00 H new ATOM 0 HD2 LYS X 111 13.202 14.287 -9.151 1.00 0.00 H new ATOM 0 HD3 LYS X 111 12.672 14.168 -10.817 1.00 0.00 H new ATOM 0 HE2 LYS X 111 15.062 14.408 -11.585 1.00 0.00 H new ATOM 0 HE3 LYS X 111 15.582 14.497 -9.914 1.00 0.00 H new ATOM 0 HZ1 LYS X 111 15.725 12.273 -10.084 1.00 0.00 H new ATOM 0 HZ2 LYS X 111 14.037 12.275 -9.899 1.00 0.00 H new ATOM 0 HZ3 LYS X 111 14.721 12.197 -11.451 1.00 0.00 H new ATOM 3278 N THR X 112 16.041 19.470 -9.637 1.00 0.00 N ATOM 3279 CA THR X 112 16.047 20.908 -10.026 1.00 0.00 C ATOM 3280 C THR X 112 17.049 21.099 -11.164 1.00 0.00 C ATOM 3281 O THR X 112 16.874 21.933 -12.030 1.00 0.00 O ATOM 3282 CB THR X 112 16.462 21.775 -8.831 1.00 0.00 C ATOM 3283 OG1 THR X 112 17.796 21.458 -8.460 1.00 0.00 O ATOM 3284 CG2 THR X 112 15.524 21.517 -7.649 1.00 0.00 C ATOM 0 H THR X 112 16.299 19.276 -8.669 1.00 0.00 H new ATOM 0 HA THR X 112 15.049 21.206 -10.346 1.00 0.00 H new ATOM 0 HB THR X 112 16.401 22.827 -9.110 1.00 0.00 H new ATOM 0 HG1 THR X 112 17.960 20.504 -8.611 1.00 0.00 H new ATOM 0 HG21 THR X 112 15.825 22.136 -6.804 1.00 0.00 H new ATOM 0 HG22 THR X 112 14.502 21.765 -7.935 1.00 0.00 H new ATOM 0 HG23 THR X 112 15.577 20.466 -7.365 1.00 0.00 H new ATOM 3292 N GLU X 113 18.099 20.324 -11.169 1.00 0.00 N ATOM 3293 CA GLU X 113 19.117 20.447 -12.249 1.00 0.00 C ATOM 3294 CB GLU X 113 18.538 19.915 -13.563 1.00 0.00 C ATOM 3295 CG GLU X 113 18.212 18.424 -13.420 1.00 0.00 C ATOM 3296 CD GLU X 113 17.705 17.881 -14.757 1.00 0.00 C ATOM 3297 OE1 GLU X 113 16.546 18.105 -15.065 1.00 0.00 O ATOM 3298 OE2 GLU X 113 18.487 17.255 -15.453 1.00 0.00 O ATOM 0 H GLU X 113 18.296 19.609 -10.469 1.00 0.00 H new ATOM 0 HB2 GLU X 113 17.637 20.470 -13.825 1.00 0.00 H new ATOM 0 HB3 GLU X 113 19.252 20.065 -14.373 1.00 0.00 H new ATOM 0 HG2 GLU X 113 19.100 17.875 -13.106 1.00 0.00 H new ATOM 0 HG3 GLU X 113 17.458 18.279 -12.647 1.00 0.00 H new TER 3305 GLU X 113 ATOM 3306 N SER Y 92 -29.808 25.425 -28.467 1.00 0.00 N ATOM 3307 CA SER Y 92 -30.789 24.989 -29.501 1.00 0.00 C ATOM 3308 C SER Y 92 -30.184 25.188 -30.891 1.00 0.00 C ATOM 3309 O SER Y 92 -30.860 25.081 -31.894 1.00 0.00 O ATOM 3310 CB SER Y 92 -32.066 25.820 -29.376 1.00 0.00 C ATOM 3311 OG SER Y 92 -32.603 25.662 -28.069 1.00 0.00 O ATOM 0 HA SER Y 92 -31.027 23.935 -29.355 1.00 0.00 H new ATOM 0 HB2 SER Y 92 -31.850 26.871 -29.568 1.00 0.00 H new ATOM 0 HB3 SER Y 92 -32.795 25.503 -30.122 1.00 0.00 H new ATOM 0 HG SER Y 92 -31.871 25.573 -27.423 1.00 0.00 H new ATOM 3319 N HIS Y 93 -28.911 25.476 -30.959 1.00 0.00 N ATOM 3320 CA HIS Y 93 -28.258 25.680 -32.285 1.00 0.00 C ATOM 3321 C HIS Y 93 -27.841 24.329 -32.866 1.00 0.00 C ATOM 3322 O HIS Y 93 -27.343 23.467 -32.169 1.00 0.00 O ATOM 3323 CB HIS Y 93 -27.021 26.566 -32.118 1.00 0.00 C ATOM 3324 CG HIS Y 93 -27.450 27.981 -31.844 1.00 0.00 C ATOM 3325 ND1 HIS Y 93 -27.825 28.848 -32.861 1.00 0.00 N ATOM 3326 CD2 HIS Y 93 -27.571 28.695 -30.677 1.00 0.00 C ATOM 3327 CE1 HIS Y 93 -28.151 30.024 -32.292 1.00 0.00 C ATOM 3328 NE2 HIS Y 93 -28.013 29.981 -30.966 1.00 0.00 N ATOM 0 H HIS Y 93 -28.295 25.579 -30.153 1.00 0.00 H new ATOM 0 HA HIS Y 93 -28.963 26.164 -32.962 1.00 0.00 H new ATOM 0 HB2 HIS Y 93 -26.404 26.197 -31.299 1.00 0.00 H new ATOM 0 HB3 HIS Y 93 -26.409 26.528 -33.019 1.00 0.00 H new ATOM 0 HD2 HIS Y 93 -27.356 28.316 -29.689 1.00 0.00 H new ATOM 0 HE1 HIS Y 93 -28.483 30.893 -32.841 1.00 0.00 H new ATOM 0 HE2 HIS Y 93 -28.194 30.734 -30.303 1.00 0.00 H new ATOM 3337 N LEU Y 94 -28.036 24.140 -34.144 1.00 0.00 N ATOM 3338 CA LEU Y 94 -27.651 22.848 -34.788 1.00 0.00 C ATOM 3339 C LEU Y 94 -26.252 22.991 -35.390 1.00 0.00 C ATOM 3340 O LEU Y 94 -25.893 24.030 -35.907 1.00 0.00 O ATOM 3341 CB LEU Y 94 -28.656 22.520 -35.897 1.00 0.00 C ATOM 3342 CG LEU Y 94 -30.070 22.417 -35.310 1.00 0.00 C ATOM 3343 CD1 LEU Y 94 -31.064 22.130 -36.440 1.00 0.00 C ATOM 3344 CD2 LEU Y 94 -30.132 21.284 -34.268 1.00 0.00 C ATOM 0 H LEU Y 94 -28.448 24.829 -34.774 1.00 0.00 H new ATOM 0 HA LEU Y 94 -27.652 22.047 -34.049 1.00 0.00 H new ATOM 0 HB2 LEU Y 94 -28.628 23.293 -36.665 1.00 0.00 H new ATOM 0 HB3 LEU Y 94 -28.384 21.581 -36.379 1.00 0.00 H new ATOM 0 HG LEU Y 94 -30.326 23.358 -34.822 1.00 0.00 H new ATOM 0 HD11 LEU Y 94 -32.071 22.056 -36.029 1.00 0.00 H new ATOM 0 HD12 LEU Y 94 -31.029 22.939 -37.170 1.00 0.00 H new ATOM 0 HD13 LEU Y 94 -30.801 21.191 -36.927 1.00 0.00 H new ATOM 0 HD21 LEU Y 94 -31.140 21.221 -33.859 1.00 0.00 H new ATOM 0 HD22 LEU Y 94 -29.873 20.338 -34.743 1.00 0.00 H new ATOM 0 HD23 LEU Y 94 -29.426 21.491 -33.464 1.00 0.00 H new ATOM 3356 N LYS Y 95 -25.453 21.959 -35.315 1.00 0.00 N ATOM 3357 CA LYS Y 95 -24.067 22.033 -35.869 1.00 0.00 C ATOM 3358 C LYS Y 95 -23.691 20.692 -36.501 1.00 0.00 C ATOM 3359 O LYS Y 95 -24.285 19.670 -36.217 1.00 0.00 O ATOM 3360 CB LYS Y 95 -23.095 22.358 -34.735 1.00 0.00 C ATOM 3361 CG LYS Y 95 -23.236 21.312 -33.628 1.00 0.00 C ATOM 3362 CD LYS Y 95 -22.402 21.736 -32.420 1.00 0.00 C ATOM 3363 CE LYS Y 95 -22.579 20.717 -31.294 1.00 0.00 C ATOM 3364 NZ LYS Y 95 -22.007 19.406 -31.712 1.00 0.00 N ATOM 0 H LYS Y 95 -25.701 21.064 -34.892 1.00 0.00 H new ATOM 0 HA LYS Y 95 -24.017 22.811 -36.631 1.00 0.00 H new ATOM 0 HB2 LYS Y 95 -22.072 22.370 -35.111 1.00 0.00 H new ATOM 0 HB3 LYS Y 95 -23.301 23.352 -34.339 1.00 0.00 H new ATOM 0 HG2 LYS Y 95 -24.283 21.207 -33.342 1.00 0.00 H new ATOM 0 HG3 LYS Y 95 -22.905 20.338 -33.988 1.00 0.00 H new ATOM 0 HD2 LYS Y 95 -21.350 21.807 -32.698 1.00 0.00 H new ATOM 0 HD3 LYS Y 95 -22.710 22.725 -32.081 1.00 0.00 H new ATOM 0 HE2 LYS Y 95 -22.083 21.070 -30.389 1.00 0.00 H new ATOM 0 HE3 LYS Y 95 -23.636 20.604 -31.055 1.00 0.00 H new ATOM 0 HZ1 LYS Y 95 -21.863 18.807 -30.874 1.00 0.00 H new ATOM 0 HZ2 LYS Y 95 -22.663 18.934 -32.367 1.00 0.00 H new ATOM 0 HZ3 LYS Y 95 -21.095 19.561 -32.188 1.00 0.00 H new ATOM 3378 N SER Y 96 -22.709 20.692 -37.365 1.00 0.00 N ATOM 3379 CA SER Y 96 -22.285 19.425 -38.035 1.00 0.00 C ATOM 3380 C SER Y 96 -21.073 18.837 -37.307 1.00 0.00 C ATOM 3381 O SER Y 96 -20.792 19.174 -36.174 1.00 0.00 O ATOM 3382 CB SER Y 96 -21.910 19.727 -39.486 1.00 0.00 C ATOM 3383 OG SER Y 96 -21.512 18.523 -40.128 1.00 0.00 O ATOM 0 H SER Y 96 -22.179 21.520 -37.637 1.00 0.00 H new ATOM 0 HA SER Y 96 -23.104 18.706 -38.007 1.00 0.00 H new ATOM 0 HB2 SER Y 96 -22.759 20.168 -40.009 1.00 0.00 H new ATOM 0 HB3 SER Y 96 -21.100 20.456 -39.520 1.00 0.00 H new ATOM 0 HG SER Y 96 -21.272 18.713 -41.059 1.00 0.00 H new ATOM 3389 N LYS Y 97 -20.360 17.951 -37.948 1.00 0.00 N ATOM 3390 CA LYS Y 97 -19.173 17.327 -37.295 1.00 0.00 C ATOM 3391 C LYS Y 97 -17.990 18.299 -37.314 1.00 0.00 C ATOM 3392 O LYS Y 97 -16.844 17.894 -37.315 1.00 0.00 O ATOM 3393 CB LYS Y 97 -18.802 16.043 -38.045 1.00 0.00 C ATOM 3394 CG LYS Y 97 -18.476 16.367 -39.506 1.00 0.00 C ATOM 3395 CD LYS Y 97 -18.125 15.077 -40.250 1.00 0.00 C ATOM 3396 CE LYS Y 97 -17.732 15.407 -41.691 1.00 0.00 C ATOM 3397 NZ LYS Y 97 -18.895 16.017 -42.396 1.00 0.00 N ATOM 0 H LYS Y 97 -20.549 17.631 -38.898 1.00 0.00 H new ATOM 0 HA LYS Y 97 -19.414 17.090 -36.259 1.00 0.00 H new ATOM 0 HB2 LYS Y 97 -17.944 15.569 -37.569 1.00 0.00 H new ATOM 0 HB3 LYS Y 97 -19.627 15.332 -37.997 1.00 0.00 H new ATOM 0 HG2 LYS Y 97 -19.329 16.852 -39.981 1.00 0.00 H new ATOM 0 HG3 LYS Y 97 -17.642 17.067 -39.557 1.00 0.00 H new ATOM 0 HD2 LYS Y 97 -17.304 14.566 -39.746 1.00 0.00 H new ATOM 0 HD3 LYS Y 97 -18.977 14.397 -40.241 1.00 0.00 H new ATOM 0 HE2 LYS Y 97 -16.886 16.094 -41.700 1.00 0.00 H new ATOM 0 HE3 LYS Y 97 -17.413 14.502 -42.209 1.00 0.00 H new ATOM 0 HZ1 LYS Y 97 -18.746 15.962 -43.424 1.00 0.00 H new ATOM 0 HZ2 LYS Y 97 -19.763 15.502 -42.144 1.00 0.00 H new ATOM 0 HZ3 LYS Y 97 -18.989 17.013 -42.113 1.00 0.00 H new ATOM 3411 N LYS Y 98 -18.255 19.577 -37.329 1.00 0.00 N ATOM 3412 CA LYS Y 98 -17.139 20.566 -37.347 1.00 0.00 C ATOM 3413 C LYS Y 98 -16.282 20.371 -36.098 1.00 0.00 C ATOM 3414 O LYS Y 98 -15.070 20.445 -36.144 1.00 0.00 O ATOM 3415 CB LYS Y 98 -17.708 21.985 -37.341 1.00 0.00 C ATOM 3416 CG LYS Y 98 -18.376 22.278 -38.683 1.00 0.00 C ATOM 3417 CD LYS Y 98 -18.941 23.698 -38.666 1.00 0.00 C ATOM 3418 CE LYS Y 98 -19.611 23.997 -40.007 1.00 0.00 C ATOM 3419 NZ LYS Y 98 -20.443 25.226 -39.879 1.00 0.00 N ATOM 0 H LYS Y 98 -19.193 19.978 -37.330 1.00 0.00 H new ATOM 0 HA LYS Y 98 -16.537 20.418 -38.244 1.00 0.00 H new ATOM 0 HB2 LYS Y 98 -18.431 22.094 -36.533 1.00 0.00 H new ATOM 0 HB3 LYS Y 98 -16.912 22.706 -37.155 1.00 0.00 H new ATOM 0 HG2 LYS Y 98 -17.654 22.171 -39.493 1.00 0.00 H new ATOM 0 HG3 LYS Y 98 -19.174 21.559 -38.870 1.00 0.00 H new ATOM 0 HD2 LYS Y 98 -19.662 23.804 -37.856 1.00 0.00 H new ATOM 0 HD3 LYS Y 98 -18.143 24.416 -38.478 1.00 0.00 H new ATOM 0 HE2 LYS Y 98 -18.856 24.134 -40.781 1.00 0.00 H new ATOM 0 HE3 LYS Y 98 -20.231 23.154 -40.312 1.00 0.00 H new ATOM 0 HZ1 LYS Y 98 -20.900 25.432 -40.790 1.00 0.00 H new ATOM 0 HZ2 LYS Y 98 -21.171 25.078 -39.152 1.00 0.00 H new ATOM 0 HZ3 LYS Y 98 -19.839 26.027 -39.606 1.00 0.00 H new ATOM 3433 N GLY Y 99 -16.904 20.121 -34.980 1.00 0.00 N ATOM 3434 CA GLY Y 99 -16.128 19.921 -33.728 1.00 0.00 C ATOM 3435 C GLY Y 99 -15.331 18.620 -33.830 1.00 0.00 C ATOM 3436 O GLY Y 99 -15.693 17.716 -34.557 1.00 0.00 O ATOM 0 H GLY Y 99 -17.916 20.047 -34.881 1.00 0.00 H new ATOM 0 HA2 GLY Y 99 -15.454 20.762 -33.566 1.00 0.00 H new ATOM 0 HA3 GLY Y 99 -16.801 19.882 -32.872 1.00 0.00 H new ATOM 3440 N GLN Y 100 -14.248 18.524 -33.104 1.00 0.00 N ATOM 3441 CA GLN Y 100 -13.406 17.287 -33.135 1.00 0.00 C ATOM 3442 C GLN Y 100 -13.130 16.853 -31.694 1.00 0.00 C ATOM 3443 O GLN Y 100 -13.246 17.636 -30.773 1.00 0.00 O ATOM 3444 CB GLN Y 100 -12.084 17.593 -33.847 1.00 0.00 C ATOM 3445 CG GLN Y 100 -12.368 18.055 -35.278 1.00 0.00 C ATOM 3446 CD GLN Y 100 -12.997 16.911 -36.074 1.00 0.00 C ATOM 3447 OE1 GLN Y 100 -12.601 15.771 -35.938 1.00 0.00 O ATOM 3448 NE2 GLN Y 100 -13.967 17.170 -36.908 1.00 0.00 N ATOM 0 H GLN Y 100 -13.906 19.257 -32.483 1.00 0.00 H new ATOM 0 HA GLN Y 100 -13.922 16.490 -33.670 1.00 0.00 H new ATOM 0 HB2 GLN Y 100 -11.538 18.366 -33.306 1.00 0.00 H new ATOM 0 HB3 GLN Y 100 -11.452 16.705 -33.859 1.00 0.00 H new ATOM 0 HG2 GLN Y 100 -13.038 18.914 -35.267 1.00 0.00 H new ATOM 0 HG3 GLN Y 100 -11.443 18.378 -35.756 1.00 0.00 H new ATOM 0 HE21 GLN Y 100 -14.299 18.128 -37.022 1.00 0.00 H new ATOM 0 HE22 GLN Y 100 -14.393 16.415 -37.446 1.00 0.00 H new ATOM 3457 N SER Y 101 -12.774 15.616 -31.482 1.00 0.00 N ATOM 3458 CA SER Y 101 -12.506 15.159 -30.090 1.00 0.00 C ATOM 3459 C SER Y 101 -11.436 16.050 -29.464 1.00 0.00 C ATOM 3460 O SER Y 101 -11.384 16.219 -28.261 1.00 0.00 O ATOM 3461 CB SER Y 101 -12.026 13.711 -30.089 1.00 0.00 C ATOM 3462 OG SER Y 101 -13.029 12.883 -30.664 1.00 0.00 O ATOM 0 H SER Y 101 -12.658 14.907 -32.206 1.00 0.00 H new ATOM 0 HA SER Y 101 -13.428 15.224 -29.512 1.00 0.00 H new ATOM 0 HB2 SER Y 101 -11.098 13.623 -30.654 1.00 0.00 H new ATOM 0 HB3 SER Y 101 -11.811 13.388 -29.070 1.00 0.00 H new ATOM 0 HG SER Y 101 -13.090 12.045 -30.160 1.00 0.00 H new ATOM 3468 N THR Y 102 -10.583 16.624 -30.272 1.00 0.00 N ATOM 3469 CA THR Y 102 -9.511 17.513 -29.734 1.00 0.00 C ATOM 3470 C THR Y 102 -10.108 18.443 -28.675 1.00 0.00 C ATOM 3471 O THR Y 102 -9.421 18.927 -27.798 1.00 0.00 O ATOM 3472 CB THR Y 102 -8.904 18.343 -30.878 1.00 0.00 C ATOM 3473 OG1 THR Y 102 -7.698 18.945 -30.428 1.00 0.00 O ATOM 3474 CG2 THR Y 102 -9.884 19.439 -31.328 1.00 0.00 C ATOM 0 H THR Y 102 -10.583 16.515 -31.286 1.00 0.00 H new ATOM 0 HA THR Y 102 -8.727 16.907 -29.281 1.00 0.00 H new ATOM 0 HB THR Y 102 -8.702 17.686 -31.724 1.00 0.00 H new ATOM 0 HG1 THR Y 102 -7.306 19.474 -31.154 1.00 0.00 H new ATOM 0 HG21 THR Y 102 -9.438 20.016 -32.138 1.00 0.00 H new ATOM 0 HG22 THR Y 102 -10.809 18.979 -31.677 1.00 0.00 H new ATOM 0 HG23 THR Y 102 -10.101 20.100 -30.489 1.00 0.00 H new ATOM 3482 N SER Y 103 -11.387 18.693 -28.751 1.00 0.00 N ATOM 3483 CA SER Y 103 -12.024 19.587 -27.749 1.00 0.00 C ATOM 3484 C SER Y 103 -11.835 18.986 -26.353 1.00 0.00 C ATOM 3485 O SER Y 103 -11.560 19.685 -25.402 1.00 0.00 O ATOM 3486 CB SER Y 103 -13.517 19.705 -28.056 1.00 0.00 C ATOM 3487 OG SER Y 103 -13.689 20.366 -29.302 1.00 0.00 O ATOM 0 H SER Y 103 -12.015 18.317 -29.462 1.00 0.00 H new ATOM 0 HA SER Y 103 -11.566 20.575 -27.788 1.00 0.00 H new ATOM 0 HB2 SER Y 103 -13.972 18.715 -28.090 1.00 0.00 H new ATOM 0 HB3 SER Y 103 -14.020 20.260 -27.264 1.00 0.00 H new ATOM 0 HG SER Y 103 -13.582 19.721 -30.032 1.00 0.00 H new ATOM 3493 N ARG Y 104 -11.957 17.696 -26.216 1.00 0.00 N ATOM 3494 CA ARG Y 104 -11.752 17.089 -24.872 1.00 0.00 C ATOM 3495 C ARG Y 104 -10.324 17.398 -24.416 1.00 0.00 C ATOM 3496 O ARG Y 104 -10.068 17.709 -23.262 1.00 0.00 O ATOM 3497 CB ARG Y 104 -11.958 15.575 -24.936 1.00 0.00 C ATOM 3498 CG ARG Y 104 -13.456 15.249 -25.080 1.00 0.00 C ATOM 3499 CD ARG Y 104 -13.915 15.483 -26.522 1.00 0.00 C ATOM 3500 NE ARG Y 104 -15.233 14.825 -26.732 1.00 0.00 N ATOM 3501 CZ ARG Y 104 -15.962 15.142 -27.765 1.00 0.00 C ATOM 3502 NH1 ARG Y 104 -15.560 16.074 -28.585 1.00 0.00 N ATOM 3503 NH2 ARG Y 104 -17.097 14.534 -27.974 1.00 0.00 N ATOM 0 H ARG Y 104 -12.187 17.043 -26.965 1.00 0.00 H new ATOM 0 HA ARG Y 104 -12.472 17.504 -24.167 1.00 0.00 H new ATOM 0 HB2 ARG Y 104 -11.405 15.161 -25.779 1.00 0.00 H new ATOM 0 HB3 ARG Y 104 -11.562 15.108 -24.034 1.00 0.00 H new ATOM 0 HG2 ARG Y 104 -13.638 14.212 -24.797 1.00 0.00 H new ATOM 0 HG3 ARG Y 104 -14.038 15.872 -24.400 1.00 0.00 H new ATOM 0 HD2 ARG Y 104 -13.993 16.552 -26.722 1.00 0.00 H new ATOM 0 HD3 ARG Y 104 -13.180 15.081 -27.219 1.00 0.00 H new ATOM 0 HE ARG Y 104 -15.566 14.126 -26.068 1.00 0.00 H new ATOM 0 HH11 ARG Y 104 -14.676 16.554 -28.417 1.00 0.00 H new ATOM 0 HH12 ARG Y 104 -16.130 16.322 -29.394 1.00 0.00 H new ATOM 0 HH21 ARG Y 104 -17.414 13.810 -27.329 1.00 0.00 H new ATOM 0 HH22 ARG Y 104 -17.667 14.782 -28.782 1.00 0.00 H new ATOM 3517 N HIS Y 105 -9.392 17.328 -25.324 1.00 0.00 N ATOM 3518 CA HIS Y 105 -7.984 17.627 -24.964 1.00 0.00 C ATOM 3519 C HIS Y 105 -7.920 19.055 -24.431 1.00 0.00 C ATOM 3520 O HIS Y 105 -7.105 19.375 -23.593 1.00 0.00 O ATOM 3521 CB HIS Y 105 -7.088 17.490 -26.200 1.00 0.00 C ATOM 3522 CG HIS Y 105 -5.643 17.499 -25.779 1.00 0.00 C ATOM 3523 ND1 HIS Y 105 -4.708 18.346 -26.359 1.00 0.00 N ATOM 3524 CD2 HIS Y 105 -4.956 16.770 -24.839 1.00 0.00 C ATOM 3525 CE1 HIS Y 105 -3.522 18.108 -25.767 1.00 0.00 C ATOM 3526 NE2 HIS Y 105 -3.621 17.158 -24.836 1.00 0.00 N ATOM 0 H HIS Y 105 -9.547 17.076 -26.300 1.00 0.00 H new ATOM 0 HA HIS Y 105 -7.634 16.927 -24.205 1.00 0.00 H new ATOM 0 HB2 HIS Y 105 -7.318 16.564 -26.728 1.00 0.00 H new ATOM 0 HB3 HIS Y 105 -7.280 18.308 -26.894 1.00 0.00 H new ATOM 0 HD2 HIS Y 105 -5.386 16.012 -24.201 1.00 0.00 H new ATOM 0 HE1 HIS Y 105 -2.605 18.622 -26.015 1.00 0.00 H new ATOM 0 HE2 HIS Y 105 -2.874 16.793 -24.246 1.00 0.00 H new ATOM 3535 N LYS Y 106 -8.785 19.915 -24.904 1.00 0.00 N ATOM 3536 CA LYS Y 106 -8.776 21.322 -24.415 1.00 0.00 C ATOM 3537 C LYS Y 106 -9.023 21.325 -22.909 1.00 0.00 C ATOM 3538 O LYS Y 106 -8.483 22.138 -22.188 1.00 0.00 O ATOM 3539 CB LYS Y 106 -9.864 22.143 -25.113 1.00 0.00 C ATOM 3540 CG LYS Y 106 -9.732 23.607 -24.695 1.00 0.00 C ATOM 3541 CD LYS Y 106 -10.812 24.440 -25.383 1.00 0.00 C ATOM 3542 CE LYS Y 106 -10.688 25.890 -24.921 1.00 0.00 C ATOM 3543 NZ LYS Y 106 -11.725 26.720 -25.597 1.00 0.00 N ATOM 0 H LYS Y 106 -9.494 19.703 -25.606 1.00 0.00 H new ATOM 0 HA LYS Y 106 -7.808 21.770 -24.638 1.00 0.00 H new ATOM 0 HB2 LYS Y 106 -9.769 22.051 -26.195 1.00 0.00 H new ATOM 0 HB3 LYS Y 106 -10.850 21.763 -24.847 1.00 0.00 H new ATOM 0 HG2 LYS Y 106 -9.826 23.696 -23.613 1.00 0.00 H new ATOM 0 HG3 LYS Y 106 -8.744 23.983 -24.962 1.00 0.00 H new ATOM 0 HD2 LYS Y 106 -10.703 24.379 -26.466 1.00 0.00 H new ATOM 0 HD3 LYS Y 106 -11.801 24.050 -25.140 1.00 0.00 H new ATOM 0 HE2 LYS Y 106 -10.808 25.949 -23.839 1.00 0.00 H new ATOM 0 HE3 LYS Y 106 -9.694 26.272 -25.152 1.00 0.00 H new ATOM 0 HZ1 LYS Y 106 -11.639 27.707 -25.281 1.00 0.00 H new ATOM 0 HZ2 LYS Y 106 -11.590 26.673 -26.627 1.00 0.00 H new ATOM 0 HZ3 LYS Y 106 -12.670 26.360 -25.355 1.00 0.00 H new ATOM 3557 N LYS Y 107 -9.819 20.419 -22.415 1.00 0.00 N ATOM 3558 CA LYS Y 107 -10.055 20.400 -20.949 1.00 0.00 C ATOM 3559 C LYS Y 107 -8.704 20.191 -20.271 1.00 0.00 C ATOM 3560 O LYS Y 107 -8.412 20.792 -19.261 1.00 0.00 O ATOM 3561 CB LYS Y 107 -11.003 19.258 -20.567 1.00 0.00 C ATOM 3562 CG LYS Y 107 -12.416 19.564 -21.071 1.00 0.00 C ATOM 3563 CD LYS Y 107 -13.413 18.594 -20.427 1.00 0.00 C ATOM 3564 CE LYS Y 107 -13.109 17.161 -20.868 1.00 0.00 C ATOM 3565 NZ LYS Y 107 -14.291 16.297 -20.589 1.00 0.00 N ATOM 0 H LYS Y 107 -10.308 19.703 -22.953 1.00 0.00 H new ATOM 0 HA LYS Y 107 -10.514 21.337 -20.633 1.00 0.00 H new ATOM 0 HB2 LYS Y 107 -10.649 18.321 -20.997 1.00 0.00 H new ATOM 0 HB3 LYS Y 107 -11.013 19.129 -19.485 1.00 0.00 H new ATOM 0 HG2 LYS Y 107 -12.685 20.592 -20.828 1.00 0.00 H new ATOM 0 HG3 LYS Y 107 -12.454 19.473 -22.157 1.00 0.00 H new ATOM 0 HD2 LYS Y 107 -13.356 18.669 -19.341 1.00 0.00 H new ATOM 0 HD3 LYS Y 107 -14.430 18.863 -20.712 1.00 0.00 H new ATOM 0 HE2 LYS Y 107 -12.871 17.139 -21.931 1.00 0.00 H new ATOM 0 HE3 LYS Y 107 -12.235 16.783 -20.338 1.00 0.00 H new ATOM 0 HZ1 LYS Y 107 -14.087 15.322 -20.888 1.00 0.00 H new ATOM 0 HZ2 LYS Y 107 -14.498 16.310 -19.570 1.00 0.00 H new ATOM 0 HZ3 LYS Y 107 -15.114 16.655 -21.114 1.00 0.00 H new ATOM 3579 N LEU Y 108 -7.873 19.354 -20.833 1.00 0.00 N ATOM 3580 CA LEU Y 108 -6.520 19.118 -20.236 1.00 0.00 C ATOM 3581 C LEU Y 108 -5.646 20.372 -20.420 1.00 0.00 C ATOM 3582 O LEU Y 108 -4.723 20.624 -19.664 1.00 0.00 O ATOM 3583 CB LEU Y 108 -5.865 17.918 -20.931 1.00 0.00 C ATOM 3584 CG LEU Y 108 -4.413 17.747 -20.458 1.00 0.00 C ATOM 3585 CD1 LEU Y 108 -4.370 17.621 -18.926 1.00 0.00 C ATOM 3586 CD2 LEU Y 108 -3.828 16.480 -21.093 1.00 0.00 C ATOM 0 H LEU Y 108 -8.070 18.822 -21.680 1.00 0.00 H new ATOM 0 HA LEU Y 108 -6.620 18.910 -19.171 1.00 0.00 H new ATOM 0 HB2 LEU Y 108 -6.432 17.012 -20.717 1.00 0.00 H new ATOM 0 HB3 LEU Y 108 -5.887 18.060 -22.012 1.00 0.00 H new ATOM 0 HG LEU Y 108 -3.829 18.617 -20.757 1.00 0.00 H new ATOM 0 HD11 LEU Y 108 -3.337 17.500 -18.600 1.00 0.00 H new ATOM 0 HD12 LEU Y 108 -4.790 18.520 -18.475 1.00 0.00 H new ATOM 0 HD13 LEU Y 108 -4.952 16.753 -18.616 1.00 0.00 H new ATOM 0 HD21 LEU Y 108 -2.797 16.350 -20.763 1.00 0.00 H new ATOM 0 HD22 LEU Y 108 -4.418 15.615 -20.789 1.00 0.00 H new ATOM 0 HD23 LEU Y 108 -3.852 16.573 -22.179 1.00 0.00 H new ATOM 3598 N MET Y 109 -5.925 21.159 -21.417 1.00 0.00 N ATOM 3599 CA MET Y 109 -5.113 22.384 -21.653 1.00 0.00 C ATOM 3600 C MET Y 109 -5.313 23.378 -20.503 1.00 0.00 C ATOM 3601 O MET Y 109 -4.467 24.211 -20.248 1.00 0.00 O ATOM 3602 CB MET Y 109 -5.504 23.008 -22.993 1.00 0.00 C ATOM 3603 CG MET Y 109 -5.090 22.040 -24.103 1.00 0.00 C ATOM 3604 SD MET Y 109 -5.553 22.696 -25.721 1.00 0.00 S ATOM 3605 CE MET Y 109 -5.348 21.142 -26.627 1.00 0.00 C ATOM 0 H MET Y 109 -6.683 21.007 -22.082 1.00 0.00 H new ATOM 0 HA MET Y 109 -4.056 22.119 -21.690 1.00 0.00 H new ATOM 0 HB2 MET Y 109 -6.578 23.192 -23.029 1.00 0.00 H new ATOM 0 HB3 MET Y 109 -5.011 23.971 -23.123 1.00 0.00 H new ATOM 0 HG2 MET Y 109 -4.013 21.874 -24.066 1.00 0.00 H new ATOM 0 HG3 MET Y 109 -5.567 21.073 -23.946 1.00 0.00 H new ATOM 0 HE1 MET Y 109 -5.567 21.304 -27.682 1.00 0.00 H new ATOM 0 HE2 MET Y 109 -4.322 20.791 -26.519 1.00 0.00 H new ATOM 0 HE3 MET Y 109 -6.032 20.394 -26.226 1.00 0.00 H new ATOM 3615 N PHE Y 110 -6.422 23.307 -19.804 1.00 0.00 N ATOM 3616 CA PHE Y 110 -6.653 24.258 -18.677 1.00 0.00 C ATOM 3617 C PHE Y 110 -5.390 24.326 -17.820 1.00 0.00 C ATOM 3618 O PHE Y 110 -5.028 25.366 -17.308 1.00 0.00 O ATOM 3619 CB PHE Y 110 -7.871 23.804 -17.843 1.00 0.00 C ATOM 3620 CG PHE Y 110 -7.526 22.680 -16.870 1.00 0.00 C ATOM 3621 CD1 PHE Y 110 -6.793 21.561 -17.290 1.00 0.00 C ATOM 3622 CD2 PHE Y 110 -7.973 22.751 -15.541 1.00 0.00 C ATOM 3623 CE1 PHE Y 110 -6.506 20.527 -16.393 1.00 0.00 C ATOM 3624 CE2 PHE Y 110 -7.687 21.711 -14.645 1.00 0.00 C ATOM 3625 CZ PHE Y 110 -6.953 20.600 -15.074 1.00 0.00 C ATOM 0 H PHE Y 110 -7.171 22.634 -19.966 1.00 0.00 H new ATOM 0 HA PHE Y 110 -6.869 25.253 -19.065 1.00 0.00 H new ATOM 0 HB2 PHE Y 110 -8.264 24.655 -17.286 1.00 0.00 H new ATOM 0 HB3 PHE Y 110 -8.662 23.470 -18.514 1.00 0.00 H new ATOM 0 HD1 PHE Y 110 -6.448 21.497 -18.311 1.00 0.00 H new ATOM 0 HD2 PHE Y 110 -8.539 23.609 -15.208 1.00 0.00 H new ATOM 0 HE1 PHE Y 110 -5.937 19.670 -16.722 1.00 0.00 H new ATOM 0 HE2 PHE Y 110 -8.033 21.768 -13.624 1.00 0.00 H new ATOM 0 HZ PHE Y 110 -6.733 19.799 -14.384 1.00 0.00 H new ATOM 3635 N LYS Y 111 -4.700 23.230 -17.694 1.00 0.00 N ATOM 3636 CA LYS Y 111 -3.441 23.230 -16.911 1.00 0.00 C ATOM 3637 C LYS Y 111 -2.362 23.949 -17.724 1.00 0.00 C ATOM 3638 O LYS Y 111 -1.565 24.696 -17.194 1.00 0.00 O ATOM 3639 CB LYS Y 111 -3.021 21.774 -16.615 1.00 0.00 C ATOM 3640 CG LYS Y 111 -2.359 21.665 -15.216 1.00 0.00 C ATOM 3641 CD LYS Y 111 -3.393 21.215 -14.173 1.00 0.00 C ATOM 3642 CE LYS Y 111 -4.534 22.237 -14.082 1.00 0.00 C ATOM 3643 NZ LYS Y 111 -5.501 21.799 -13.037 1.00 0.00 N ATOM 0 H LYS Y 111 -4.957 22.331 -18.102 1.00 0.00 H new ATOM 0 HA LYS Y 111 -3.581 23.748 -15.962 1.00 0.00 H new ATOM 0 HB2 LYS Y 111 -3.894 21.123 -16.661 1.00 0.00 H new ATOM 0 HB3 LYS Y 111 -2.325 21.429 -17.380 1.00 0.00 H new ATOM 0 HG2 LYS Y 111 -1.534 20.954 -15.251 1.00 0.00 H new ATOM 0 HG3 LYS Y 111 -1.938 22.628 -14.929 1.00 0.00 H new ATOM 0 HD2 LYS Y 111 -3.792 20.237 -14.444 1.00 0.00 H new ATOM 0 HD3 LYS Y 111 -2.915 21.106 -13.200 1.00 0.00 H new ATOM 0 HE2 LYS Y 111 -4.137 23.222 -13.837 1.00 0.00 H new ATOM 0 HE3 LYS Y 111 -5.036 22.326 -15.045 1.00 0.00 H new ATOM 0 HZ1 LYS Y 111 -6.466 21.821 -13.425 1.00 0.00 H new ATOM 0 HZ2 LYS Y 111 -5.272 20.830 -12.736 1.00 0.00 H new ATOM 0 HZ3 LYS Y 111 -5.442 22.439 -12.219 1.00 0.00 H new ATOM 3657 N THR Y 112 -2.328 23.724 -19.012 1.00 0.00 N ATOM 3658 CA THR Y 112 -1.296 24.404 -19.846 1.00 0.00 C ATOM 3659 C THR Y 112 -1.482 25.916 -19.717 1.00 0.00 C ATOM 3660 O THR Y 112 -0.538 26.679 -19.779 1.00 0.00 O ATOM 3661 CB THR Y 112 -1.456 23.995 -21.317 1.00 0.00 C ATOM 3662 OG1 THR Y 112 -2.712 24.448 -21.800 1.00 0.00 O ATOM 3663 CG2 THR Y 112 -1.372 22.472 -21.449 1.00 0.00 C ATOM 0 H THR Y 112 -2.963 23.106 -19.517 1.00 0.00 H new ATOM 0 HA THR Y 112 -0.302 24.115 -19.505 1.00 0.00 H new ATOM 0 HB THR Y 112 -0.656 24.446 -21.904 1.00 0.00 H new ATOM 0 HG1 THR Y 112 -3.335 24.547 -21.050 1.00 0.00 H new ATOM 0 HG21 THR Y 112 -1.487 22.191 -22.496 1.00 0.00 H new ATOM 0 HG22 THR Y 112 -0.404 22.128 -21.085 1.00 0.00 H new ATOM 0 HG23 THR Y 112 -2.166 22.011 -20.861 1.00 0.00 H new ATOM 3671 N GLU Y 113 -2.698 26.354 -19.528 1.00 0.00 N ATOM 3672 CA GLU Y 113 -2.958 27.814 -19.387 1.00 0.00 C ATOM 3673 CB GLU Y 113 -2.438 28.301 -18.032 1.00 0.00 C ATOM 3674 CG GLU Y 113 -3.191 27.592 -16.900 1.00 0.00 C ATOM 3675 CD GLU Y 113 -2.716 28.138 -15.553 1.00 0.00 C ATOM 3676 OE1 GLU Y 113 -1.663 27.718 -15.103 1.00 0.00 O ATOM 3677 OE2 GLU Y 113 -3.412 28.972 -14.997 1.00 0.00 O ATOM 0 H GLU Y 113 -3.525 25.760 -19.465 1.00 0.00 H new ATOM 0 HB2 GLU Y 113 -1.369 28.103 -17.950 1.00 0.00 H new ATOM 0 HB3 GLU Y 113 -2.569 29.380 -17.948 1.00 0.00 H new ATOM 0 HG2 GLU Y 113 -4.264 27.747 -17.010 1.00 0.00 H new ATOM 0 HG3 GLU Y 113 -3.018 26.517 -16.951 1.00 0.00 H new TER 3684 GLU Y 113 HETATM 3685 CA CA A 114 -3.418 24.991 3.061 1.00 0.00 CA HETATM 3686 CA CA A 115 3.753 30.012 -5.765 1.00 0.00 CA HETATM 3687 CA CA B 116 9.319 2.966 -22.516 1.00 0.00 CA HETATM 3688 CA CA B 117 11.559 15.290 -23.947 1.00 0.00 CA