USER MOD reduce.3.24.130724 H: found=0, std=0, add=1225, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1222 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 98 THR OG1 : rot -26:sc= 1.24 USER MOD Set 1.2: A 101 CYS SG : rot -150:sc= 0.477 USER MOD Set 2.1: A 63 GLN : amide:sc= -0.0183 K(o=-0.016,f=-1.8!) USER MOD Set 2.2: A 75 LYS NZ :NH3+ -124:sc= 0.00222 (180deg=0) USER MOD Set 3.1: A 59 HIS : no HE2:sc= -0.881 K(o=-1.3,f=-6.4!) USER MOD Set 3.2: A 78 SER OG : rot 162:sc= -0.463 USER MOD Set 4.1: A 34 CYS SG : rot 180:sc= 0 USER MOD Set 4.2: A 36 ASN : amide:sc= -6.98! C(o=-7!,f=-6.2!) USER MOD Set 5.1: A 25 HIS : no HD1:sc= -8.15! C(o=-8.2!,f=-5.7!) USER MOD Set 5.2: A 152 SER OG : rot 80:sc= 0 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -143:sc= -0.23 (180deg=-1.28!) USER MOD Single : A 7 THR OG1 : rot -179:sc= -0.244 USER MOD Single : A 8 THR OG1 : rot -68:sc= 1.08 USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ -137:sc= 0.948 (180deg=-1.51!) USER MOD Single : A 44 HIS : no HD1:sc= -0.469 K(o=-0.47,f=-3.6!) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 SER OG : rot 180:sc= 0.104 USER MOD Single : A 61 LYS NZ :NH3+ -132:sc= 0.414 (180deg=0) USER MOD Single : A 65 GLN : amide:sc= 0 X(o=0,f=-0.47) USER MOD Single : A 73 SER OG : rot -98:sc= 0.799 USER MOD Single : A 80 ASN : amide:sc= -1.29 X(o=-1.3,f=-1.3) USER MOD Single : A 82 TYR OH : rot 180:sc= -0.0624 USER MOD Single : A 85 MET CE :methyl 155:sc= -0.165 (180deg=-1.39) USER MOD Single : A 86 LYS NZ :NH3+ 173:sc= -1.07 (180deg=-1.31) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 ASN : amide:sc= -0.393 K(o=-0.39,f=-2.8!) USER MOD Single : A 111 ASN : amide:sc= -1.67! C(o=-1.7!,f=-5.7!) USER MOD Single : A 112 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 ASN : amide:sc= -6.7! C(o=-6.7!,f=-5.1!) USER MOD Single : A 114 THR OG1 : rot -7:sc= 0.889 USER MOD Single : A 115 TYR OH : rot 57:sc= 0.784 USER MOD Single : A 117 SER OG : rot 100:sc= -0.425 USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 121 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 124 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 LYS NZ :NH3+ -157:sc= -0.118 (180deg=-0.544) USER MOD Single : A 130 THR OG1 : rot 1:sc= 0.632! USER MOD Single : A 132 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 133 TYR OH : rot 180:sc= 0 USER MOD Single : A 134 LYS NZ :NH3+ 173:sc= -1.11 (180deg=-1.29) USER MOD Single : A 137 SER OG : rot 180:sc= -0.777 USER MOD Single : A 138 LYS NZ :NH3+ 166:sc= -0.507 (180deg=-1.08) USER MOD Single : A 139 THR OG1 : rot -74:sc= 0.847 USER MOD Single : A 143 GLN : amide:sc= -0.184 K(o=-0.18,f=-2.2) USER MOD Single : A 144 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 151 MET CE :methyl -139:sc= -0.354 (180deg=-3.08!) USER MOD Single : A 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 SER OG : rot -53:sc= 0.223 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 20.836 19.784 0.184 1.00 0.00 N ATOM 2 CA MET A 1 21.018 18.678 1.166 1.00 0.00 C ATOM 3 C MET A 1 19.788 18.594 2.073 1.00 0.00 C ATOM 4 O MET A 1 19.843 18.923 3.241 1.00 0.00 O ATOM 5 CB MET A 1 22.260 18.948 2.016 1.00 0.00 C ATOM 6 CG MET A 1 23.496 18.990 1.115 1.00 0.00 C ATOM 7 SD MET A 1 24.242 17.343 1.038 1.00 0.00 S ATOM 8 CE MET A 1 25.880 17.861 0.472 1.00 0.00 C ATOM 0 H1 MET A 1 21.242 19.505 -0.732 1.00 0.00 H new ATOM 0 H2 MET A 1 19.822 19.981 0.067 1.00 0.00 H new ATOM 0 H3 MET A 1 21.317 20.638 0.530 1.00 0.00 H new ATOM 0 HA MET A 1 21.142 17.736 0.632 1.00 0.00 H new ATOM 0 HB2 MET A 1 22.152 19.894 2.547 1.00 0.00 H new ATOM 0 HB3 MET A 1 22.373 18.170 2.771 1.00 0.00 H new ATOM 0 HG2 MET A 1 23.219 19.323 0.115 1.00 0.00 H new ATOM 0 HG3 MET A 1 24.217 19.710 1.502 1.00 0.00 H new ATOM 0 HE1 MET A 1 26.518 16.985 0.355 1.00 0.00 H new ATOM 0 HE2 MET A 1 25.789 18.374 -0.485 1.00 0.00 H new ATOM 0 HE3 MET A 1 26.321 18.536 1.205 1.00 0.00 H new ATOM 20 N ALA A 2 18.678 18.157 1.544 1.00 0.00 N ATOM 21 CA ALA A 2 17.447 18.053 2.377 1.00 0.00 C ATOM 22 C ALA A 2 16.563 16.925 1.840 1.00 0.00 C ATOM 23 O ALA A 2 16.651 15.794 2.275 1.00 0.00 O ATOM 24 CB ALA A 2 16.678 19.374 2.319 1.00 0.00 C ATOM 0 H ALA A 2 18.571 17.868 0.572 1.00 0.00 H new ATOM 0 HA ALA A 2 17.724 17.839 3.409 1.00 0.00 H new ATOM 0 HB1 ALA A 2 15.777 19.298 2.928 1.00 0.00 H new ATOM 0 HB2 ALA A 2 17.307 20.178 2.700 1.00 0.00 H new ATOM 0 HB3 ALA A 2 16.401 19.589 1.287 1.00 0.00 H new ATOM 30 N GLU A 3 15.711 17.224 0.898 1.00 0.00 N ATOM 31 CA GLU A 3 14.822 16.169 0.335 1.00 0.00 C ATOM 32 C GLU A 3 14.121 15.429 1.476 1.00 0.00 C ATOM 33 O GLU A 3 14.183 15.831 2.621 1.00 0.00 O ATOM 34 CB GLU A 3 15.659 15.178 -0.477 1.00 0.00 C ATOM 35 CG GLU A 3 16.348 15.914 -1.627 1.00 0.00 C ATOM 36 CD GLU A 3 17.853 15.989 -1.357 1.00 0.00 C ATOM 37 OE1 GLU A 3 18.498 14.955 -1.423 1.00 0.00 O ATOM 38 OE2 GLU A 3 18.333 17.078 -1.088 1.00 0.00 O ATOM 0 H GLU A 3 15.592 18.153 0.494 1.00 0.00 H new ATOM 0 HA GLU A 3 14.075 16.630 -0.311 1.00 0.00 H new ATOM 0 HB2 GLU A 3 16.403 14.704 0.163 1.00 0.00 H new ATOM 0 HB3 GLU A 3 15.023 14.384 -0.869 1.00 0.00 H new ATOM 0 HG2 GLU A 3 16.162 15.396 -2.568 1.00 0.00 H new ATOM 0 HG3 GLU A 3 15.936 16.918 -1.729 1.00 0.00 H new ATOM 45 N GLY A 4 13.454 14.348 1.173 1.00 0.00 N ATOM 46 CA GLY A 4 12.750 13.584 2.241 1.00 0.00 C ATOM 47 C GLY A 4 13.758 12.722 3.004 1.00 0.00 C ATOM 48 O GLY A 4 14.010 12.935 4.173 1.00 0.00 O ATOM 0 H GLY A 4 13.367 13.962 0.233 1.00 0.00 H new ATOM 0 HA2 GLY A 4 12.252 14.271 2.925 1.00 0.00 H new ATOM 0 HA3 GLY A 4 11.976 12.954 1.802 1.00 0.00 H new ATOM 52 N GLU A 5 14.335 11.750 2.352 1.00 0.00 N ATOM 53 CA GLU A 5 15.325 10.876 3.041 1.00 0.00 C ATOM 54 C GLU A 5 16.225 10.206 2.001 1.00 0.00 C ATOM 55 O GLU A 5 16.611 10.809 1.019 1.00 0.00 O ATOM 56 CB GLU A 5 14.586 9.803 3.844 1.00 0.00 C ATOM 57 CG GLU A 5 15.471 9.326 4.997 1.00 0.00 C ATOM 58 CD GLU A 5 15.018 7.937 5.449 1.00 0.00 C ATOM 59 OE1 GLU A 5 13.898 7.570 5.135 1.00 0.00 O ATOM 60 OE2 GLU A 5 15.799 7.263 6.100 1.00 0.00 O ATOM 0 H GLU A 5 14.163 11.524 1.372 1.00 0.00 H new ATOM 0 HA GLU A 5 15.935 11.478 3.715 1.00 0.00 H new ATOM 0 HB2 GLU A 5 13.650 10.205 4.232 1.00 0.00 H new ATOM 0 HB3 GLU A 5 14.329 8.964 3.198 1.00 0.00 H new ATOM 0 HG2 GLU A 5 16.513 9.295 4.680 1.00 0.00 H new ATOM 0 HG3 GLU A 5 15.412 10.028 5.829 1.00 0.00 H new ATOM 67 N ILE A 6 16.563 8.962 2.209 1.00 0.00 N ATOM 68 CA ILE A 6 17.438 8.254 1.232 1.00 0.00 C ATOM 69 C ILE A 6 16.919 8.495 -0.187 1.00 0.00 C ATOM 70 O ILE A 6 15.736 8.670 -0.404 1.00 0.00 O ATOM 71 CB ILE A 6 17.425 6.754 1.532 1.00 0.00 C ATOM 72 CG1 ILE A 6 18.090 6.500 2.888 1.00 0.00 C ATOM 73 CG2 ILE A 6 18.197 6.009 0.441 1.00 0.00 C ATOM 74 CD1 ILE A 6 17.328 5.401 3.632 1.00 0.00 C ATOM 0 H ILE A 6 16.271 8.406 3.013 1.00 0.00 H new ATOM 0 HA ILE A 6 18.457 8.633 1.315 1.00 0.00 H new ATOM 0 HB ILE A 6 16.395 6.398 1.558 1.00 0.00 H new ATOM 0 HG12 ILE A 6 19.129 6.204 2.746 1.00 0.00 H new ATOM 0 HG13 ILE A 6 18.097 7.416 3.479 1.00 0.00 H new ATOM 0 HG21 ILE A 6 18.188 4.940 0.654 1.00 0.00 H new ATOM 0 HG22 ILE A 6 17.727 6.190 -0.526 1.00 0.00 H new ATOM 0 HG23 ILE A 6 19.227 6.365 0.416 1.00 0.00 H new ATOM 0 HD11 ILE A 6 17.801 5.220 4.597 1.00 0.00 H new ATOM 0 HD12 ILE A 6 16.296 5.715 3.787 1.00 0.00 H new ATOM 0 HD13 ILE A 6 17.344 4.484 3.042 1.00 0.00 H new ATOM 86 N THR A 7 17.795 8.506 -1.155 1.00 0.00 N ATOM 87 CA THR A 7 17.350 8.735 -2.558 1.00 0.00 C ATOM 88 C THR A 7 16.346 7.652 -2.956 1.00 0.00 C ATOM 89 O THR A 7 16.360 6.556 -2.433 1.00 0.00 O ATOM 90 CB THR A 7 18.561 8.676 -3.493 1.00 0.00 C ATOM 91 OG1 THR A 7 18.186 8.051 -4.712 1.00 0.00 O ATOM 92 CG2 THR A 7 19.681 7.874 -2.829 1.00 0.00 C ATOM 0 H THR A 7 18.798 8.366 -1.034 1.00 0.00 H new ATOM 0 HA THR A 7 16.879 9.715 -2.635 1.00 0.00 H new ATOM 0 HB THR A 7 18.913 9.687 -3.697 1.00 0.00 H new ATOM 0 HG1 THR A 7 18.964 7.999 -5.306 1.00 0.00 H new ATOM 0 HG21 THR A 7 20.543 7.832 -3.495 1.00 0.00 H new ATOM 0 HG22 THR A 7 19.968 8.355 -1.894 1.00 0.00 H new ATOM 0 HG23 THR A 7 19.332 6.862 -2.624 1.00 0.00 H new ATOM 100 N THR A 8 15.472 7.950 -3.878 1.00 0.00 N ATOM 101 CA THR A 8 14.468 6.937 -4.308 1.00 0.00 C ATOM 102 C THR A 8 15.021 6.136 -5.488 1.00 0.00 C ATOM 103 O THR A 8 14.428 6.086 -6.549 1.00 0.00 O ATOM 104 CB THR A 8 13.178 7.646 -4.731 1.00 0.00 C ATOM 105 OG1 THR A 8 12.324 6.718 -5.386 1.00 0.00 O ATOM 106 CG2 THR A 8 13.514 8.794 -5.683 1.00 0.00 C ATOM 0 H THR A 8 15.410 8.851 -4.352 1.00 0.00 H new ATOM 0 HA THR A 8 14.257 6.261 -3.479 1.00 0.00 H new ATOM 0 HB THR A 8 12.675 8.044 -3.850 1.00 0.00 H new ATOM 0 HG1 THR A 8 12.719 6.460 -6.245 1.00 0.00 H new ATOM 0 HG21 THR A 8 12.595 9.298 -5.984 1.00 0.00 H new ATOM 0 HG22 THR A 8 14.170 9.504 -5.179 1.00 0.00 H new ATOM 0 HG23 THR A 8 14.017 8.399 -6.566 1.00 0.00 H new ATOM 114 N LEU A 9 16.153 5.511 -5.316 1.00 0.00 N ATOM 115 CA LEU A 9 16.742 4.715 -6.429 1.00 0.00 C ATOM 116 C LEU A 9 15.669 3.748 -6.971 1.00 0.00 C ATOM 117 O LEU A 9 14.815 3.325 -6.220 1.00 0.00 O ATOM 118 CB LEU A 9 17.932 3.913 -5.890 1.00 0.00 C ATOM 119 CG LEU A 9 19.076 4.868 -5.538 1.00 0.00 C ATOM 120 CD1 LEU A 9 19.519 4.627 -4.094 1.00 0.00 C ATOM 121 CD2 LEU A 9 20.257 4.616 -6.480 1.00 0.00 C ATOM 0 H LEU A 9 16.696 5.517 -4.452 1.00 0.00 H new ATOM 0 HA LEU A 9 17.079 5.374 -7.229 1.00 0.00 H new ATOM 0 HB2 LEU A 9 17.633 3.347 -5.008 1.00 0.00 H new ATOM 0 HB3 LEU A 9 18.264 3.190 -6.635 1.00 0.00 H new ATOM 0 HG LEU A 9 18.735 5.898 -5.646 1.00 0.00 H new ATOM 0 HD11 LEU A 9 20.333 5.307 -3.845 1.00 0.00 H new ATOM 0 HD12 LEU A 9 18.680 4.804 -3.422 1.00 0.00 H new ATOM 0 HD13 LEU A 9 19.860 3.598 -3.985 1.00 0.00 H new ATOM 0 HD21 LEU A 9 21.072 5.295 -6.231 1.00 0.00 H new ATOM 0 HD22 LEU A 9 20.596 3.586 -6.371 1.00 0.00 H new ATOM 0 HD23 LEU A 9 19.944 4.787 -7.510 1.00 0.00 H new ATOM 133 N PRO A 10 15.727 3.409 -8.251 1.00 0.00 N ATOM 134 CA PRO A 10 14.737 2.483 -8.840 1.00 0.00 C ATOM 135 C PRO A 10 14.756 1.138 -8.093 1.00 0.00 C ATOM 136 O PRO A 10 15.283 0.151 -8.568 1.00 0.00 O ATOM 137 CB PRO A 10 15.172 2.321 -10.309 1.00 0.00 C ATOM 138 CG PRO A 10 16.474 3.134 -10.506 1.00 0.00 C ATOM 139 CD PRO A 10 16.748 3.900 -9.203 1.00 0.00 C ATOM 0 HA PRO A 10 13.716 2.857 -8.766 1.00 0.00 H new ATOM 0 HB2 PRO A 10 15.338 1.270 -10.545 1.00 0.00 H new ATOM 0 HB3 PRO A 10 14.392 2.679 -10.981 1.00 0.00 H new ATOM 0 HG2 PRO A 10 17.307 2.471 -10.742 1.00 0.00 H new ATOM 0 HG3 PRO A 10 16.370 3.826 -11.342 1.00 0.00 H new ATOM 0 HD2 PRO A 10 17.756 3.707 -8.836 1.00 0.00 H new ATOM 0 HD3 PRO A 10 16.664 4.976 -9.352 1.00 0.00 H new ATOM 147 N ALA A 11 14.175 1.097 -6.922 1.00 0.00 N ATOM 148 CA ALA A 11 14.144 -0.170 -6.133 1.00 0.00 C ATOM 149 C ALA A 11 15.504 -0.869 -6.202 1.00 0.00 C ATOM 150 O ALA A 11 15.726 -1.731 -7.029 1.00 0.00 O ATOM 151 CB ALA A 11 13.068 -1.096 -6.705 1.00 0.00 C ATOM 0 H ALA A 11 13.718 1.892 -6.476 1.00 0.00 H new ATOM 0 HA ALA A 11 13.918 0.064 -5.093 1.00 0.00 H new ATOM 0 HB1 ALA A 11 13.043 -2.022 -6.131 1.00 0.00 H new ATOM 0 HB2 ALA A 11 12.096 -0.605 -6.645 1.00 0.00 H new ATOM 0 HB3 ALA A 11 13.298 -1.321 -7.747 1.00 0.00 H new ATOM 157 N LEU A 12 16.415 -0.509 -5.340 1.00 0.00 N ATOM 158 CA LEU A 12 17.755 -1.158 -5.358 1.00 0.00 C ATOM 159 C LEU A 12 17.783 -2.374 -4.415 1.00 0.00 C ATOM 160 O LEU A 12 18.261 -3.421 -4.804 1.00 0.00 O ATOM 161 CB LEU A 12 18.831 -0.152 -4.936 1.00 0.00 C ATOM 162 CG LEU A 12 19.855 0.002 -6.062 1.00 0.00 C ATOM 163 CD1 LEU A 12 19.182 0.628 -7.285 1.00 0.00 C ATOM 164 CD2 LEU A 12 20.996 0.907 -5.591 1.00 0.00 C ATOM 0 H LEU A 12 16.289 0.207 -4.624 1.00 0.00 H new ATOM 0 HA LEU A 12 17.957 -1.499 -6.373 1.00 0.00 H new ATOM 0 HB2 LEU A 12 18.375 0.812 -4.711 1.00 0.00 H new ATOM 0 HB3 LEU A 12 19.324 -0.492 -4.025 1.00 0.00 H new ATOM 0 HG LEU A 12 20.251 -0.978 -6.328 1.00 0.00 H new ATOM 0 HD11 LEU A 12 19.913 0.737 -8.086 1.00 0.00 H new ATOM 0 HD12 LEU A 12 18.368 -0.014 -7.621 1.00 0.00 H new ATOM 0 HD13 LEU A 12 18.785 1.608 -7.020 1.00 0.00 H new ATOM 0 HD21 LEU A 12 21.727 1.018 -6.392 1.00 0.00 H new ATOM 0 HD22 LEU A 12 20.598 1.886 -5.325 1.00 0.00 H new ATOM 0 HD23 LEU A 12 21.477 0.462 -4.720 1.00 0.00 H new ATOM 176 N PRO A 13 17.287 -2.223 -3.200 1.00 0.00 N ATOM 177 CA PRO A 13 17.288 -3.337 -2.235 1.00 0.00 C ATOM 178 C PRO A 13 16.348 -4.449 -2.711 1.00 0.00 C ATOM 179 O PRO A 13 15.152 -4.395 -2.506 1.00 0.00 O ATOM 180 CB PRO A 13 16.783 -2.725 -0.921 1.00 0.00 C ATOM 181 CG PRO A 13 16.463 -1.234 -1.190 1.00 0.00 C ATOM 182 CD PRO A 13 16.697 -0.967 -2.685 1.00 0.00 C ATOM 0 HA PRO A 13 18.275 -3.785 -2.121 1.00 0.00 H new ATOM 0 HB2 PRO A 13 15.894 -3.250 -0.571 1.00 0.00 H new ATOM 0 HB3 PRO A 13 17.537 -2.820 -0.140 1.00 0.00 H new ATOM 0 HG2 PRO A 13 15.432 -1.009 -0.919 1.00 0.00 H new ATOM 0 HG3 PRO A 13 17.100 -0.591 -0.583 1.00 0.00 H new ATOM 0 HD2 PRO A 13 15.764 -0.728 -3.196 1.00 0.00 H new ATOM 0 HD3 PRO A 13 17.369 -0.122 -2.837 1.00 0.00 H new ATOM 190 N GLU A 14 16.880 -5.456 -3.348 1.00 0.00 N ATOM 191 CA GLU A 14 16.018 -6.568 -3.838 1.00 0.00 C ATOM 192 C GLU A 14 16.896 -7.695 -4.385 1.00 0.00 C ATOM 193 O GLU A 14 17.127 -7.794 -5.573 1.00 0.00 O ATOM 194 CB GLU A 14 15.103 -6.050 -4.951 1.00 0.00 C ATOM 195 CG GLU A 14 14.311 -7.215 -5.547 1.00 0.00 C ATOM 196 CD GLU A 14 12.978 -6.700 -6.092 1.00 0.00 C ATOM 197 OE1 GLU A 14 12.142 -6.315 -5.292 1.00 0.00 O ATOM 198 OE2 GLU A 14 12.815 -6.699 -7.301 1.00 0.00 O ATOM 0 H GLU A 14 17.875 -5.557 -3.550 1.00 0.00 H new ATOM 0 HA GLU A 14 15.413 -6.947 -3.014 1.00 0.00 H new ATOM 0 HB2 GLU A 14 14.421 -5.298 -4.554 1.00 0.00 H new ATOM 0 HB3 GLU A 14 15.696 -5.565 -5.727 1.00 0.00 H new ATOM 0 HG2 GLU A 14 14.884 -7.688 -6.345 1.00 0.00 H new ATOM 0 HG3 GLU A 14 14.135 -7.976 -4.787 1.00 0.00 H new ATOM 205 N ASP A 15 17.388 -8.548 -3.526 1.00 0.00 N ATOM 206 CA ASP A 15 18.249 -9.668 -3.999 1.00 0.00 C ATOM 207 C ASP A 15 17.421 -10.614 -4.869 1.00 0.00 C ATOM 208 O ASP A 15 17.876 -11.096 -5.888 1.00 0.00 O ATOM 209 CB ASP A 15 18.797 -10.436 -2.795 1.00 0.00 C ATOM 210 CG ASP A 15 20.150 -9.851 -2.387 1.00 0.00 C ATOM 211 OD1 ASP A 15 21.074 -9.937 -3.179 1.00 0.00 O ATOM 212 OD2 ASP A 15 20.240 -9.327 -1.289 1.00 0.00 O ATOM 0 H ASP A 15 17.230 -8.517 -2.519 1.00 0.00 H new ATOM 0 HA ASP A 15 19.078 -9.266 -4.582 1.00 0.00 H new ATOM 0 HB2 ASP A 15 18.097 -10.375 -1.962 1.00 0.00 H new ATOM 0 HB3 ASP A 15 18.906 -11.492 -3.043 1.00 0.00 H new ATOM 217 N GLY A 16 16.210 -10.881 -4.474 1.00 0.00 N ATOM 218 CA GLY A 16 15.347 -11.795 -5.274 1.00 0.00 C ATOM 219 C GLY A 16 14.432 -12.586 -4.337 1.00 0.00 C ATOM 220 O GLY A 16 14.022 -12.099 -3.301 1.00 0.00 O ATOM 0 H GLY A 16 15.778 -10.506 -3.630 1.00 0.00 H new ATOM 0 HA2 GLY A 16 14.750 -11.221 -5.983 1.00 0.00 H new ATOM 0 HA3 GLY A 16 15.965 -12.478 -5.857 1.00 0.00 H new ATOM 224 N GLY A 17 14.111 -13.801 -4.695 1.00 0.00 N ATOM 225 CA GLY A 17 13.222 -14.634 -3.831 1.00 0.00 C ATOM 226 C GLY A 17 14.062 -15.640 -3.048 1.00 0.00 C ATOM 227 O GLY A 17 15.271 -15.684 -3.168 1.00 0.00 O ATOM 0 H GLY A 17 14.427 -14.255 -5.552 1.00 0.00 H new ATOM 0 HA2 GLY A 17 12.666 -13.997 -3.144 1.00 0.00 H new ATOM 0 HA3 GLY A 17 12.489 -15.157 -4.445 1.00 0.00 H new ATOM 231 N SER A 18 13.426 -16.450 -2.245 1.00 0.00 N ATOM 232 CA SER A 18 14.160 -17.457 -1.446 1.00 0.00 C ATOM 233 C SER A 18 13.435 -18.783 -1.540 1.00 0.00 C ATOM 234 O SER A 18 13.143 -19.291 -2.605 1.00 0.00 O ATOM 235 CB SER A 18 14.204 -17.004 0.015 1.00 0.00 C ATOM 236 OG SER A 18 14.664 -15.660 0.076 1.00 0.00 O ATOM 0 H SER A 18 12.415 -16.452 -2.111 1.00 0.00 H new ATOM 0 HA SER A 18 15.176 -17.565 -1.825 1.00 0.00 H new ATOM 0 HB2 SER A 18 13.213 -17.082 0.462 1.00 0.00 H new ATOM 0 HB3 SER A 18 14.865 -17.653 0.589 1.00 0.00 H new ATOM 0 HG SER A 18 14.692 -15.366 1.010 1.00 0.00 H new ATOM 242 N GLY A 19 13.148 -19.329 -0.421 1.00 0.00 N ATOM 243 CA GLY A 19 12.433 -20.635 -0.365 1.00 0.00 C ATOM 244 C GLY A 19 10.973 -20.432 -0.773 1.00 0.00 C ATOM 245 O GLY A 19 10.487 -21.041 -1.707 1.00 0.00 O ATOM 0 H GLY A 19 13.377 -18.929 0.489 1.00 0.00 H new ATOM 0 HA2 GLY A 19 12.912 -21.353 -1.031 1.00 0.00 H new ATOM 0 HA3 GLY A 19 12.487 -21.049 0.642 1.00 0.00 H new ATOM 249 N ALA A 20 10.269 -19.579 -0.081 1.00 0.00 N ATOM 250 CA ALA A 20 8.840 -19.333 -0.428 1.00 0.00 C ATOM 251 C ALA A 20 8.494 -17.874 -0.141 1.00 0.00 C ATOM 252 O ALA A 20 8.598 -17.018 -0.998 1.00 0.00 O ATOM 253 CB ALA A 20 7.942 -20.236 0.417 1.00 0.00 C ATOM 0 H ALA A 20 10.622 -19.041 0.711 1.00 0.00 H new ATOM 0 HA ALA A 20 8.683 -19.550 -1.485 1.00 0.00 H new ATOM 0 HB1 ALA A 20 6.898 -20.054 0.161 1.00 0.00 H new ATOM 0 HB2 ALA A 20 8.187 -21.280 0.220 1.00 0.00 H new ATOM 0 HB3 ALA A 20 8.099 -20.020 1.474 1.00 0.00 H new ATOM 259 N PHE A 21 8.080 -17.583 1.061 1.00 0.00 N ATOM 260 CA PHE A 21 7.724 -16.181 1.405 1.00 0.00 C ATOM 261 C PHE A 21 8.049 -15.905 2.887 1.00 0.00 C ATOM 262 O PHE A 21 7.165 -15.654 3.681 1.00 0.00 O ATOM 263 CB PHE A 21 6.226 -15.981 1.130 1.00 0.00 C ATOM 264 CG PHE A 21 6.003 -14.617 0.525 1.00 0.00 C ATOM 265 CD1 PHE A 21 6.643 -13.496 1.065 1.00 0.00 C ATOM 266 CD2 PHE A 21 5.156 -14.476 -0.580 1.00 0.00 C ATOM 267 CE1 PHE A 21 6.437 -12.234 0.500 1.00 0.00 C ATOM 268 CE2 PHE A 21 4.949 -13.214 -1.145 1.00 0.00 C ATOM 269 CZ PHE A 21 5.589 -12.091 -0.606 1.00 0.00 C ATOM 0 H PHE A 21 7.973 -18.257 1.819 1.00 0.00 H new ATOM 0 HA PHE A 21 8.302 -15.483 0.799 1.00 0.00 H new ATOM 0 HB2 PHE A 21 5.863 -16.754 0.453 1.00 0.00 H new ATOM 0 HB3 PHE A 21 5.659 -16.077 2.056 1.00 0.00 H new ATOM 0 HD1 PHE A 21 7.296 -13.606 1.918 1.00 0.00 H new ATOM 0 HD2 PHE A 21 4.662 -15.342 -0.996 1.00 0.00 H new ATOM 0 HE1 PHE A 21 6.932 -11.369 0.916 1.00 0.00 H new ATOM 0 HE2 PHE A 21 4.295 -13.105 -1.998 1.00 0.00 H new ATOM 0 HZ PHE A 21 5.429 -11.116 -1.042 1.00 0.00 H new ATOM 279 N PRO A 22 9.319 -15.953 3.224 1.00 0.00 N ATOM 280 CA PRO A 22 9.757 -15.706 4.610 1.00 0.00 C ATOM 281 C PRO A 22 9.467 -14.247 4.994 1.00 0.00 C ATOM 282 O PRO A 22 9.168 -13.440 4.137 1.00 0.00 O ATOM 283 CB PRO A 22 11.270 -15.961 4.596 1.00 0.00 C ATOM 284 CG PRO A 22 11.683 -16.263 3.133 1.00 0.00 C ATOM 285 CD PRO A 22 10.409 -16.255 2.274 1.00 0.00 C ATOM 0 HA PRO A 22 9.241 -16.341 5.331 1.00 0.00 H new ATOM 0 HB2 PRO A 22 11.808 -15.091 4.974 1.00 0.00 H new ATOM 0 HB3 PRO A 22 11.523 -16.799 5.246 1.00 0.00 H new ATOM 0 HG2 PRO A 22 12.391 -15.516 2.774 1.00 0.00 H new ATOM 0 HG3 PRO A 22 12.181 -17.230 3.069 1.00 0.00 H new ATOM 0 HD2 PRO A 22 10.467 -15.504 1.486 1.00 0.00 H new ATOM 0 HD3 PRO A 22 10.254 -17.217 1.786 1.00 0.00 H new ATOM 293 N PRO A 23 9.573 -13.938 6.267 1.00 0.00 N ATOM 294 CA PRO A 23 9.335 -12.567 6.752 1.00 0.00 C ATOM 295 C PRO A 23 10.342 -11.607 6.107 1.00 0.00 C ATOM 296 O PRO A 23 11.436 -11.412 6.598 1.00 0.00 O ATOM 297 CB PRO A 23 9.551 -12.641 8.271 1.00 0.00 C ATOM 298 CG PRO A 23 10.014 -14.081 8.609 1.00 0.00 C ATOM 299 CD PRO A 23 9.935 -14.911 7.318 1.00 0.00 C ATOM 0 HA PRO A 23 8.339 -12.201 6.504 1.00 0.00 H new ATOM 0 HB2 PRO A 23 10.299 -11.914 8.587 1.00 0.00 H new ATOM 0 HB3 PRO A 23 8.629 -12.401 8.801 1.00 0.00 H new ATOM 0 HG2 PRO A 23 11.032 -14.074 8.998 1.00 0.00 H new ATOM 0 HG3 PRO A 23 9.380 -14.515 9.382 1.00 0.00 H new ATOM 0 HD2 PRO A 23 10.887 -15.394 7.099 1.00 0.00 H new ATOM 0 HD3 PRO A 23 9.188 -15.701 7.400 1.00 0.00 H new ATOM 307 N GLY A 24 9.984 -11.017 5.002 1.00 0.00 N ATOM 308 CA GLY A 24 10.918 -10.077 4.320 1.00 0.00 C ATOM 309 C GLY A 24 11.220 -8.892 5.240 1.00 0.00 C ATOM 310 O GLY A 24 11.594 -9.062 6.383 1.00 0.00 O ATOM 0 H GLY A 24 9.084 -11.145 4.540 1.00 0.00 H new ATOM 0 HA2 GLY A 24 11.842 -10.593 4.060 1.00 0.00 H new ATOM 0 HA3 GLY A 24 10.477 -9.723 3.388 1.00 0.00 H new ATOM 314 N HIS A 25 11.061 -7.694 4.744 1.00 0.00 N ATOM 315 CA HIS A 25 11.336 -6.488 5.578 1.00 0.00 C ATOM 316 C HIS A 25 10.015 -5.930 6.114 1.00 0.00 C ATOM 317 O HIS A 25 9.611 -4.830 5.791 1.00 0.00 O ATOM 318 CB HIS A 25 12.041 -5.434 4.719 1.00 0.00 C ATOM 319 CG HIS A 25 11.595 -5.577 3.290 1.00 0.00 C ATOM 320 ND1 HIS A 25 12.472 -5.439 2.225 1.00 0.00 N ATOM 321 CD2 HIS A 25 10.371 -5.851 2.733 1.00 0.00 C ATOM 322 CE1 HIS A 25 11.769 -5.629 1.094 1.00 0.00 C ATOM 323 NE2 HIS A 25 10.482 -5.884 1.346 1.00 0.00 N ATOM 0 H HIS A 25 10.751 -7.498 3.792 1.00 0.00 H new ATOM 0 HA HIS A 25 11.977 -6.755 6.418 1.00 0.00 H new ATOM 0 HB2 HIS A 25 11.808 -4.434 5.086 1.00 0.00 H new ATOM 0 HB3 HIS A 25 13.122 -5.556 4.788 1.00 0.00 H new ATOM 0 HD2 HIS A 25 9.459 -6.016 3.287 1.00 0.00 H new ATOM 0 HE1 HIS A 25 12.194 -5.581 0.102 1.00 0.00 H new ATOM 0 HE2 HIS A 25 9.741 -6.064 0.668 1.00 0.00 H new ATOM 331 N PHE A 26 9.335 -6.686 6.931 1.00 0.00 N ATOM 332 CA PHE A 26 8.039 -6.205 7.489 1.00 0.00 C ATOM 333 C PHE A 26 8.296 -5.418 8.776 1.00 0.00 C ATOM 334 O PHE A 26 7.376 -5.009 9.456 1.00 0.00 O ATOM 335 CB PHE A 26 7.145 -7.405 7.804 1.00 0.00 C ATOM 336 CG PHE A 26 6.694 -8.048 6.516 1.00 0.00 C ATOM 337 CD1 PHE A 26 7.576 -8.859 5.792 1.00 0.00 C ATOM 338 CD2 PHE A 26 5.395 -7.833 6.044 1.00 0.00 C ATOM 339 CE1 PHE A 26 7.157 -9.456 4.598 1.00 0.00 C ATOM 340 CE2 PHE A 26 4.976 -8.429 4.850 1.00 0.00 C ATOM 341 CZ PHE A 26 5.858 -9.241 4.127 1.00 0.00 C ATOM 0 H PHE A 26 9.620 -7.616 7.237 1.00 0.00 H new ATOM 0 HA PHE A 26 7.548 -5.561 6.759 1.00 0.00 H new ATOM 0 HB2 PHE A 26 7.689 -8.127 8.413 1.00 0.00 H new ATOM 0 HB3 PHE A 26 6.280 -7.085 8.386 1.00 0.00 H new ATOM 0 HD1 PHE A 26 8.580 -9.024 6.155 1.00 0.00 H new ATOM 0 HD2 PHE A 26 4.715 -7.206 6.602 1.00 0.00 H new ATOM 0 HE1 PHE A 26 7.837 -10.083 4.040 1.00 0.00 H new ATOM 0 HE2 PHE A 26 3.973 -8.263 4.486 1.00 0.00 H new ATOM 0 HZ PHE A 26 5.535 -9.702 3.205 1.00 0.00 H new ATOM 351 N LYS A 27 9.541 -5.209 9.116 1.00 0.00 N ATOM 352 CA LYS A 27 9.863 -4.456 10.364 1.00 0.00 C ATOM 353 C LYS A 27 10.201 -3.004 10.020 1.00 0.00 C ATOM 354 O LYS A 27 10.257 -2.156 10.890 1.00 0.00 O ATOM 355 CB LYS A 27 11.065 -5.107 11.051 1.00 0.00 C ATOM 356 CG LYS A 27 12.162 -5.374 10.020 1.00 0.00 C ATOM 357 CD LYS A 27 13.467 -5.716 10.740 1.00 0.00 C ATOM 358 CE LYS A 27 13.236 -6.898 11.682 1.00 0.00 C ATOM 359 NZ LYS A 27 14.525 -7.612 11.908 1.00 0.00 N ATOM 0 H LYS A 27 10.350 -5.528 8.582 1.00 0.00 H new ATOM 0 HA LYS A 27 9.001 -4.477 11.031 1.00 0.00 H new ATOM 0 HB2 LYS A 27 11.443 -4.456 11.839 1.00 0.00 H new ATOM 0 HB3 LYS A 27 10.764 -6.040 11.526 1.00 0.00 H new ATOM 0 HG2 LYS A 27 11.869 -6.195 9.366 1.00 0.00 H new ATOM 0 HG3 LYS A 27 12.302 -4.498 9.387 1.00 0.00 H new ATOM 0 HD2 LYS A 27 14.242 -5.962 10.014 1.00 0.00 H new ATOM 0 HD3 LYS A 27 13.821 -4.852 11.303 1.00 0.00 H new ATOM 0 HE2 LYS A 27 12.831 -6.547 12.631 1.00 0.00 H new ATOM 0 HE3 LYS A 27 12.501 -7.579 11.254 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 14.369 -8.416 12.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 14.893 -7.960 11.000 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 15.214 -6.959 12.334 1.00 0.00 H new ATOM 373 N ASP A 28 10.430 -2.715 8.763 1.00 0.00 N ATOM 374 CA ASP A 28 10.770 -1.318 8.353 1.00 0.00 C ATOM 375 C ASP A 28 9.643 -0.762 7.459 1.00 0.00 C ATOM 376 O ASP A 28 8.978 -1.527 6.790 1.00 0.00 O ATOM 377 CB ASP A 28 12.082 -1.342 7.562 1.00 0.00 C ATOM 378 CG ASP A 28 13.262 -1.410 8.533 1.00 0.00 C ATOM 379 OD1 ASP A 28 13.023 -1.607 9.713 1.00 0.00 O ATOM 380 OD2 ASP A 28 14.385 -1.263 8.080 1.00 0.00 O ATOM 0 H ASP A 28 10.396 -3.391 8.000 1.00 0.00 H new ATOM 0 HA ASP A 28 10.879 -0.686 9.234 1.00 0.00 H new ATOM 0 HB2 ASP A 28 12.099 -2.201 6.892 1.00 0.00 H new ATOM 0 HB3 ASP A 28 12.160 -0.450 6.940 1.00 0.00 H new ATOM 385 N PRO A 29 9.452 0.547 7.451 1.00 0.00 N ATOM 386 CA PRO A 29 8.403 1.163 6.615 1.00 0.00 C ATOM 387 C PRO A 29 8.623 0.806 5.142 1.00 0.00 C ATOM 388 O PRO A 29 9.718 0.476 4.734 1.00 0.00 O ATOM 389 CB PRO A 29 8.557 2.675 6.828 1.00 0.00 C ATOM 390 CG PRO A 29 9.743 2.896 7.799 1.00 0.00 C ATOM 391 CD PRO A 29 10.239 1.514 8.250 1.00 0.00 C ATOM 0 HA PRO A 29 7.406 0.813 6.883 1.00 0.00 H new ATOM 0 HB2 PRO A 29 8.741 3.178 5.879 1.00 0.00 H new ATOM 0 HB3 PRO A 29 7.641 3.098 7.241 1.00 0.00 H new ATOM 0 HG2 PRO A 29 10.543 3.448 7.306 1.00 0.00 H new ATOM 0 HG3 PRO A 29 9.429 3.489 8.658 1.00 0.00 H new ATOM 0 HD2 PRO A 29 11.308 1.399 8.068 1.00 0.00 H new ATOM 0 HD3 PRO A 29 10.079 1.366 9.318 1.00 0.00 H new ATOM 399 N LYS A 30 7.587 0.876 4.346 1.00 0.00 N ATOM 400 CA LYS A 30 7.722 0.548 2.895 1.00 0.00 C ATOM 401 C LYS A 30 6.977 1.600 2.070 1.00 0.00 C ATOM 402 O LYS A 30 5.844 1.934 2.351 1.00 0.00 O ATOM 403 CB LYS A 30 7.116 -0.833 2.625 1.00 0.00 C ATOM 404 CG LYS A 30 7.767 -1.867 3.549 1.00 0.00 C ATOM 405 CD LYS A 30 7.998 -3.178 2.791 1.00 0.00 C ATOM 406 CE LYS A 30 6.655 -3.765 2.354 1.00 0.00 C ATOM 407 NZ LYS A 30 6.489 -5.121 2.949 1.00 0.00 N ATOM 0 H LYS A 30 6.649 1.148 4.640 1.00 0.00 H new ATOM 0 HA LYS A 30 8.776 0.542 2.617 1.00 0.00 H new ATOM 0 HB2 LYS A 30 6.039 -0.808 2.791 1.00 0.00 H new ATOM 0 HB3 LYS A 30 7.271 -1.112 1.583 1.00 0.00 H new ATOM 0 HG2 LYS A 30 8.715 -1.484 3.926 1.00 0.00 H new ATOM 0 HG3 LYS A 30 7.129 -2.046 4.414 1.00 0.00 H new ATOM 0 HD2 LYS A 30 8.628 -2.999 1.920 1.00 0.00 H new ATOM 0 HD3 LYS A 30 8.527 -3.888 3.427 1.00 0.00 H new ATOM 0 HE2 LYS A 30 5.841 -3.114 2.672 1.00 0.00 H new ATOM 0 HE3 LYS A 30 6.609 -3.825 1.267 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 5.576 -5.521 2.652 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 7.260 -5.739 2.624 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 6.515 -5.051 3.986 1.00 0.00 H new ATOM 421 N ARG A 31 7.606 2.125 1.052 1.00 0.00 N ATOM 422 CA ARG A 31 6.931 3.156 0.214 1.00 0.00 C ATOM 423 C ARG A 31 6.078 2.469 -0.853 1.00 0.00 C ATOM 424 O ARG A 31 6.579 1.743 -1.690 1.00 0.00 O ATOM 425 CB ARG A 31 7.987 4.031 -0.464 1.00 0.00 C ATOM 426 CG ARG A 31 9.076 4.395 0.548 1.00 0.00 C ATOM 427 CD ARG A 31 10.054 5.385 -0.087 1.00 0.00 C ATOM 428 NE ARG A 31 11.431 4.817 -0.047 1.00 0.00 N ATOM 429 CZ ARG A 31 12.374 5.340 -0.782 1.00 0.00 C ATOM 430 NH1 ARG A 31 12.112 6.362 -1.552 1.00 0.00 N ATOM 431 NH2 ARG A 31 13.579 4.841 -0.749 1.00 0.00 N ATOM 0 H ARG A 31 8.555 1.885 0.766 1.00 0.00 H new ATOM 0 HA ARG A 31 6.293 3.776 0.844 1.00 0.00 H new ATOM 0 HB2 ARG A 31 8.425 3.501 -1.310 1.00 0.00 H new ATOM 0 HB3 ARG A 31 7.526 4.936 -0.859 1.00 0.00 H new ATOM 0 HG2 ARG A 31 8.627 4.833 1.440 1.00 0.00 H new ATOM 0 HG3 ARG A 31 9.606 3.497 0.866 1.00 0.00 H new ATOM 0 HD2 ARG A 31 9.763 5.590 -1.117 1.00 0.00 H new ATOM 0 HD3 ARG A 31 10.025 6.335 0.447 1.00 0.00 H new ATOM 0 HE ARG A 31 11.637 4.019 0.555 1.00 0.00 H new ATOM 0 HH11 ARG A 31 11.170 6.752 -1.579 1.00 0.00 H new ATOM 0 HH12 ARG A 31 12.850 6.770 -2.126 1.00 0.00 H new ATOM 0 HH21 ARG A 31 13.784 4.042 -0.149 1.00 0.00 H new ATOM 0 HH22 ARG A 31 14.316 5.250 -1.323 1.00 0.00 H new ATOM 445 N LEU A 32 4.793 2.691 -0.833 1.00 0.00 N ATOM 446 CA LEU A 32 3.908 2.049 -1.847 1.00 0.00 C ATOM 447 C LEU A 32 3.890 2.900 -3.118 1.00 0.00 C ATOM 448 O LEU A 32 3.171 3.874 -3.216 1.00 0.00 O ATOM 449 CB LEU A 32 2.489 1.938 -1.288 1.00 0.00 C ATOM 450 CG LEU A 32 2.541 1.354 0.124 1.00 0.00 C ATOM 451 CD1 LEU A 32 1.116 1.140 0.641 1.00 0.00 C ATOM 452 CD2 LEU A 32 3.277 0.013 0.094 1.00 0.00 C ATOM 0 H LEU A 32 4.317 3.289 -0.158 1.00 0.00 H new ATOM 0 HA LEU A 32 4.285 1.053 -2.081 1.00 0.00 H new ATOM 0 HB2 LEU A 32 2.016 2.920 -1.270 1.00 0.00 H new ATOM 0 HB3 LEU A 32 1.881 1.304 -1.933 1.00 0.00 H new ATOM 0 HG LEU A 32 3.068 2.044 0.783 1.00 0.00 H new ATOM 0 HD11 LEU A 32 1.153 0.724 1.648 1.00 0.00 H new ATOM 0 HD12 LEU A 32 0.589 2.094 0.662 1.00 0.00 H new ATOM 0 HD13 LEU A 32 0.590 0.450 -0.018 1.00 0.00 H new ATOM 0 HD21 LEU A 32 3.315 -0.404 1.100 1.00 0.00 H new ATOM 0 HD22 LEU A 32 2.750 -0.677 -0.565 1.00 0.00 H new ATOM 0 HD23 LEU A 32 4.292 0.163 -0.275 1.00 0.00 H new ATOM 464 N TYR A 33 4.678 2.538 -4.094 1.00 0.00 N ATOM 465 CA TYR A 33 4.708 3.323 -5.359 1.00 0.00 C ATOM 466 C TYR A 33 3.730 2.709 -6.364 1.00 0.00 C ATOM 467 O TYR A 33 3.878 1.576 -6.777 1.00 0.00 O ATOM 468 CB TYR A 33 6.123 3.293 -5.942 1.00 0.00 C ATOM 469 CG TYR A 33 6.105 3.865 -7.341 1.00 0.00 C ATOM 470 CD1 TYR A 33 5.748 5.204 -7.542 1.00 0.00 C ATOM 471 CD2 TYR A 33 6.445 3.058 -8.434 1.00 0.00 C ATOM 472 CE1 TYR A 33 5.731 5.736 -8.838 1.00 0.00 C ATOM 473 CE2 TYR A 33 6.427 3.591 -9.729 1.00 0.00 C ATOM 474 CZ TYR A 33 6.070 4.930 -9.930 1.00 0.00 C ATOM 475 OH TYR A 33 6.053 5.455 -11.206 1.00 0.00 O ATOM 0 H TYR A 33 5.302 1.732 -4.069 1.00 0.00 H new ATOM 0 HA TYR A 33 4.419 4.354 -5.155 1.00 0.00 H new ATOM 0 HB2 TYR A 33 6.800 3.869 -5.311 1.00 0.00 H new ATOM 0 HB3 TYR A 33 6.498 2.270 -5.961 1.00 0.00 H new ATOM 0 HD1 TYR A 33 5.486 5.826 -6.699 1.00 0.00 H new ATOM 0 HD2 TYR A 33 6.721 2.025 -8.278 1.00 0.00 H new ATOM 0 HE1 TYR A 33 5.456 6.769 -8.994 1.00 0.00 H new ATOM 0 HE2 TYR A 33 6.688 2.969 -10.573 1.00 0.00 H new ATOM 0 HH TYR A 33 6.315 4.763 -11.848 1.00 0.00 H new ATOM 485 N CYS A 34 2.731 3.449 -6.760 1.00 0.00 N ATOM 486 CA CYS A 34 1.744 2.908 -7.738 1.00 0.00 C ATOM 487 C CYS A 34 2.282 3.092 -9.158 1.00 0.00 C ATOM 488 O CYS A 34 2.241 4.173 -9.713 1.00 0.00 O ATOM 489 CB CYS A 34 0.418 3.658 -7.592 1.00 0.00 C ATOM 490 SG CYS A 34 -0.902 2.707 -8.384 1.00 0.00 S ATOM 0 H CYS A 34 2.555 4.404 -6.449 1.00 0.00 H new ATOM 0 HA CYS A 34 1.584 1.847 -7.545 1.00 0.00 H new ATOM 0 HB2 CYS A 34 0.188 3.811 -6.537 1.00 0.00 H new ATOM 0 HB3 CYS A 34 0.494 4.645 -8.048 1.00 0.00 H new ATOM 0 HG CYS A 34 -2.029 3.342 -8.259 1.00 0.00 H new ATOM 496 N LYS A 35 2.784 2.044 -9.753 1.00 0.00 N ATOM 497 CA LYS A 35 3.323 2.159 -11.136 1.00 0.00 C ATOM 498 C LYS A 35 2.245 2.733 -12.057 1.00 0.00 C ATOM 499 O LYS A 35 2.535 3.373 -13.048 1.00 0.00 O ATOM 500 CB LYS A 35 3.740 0.771 -11.631 1.00 0.00 C ATOM 501 CG LYS A 35 4.132 0.842 -13.110 1.00 0.00 C ATOM 502 CD LYS A 35 2.997 0.275 -13.970 1.00 0.00 C ATOM 503 CE LYS A 35 3.193 0.706 -15.424 1.00 0.00 C ATOM 504 NZ LYS A 35 3.211 2.194 -15.504 1.00 0.00 N ATOM 0 H LYS A 35 2.844 1.113 -9.340 1.00 0.00 H new ATOM 0 HA LYS A 35 4.188 2.822 -11.140 1.00 0.00 H new ATOM 0 HB2 LYS A 35 4.579 0.401 -11.041 1.00 0.00 H new ATOM 0 HB3 LYS A 35 2.920 0.066 -11.496 1.00 0.00 H new ATOM 0 HG2 LYS A 35 4.336 1.875 -13.394 1.00 0.00 H new ATOM 0 HG3 LYS A 35 5.049 0.278 -13.281 1.00 0.00 H new ATOM 0 HD2 LYS A 35 2.983 -0.813 -13.901 1.00 0.00 H new ATOM 0 HD3 LYS A 35 2.035 0.630 -13.601 1.00 0.00 H new ATOM 0 HE2 LYS A 35 4.127 0.299 -15.812 1.00 0.00 H new ATOM 0 HE3 LYS A 35 2.390 0.308 -16.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 2.647 2.505 -16.321 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 2.808 2.593 -14.633 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 4.191 2.524 -15.615 1.00 0.00 H new ATOM 518 N ASN A 36 1.000 2.508 -11.739 1.00 0.00 N ATOM 519 CA ASN A 36 -0.097 3.038 -12.596 1.00 0.00 C ATOM 520 C ASN A 36 -0.276 4.535 -12.335 1.00 0.00 C ATOM 521 O ASN A 36 -0.846 4.939 -11.340 1.00 0.00 O ATOM 522 CB ASN A 36 -1.396 2.300 -12.269 1.00 0.00 C ATOM 523 CG ASN A 36 -1.141 0.792 -12.285 1.00 0.00 C ATOM 524 OD1 ASN A 36 -0.979 0.181 -11.248 1.00 0.00 O ATOM 525 ND2 ASN A 36 -1.097 0.161 -13.427 1.00 0.00 N ATOM 0 H ASN A 36 0.695 1.979 -10.922 1.00 0.00 H new ATOM 0 HA ASN A 36 0.154 2.885 -13.646 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -1.765 2.607 -11.291 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -2.166 2.557 -12.996 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -0.927 -0.844 -13.448 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -1.233 0.673 -14.298 1.00 0.00 H new ATOM 532 N GLY A 37 0.205 5.362 -13.224 1.00 0.00 N ATOM 533 CA GLY A 37 0.065 6.833 -13.032 1.00 0.00 C ATOM 534 C GLY A 37 1.136 7.330 -12.060 1.00 0.00 C ATOM 535 O GLY A 37 1.164 8.487 -11.690 1.00 0.00 O ATOM 0 H GLY A 37 0.690 5.081 -14.076 1.00 0.00 H new ATOM 0 HA2 GLY A 37 0.163 7.345 -13.989 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -0.927 7.066 -12.645 1.00 0.00 H new ATOM 539 N GLY A 38 2.022 6.467 -11.645 1.00 0.00 N ATOM 540 CA GLY A 38 3.092 6.893 -10.699 1.00 0.00 C ATOM 541 C GLY A 38 2.477 7.707 -9.559 1.00 0.00 C ATOM 542 O GLY A 38 2.444 8.921 -9.600 1.00 0.00 O ATOM 0 H GLY A 38 2.051 5.485 -11.920 1.00 0.00 H new ATOM 0 HA2 GLY A 38 3.606 6.019 -10.299 1.00 0.00 H new ATOM 0 HA3 GLY A 38 3.838 7.490 -11.224 1.00 0.00 H new ATOM 546 N PHE A 39 1.990 7.047 -8.541 1.00 0.00 N ATOM 547 CA PHE A 39 1.377 7.781 -7.397 1.00 0.00 C ATOM 548 C PHE A 39 1.711 7.060 -6.089 1.00 0.00 C ATOM 549 O PHE A 39 1.579 5.858 -5.980 1.00 0.00 O ATOM 550 CB PHE A 39 -0.142 7.828 -7.574 1.00 0.00 C ATOM 551 CG PHE A 39 -0.501 8.891 -8.584 1.00 0.00 C ATOM 552 CD1 PHE A 39 -0.572 10.234 -8.192 1.00 0.00 C ATOM 553 CD2 PHE A 39 -0.763 8.534 -9.912 1.00 0.00 C ATOM 554 CE1 PHE A 39 -0.905 11.219 -9.130 1.00 0.00 C ATOM 555 CE2 PHE A 39 -1.096 9.519 -10.849 1.00 0.00 C ATOM 556 CZ PHE A 39 -1.168 10.862 -10.458 1.00 0.00 C ATOM 0 H PHE A 39 1.991 6.031 -8.453 1.00 0.00 H new ATOM 0 HA PHE A 39 1.773 8.796 -7.366 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -0.510 6.857 -7.906 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -0.623 8.042 -6.620 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -0.370 10.509 -7.167 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -0.708 7.498 -10.214 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -0.959 12.255 -8.829 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -1.297 9.243 -11.874 1.00 0.00 H new ATOM 0 HZ PHE A 39 -1.426 11.622 -11.181 1.00 0.00 H new ATOM 566 N PHE A 40 2.143 7.787 -5.095 1.00 0.00 N ATOM 567 CA PHE A 40 2.484 7.144 -3.794 1.00 0.00 C ATOM 568 C PHE A 40 1.265 7.189 -2.869 1.00 0.00 C ATOM 569 O PHE A 40 0.667 8.227 -2.667 1.00 0.00 O ATOM 570 CB PHE A 40 3.645 7.898 -3.141 1.00 0.00 C ATOM 571 CG PHE A 40 4.891 7.727 -3.977 1.00 0.00 C ATOM 572 CD1 PHE A 40 5.092 8.527 -5.107 1.00 0.00 C ATOM 573 CD2 PHE A 40 5.845 6.767 -3.620 1.00 0.00 C ATOM 574 CE1 PHE A 40 6.246 8.369 -5.882 1.00 0.00 C ATOM 575 CE2 PHE A 40 7.001 6.608 -4.395 1.00 0.00 C ATOM 576 CZ PHE A 40 7.202 7.409 -5.526 1.00 0.00 C ATOM 0 H PHE A 40 2.275 8.798 -5.127 1.00 0.00 H new ATOM 0 HA PHE A 40 2.774 6.107 -3.966 1.00 0.00 H new ATOM 0 HB2 PHE A 40 3.399 8.956 -3.048 1.00 0.00 H new ATOM 0 HB3 PHE A 40 3.816 7.521 -2.133 1.00 0.00 H new ATOM 0 HD1 PHE A 40 4.355 9.268 -5.381 1.00 0.00 H new ATOM 0 HD2 PHE A 40 5.690 6.149 -2.748 1.00 0.00 H new ATOM 0 HE1 PHE A 40 6.400 8.987 -6.754 1.00 0.00 H new ATOM 0 HE2 PHE A 40 7.738 5.867 -4.120 1.00 0.00 H new ATOM 0 HZ PHE A 40 8.093 7.287 -6.123 1.00 0.00 H new ATOM 586 N LEU A 41 0.892 6.073 -2.306 1.00 0.00 N ATOM 587 CA LEU A 41 -0.289 6.057 -1.396 1.00 0.00 C ATOM 588 C LEU A 41 -0.027 6.992 -0.213 1.00 0.00 C ATOM 589 O LEU A 41 1.076 7.079 0.289 1.00 0.00 O ATOM 590 CB LEU A 41 -0.520 4.630 -0.886 1.00 0.00 C ATOM 591 CG LEU A 41 -1.786 4.578 -0.019 1.00 0.00 C ATOM 592 CD1 LEU A 41 -3.013 4.944 -0.859 1.00 0.00 C ATOM 593 CD2 LEU A 41 -1.960 3.162 0.536 1.00 0.00 C ATOM 0 H LEU A 41 1.353 5.172 -2.436 1.00 0.00 H new ATOM 0 HA LEU A 41 -1.174 6.394 -1.936 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -0.619 3.946 -1.729 1.00 0.00 H new ATOM 0 HB3 LEU A 41 0.341 4.299 -0.306 1.00 0.00 H new ATOM 0 HG LEU A 41 -1.687 5.290 0.800 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -3.906 4.904 -0.235 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -2.894 5.951 -1.258 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -3.114 4.237 -1.683 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -2.858 3.121 1.152 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -2.054 2.457 -0.290 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -1.092 2.899 1.141 1.00 0.00 H new ATOM 605 N ARG A 42 -1.033 7.693 0.236 1.00 0.00 N ATOM 606 CA ARG A 42 -0.841 8.622 1.385 1.00 0.00 C ATOM 607 C ARG A 42 -2.122 8.673 2.222 1.00 0.00 C ATOM 608 O ARG A 42 -3.156 9.116 1.763 1.00 0.00 O ATOM 609 CB ARG A 42 -0.519 10.023 0.861 1.00 0.00 C ATOM 610 CG ARG A 42 -0.161 10.938 2.034 1.00 0.00 C ATOM 611 CD ARG A 42 0.131 12.347 1.514 1.00 0.00 C ATOM 612 NE ARG A 42 -0.040 13.330 2.620 1.00 0.00 N ATOM 613 CZ ARG A 42 0.429 14.541 2.497 1.00 0.00 C ATOM 614 NH1 ARG A 42 1.046 14.892 1.401 1.00 0.00 N ATOM 615 NH2 ARG A 42 0.282 15.400 3.467 1.00 0.00 N ATOM 0 H ARG A 42 -1.979 7.662 -0.144 1.00 0.00 H new ATOM 0 HA ARG A 42 -0.017 8.267 2.004 1.00 0.00 H new ATOM 0 HB2 ARG A 42 0.311 9.977 0.156 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -1.375 10.426 0.320 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -0.982 10.966 2.750 1.00 0.00 H new ATOM 0 HG3 ARG A 42 0.709 10.547 2.562 1.00 0.00 H new ATOM 0 HD2 ARG A 42 1.147 12.398 1.122 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -0.541 12.589 0.691 1.00 0.00 H new ATOM 0 HE ARG A 42 -0.524 13.056 3.475 1.00 0.00 H new ATOM 0 HH11 ARG A 42 1.161 14.220 0.643 1.00 0.00 H new ATOM 0 HH12 ARG A 42 1.413 15.839 1.303 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -0.200 15.125 4.323 1.00 0.00 H new ATOM 0 HH22 ARG A 42 0.649 16.347 3.370 1.00 0.00 H new ATOM 629 N ILE A 43 -2.061 8.226 3.446 1.00 0.00 N ATOM 630 CA ILE A 43 -3.275 8.253 4.309 1.00 0.00 C ATOM 631 C ILE A 43 -3.319 9.575 5.078 1.00 0.00 C ATOM 632 O ILE A 43 -2.468 9.857 5.898 1.00 0.00 O ATOM 633 CB ILE A 43 -3.225 7.090 5.299 1.00 0.00 C ATOM 634 CG1 ILE A 43 -3.241 5.765 4.532 1.00 0.00 C ATOM 635 CG2 ILE A 43 -4.441 7.155 6.225 1.00 0.00 C ATOM 636 CD1 ILE A 43 -2.608 4.669 5.390 1.00 0.00 C ATOM 0 H ILE A 43 -1.224 7.844 3.885 1.00 0.00 H new ATOM 0 HA ILE A 43 -4.166 8.161 3.688 1.00 0.00 H new ATOM 0 HB ILE A 43 -2.312 7.157 5.891 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -4.265 5.494 4.275 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -2.694 5.869 3.595 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -4.405 6.325 6.931 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -4.432 8.098 6.772 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -5.353 7.088 5.633 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -2.620 3.726 4.843 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -1.578 4.940 5.624 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -3.174 4.559 6.315 1.00 0.00 H new ATOM 648 N HIS A 44 -4.306 10.388 4.819 1.00 0.00 N ATOM 649 CA HIS A 44 -4.403 11.691 5.534 1.00 0.00 C ATOM 650 C HIS A 44 -4.899 11.439 6.972 1.00 0.00 C ATOM 651 O HIS A 44 -5.609 10.479 7.200 1.00 0.00 O ATOM 652 CB HIS A 44 -5.399 12.587 4.793 1.00 0.00 C ATOM 653 CG HIS A 44 -4.734 13.171 3.577 1.00 0.00 C ATOM 654 ND1 HIS A 44 -3.615 13.985 3.663 1.00 0.00 N ATOM 655 CD2 HIS A 44 -5.017 13.065 2.236 1.00 0.00 C ATOM 656 CE1 HIS A 44 -3.268 14.332 2.410 1.00 0.00 C ATOM 657 NE2 HIS A 44 -4.090 13.800 1.503 1.00 0.00 N ATOM 0 H HIS A 44 -5.049 10.206 4.144 1.00 0.00 H new ATOM 0 HA HIS A 44 -3.428 12.178 5.568 1.00 0.00 H new ATOM 0 HB2 HIS A 44 -6.276 12.010 4.500 1.00 0.00 H new ATOM 0 HB3 HIS A 44 -5.747 13.384 5.450 1.00 0.00 H new ATOM 0 HD2 HIS A 44 -5.834 12.498 1.815 1.00 0.00 H new ATOM 0 HE1 HIS A 44 -2.427 14.964 2.168 1.00 0.00 H new ATOM 0 HE2 HIS A 44 -4.048 13.909 0.490 1.00 0.00 H new ATOM 665 N PRO A 45 -4.531 12.294 7.912 1.00 0.00 N ATOM 666 CA PRO A 45 -4.970 12.128 9.310 1.00 0.00 C ATOM 667 C PRO A 45 -6.499 12.069 9.388 1.00 0.00 C ATOM 668 O PRO A 45 -7.060 11.453 10.272 1.00 0.00 O ATOM 669 CB PRO A 45 -4.440 13.367 10.045 1.00 0.00 C ATOM 670 CG PRO A 45 -3.659 14.225 9.018 1.00 0.00 C ATOM 671 CD PRO A 45 -3.670 13.475 7.678 1.00 0.00 C ATOM 0 HA PRO A 45 -4.597 11.203 9.749 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -5.263 13.939 10.474 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -3.791 13.074 10.871 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -4.120 15.207 8.911 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -2.636 14.389 9.356 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -4.066 14.101 6.878 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -2.664 13.178 7.383 1.00 0.00 H new ATOM 679 N ASP A 46 -7.177 12.706 8.473 1.00 0.00 N ATOM 680 CA ASP A 46 -8.667 12.683 8.503 1.00 0.00 C ATOM 681 C ASP A 46 -9.169 11.333 7.986 1.00 0.00 C ATOM 682 O ASP A 46 -10.355 11.109 7.854 1.00 0.00 O ATOM 683 CB ASP A 46 -9.217 13.804 7.617 1.00 0.00 C ATOM 684 CG ASP A 46 -8.410 13.873 6.320 1.00 0.00 C ATOM 685 OD1 ASP A 46 -7.982 12.830 5.855 1.00 0.00 O ATOM 686 OD2 ASP A 46 -8.235 14.969 5.813 1.00 0.00 O ATOM 0 H ASP A 46 -6.765 13.240 7.708 1.00 0.00 H new ATOM 0 HA ASP A 46 -9.009 12.830 9.528 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -10.268 13.623 7.394 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -9.162 14.757 8.143 1.00 0.00 H new ATOM 691 N GLY A 47 -8.274 10.427 7.695 1.00 0.00 N ATOM 692 CA GLY A 47 -8.702 9.092 7.188 1.00 0.00 C ATOM 693 C GLY A 47 -8.792 9.127 5.662 1.00 0.00 C ATOM 694 O GLY A 47 -8.565 8.136 4.996 1.00 0.00 O ATOM 0 H GLY A 47 -7.266 10.554 7.787 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -7.992 8.327 7.503 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -9.669 8.823 7.613 1.00 0.00 H new ATOM 698 N ARG A 48 -9.125 10.258 5.103 1.00 0.00 N ATOM 699 CA ARG A 48 -9.230 10.353 3.619 1.00 0.00 C ATOM 700 C ARG A 48 -7.999 9.709 2.977 1.00 0.00 C ATOM 701 O ARG A 48 -6.890 10.181 3.131 1.00 0.00 O ATOM 702 CB ARG A 48 -9.309 11.825 3.208 1.00 0.00 C ATOM 703 CG ARG A 48 -10.580 12.451 3.785 1.00 0.00 C ATOM 704 CD ARG A 48 -11.721 12.315 2.775 1.00 0.00 C ATOM 705 NE ARG A 48 -11.396 13.095 1.548 1.00 0.00 N ATOM 706 CZ ARG A 48 -12.062 12.883 0.446 1.00 0.00 C ATOM 707 NH1 ARG A 48 -13.009 11.986 0.417 1.00 0.00 N ATOM 708 NH2 ARG A 48 -11.782 13.569 -0.629 1.00 0.00 N ATOM 0 H ARG A 48 -9.329 11.120 5.609 1.00 0.00 H new ATOM 0 HA ARG A 48 -10.127 9.833 3.284 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -8.431 12.361 3.569 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -9.310 11.910 2.121 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -10.848 11.959 4.720 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -10.408 13.502 4.015 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -11.873 11.266 2.522 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -12.652 12.676 3.212 1.00 0.00 H new ATOM 0 HE ARG A 48 -10.654 13.794 1.569 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -13.229 11.450 1.256 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -13.529 11.821 -0.445 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -11.042 14.271 -0.608 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -12.303 13.403 -1.490 1.00 0.00 H new ATOM 722 N VAL A 49 -8.186 8.636 2.258 1.00 0.00 N ATOM 723 CA VAL A 49 -7.026 7.965 1.606 1.00 0.00 C ATOM 724 C VAL A 49 -6.863 8.495 0.181 1.00 0.00 C ATOM 725 O VAL A 49 -7.803 8.534 -0.588 1.00 0.00 O ATOM 726 CB VAL A 49 -7.268 6.455 1.562 1.00 0.00 C ATOM 727 CG1 VAL A 49 -6.030 5.755 1.000 1.00 0.00 C ATOM 728 CG2 VAL A 49 -7.545 5.943 2.978 1.00 0.00 C ATOM 0 H VAL A 49 -9.091 8.195 2.094 1.00 0.00 H new ATOM 0 HA VAL A 49 -6.121 8.172 2.177 1.00 0.00 H new ATOM 0 HB VAL A 49 -8.125 6.243 0.923 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -6.203 4.679 0.969 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -5.832 6.120 -0.008 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -5.172 5.966 1.638 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -7.718 4.867 2.949 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -6.687 6.156 3.616 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -8.428 6.441 3.379 1.00 0.00 H new ATOM 738 N ASP A 50 -5.678 8.904 -0.178 1.00 0.00 N ATOM 739 CA ASP A 50 -5.457 9.431 -1.554 1.00 0.00 C ATOM 740 C ASP A 50 -3.984 9.270 -1.931 1.00 0.00 C ATOM 741 O ASP A 50 -3.109 9.306 -1.089 1.00 0.00 O ATOM 742 CB ASP A 50 -5.835 10.913 -1.599 1.00 0.00 C ATOM 743 CG ASP A 50 -4.879 11.710 -0.709 1.00 0.00 C ATOM 744 OD1 ASP A 50 -4.384 11.143 0.251 1.00 0.00 O ATOM 745 OD2 ASP A 50 -4.657 12.873 -1.004 1.00 0.00 O ATOM 0 H ASP A 50 -4.853 8.896 0.422 1.00 0.00 H new ATOM 0 HA ASP A 50 -6.076 8.876 -2.259 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -5.787 11.281 -2.624 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -6.862 11.048 -1.260 1.00 0.00 H new ATOM 750 N GLY A 51 -3.703 9.094 -3.194 1.00 0.00 N ATOM 751 CA GLY A 51 -2.286 8.931 -3.627 1.00 0.00 C ATOM 752 C GLY A 51 -1.717 10.293 -4.026 1.00 0.00 C ATOM 753 O GLY A 51 -2.442 11.196 -4.395 1.00 0.00 O ATOM 0 H GLY A 51 -4.393 9.056 -3.944 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -1.695 8.500 -2.819 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -2.228 8.240 -4.468 1.00 0.00 H new ATOM 757 N VAL A 52 -0.423 10.449 -3.957 1.00 0.00 N ATOM 758 CA VAL A 52 0.193 11.753 -4.332 1.00 0.00 C ATOM 759 C VAL A 52 1.564 11.506 -4.963 1.00 0.00 C ATOM 760 O VAL A 52 2.218 10.519 -4.685 1.00 0.00 O ATOM 761 CB VAL A 52 0.356 12.620 -3.082 1.00 0.00 C ATOM 762 CG1 VAL A 52 -1.014 12.861 -2.446 1.00 0.00 C ATOM 763 CG2 VAL A 52 1.263 11.902 -2.081 1.00 0.00 C ATOM 0 H VAL A 52 0.234 9.729 -3.657 1.00 0.00 H new ATOM 0 HA VAL A 52 -0.450 12.265 -5.048 1.00 0.00 H new ATOM 0 HB VAL A 52 0.801 13.576 -3.357 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -0.898 13.479 -1.555 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -1.662 13.371 -3.159 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -1.460 11.906 -2.169 1.00 0.00 H new ATOM 0 HG21 VAL A 52 1.381 12.518 -1.190 1.00 0.00 H new ATOM 0 HG22 VAL A 52 0.816 10.947 -1.806 1.00 0.00 H new ATOM 0 HG23 VAL A 52 2.239 11.729 -2.534 1.00 0.00 H new ATOM 773 N ARG A 53 2.006 12.392 -5.812 1.00 0.00 N ATOM 774 CA ARG A 53 3.334 12.207 -6.462 1.00 0.00 C ATOM 775 C ARG A 53 4.437 12.697 -5.521 1.00 0.00 C ATOM 776 O ARG A 53 5.606 12.451 -5.739 1.00 0.00 O ATOM 777 CB ARG A 53 3.380 13.007 -7.765 1.00 0.00 C ATOM 778 CG ARG A 53 2.353 12.439 -8.748 1.00 0.00 C ATOM 779 CD ARG A 53 2.624 12.992 -10.148 1.00 0.00 C ATOM 780 NE ARG A 53 2.416 14.469 -10.147 1.00 0.00 N ATOM 781 CZ ARG A 53 2.869 15.192 -11.135 1.00 0.00 C ATOM 782 NH1 ARG A 53 3.500 14.624 -12.126 1.00 0.00 N ATOM 783 NH2 ARG A 53 2.688 16.484 -11.133 1.00 0.00 N ATOM 0 H ARG A 53 1.504 13.237 -6.084 1.00 0.00 H new ATOM 0 HA ARG A 53 3.487 11.150 -6.680 1.00 0.00 H new ATOM 0 HB2 ARG A 53 3.168 14.058 -7.567 1.00 0.00 H new ATOM 0 HB3 ARG A 53 4.379 12.960 -8.198 1.00 0.00 H new ATOM 0 HG2 ARG A 53 2.408 11.350 -8.759 1.00 0.00 H new ATOM 0 HG3 ARG A 53 1.345 12.704 -8.430 1.00 0.00 H new ATOM 0 HD2 ARG A 53 3.644 12.758 -10.452 1.00 0.00 H new ATOM 0 HD3 ARG A 53 1.959 12.521 -10.872 1.00 0.00 H new ATOM 0 HE ARG A 53 1.920 14.914 -9.375 1.00 0.00 H new ATOM 0 HH11 ARG A 53 3.640 13.614 -12.129 1.00 0.00 H new ATOM 0 HH12 ARG A 53 3.853 15.190 -12.897 1.00 0.00 H new ATOM 0 HH21 ARG A 53 2.193 16.928 -10.360 1.00 0.00 H new ATOM 0 HH22 ARG A 53 3.042 17.050 -11.905 1.00 0.00 H new ATOM 797 N GLU A 54 4.075 13.388 -4.475 1.00 0.00 N ATOM 798 CA GLU A 54 5.104 13.891 -3.521 1.00 0.00 C ATOM 799 C GLU A 54 5.767 12.706 -2.817 1.00 0.00 C ATOM 800 O GLU A 54 5.217 12.128 -1.900 1.00 0.00 O ATOM 801 CB GLU A 54 4.439 14.795 -2.482 1.00 0.00 C ATOM 802 CG GLU A 54 5.448 15.831 -1.985 1.00 0.00 C ATOM 803 CD GLU A 54 5.576 16.954 -3.015 1.00 0.00 C ATOM 804 OE1 GLU A 54 4.651 17.742 -3.122 1.00 0.00 O ATOM 805 OE2 GLU A 54 6.597 17.007 -3.681 1.00 0.00 O ATOM 0 H GLU A 54 3.112 13.626 -4.240 1.00 0.00 H new ATOM 0 HA GLU A 54 5.858 14.459 -4.066 1.00 0.00 H new ATOM 0 HB2 GLU A 54 3.575 15.295 -2.919 1.00 0.00 H new ATOM 0 HB3 GLU A 54 4.073 14.198 -1.646 1.00 0.00 H new ATOM 0 HG2 GLU A 54 5.126 16.237 -1.026 1.00 0.00 H new ATOM 0 HG3 GLU A 54 6.418 15.361 -1.822 1.00 0.00 H new ATOM 812 N LYS A 55 6.946 12.336 -3.238 1.00 0.00 N ATOM 813 CA LYS A 55 7.642 11.188 -2.592 1.00 0.00 C ATOM 814 C LYS A 55 8.400 11.676 -1.356 1.00 0.00 C ATOM 815 O LYS A 55 8.969 10.897 -0.617 1.00 0.00 O ATOM 816 CB LYS A 55 8.631 10.568 -3.583 1.00 0.00 C ATOM 817 CG LYS A 55 9.022 11.609 -4.633 1.00 0.00 C ATOM 818 CD LYS A 55 10.318 11.177 -5.322 1.00 0.00 C ATOM 819 CE LYS A 55 11.514 11.806 -4.605 1.00 0.00 C ATOM 820 NZ LYS A 55 11.706 13.202 -5.091 1.00 0.00 N ATOM 0 H LYS A 55 7.457 12.779 -4.001 1.00 0.00 H new ATOM 0 HA LYS A 55 6.906 10.441 -2.294 1.00 0.00 H new ATOM 0 HB2 LYS A 55 9.518 10.217 -3.056 1.00 0.00 H new ATOM 0 HB3 LYS A 55 8.182 9.700 -4.066 1.00 0.00 H new ATOM 0 HG2 LYS A 55 8.225 11.716 -5.369 1.00 0.00 H new ATOM 0 HG3 LYS A 55 9.155 12.583 -4.163 1.00 0.00 H new ATOM 0 HD2 LYS A 55 10.404 10.090 -5.309 1.00 0.00 H new ATOM 0 HD3 LYS A 55 10.306 11.484 -6.368 1.00 0.00 H new ATOM 0 HE2 LYS A 55 11.348 11.804 -3.528 1.00 0.00 H new ATOM 0 HE3 LYS A 55 12.413 11.218 -4.790 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 12.519 13.630 -4.604 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 11.882 13.192 -6.116 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 10.851 13.759 -4.893 1.00 0.00 H new ATOM 834 N SER A 56 8.413 12.961 -1.123 1.00 0.00 N ATOM 835 CA SER A 56 9.134 13.492 0.067 1.00 0.00 C ATOM 836 C SER A 56 8.173 13.571 1.254 1.00 0.00 C ATOM 837 O SER A 56 8.583 13.617 2.396 1.00 0.00 O ATOM 838 CB SER A 56 9.674 14.889 -0.246 1.00 0.00 C ATOM 839 OG SER A 56 9.018 15.397 -1.400 1.00 0.00 O ATOM 0 H SER A 56 7.956 13.664 -1.704 1.00 0.00 H new ATOM 0 HA SER A 56 9.963 12.829 0.315 1.00 0.00 H new ATOM 0 HB2 SER A 56 9.510 15.554 0.602 1.00 0.00 H new ATOM 0 HB3 SER A 56 10.750 14.847 -0.414 1.00 0.00 H new ATOM 0 HG SER A 56 9.360 16.293 -1.603 1.00 0.00 H new ATOM 845 N ASP A 57 6.894 13.583 0.992 1.00 0.00 N ATOM 846 CA ASP A 57 5.903 13.657 2.102 1.00 0.00 C ATOM 847 C ASP A 57 6.213 12.551 3.137 1.00 0.00 C ATOM 848 O ASP A 57 6.057 11.388 2.820 1.00 0.00 O ATOM 849 CB ASP A 57 4.503 13.418 1.530 1.00 0.00 C ATOM 850 CG ASP A 57 3.715 14.728 1.548 1.00 0.00 C ATOM 851 OD1 ASP A 57 3.284 15.122 2.619 1.00 0.00 O ATOM 852 OD2 ASP A 57 3.555 15.316 0.490 1.00 0.00 O ATOM 0 H ASP A 57 6.493 13.545 0.055 1.00 0.00 H new ATOM 0 HA ASP A 57 5.955 14.636 2.579 1.00 0.00 H new ATOM 0 HB2 ASP A 57 4.575 13.038 0.511 1.00 0.00 H new ATOM 0 HB3 ASP A 57 3.983 12.660 2.117 1.00 0.00 H new ATOM 857 N PRO A 58 6.645 12.903 4.342 1.00 0.00 N ATOM 858 CA PRO A 58 6.957 11.878 5.359 1.00 0.00 C ATOM 859 C PRO A 58 5.696 11.084 5.711 1.00 0.00 C ATOM 860 O PRO A 58 5.708 10.233 6.580 1.00 0.00 O ATOM 861 CB PRO A 58 7.458 12.660 6.580 1.00 0.00 C ATOM 862 CG PRO A 58 7.417 14.166 6.224 1.00 0.00 C ATOM 863 CD PRO A 58 6.861 14.296 4.798 1.00 0.00 C ATOM 0 HA PRO A 58 7.698 11.161 5.006 1.00 0.00 H new ATOM 0 HB2 PRO A 58 6.832 12.455 7.448 1.00 0.00 H new ATOM 0 HB3 PRO A 58 8.472 12.356 6.839 1.00 0.00 H new ATOM 0 HG2 PRO A 58 6.788 14.709 6.930 1.00 0.00 H new ATOM 0 HG3 PRO A 58 8.415 14.601 6.286 1.00 0.00 H new ATOM 0 HD2 PRO A 58 5.930 14.863 4.787 1.00 0.00 H new ATOM 0 HD3 PRO A 58 7.561 14.820 4.148 1.00 0.00 H new ATOM 871 N HIS A 59 4.605 11.355 5.046 1.00 0.00 N ATOM 872 CA HIS A 59 3.346 10.616 5.346 1.00 0.00 C ATOM 873 C HIS A 59 3.301 9.326 4.523 1.00 0.00 C ATOM 874 O HIS A 59 2.521 8.435 4.792 1.00 0.00 O ATOM 875 CB HIS A 59 2.145 11.492 4.986 1.00 0.00 C ATOM 876 CG HIS A 59 1.901 12.486 6.089 1.00 0.00 C ATOM 877 ND1 HIS A 59 2.472 13.749 6.086 1.00 0.00 N ATOM 878 CD2 HIS A 59 1.150 12.417 7.236 1.00 0.00 C ATOM 879 CE1 HIS A 59 2.060 14.382 7.199 1.00 0.00 C ATOM 880 NE2 HIS A 59 1.252 13.616 7.936 1.00 0.00 N ATOM 0 H HIS A 59 4.532 12.056 4.309 1.00 0.00 H new ATOM 0 HA HIS A 59 3.313 10.370 6.407 1.00 0.00 H new ATOM 0 HB2 HIS A 59 2.330 12.013 4.047 1.00 0.00 H new ATOM 0 HB3 HIS A 59 1.261 10.872 4.838 1.00 0.00 H new ATOM 0 HD1 HIS A 59 3.092 14.129 5.370 1.00 0.00 H new ATOM 0 HD2 HIS A 59 0.568 11.562 7.548 1.00 0.00 H new ATOM 0 HE1 HIS A 59 2.348 15.388 7.465 1.00 0.00 H new ATOM 888 N ILE A 60 4.132 9.219 3.521 1.00 0.00 N ATOM 889 CA ILE A 60 4.133 7.986 2.684 1.00 0.00 C ATOM 890 C ILE A 60 4.845 6.858 3.435 1.00 0.00 C ATOM 891 O ILE A 60 4.929 5.742 2.964 1.00 0.00 O ATOM 892 CB ILE A 60 4.863 8.262 1.368 1.00 0.00 C ATOM 893 CG1 ILE A 60 6.352 8.480 1.650 1.00 0.00 C ATOM 894 CG2 ILE A 60 4.280 9.515 0.712 1.00 0.00 C ATOM 895 CD1 ILE A 60 6.997 9.197 0.462 1.00 0.00 C ATOM 0 H ILE A 60 4.809 9.931 3.247 1.00 0.00 H new ATOM 0 HA ILE A 60 3.105 7.690 2.474 1.00 0.00 H new ATOM 0 HB ILE A 60 4.739 7.411 0.698 1.00 0.00 H new ATOM 0 HG12 ILE A 60 6.478 9.071 2.557 1.00 0.00 H new ATOM 0 HG13 ILE A 60 6.844 7.523 1.822 1.00 0.00 H new ATOM 0 HG21 ILE A 60 4.801 9.711 -0.225 1.00 0.00 H new ATOM 0 HG22 ILE A 60 3.219 9.361 0.513 1.00 0.00 H new ATOM 0 HG23 ILE A 60 4.404 10.367 1.381 1.00 0.00 H new ATOM 0 HD11 ILE A 60 8.057 9.352 0.663 1.00 0.00 H new ATOM 0 HD12 ILE A 60 6.883 8.589 -0.436 1.00 0.00 H new ATOM 0 HD13 ILE A 60 6.511 10.161 0.311 1.00 0.00 H new ATOM 907 N LYS A 61 5.357 7.141 4.602 1.00 0.00 N ATOM 908 CA LYS A 61 6.061 6.084 5.382 1.00 0.00 C ATOM 909 C LYS A 61 5.035 5.240 6.139 1.00 0.00 C ATOM 910 O LYS A 61 4.732 5.495 7.288 1.00 0.00 O ATOM 911 CB LYS A 61 7.019 6.738 6.380 1.00 0.00 C ATOM 912 CG LYS A 61 8.023 7.613 5.627 1.00 0.00 C ATOM 913 CD LYS A 61 9.210 7.930 6.539 1.00 0.00 C ATOM 914 CE LYS A 61 10.387 7.023 6.179 1.00 0.00 C ATOM 915 NZ LYS A 61 11.534 7.314 7.085 1.00 0.00 N ATOM 0 H LYS A 61 5.318 8.057 5.048 1.00 0.00 H new ATOM 0 HA LYS A 61 6.625 5.446 4.701 1.00 0.00 H new ATOM 0 HB2 LYS A 61 6.460 7.341 7.095 1.00 0.00 H new ATOM 0 HB3 LYS A 61 7.544 5.972 6.951 1.00 0.00 H new ATOM 0 HG2 LYS A 61 8.368 7.099 4.730 1.00 0.00 H new ATOM 0 HG3 LYS A 61 7.544 8.537 5.302 1.00 0.00 H new ATOM 0 HD2 LYS A 61 9.497 8.976 6.430 1.00 0.00 H new ATOM 0 HD3 LYS A 61 8.930 7.783 7.582 1.00 0.00 H new ATOM 0 HE2 LYS A 61 10.095 5.977 6.269 1.00 0.00 H new ATOM 0 HE3 LYS A 61 10.680 7.184 5.141 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 12.401 7.425 6.522 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 11.347 8.192 7.611 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 11.655 6.528 7.755 1.00 0.00 H new ATOM 929 N LEU A 62 4.495 4.235 5.504 1.00 0.00 N ATOM 930 CA LEU A 62 3.488 3.376 6.187 1.00 0.00 C ATOM 931 C LEU A 62 4.198 2.218 6.890 1.00 0.00 C ATOM 932 O LEU A 62 5.076 1.586 6.335 1.00 0.00 O ATOM 933 CB LEU A 62 2.506 2.821 5.152 1.00 0.00 C ATOM 934 CG LEU A 62 2.166 3.910 4.134 1.00 0.00 C ATOM 935 CD1 LEU A 62 1.018 3.435 3.241 1.00 0.00 C ATOM 936 CD2 LEU A 62 1.745 5.184 4.871 1.00 0.00 C ATOM 0 H LEU A 62 4.708 3.972 4.542 1.00 0.00 H new ATOM 0 HA LEU A 62 2.944 3.968 6.923 1.00 0.00 H new ATOM 0 HB2 LEU A 62 2.943 1.960 4.646 1.00 0.00 H new ATOM 0 HB3 LEU A 62 1.598 2.474 5.646 1.00 0.00 H new ATOM 0 HG LEU A 62 3.042 4.118 3.519 1.00 0.00 H new ATOM 0 HD11 LEU A 62 0.776 4.212 2.516 1.00 0.00 H new ATOM 0 HD12 LEU A 62 1.317 2.528 2.716 1.00 0.00 H new ATOM 0 HD13 LEU A 62 0.142 3.226 3.855 1.00 0.00 H new ATOM 0 HD21 LEU A 62 1.503 5.961 4.146 1.00 0.00 H new ATOM 0 HD22 LEU A 62 0.870 4.976 5.486 1.00 0.00 H new ATOM 0 HD23 LEU A 62 2.563 5.524 5.507 1.00 0.00 H new ATOM 948 N GLN A 63 3.824 1.931 8.107 1.00 0.00 N ATOM 949 CA GLN A 63 4.478 0.813 8.844 1.00 0.00 C ATOM 950 C GLN A 63 3.694 -0.478 8.604 1.00 0.00 C ATOM 951 O GLN A 63 2.600 -0.652 9.101 1.00 0.00 O ATOM 952 CB GLN A 63 4.495 1.130 10.341 1.00 0.00 C ATOM 953 CG GLN A 63 5.184 -0.007 11.098 1.00 0.00 C ATOM 954 CD GLN A 63 5.581 0.476 12.494 1.00 0.00 C ATOM 955 OE1 GLN A 63 5.311 1.603 12.860 1.00 0.00 O ATOM 956 NE2 GLN A 63 6.216 -0.334 13.295 1.00 0.00 N ATOM 0 H GLN A 63 3.094 2.422 8.623 1.00 0.00 H new ATOM 0 HA GLN A 63 5.501 0.690 8.489 1.00 0.00 H new ATOM 0 HB2 GLN A 63 5.020 2.069 10.518 1.00 0.00 H new ATOM 0 HB3 GLN A 63 3.477 1.260 10.707 1.00 0.00 H new ATOM 0 HG2 GLN A 63 4.515 -0.864 11.175 1.00 0.00 H new ATOM 0 HG3 GLN A 63 6.067 -0.339 10.552 1.00 0.00 H new ATOM 0 HE21 GLN A 63 6.443 -1.280 12.989 1.00 0.00 H new ATOM 0 HE22 GLN A 63 6.486 -0.021 14.228 1.00 0.00 H new ATOM 965 N LEU A 64 4.245 -1.385 7.843 1.00 0.00 N ATOM 966 CA LEU A 64 3.530 -2.663 7.569 1.00 0.00 C ATOM 967 C LEU A 64 3.978 -3.729 8.569 1.00 0.00 C ATOM 968 O LEU A 64 5.101 -3.725 9.033 1.00 0.00 O ATOM 969 CB LEU A 64 3.846 -3.132 6.147 1.00 0.00 C ATOM 970 CG LEU A 64 2.977 -2.360 5.152 1.00 0.00 C ATOM 971 CD1 LEU A 64 3.288 -0.866 5.254 1.00 0.00 C ATOM 972 CD2 LEU A 64 3.273 -2.845 3.730 1.00 0.00 C ATOM 0 H LEU A 64 5.159 -1.295 7.400 1.00 0.00 H new ATOM 0 HA LEU A 64 2.456 -2.503 7.669 1.00 0.00 H new ATOM 0 HB2 LEU A 64 4.901 -2.972 5.926 1.00 0.00 H new ATOM 0 HB3 LEU A 64 3.660 -4.202 6.055 1.00 0.00 H new ATOM 0 HG LEU A 64 1.925 -2.530 5.383 1.00 0.00 H new ATOM 0 HD11 LEU A 64 2.669 -0.316 4.545 1.00 0.00 H new ATOM 0 HD12 LEU A 64 3.077 -0.519 6.265 1.00 0.00 H new ATOM 0 HD13 LEU A 64 4.340 -0.697 5.024 1.00 0.00 H new ATOM 0 HD21 LEU A 64 2.654 -2.295 3.022 1.00 0.00 H new ATOM 0 HD22 LEU A 64 4.325 -2.676 3.500 1.00 0.00 H new ATOM 0 HD23 LEU A 64 3.051 -3.910 3.655 1.00 0.00 H new ATOM 984 N GLN A 65 3.105 -4.641 8.903 1.00 0.00 N ATOM 985 CA GLN A 65 3.470 -5.714 9.873 1.00 0.00 C ATOM 986 C GLN A 65 2.836 -7.035 9.431 1.00 0.00 C ATOM 987 O GLN A 65 1.677 -7.086 9.071 1.00 0.00 O ATOM 988 CB GLN A 65 2.954 -5.341 11.265 1.00 0.00 C ATOM 989 CG GLN A 65 3.740 -6.114 12.325 1.00 0.00 C ATOM 990 CD GLN A 65 3.045 -5.973 13.681 1.00 0.00 C ATOM 991 OE1 GLN A 65 2.481 -4.940 13.983 1.00 0.00 O ATOM 992 NE2 GLN A 65 3.060 -6.976 14.515 1.00 0.00 N ATOM 0 H GLN A 65 2.151 -4.689 8.545 1.00 0.00 H new ATOM 0 HA GLN A 65 4.554 -5.823 9.905 1.00 0.00 H new ATOM 0 HB2 GLN A 65 3.060 -4.269 11.428 1.00 0.00 H new ATOM 0 HB3 GLN A 65 1.892 -5.572 11.345 1.00 0.00 H new ATOM 0 HG2 GLN A 65 3.808 -7.166 12.047 1.00 0.00 H new ATOM 0 HG3 GLN A 65 4.760 -5.734 12.386 1.00 0.00 H new ATOM 0 HE21 GLN A 65 3.533 -7.843 14.261 1.00 0.00 H new ATOM 0 HE22 GLN A 65 2.598 -6.893 15.421 1.00 0.00 H new ATOM 1001 N ALA A 66 3.588 -8.101 9.454 1.00 0.00 N ATOM 1002 CA ALA A 66 3.030 -9.417 9.033 1.00 0.00 C ATOM 1003 C ALA A 66 2.512 -10.170 10.260 1.00 0.00 C ATOM 1004 O ALA A 66 3.190 -10.282 11.262 1.00 0.00 O ATOM 1005 CB ALA A 66 4.126 -10.241 8.355 1.00 0.00 C ATOM 0 H ALA A 66 4.565 -8.118 9.746 1.00 0.00 H new ATOM 0 HA ALA A 66 2.210 -9.256 8.334 1.00 0.00 H new ATOM 0 HB1 ALA A 66 3.719 -11.204 8.047 1.00 0.00 H new ATOM 0 HB2 ALA A 66 4.495 -9.706 7.480 1.00 0.00 H new ATOM 0 HB3 ALA A 66 4.946 -10.401 9.055 1.00 0.00 H new ATOM 1011 N GLU A 67 1.316 -10.690 10.186 1.00 0.00 N ATOM 1012 CA GLU A 67 0.750 -11.439 11.345 1.00 0.00 C ATOM 1013 C GLU A 67 0.966 -12.939 11.137 1.00 0.00 C ATOM 1014 O GLU A 67 1.838 -13.539 11.733 1.00 0.00 O ATOM 1015 CB GLU A 67 -0.749 -11.148 11.455 1.00 0.00 C ATOM 1016 CG GLU A 67 -1.285 -11.711 12.773 1.00 0.00 C ATOM 1017 CD GLU A 67 -0.743 -10.885 13.940 1.00 0.00 C ATOM 1018 OE1 GLU A 67 -0.893 -9.674 13.902 1.00 0.00 O ATOM 1019 OE2 GLU A 67 -0.188 -11.475 14.852 1.00 0.00 O ATOM 0 H GLU A 67 0.706 -10.628 9.371 1.00 0.00 H new ATOM 0 HA GLU A 67 1.249 -11.125 12.261 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -0.926 -10.073 11.408 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -1.279 -11.595 10.614 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -2.375 -11.689 12.773 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -0.987 -12.754 12.883 1.00 0.00 H new ATOM 1026 N GLU A 68 0.178 -13.545 10.294 1.00 0.00 N ATOM 1027 CA GLU A 68 0.331 -15.005 10.040 1.00 0.00 C ATOM 1028 C GLU A 68 1.193 -15.220 8.794 1.00 0.00 C ATOM 1029 O GLU A 68 2.327 -14.790 8.731 1.00 0.00 O ATOM 1030 CB GLU A 68 -1.049 -15.630 9.819 1.00 0.00 C ATOM 1031 CG GLU A 68 -1.853 -15.566 11.119 1.00 0.00 C ATOM 1032 CD GLU A 68 -3.250 -16.142 10.884 1.00 0.00 C ATOM 1033 OE1 GLU A 68 -3.339 -17.223 10.326 1.00 0.00 O ATOM 1034 OE2 GLU A 68 -4.209 -15.493 11.268 1.00 0.00 O ATOM 0 H GLU A 68 -0.568 -13.091 9.768 1.00 0.00 H new ATOM 0 HA GLU A 68 0.811 -15.475 10.898 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -1.577 -15.100 9.026 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -0.943 -16.665 9.495 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -1.344 -16.128 11.902 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -1.927 -14.534 11.463 1.00 0.00 H new ATOM 1041 N ARG A 69 0.662 -15.884 7.802 1.00 0.00 N ATOM 1042 CA ARG A 69 1.451 -16.128 6.561 1.00 0.00 C ATOM 1043 C ARG A 69 1.146 -15.031 5.538 1.00 0.00 C ATOM 1044 O ARG A 69 1.717 -13.960 5.571 1.00 0.00 O ATOM 1045 CB ARG A 69 1.071 -17.490 5.976 1.00 0.00 C ATOM 1046 CG ARG A 69 1.723 -18.600 6.805 1.00 0.00 C ATOM 1047 CD ARG A 69 1.314 -19.963 6.242 1.00 0.00 C ATOM 1048 NE ARG A 69 -0.168 -20.103 6.305 1.00 0.00 N ATOM 1049 CZ ARG A 69 -0.765 -21.037 5.617 1.00 0.00 C ATOM 1050 NH1 ARG A 69 -0.064 -21.847 4.872 1.00 0.00 N ATOM 1051 NH2 ARG A 69 -2.063 -21.161 5.672 1.00 0.00 N ATOM 0 H ARG A 69 -0.283 -16.267 7.798 1.00 0.00 H new ATOM 0 HA ARG A 69 2.515 -16.117 6.799 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -0.012 -17.609 5.977 1.00 0.00 H new ATOM 0 HB3 ARG A 69 1.398 -17.556 4.938 1.00 0.00 H new ATOM 0 HG2 ARG A 69 2.808 -18.496 6.783 1.00 0.00 H new ATOM 0 HG3 ARG A 69 1.416 -18.518 7.848 1.00 0.00 H new ATOM 0 HD2 ARG A 69 1.655 -20.060 5.211 1.00 0.00 H new ATOM 0 HD3 ARG A 69 1.790 -20.761 6.812 1.00 0.00 H new ATOM 0 HE ARG A 69 -0.716 -19.469 6.886 1.00 0.00 H new ATOM 0 HH11 ARG A 69 0.950 -21.750 4.828 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -0.530 -22.577 4.334 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -2.612 -20.527 6.253 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -2.529 -21.892 5.134 1.00 0.00 H new ATOM 1065 N GLY A 70 0.248 -15.291 4.626 1.00 0.00 N ATOM 1066 CA GLY A 70 -0.093 -14.265 3.600 1.00 0.00 C ATOM 1067 C GLY A 70 -0.959 -13.175 4.234 1.00 0.00 C ATOM 1068 O GLY A 70 -1.409 -12.261 3.569 1.00 0.00 O ATOM 0 H GLY A 70 -0.264 -16.170 4.548 1.00 0.00 H new ATOM 0 HA2 GLY A 70 0.818 -13.828 3.191 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -0.625 -14.729 2.769 1.00 0.00 H new ATOM 1072 N VAL A 71 -1.197 -13.260 5.514 1.00 0.00 N ATOM 1073 CA VAL A 71 -2.033 -12.228 6.188 1.00 0.00 C ATOM 1074 C VAL A 71 -1.136 -11.095 6.690 1.00 0.00 C ATOM 1075 O VAL A 71 -0.186 -11.321 7.412 1.00 0.00 O ATOM 1076 CB VAL A 71 -2.769 -12.861 7.371 1.00 0.00 C ATOM 1077 CG1 VAL A 71 -3.979 -12.001 7.741 1.00 0.00 C ATOM 1078 CG2 VAL A 71 -3.240 -14.264 6.984 1.00 0.00 C ATOM 0 H VAL A 71 -0.848 -14.001 6.122 1.00 0.00 H new ATOM 0 HA VAL A 71 -2.760 -11.829 5.481 1.00 0.00 H new ATOM 0 HB VAL A 71 -2.096 -12.925 8.226 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -4.502 -12.453 8.584 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -3.644 -11.001 8.016 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -4.654 -11.936 6.887 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -3.765 -14.717 7.825 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -3.913 -14.199 6.129 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -2.378 -14.878 6.721 1.00 0.00 H new ATOM 1088 N VAL A 72 -1.431 -9.879 6.308 1.00 0.00 N ATOM 1089 CA VAL A 72 -0.598 -8.723 6.756 1.00 0.00 C ATOM 1090 C VAL A 72 -1.511 -7.564 7.162 1.00 0.00 C ATOM 1091 O VAL A 72 -2.702 -7.586 6.923 1.00 0.00 O ATOM 1092 CB VAL A 72 0.311 -8.274 5.609 1.00 0.00 C ATOM 1093 CG1 VAL A 72 1.469 -9.262 5.453 1.00 0.00 C ATOM 1094 CG2 VAL A 72 -0.496 -8.227 4.309 1.00 0.00 C ATOM 0 H VAL A 72 -2.216 -9.636 5.703 1.00 0.00 H new ATOM 0 HA VAL A 72 0.011 -9.024 7.608 1.00 0.00 H new ATOM 0 HB VAL A 72 0.708 -7.283 5.829 1.00 0.00 H new ATOM 0 HG11 VAL A 72 2.114 -8.940 4.636 1.00 0.00 H new ATOM 0 HG12 VAL A 72 2.045 -9.297 6.378 1.00 0.00 H new ATOM 0 HG13 VAL A 72 1.074 -10.254 5.234 1.00 0.00 H new ATOM 0 HG21 VAL A 72 0.150 -7.907 3.491 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -0.893 -9.218 4.091 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -1.320 -7.522 4.418 1.00 0.00 H new ATOM 1104 N SER A 73 -0.957 -6.551 7.774 1.00 0.00 N ATOM 1105 CA SER A 73 -1.785 -5.386 8.198 1.00 0.00 C ATOM 1106 C SER A 73 -0.982 -4.098 8.007 1.00 0.00 C ATOM 1107 O SER A 73 0.140 -3.982 8.459 1.00 0.00 O ATOM 1108 CB SER A 73 -2.163 -5.537 9.671 1.00 0.00 C ATOM 1109 OG SER A 73 -2.490 -6.895 9.936 1.00 0.00 O ATOM 0 H SER A 73 0.035 -6.481 7.999 1.00 0.00 H new ATOM 0 HA SER A 73 -2.692 -5.344 7.594 1.00 0.00 H new ATOM 0 HB2 SER A 73 -1.335 -5.220 10.305 1.00 0.00 H new ATOM 0 HB3 SER A 73 -3.010 -4.894 9.908 1.00 0.00 H new ATOM 0 HG SER A 73 -3.463 -7.009 9.907 1.00 0.00 H new ATOM 1115 N ILE A 74 -1.545 -3.129 7.336 1.00 0.00 N ATOM 1116 CA ILE A 74 -0.811 -1.853 7.115 1.00 0.00 C ATOM 1117 C ILE A 74 -1.158 -0.859 8.225 1.00 0.00 C ATOM 1118 O ILE A 74 -2.243 -0.876 8.771 1.00 0.00 O ATOM 1119 CB ILE A 74 -1.211 -1.263 5.761 1.00 0.00 C ATOM 1120 CG1 ILE A 74 -1.265 -2.379 4.716 1.00 0.00 C ATOM 1121 CG2 ILE A 74 -0.180 -0.217 5.335 1.00 0.00 C ATOM 1122 CD1 ILE A 74 -1.403 -1.766 3.321 1.00 0.00 C ATOM 0 H ILE A 74 -2.481 -3.167 6.932 1.00 0.00 H new ATOM 0 HA ILE A 74 0.261 -2.048 7.127 1.00 0.00 H new ATOM 0 HB ILE A 74 -2.191 -0.794 5.845 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -0.362 -2.986 4.770 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -2.107 -3.041 4.919 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -0.465 0.203 4.370 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -0.139 0.578 6.079 1.00 0.00 H new ATOM 0 HG23 ILE A 74 0.800 -0.686 5.251 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -1.441 -2.561 2.576 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -2.319 -1.178 3.271 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -0.547 -1.122 3.120 1.00 0.00 H new ATOM 1134 N LYS A 75 -0.242 0.010 8.563 1.00 0.00 N ATOM 1135 CA LYS A 75 -0.520 1.005 9.636 1.00 0.00 C ATOM 1136 C LYS A 75 0.219 2.308 9.325 1.00 0.00 C ATOM 1137 O LYS A 75 1.433 2.344 9.259 1.00 0.00 O ATOM 1138 CB LYS A 75 -0.040 0.455 10.981 1.00 0.00 C ATOM 1139 CG LYS A 75 -0.598 1.317 12.115 1.00 0.00 C ATOM 1140 CD LYS A 75 0.217 1.078 13.388 1.00 0.00 C ATOM 1141 CE LYS A 75 1.247 2.197 13.552 1.00 0.00 C ATOM 1142 NZ LYS A 75 2.314 1.756 14.494 1.00 0.00 N ATOM 0 H LYS A 75 0.685 0.073 8.142 1.00 0.00 H new ATOM 0 HA LYS A 75 -1.592 1.197 9.685 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -0.367 -0.578 11.101 1.00 0.00 H new ATOM 0 HB3 LYS A 75 1.049 0.451 11.016 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -0.559 2.371 11.838 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -1.646 1.072 12.290 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -0.443 1.047 14.255 1.00 0.00 H new ATOM 0 HD3 LYS A 75 0.719 0.112 13.335 1.00 0.00 H new ATOM 0 HE2 LYS A 75 1.682 2.450 12.585 1.00 0.00 H new ATOM 0 HE3 LYS A 75 0.764 3.098 13.929 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 2.389 2.437 15.277 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 2.076 0.817 14.873 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 3.223 1.706 13.990 1.00 0.00 H new ATOM 1156 N GLY A 76 -0.501 3.379 9.133 1.00 0.00 N ATOM 1157 CA GLY A 76 0.162 4.678 8.825 1.00 0.00 C ATOM 1158 C GLY A 76 0.800 5.243 10.096 1.00 0.00 C ATOM 1159 O GLY A 76 0.171 5.328 11.132 1.00 0.00 O ATOM 0 H GLY A 76 -1.520 3.411 9.176 1.00 0.00 H new ATOM 0 HA2 GLY A 76 0.922 4.537 8.056 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -0.567 5.384 8.427 1.00 0.00 H new ATOM 1163 N VAL A 77 2.045 5.629 10.025 1.00 0.00 N ATOM 1164 CA VAL A 77 2.720 6.188 11.230 1.00 0.00 C ATOM 1165 C VAL A 77 2.146 7.572 11.540 1.00 0.00 C ATOM 1166 O VAL A 77 1.383 7.744 12.470 1.00 0.00 O ATOM 1167 CB VAL A 77 4.222 6.307 10.964 1.00 0.00 C ATOM 1168 CG1 VAL A 77 4.922 6.841 12.214 1.00 0.00 C ATOM 1169 CG2 VAL A 77 4.787 4.929 10.612 1.00 0.00 C ATOM 0 H VAL A 77 2.623 5.581 9.186 1.00 0.00 H new ATOM 0 HA VAL A 77 2.553 5.526 12.080 1.00 0.00 H new ATOM 0 HB VAL A 77 4.391 6.993 10.134 1.00 0.00 H new ATOM 0 HG11 VAL A 77 5.992 6.925 12.024 1.00 0.00 H new ATOM 0 HG12 VAL A 77 4.519 7.822 12.465 1.00 0.00 H new ATOM 0 HG13 VAL A 77 4.754 6.156 13.045 1.00 0.00 H new ATOM 0 HG21 VAL A 77 5.857 5.012 10.422 1.00 0.00 H new ATOM 0 HG22 VAL A 77 4.618 4.243 11.442 1.00 0.00 H new ATOM 0 HG23 VAL A 77 4.289 4.548 9.720 1.00 0.00 H new ATOM 1179 N SER A 78 2.504 8.560 10.766 1.00 0.00 N ATOM 1180 CA SER A 78 1.978 9.932 11.018 1.00 0.00 C ATOM 1181 C SER A 78 0.459 9.870 11.188 1.00 0.00 C ATOM 1182 O SER A 78 -0.083 10.313 12.181 1.00 0.00 O ATOM 1183 CB SER A 78 2.323 10.835 9.833 1.00 0.00 C ATOM 1184 OG SER A 78 1.589 12.048 9.938 1.00 0.00 O ATOM 0 H SER A 78 3.137 8.477 9.971 1.00 0.00 H new ATOM 0 HA SER A 78 2.429 10.335 11.925 1.00 0.00 H new ATOM 0 HB2 SER A 78 3.393 11.044 9.819 1.00 0.00 H new ATOM 0 HB3 SER A 78 2.084 10.332 8.896 1.00 0.00 H new ATOM 0 HG SER A 78 2.003 12.731 9.370 1.00 0.00 H new ATOM 1190 N ALA A 79 -0.234 9.323 10.226 1.00 0.00 N ATOM 1191 CA ALA A 79 -1.717 9.233 10.332 1.00 0.00 C ATOM 1192 C ALA A 79 -2.089 8.397 11.559 1.00 0.00 C ATOM 1193 O ALA A 79 -3.146 8.560 12.136 1.00 0.00 O ATOM 1194 CB ALA A 79 -2.279 8.570 9.073 1.00 0.00 C ATOM 0 H ALA A 79 0.164 8.935 9.371 1.00 0.00 H new ATOM 0 HA ALA A 79 -2.137 10.234 10.433 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -3.364 8.504 9.150 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -2.013 9.164 8.199 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -1.861 7.569 8.972 1.00 0.00 H new ATOM 1200 N ASN A 80 -1.227 7.503 11.962 1.00 0.00 N ATOM 1201 CA ASN A 80 -1.530 6.658 13.151 1.00 0.00 C ATOM 1202 C ASN A 80 -2.910 6.017 12.987 1.00 0.00 C ATOM 1203 O ASN A 80 -3.743 6.081 13.870 1.00 0.00 O ATOM 1204 CB ASN A 80 -1.517 7.527 14.410 1.00 0.00 C ATOM 1205 CG ASN A 80 -0.070 7.811 14.819 1.00 0.00 C ATOM 1206 OD1 ASN A 80 0.359 8.948 14.827 1.00 0.00 O ATOM 1207 ND2 ASN A 80 0.706 6.819 15.159 1.00 0.00 N ATOM 0 H ASN A 80 -0.326 7.322 11.519 1.00 0.00 H new ATOM 0 HA ASN A 80 -0.777 5.876 13.241 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -2.044 8.463 14.224 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -2.042 7.021 15.220 1.00 0.00 H new ATOM 0 HD21 ASN A 80 1.673 6.998 15.431 1.00 0.00 H new ATOM 0 HD22 ASN A 80 0.346 5.865 15.152 1.00 0.00 H new ATOM 1214 N ARG A 81 -3.160 5.398 11.866 1.00 0.00 N ATOM 1215 CA ARG A 81 -4.484 4.751 11.649 1.00 0.00 C ATOM 1216 C ARG A 81 -4.308 3.498 10.790 1.00 0.00 C ATOM 1217 O ARG A 81 -3.452 3.438 9.930 1.00 0.00 O ATOM 1218 CB ARG A 81 -5.424 5.728 10.938 1.00 0.00 C ATOM 1219 CG ARG A 81 -6.004 6.714 11.955 1.00 0.00 C ATOM 1220 CD ARG A 81 -6.935 7.696 11.242 1.00 0.00 C ATOM 1221 NE ARG A 81 -8.349 7.379 11.588 1.00 0.00 N ATOM 1222 CZ ARG A 81 -9.290 8.248 11.341 1.00 0.00 C ATOM 1223 NH1 ARG A 81 -8.995 9.394 10.793 1.00 0.00 N ATOM 1224 NH2 ARG A 81 -10.529 7.970 11.646 1.00 0.00 N ATOM 0 H ARG A 81 -2.503 5.312 11.090 1.00 0.00 H new ATOM 0 HA ARG A 81 -4.911 4.474 12.613 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -4.884 6.268 10.160 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -6.229 5.182 10.446 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -6.551 6.175 12.729 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -5.199 7.255 12.452 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -6.698 8.718 11.537 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -6.790 7.633 10.163 1.00 0.00 H new ATOM 0 HE ARG A 81 -8.581 6.483 12.018 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -8.027 9.612 10.557 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -9.732 10.072 10.601 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -10.760 7.075 12.077 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -11.266 8.648 11.454 1.00 0.00 H new ATOM 1238 N TYR A 82 -5.114 2.496 11.014 1.00 0.00 N ATOM 1239 CA TYR A 82 -4.994 1.248 10.211 1.00 0.00 C ATOM 1240 C TYR A 82 -5.886 1.350 8.972 1.00 0.00 C ATOM 1241 O TYR A 82 -7.048 1.697 9.059 1.00 0.00 O ATOM 1242 CB TYR A 82 -5.432 0.052 11.059 1.00 0.00 C ATOM 1243 CG TYR A 82 -4.497 -0.102 12.235 1.00 0.00 C ATOM 1244 CD1 TYR A 82 -4.673 0.687 13.377 1.00 0.00 C ATOM 1245 CD2 TYR A 82 -3.455 -1.035 12.182 1.00 0.00 C ATOM 1246 CE1 TYR A 82 -3.807 0.546 14.467 1.00 0.00 C ATOM 1247 CE2 TYR A 82 -2.587 -1.177 13.272 1.00 0.00 C ATOM 1248 CZ TYR A 82 -2.763 -0.387 14.415 1.00 0.00 C ATOM 1249 OH TYR A 82 -1.908 -0.528 15.489 1.00 0.00 O ATOM 0 H TYR A 82 -5.851 2.489 11.719 1.00 0.00 H new ATOM 0 HA TYR A 82 -3.958 1.113 9.901 1.00 0.00 H new ATOM 0 HB2 TYR A 82 -6.454 0.196 11.410 1.00 0.00 H new ATOM 0 HB3 TYR A 82 -5.427 -0.856 10.456 1.00 0.00 H new ATOM 0 HD1 TYR A 82 -5.478 1.406 13.417 1.00 0.00 H new ATOM 0 HD2 TYR A 82 -3.320 -1.645 11.301 1.00 0.00 H new ATOM 0 HE1 TYR A 82 -3.943 1.156 15.348 1.00 0.00 H new ATOM 0 HE2 TYR A 82 -1.782 -1.896 13.231 1.00 0.00 H new ATOM 0 HH TYR A 82 -1.242 -1.218 15.288 1.00 0.00 H new ATOM 1259 N LEU A 83 -5.352 1.049 7.820 1.00 0.00 N ATOM 1260 CA LEU A 83 -6.167 1.127 6.575 1.00 0.00 C ATOM 1261 C LEU A 83 -7.286 0.084 6.636 1.00 0.00 C ATOM 1262 O LEU A 83 -7.093 -1.021 7.102 1.00 0.00 O ATOM 1263 CB LEU A 83 -5.269 0.847 5.364 1.00 0.00 C ATOM 1264 CG LEU A 83 -6.060 1.049 4.065 1.00 0.00 C ATOM 1265 CD1 LEU A 83 -6.486 2.514 3.927 1.00 0.00 C ATOM 1266 CD2 LEU A 83 -5.180 0.666 2.874 1.00 0.00 C ATOM 0 H LEU A 83 -4.385 0.752 7.687 1.00 0.00 H new ATOM 0 HA LEU A 83 -6.603 2.122 6.482 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -4.405 1.512 5.380 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -4.887 -0.173 5.412 1.00 0.00 H new ATOM 0 HG LEU A 83 -6.950 0.420 4.089 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -7.046 2.644 3.001 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -7.114 2.792 4.774 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -5.601 3.150 3.908 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -5.738 0.808 1.949 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -4.290 1.296 2.861 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -4.883 -0.379 2.962 1.00 0.00 H new ATOM 1278 N ALA A 84 -8.456 0.427 6.169 1.00 0.00 N ATOM 1279 CA ALA A 84 -9.584 -0.546 6.202 1.00 0.00 C ATOM 1280 C ALA A 84 -10.529 -0.274 5.030 1.00 0.00 C ATOM 1281 O ALA A 84 -10.810 0.860 4.700 1.00 0.00 O ATOM 1282 CB ALA A 84 -10.348 -0.397 7.519 1.00 0.00 C ATOM 0 H ALA A 84 -8.679 1.337 5.767 1.00 0.00 H new ATOM 0 HA ALA A 84 -9.191 -1.560 6.123 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -11.173 -1.109 7.543 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -9.675 -0.593 8.354 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -10.741 0.617 7.599 1.00 0.00 H new ATOM 1288 N MET A 85 -11.021 -1.309 4.402 1.00 0.00 N ATOM 1289 CA MET A 85 -11.951 -1.115 3.251 1.00 0.00 C ATOM 1290 C MET A 85 -13.395 -1.250 3.739 1.00 0.00 C ATOM 1291 O MET A 85 -13.741 -2.186 4.432 1.00 0.00 O ATOM 1292 CB MET A 85 -11.672 -2.177 2.186 1.00 0.00 C ATOM 1293 CG MET A 85 -12.602 -1.958 0.992 1.00 0.00 C ATOM 1294 SD MET A 85 -12.122 -3.066 -0.357 1.00 0.00 S ATOM 1295 CE MET A 85 -11.188 -1.856 -1.324 1.00 0.00 C ATOM 0 H MET A 85 -10.819 -2.281 4.636 1.00 0.00 H new ATOM 0 HA MET A 85 -11.801 -0.124 2.823 1.00 0.00 H new ATOM 0 HB2 MET A 85 -10.632 -2.121 1.865 1.00 0.00 H new ATOM 0 HB3 MET A 85 -11.825 -3.173 2.602 1.00 0.00 H new ATOM 0 HG2 MET A 85 -13.635 -2.148 1.283 1.00 0.00 H new ATOM 0 HG3 MET A 85 -12.549 -0.921 0.661 1.00 0.00 H new ATOM 0 HE1 MET A 85 -10.451 -2.372 -1.939 1.00 0.00 H new ATOM 0 HE2 MET A 85 -11.870 -1.299 -1.966 1.00 0.00 H new ATOM 0 HE3 MET A 85 -10.679 -1.166 -0.650 1.00 0.00 H new ATOM 1305 N LYS A 86 -14.241 -0.323 3.383 1.00 0.00 N ATOM 1306 CA LYS A 86 -15.662 -0.401 3.828 1.00 0.00 C ATOM 1307 C LYS A 86 -16.380 -1.506 3.049 1.00 0.00 C ATOM 1308 O LYS A 86 -15.776 -2.236 2.289 1.00 0.00 O ATOM 1309 CB LYS A 86 -16.353 0.940 3.567 1.00 0.00 C ATOM 1310 CG LYS A 86 -15.965 1.937 4.663 1.00 0.00 C ATOM 1311 CD LYS A 86 -16.889 1.770 5.873 1.00 0.00 C ATOM 1312 CE LYS A 86 -18.043 2.771 5.778 1.00 0.00 C ATOM 1313 NZ LYS A 86 -18.791 2.550 4.509 1.00 0.00 N ATOM 0 H LYS A 86 -14.011 0.484 2.804 1.00 0.00 H new ATOM 0 HA LYS A 86 -15.698 -0.626 4.894 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -16.063 1.326 2.590 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -17.435 0.806 3.549 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -14.929 1.777 4.961 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -16.033 2.955 4.281 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -17.278 0.753 5.909 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -16.330 1.930 6.795 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -18.711 2.654 6.631 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -17.658 3.790 5.813 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -19.642 3.147 4.499 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -18.185 2.798 3.701 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -19.069 1.550 4.440 1.00 0.00 H new ATOM 1327 N GLU A 87 -17.666 -1.633 3.232 1.00 0.00 N ATOM 1328 CA GLU A 87 -18.421 -2.690 2.501 1.00 0.00 C ATOM 1329 C GLU A 87 -18.983 -2.109 1.202 1.00 0.00 C ATOM 1330 O GLU A 87 -19.371 -2.830 0.305 1.00 0.00 O ATOM 1331 CB GLU A 87 -19.572 -3.192 3.377 1.00 0.00 C ATOM 1332 CG GLU A 87 -20.522 -2.032 3.686 1.00 0.00 C ATOM 1333 CD GLU A 87 -20.979 -2.122 5.142 1.00 0.00 C ATOM 1334 OE1 GLU A 87 -20.138 -1.991 6.016 1.00 0.00 O ATOM 1335 OE2 GLU A 87 -22.163 -2.322 5.360 1.00 0.00 O ATOM 0 H GLU A 87 -18.226 -1.051 3.855 1.00 0.00 H new ATOM 0 HA GLU A 87 -17.753 -3.520 2.268 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -20.110 -3.991 2.866 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -19.181 -3.613 4.304 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -20.021 -1.080 3.509 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -21.384 -2.067 3.020 1.00 0.00 H new ATOM 1342 N ASP A 88 -19.032 -0.810 1.096 1.00 0.00 N ATOM 1343 CA ASP A 88 -19.569 -0.185 -0.146 1.00 0.00 C ATOM 1344 C ASP A 88 -18.430 0.039 -1.142 1.00 0.00 C ATOM 1345 O ASP A 88 -18.590 -0.144 -2.332 1.00 0.00 O ATOM 1346 CB ASP A 88 -20.220 1.157 0.197 1.00 0.00 C ATOM 1347 CG ASP A 88 -19.372 1.888 1.241 1.00 0.00 C ATOM 1348 OD1 ASP A 88 -18.245 1.474 1.454 1.00 0.00 O ATOM 1349 OD2 ASP A 88 -19.865 2.849 1.807 1.00 0.00 O ATOM 0 H ASP A 88 -18.724 -0.155 1.814 1.00 0.00 H new ATOM 0 HA ASP A 88 -20.313 -0.846 -0.591 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -20.314 1.767 -0.701 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -21.228 0.996 0.580 1.00 0.00 H new ATOM 1354 N GLY A 89 -17.279 0.433 -0.664 1.00 0.00 N ATOM 1355 CA GLY A 89 -16.127 0.669 -1.582 1.00 0.00 C ATOM 1356 C GLY A 89 -15.320 1.872 -1.091 1.00 0.00 C ATOM 1357 O GLY A 89 -14.232 2.137 -1.564 1.00 0.00 O ATOM 0 H GLY A 89 -17.087 0.602 0.324 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -15.492 -0.216 -1.621 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -16.487 0.848 -2.595 1.00 0.00 H new ATOM 1361 N ARG A 90 -15.844 2.606 -0.147 1.00 0.00 N ATOM 1362 CA ARG A 90 -15.106 3.792 0.372 1.00 0.00 C ATOM 1363 C ARG A 90 -13.929 3.327 1.231 1.00 0.00 C ATOM 1364 O ARG A 90 -14.095 2.581 2.176 1.00 0.00 O ATOM 1365 CB ARG A 90 -16.049 4.649 1.219 1.00 0.00 C ATOM 1366 CG ARG A 90 -16.962 5.464 0.300 1.00 0.00 C ATOM 1367 CD ARG A 90 -17.939 6.282 1.147 1.00 0.00 C ATOM 1368 NE ARG A 90 -17.877 7.712 0.734 1.00 0.00 N ATOM 1369 CZ ARG A 90 -18.817 8.539 1.103 1.00 0.00 C ATOM 1370 NH1 ARG A 90 -19.808 8.114 1.836 1.00 0.00 N ATOM 1371 NH2 ARG A 90 -18.764 9.791 0.738 1.00 0.00 N ATOM 0 H ARG A 90 -16.751 2.435 0.287 1.00 0.00 H new ATOM 0 HA ARG A 90 -14.733 4.381 -0.465 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -16.647 4.014 1.873 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -15.474 5.315 1.862 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -16.366 6.126 -0.328 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -17.511 4.800 -0.368 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -18.952 5.900 1.023 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -17.689 6.186 2.204 1.00 0.00 H new ATOM 0 HE ARG A 90 -17.100 8.045 0.163 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -19.849 7.135 2.121 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -20.543 8.760 2.124 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -17.988 10.123 0.165 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -19.498 10.438 1.026 1.00 0.00 H new ATOM 1385 N LEU A 91 -12.741 3.763 0.912 1.00 0.00 N ATOM 1386 CA LEU A 91 -11.554 3.348 1.710 1.00 0.00 C ATOM 1387 C LEU A 91 -11.284 4.388 2.798 1.00 0.00 C ATOM 1388 O LEU A 91 -11.357 5.578 2.563 1.00 0.00 O ATOM 1389 CB LEU A 91 -10.336 3.241 0.791 1.00 0.00 C ATOM 1390 CG LEU A 91 -10.373 1.906 0.045 1.00 0.00 C ATOM 1391 CD1 LEU A 91 -11.672 1.804 -0.756 1.00 0.00 C ATOM 1392 CD2 LEU A 91 -9.179 1.822 -0.908 1.00 0.00 C ATOM 0 H LEU A 91 -12.542 4.389 0.132 1.00 0.00 H new ATOM 0 HA LEU A 91 -11.746 2.380 2.173 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -10.331 4.067 0.080 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -9.419 3.318 1.375 1.00 0.00 H new ATOM 0 HG LEU A 91 -10.324 1.087 0.763 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -11.698 0.853 -1.287 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -12.523 1.864 -0.078 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -11.722 2.622 -1.474 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -9.204 0.871 -1.440 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -9.228 2.641 -1.626 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -8.253 1.894 -0.338 1.00 0.00 H new ATOM 1404 N LEU A 92 -10.971 3.953 3.988 1.00 0.00 N ATOM 1405 CA LEU A 92 -10.696 4.921 5.086 1.00 0.00 C ATOM 1406 C LEU A 92 -9.686 4.317 6.064 1.00 0.00 C ATOM 1407 O LEU A 92 -9.150 3.251 5.838 1.00 0.00 O ATOM 1408 CB LEU A 92 -11.998 5.256 5.828 1.00 0.00 C ATOM 1409 CG LEU A 92 -12.844 3.991 6.030 1.00 0.00 C ATOM 1410 CD1 LEU A 92 -12.111 3.006 6.944 1.00 0.00 C ATOM 1411 CD2 LEU A 92 -14.177 4.378 6.677 1.00 0.00 C ATOM 0 H LEU A 92 -10.894 2.969 4.247 1.00 0.00 H new ATOM 0 HA LEU A 92 -10.284 5.836 4.660 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -11.767 5.704 6.794 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -12.566 5.994 5.262 1.00 0.00 H new ATOM 0 HG LEU A 92 -13.018 3.519 5.063 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -12.721 2.113 7.080 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -11.159 2.730 6.492 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -11.931 3.473 7.912 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -14.783 3.484 6.824 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -13.990 4.851 7.641 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -14.708 5.074 6.028 1.00 0.00 H new ATOM 1423 N ALA A 93 -9.422 4.993 7.151 1.00 0.00 N ATOM 1424 CA ALA A 93 -8.446 4.462 8.146 1.00 0.00 C ATOM 1425 C ALA A 93 -8.921 4.814 9.558 1.00 0.00 C ATOM 1426 O ALA A 93 -9.284 5.941 9.834 1.00 0.00 O ATOM 1427 CB ALA A 93 -7.073 5.089 7.898 1.00 0.00 C ATOM 0 H ALA A 93 -9.841 5.891 7.393 1.00 0.00 H new ATOM 0 HA ALA A 93 -8.373 3.379 8.045 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -6.359 4.701 8.625 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -6.736 4.841 6.891 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -7.144 6.172 8.001 1.00 0.00 H new ATOM 1433 N SER A 94 -8.921 3.855 10.448 1.00 0.00 N ATOM 1434 CA SER A 94 -9.373 4.116 11.848 1.00 0.00 C ATOM 1435 C SER A 94 -8.174 4.053 12.795 1.00 0.00 C ATOM 1436 O SER A 94 -7.099 3.626 12.425 1.00 0.00 O ATOM 1437 CB SER A 94 -10.397 3.057 12.256 1.00 0.00 C ATOM 1438 OG SER A 94 -11.202 2.726 11.133 1.00 0.00 O ATOM 0 H SER A 94 -8.625 2.896 10.264 1.00 0.00 H new ATOM 0 HA SER A 94 -9.827 5.106 11.903 1.00 0.00 H new ATOM 0 HB2 SER A 94 -9.889 2.168 12.629 1.00 0.00 H new ATOM 0 HB3 SER A 94 -11.021 3.431 13.068 1.00 0.00 H new ATOM 0 HG SER A 94 -11.859 2.046 11.390 1.00 0.00 H new ATOM 1444 N LYS A 95 -8.351 4.477 14.018 1.00 0.00 N ATOM 1445 CA LYS A 95 -7.223 4.442 14.992 1.00 0.00 C ATOM 1446 C LYS A 95 -7.141 3.055 15.632 1.00 0.00 C ATOM 1447 O LYS A 95 -6.280 2.792 16.448 1.00 0.00 O ATOM 1448 CB LYS A 95 -7.459 5.491 16.079 1.00 0.00 C ATOM 1449 CG LYS A 95 -7.323 6.891 15.476 1.00 0.00 C ATOM 1450 CD LYS A 95 -7.440 7.939 16.584 1.00 0.00 C ATOM 1451 CE LYS A 95 -6.054 8.227 17.163 1.00 0.00 C ATOM 1452 NZ LYS A 95 -6.191 8.695 18.571 1.00 0.00 N ATOM 0 H LYS A 95 -9.229 4.846 14.384 1.00 0.00 H new ATOM 0 HA LYS A 95 -6.289 4.657 14.473 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -8.451 5.365 16.512 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -6.740 5.360 16.888 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -6.363 6.988 14.969 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -8.097 7.052 14.726 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -7.878 8.855 16.188 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -8.106 7.581 17.369 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -5.439 7.328 17.126 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -5.548 8.985 16.564 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -5.249 8.891 18.965 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -6.763 9.563 18.594 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -6.657 7.958 19.138 1.00 0.00 H new ATOM 1466 N SER A 96 -8.035 2.172 15.266 1.00 0.00 N ATOM 1467 CA SER A 96 -8.024 0.795 15.846 1.00 0.00 C ATOM 1468 C SER A 96 -8.021 -0.234 14.713 1.00 0.00 C ATOM 1469 O SER A 96 -8.735 -0.103 13.740 1.00 0.00 O ATOM 1470 CB SER A 96 -9.273 0.597 16.706 1.00 0.00 C ATOM 1471 OG SER A 96 -8.904 0.616 18.079 1.00 0.00 O ATOM 0 H SER A 96 -8.776 2.347 14.587 1.00 0.00 H new ATOM 0 HA SER A 96 -7.133 0.665 16.460 1.00 0.00 H new ATOM 0 HB2 SER A 96 -9.998 1.384 16.501 1.00 0.00 H new ATOM 0 HB3 SER A 96 -9.752 -0.350 16.459 1.00 0.00 H new ATOM 0 HG SER A 96 -9.702 0.491 18.634 1.00 0.00 H new ATOM 1477 N VAL A 97 -7.220 -1.258 14.833 1.00 0.00 N ATOM 1478 CA VAL A 97 -7.170 -2.295 13.764 1.00 0.00 C ATOM 1479 C VAL A 97 -8.340 -3.266 13.939 1.00 0.00 C ATOM 1480 O VAL A 97 -8.368 -4.058 14.860 1.00 0.00 O ATOM 1481 CB VAL A 97 -5.848 -3.060 13.861 1.00 0.00 C ATOM 1482 CG1 VAL A 97 -5.783 -3.804 15.196 1.00 0.00 C ATOM 1483 CG2 VAL A 97 -5.757 -4.069 12.712 1.00 0.00 C ATOM 0 H VAL A 97 -6.598 -1.421 15.625 1.00 0.00 H new ATOM 0 HA VAL A 97 -7.242 -1.817 12.787 1.00 0.00 H new ATOM 0 HB VAL A 97 -5.018 -2.357 13.796 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -4.841 -4.348 15.264 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -5.848 -3.088 16.015 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -6.614 -4.507 15.262 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -4.816 -4.614 12.780 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -6.588 -4.771 12.777 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -5.802 -3.541 11.760 1.00 0.00 H new ATOM 1493 N THR A 98 -9.306 -3.208 13.061 1.00 0.00 N ATOM 1494 CA THR A 98 -10.478 -4.124 13.172 1.00 0.00 C ATOM 1495 C THR A 98 -10.276 -5.325 12.245 1.00 0.00 C ATOM 1496 O THR A 98 -9.286 -5.422 11.546 1.00 0.00 O ATOM 1497 CB THR A 98 -11.749 -3.377 12.766 1.00 0.00 C ATOM 1498 OG1 THR A 98 -11.689 -3.061 11.382 1.00 0.00 O ATOM 1499 CG2 THR A 98 -11.867 -2.088 13.581 1.00 0.00 C ATOM 0 H THR A 98 -9.334 -2.564 12.270 1.00 0.00 H new ATOM 0 HA THR A 98 -10.572 -4.470 14.201 1.00 0.00 H new ATOM 0 HB THR A 98 -12.618 -4.006 12.958 1.00 0.00 H new ATOM 0 HG1 THR A 98 -10.752 -2.992 11.103 1.00 0.00 H new ATOM 0 HG21 THR A 98 -12.773 -1.556 13.291 1.00 0.00 H new ATOM 0 HG22 THR A 98 -11.913 -2.332 14.642 1.00 0.00 H new ATOM 0 HG23 THR A 98 -10.999 -1.457 13.391 1.00 0.00 H new ATOM 1507 N ASP A 99 -11.206 -6.239 12.232 1.00 0.00 N ATOM 1508 CA ASP A 99 -11.067 -7.431 11.349 1.00 0.00 C ATOM 1509 C ASP A 99 -11.053 -6.980 9.887 1.00 0.00 C ATOM 1510 O ASP A 99 -10.574 -7.679 9.017 1.00 0.00 O ATOM 1511 CB ASP A 99 -12.246 -8.378 11.580 1.00 0.00 C ATOM 1512 CG ASP A 99 -12.234 -8.866 13.030 1.00 0.00 C ATOM 1513 OD1 ASP A 99 -11.477 -8.316 13.812 1.00 0.00 O ATOM 1514 OD2 ASP A 99 -12.980 -9.783 13.333 1.00 0.00 O ATOM 0 H ASP A 99 -12.056 -6.212 12.795 1.00 0.00 H new ATOM 0 HA ASP A 99 -10.136 -7.949 11.580 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -13.184 -7.866 11.365 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -12.183 -9.227 10.899 1.00 0.00 H new ATOM 1519 N GLU A 100 -11.574 -5.817 9.612 1.00 0.00 N ATOM 1520 CA GLU A 100 -11.591 -5.320 8.206 1.00 0.00 C ATOM 1521 C GLU A 100 -10.350 -4.462 7.953 1.00 0.00 C ATOM 1522 O GLU A 100 -10.444 -3.337 7.507 1.00 0.00 O ATOM 1523 CB GLU A 100 -12.848 -4.477 7.978 1.00 0.00 C ATOM 1524 CG GLU A 100 -14.083 -5.378 8.025 1.00 0.00 C ATOM 1525 CD GLU A 100 -15.281 -4.577 8.538 1.00 0.00 C ATOM 1526 OE1 GLU A 100 -15.378 -4.399 9.742 1.00 0.00 O ATOM 1527 OE2 GLU A 100 -16.080 -4.154 7.719 1.00 0.00 O ATOM 0 H GLU A 100 -11.989 -5.188 10.300 1.00 0.00 H new ATOM 0 HA GLU A 100 -11.592 -6.168 7.521 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -12.922 -3.701 8.740 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -12.790 -3.972 7.014 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -14.295 -5.774 7.032 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -13.898 -6.233 8.676 1.00 0.00 H new ATOM 1534 N CYS A 101 -9.187 -4.988 8.236 1.00 0.00 N ATOM 1535 CA CYS A 101 -7.936 -4.209 8.014 1.00 0.00 C ATOM 1536 C CYS A 101 -6.841 -5.139 7.487 1.00 0.00 C ATOM 1537 O CYS A 101 -5.703 -4.745 7.327 1.00 0.00 O ATOM 1538 CB CYS A 101 -7.482 -3.588 9.337 1.00 0.00 C ATOM 1539 SG CYS A 101 -8.849 -2.648 10.062 1.00 0.00 S ATOM 0 H CYS A 101 -9.051 -5.926 8.612 1.00 0.00 H new ATOM 0 HA CYS A 101 -8.124 -3.420 7.286 1.00 0.00 H new ATOM 0 HB2 CYS A 101 -7.158 -4.369 10.025 1.00 0.00 H new ATOM 0 HB3 CYS A 101 -6.626 -2.935 9.170 1.00 0.00 H new ATOM 0 HG CYS A 101 -8.374 -1.660 10.761 1.00 0.00 H new ATOM 1545 N PHE A 102 -7.177 -6.371 7.215 1.00 0.00 N ATOM 1546 CA PHE A 102 -6.155 -7.325 6.698 1.00 0.00 C ATOM 1547 C PHE A 102 -6.184 -7.323 5.168 1.00 0.00 C ATOM 1548 O PHE A 102 -7.193 -7.031 4.557 1.00 0.00 O ATOM 1549 CB PHE A 102 -6.465 -8.733 7.212 1.00 0.00 C ATOM 1550 CG PHE A 102 -6.230 -8.787 8.703 1.00 0.00 C ATOM 1551 CD1 PHE A 102 -4.924 -8.812 9.206 1.00 0.00 C ATOM 1552 CD2 PHE A 102 -7.319 -8.814 9.582 1.00 0.00 C ATOM 1553 CE1 PHE A 102 -4.706 -8.863 10.587 1.00 0.00 C ATOM 1554 CE2 PHE A 102 -7.102 -8.866 10.964 1.00 0.00 C ATOM 1555 CZ PHE A 102 -5.795 -8.891 11.467 1.00 0.00 C ATOM 0 H PHE A 102 -8.114 -6.758 7.328 1.00 0.00 H new ATOM 0 HA PHE A 102 -5.167 -7.022 7.044 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -7.499 -8.995 6.986 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -5.833 -9.464 6.707 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -4.084 -8.792 8.528 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -8.327 -8.795 9.194 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -3.698 -8.881 10.974 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -7.942 -8.887 11.642 1.00 0.00 H new ATOM 0 HZ PHE A 102 -5.627 -8.932 12.533 1.00 0.00 H new ATOM 1565 N PHE A 103 -5.085 -7.647 4.542 1.00 0.00 N ATOM 1566 CA PHE A 103 -5.052 -7.663 3.052 1.00 0.00 C ATOM 1567 C PHE A 103 -4.062 -8.728 2.575 1.00 0.00 C ATOM 1568 O PHE A 103 -2.872 -8.632 2.806 1.00 0.00 O ATOM 1569 CB PHE A 103 -4.612 -6.292 2.537 1.00 0.00 C ATOM 1570 CG PHE A 103 -5.654 -5.259 2.894 1.00 0.00 C ATOM 1571 CD1 PHE A 103 -5.645 -4.665 4.161 1.00 0.00 C ATOM 1572 CD2 PHE A 103 -6.629 -4.897 1.958 1.00 0.00 C ATOM 1573 CE1 PHE A 103 -6.611 -3.707 4.493 1.00 0.00 C ATOM 1574 CE2 PHE A 103 -7.596 -3.939 2.288 1.00 0.00 C ATOM 1575 CZ PHE A 103 -7.586 -3.345 3.556 1.00 0.00 C ATOM 0 H PHE A 103 -4.209 -7.901 4.998 1.00 0.00 H new ATOM 0 HA PHE A 103 -6.046 -7.893 2.669 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -3.651 -6.020 2.973 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -4.474 -6.325 1.456 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -4.893 -4.946 4.883 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -6.636 -5.356 0.981 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -6.604 -3.248 5.471 1.00 0.00 H new ATOM 0 HE2 PHE A 103 -8.348 -3.659 1.566 1.00 0.00 H new ATOM 0 HZ PHE A 103 -8.332 -2.607 3.811 1.00 0.00 H new ATOM 1585 N PHE A 104 -4.543 -9.744 1.911 1.00 0.00 N ATOM 1586 CA PHE A 104 -3.629 -10.814 1.420 1.00 0.00 C ATOM 1587 C PHE A 104 -2.622 -10.213 0.437 1.00 0.00 C ATOM 1588 O PHE A 104 -2.958 -9.871 -0.680 1.00 0.00 O ATOM 1589 CB PHE A 104 -4.446 -11.898 0.714 1.00 0.00 C ATOM 1590 CG PHE A 104 -5.162 -12.741 1.743 1.00 0.00 C ATOM 1591 CD1 PHE A 104 -4.455 -13.707 2.471 1.00 0.00 C ATOM 1592 CD2 PHE A 104 -6.530 -12.557 1.970 1.00 0.00 C ATOM 1593 CE1 PHE A 104 -5.119 -14.489 3.425 1.00 0.00 C ATOM 1594 CE2 PHE A 104 -7.194 -13.339 2.924 1.00 0.00 C ATOM 1595 CZ PHE A 104 -6.489 -14.304 3.651 1.00 0.00 C ATOM 0 H PHE A 104 -5.529 -9.879 1.688 1.00 0.00 H new ATOM 0 HA PHE A 104 -3.096 -11.252 2.264 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -5.168 -11.441 0.037 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -3.792 -12.524 0.107 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -3.399 -13.849 2.297 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -7.075 -11.812 1.409 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -4.575 -15.234 3.986 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -8.250 -13.197 3.098 1.00 0.00 H new ATOM 0 HZ PHE A 104 -7.001 -14.907 4.387 1.00 0.00 H new ATOM 1605 N GLU A 105 -1.388 -10.082 0.842 1.00 0.00 N ATOM 1606 CA GLU A 105 -0.360 -9.504 -0.069 1.00 0.00 C ATOM 1607 C GLU A 105 0.235 -10.614 -0.939 1.00 0.00 C ATOM 1608 O GLU A 105 1.166 -11.289 -0.547 1.00 0.00 O ATOM 1609 CB GLU A 105 0.750 -8.855 0.762 1.00 0.00 C ATOM 1610 CG GLU A 105 1.886 -8.408 -0.160 1.00 0.00 C ATOM 1611 CD GLU A 105 2.795 -7.430 0.586 1.00 0.00 C ATOM 1612 OE1 GLU A 105 2.772 -7.445 1.806 1.00 0.00 O ATOM 1613 OE2 GLU A 105 3.497 -6.683 -0.075 1.00 0.00 O ATOM 0 H GLU A 105 -1.047 -10.351 1.765 1.00 0.00 H new ATOM 0 HA GLU A 105 -0.823 -8.752 -0.708 1.00 0.00 H new ATOM 0 HB2 GLU A 105 0.355 -8.000 1.310 1.00 0.00 H new ATOM 0 HB3 GLU A 105 1.125 -9.562 1.502 1.00 0.00 H new ATOM 0 HG2 GLU A 105 2.460 -9.273 -0.493 1.00 0.00 H new ATOM 0 HG3 GLU A 105 1.479 -7.933 -1.053 1.00 0.00 H new ATOM 1620 N ARG A 106 -0.295 -10.806 -2.116 1.00 0.00 N ATOM 1621 CA ARG A 106 0.239 -11.872 -3.012 1.00 0.00 C ATOM 1622 C ARG A 106 1.261 -11.264 -3.975 1.00 0.00 C ATOM 1623 O ARG A 106 0.969 -10.330 -4.695 1.00 0.00 O ATOM 1624 CB ARG A 106 -0.911 -12.489 -3.810 1.00 0.00 C ATOM 1625 CG ARG A 106 -1.961 -13.045 -2.846 1.00 0.00 C ATOM 1626 CD ARG A 106 -2.561 -14.327 -3.426 1.00 0.00 C ATOM 1627 NE ARG A 106 -3.681 -14.787 -2.558 1.00 0.00 N ATOM 1628 CZ ARG A 106 -4.528 -15.675 -3.002 1.00 0.00 C ATOM 1629 NH1 ARG A 106 -4.395 -16.160 -4.207 1.00 0.00 N ATOM 1630 NH2 ARG A 106 -5.510 -16.078 -2.243 1.00 0.00 N ATOM 0 H ARG A 106 -1.075 -10.271 -2.497 1.00 0.00 H new ATOM 0 HA ARG A 106 0.721 -12.644 -2.412 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -1.360 -11.738 -4.460 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -0.535 -13.285 -4.454 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -1.507 -13.250 -1.876 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -2.745 -12.306 -2.681 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -2.922 -14.147 -4.439 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -1.797 -15.101 -3.493 1.00 0.00 H new ATOM 0 HE ARG A 106 -3.786 -14.408 -1.617 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -3.629 -15.845 -4.802 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -5.057 -16.854 -4.553 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -5.616 -15.699 -1.302 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -6.172 -16.772 -2.591 1.00 0.00 H new ATOM 1644 N LEU A 107 2.457 -11.785 -3.995 1.00 0.00 N ATOM 1645 CA LEU A 107 3.494 -11.233 -4.912 1.00 0.00 C ATOM 1646 C LEU A 107 3.457 -11.987 -6.242 1.00 0.00 C ATOM 1647 O LEU A 107 3.414 -13.201 -6.278 1.00 0.00 O ATOM 1648 CB LEU A 107 4.877 -11.392 -4.276 1.00 0.00 C ATOM 1649 CG LEU A 107 5.940 -10.822 -5.219 1.00 0.00 C ATOM 1650 CD1 LEU A 107 6.910 -9.945 -4.424 1.00 0.00 C ATOM 1651 CD2 LEU A 107 6.711 -11.970 -5.871 1.00 0.00 C ATOM 0 H LEU A 107 2.761 -12.568 -3.417 1.00 0.00 H new ATOM 0 HA LEU A 107 3.293 -10.176 -5.088 1.00 0.00 H new ATOM 0 HB2 LEU A 107 4.910 -10.874 -3.318 1.00 0.00 H new ATOM 0 HB3 LEU A 107 5.079 -12.444 -4.077 1.00 0.00 H new ATOM 0 HG LEU A 107 5.457 -10.223 -5.991 1.00 0.00 H new ATOM 0 HD11 LEU A 107 7.667 -9.539 -5.095 1.00 0.00 H new ATOM 0 HD12 LEU A 107 6.362 -9.126 -3.958 1.00 0.00 H new ATOM 0 HD13 LEU A 107 7.393 -10.544 -3.652 1.00 0.00 H new ATOM 0 HD21 LEU A 107 7.468 -11.565 -6.543 1.00 0.00 H new ATOM 0 HD22 LEU A 107 7.194 -12.569 -5.099 1.00 0.00 H new ATOM 0 HD23 LEU A 107 6.021 -12.596 -6.437 1.00 0.00 H new ATOM 1663 N GLU A 108 3.475 -11.275 -7.338 1.00 0.00 N ATOM 1664 CA GLU A 108 3.445 -11.949 -8.667 1.00 0.00 C ATOM 1665 C GLU A 108 4.874 -12.123 -9.184 1.00 0.00 C ATOM 1666 O GLU A 108 5.756 -11.348 -8.870 1.00 0.00 O ATOM 1667 CB GLU A 108 2.648 -11.093 -9.654 1.00 0.00 C ATOM 1668 CG GLU A 108 1.407 -10.531 -8.957 1.00 0.00 C ATOM 1669 CD GLU A 108 0.221 -10.564 -9.922 1.00 0.00 C ATOM 1670 OE1 GLU A 108 -0.406 -11.605 -10.022 1.00 0.00 O ATOM 1671 OE2 GLU A 108 -0.039 -9.548 -10.544 1.00 0.00 O ATOM 0 H GLU A 108 3.509 -10.256 -7.369 1.00 0.00 H new ATOM 0 HA GLU A 108 2.973 -12.926 -8.568 1.00 0.00 H new ATOM 0 HB2 GLU A 108 3.268 -10.278 -10.028 1.00 0.00 H new ATOM 0 HB3 GLU A 108 2.354 -11.692 -10.516 1.00 0.00 H new ATOM 0 HG2 GLU A 108 1.181 -11.117 -8.066 1.00 0.00 H new ATOM 0 HG3 GLU A 108 1.593 -9.509 -8.628 1.00 0.00 H new ATOM 1678 N SER A 109 5.112 -13.134 -9.975 1.00 0.00 N ATOM 1679 CA SER A 109 6.485 -13.353 -10.511 1.00 0.00 C ATOM 1680 C SER A 109 6.879 -12.174 -11.403 1.00 0.00 C ATOM 1681 O SER A 109 7.947 -12.149 -11.980 1.00 0.00 O ATOM 1682 CB SER A 109 6.514 -14.643 -11.331 1.00 0.00 C ATOM 1683 OG SER A 109 6.561 -15.759 -10.452 1.00 0.00 O ATOM 0 H SER A 109 4.415 -13.817 -10.273 1.00 0.00 H new ATOM 0 HA SER A 109 7.189 -13.433 -9.682 1.00 0.00 H new ATOM 0 HB2 SER A 109 5.630 -14.703 -11.966 1.00 0.00 H new ATOM 0 HB3 SER A 109 7.382 -14.649 -11.991 1.00 0.00 H new ATOM 0 HG SER A 109 6.578 -16.587 -10.976 1.00 0.00 H new ATOM 1689 N ASN A 110 6.022 -11.196 -11.520 1.00 0.00 N ATOM 1690 CA ASN A 110 6.344 -10.018 -12.374 1.00 0.00 C ATOM 1691 C ASN A 110 6.976 -8.921 -11.513 1.00 0.00 C ATOM 1692 O ASN A 110 6.905 -7.751 -11.832 1.00 0.00 O ATOM 1693 CB ASN A 110 5.060 -9.491 -13.016 1.00 0.00 C ATOM 1694 CG ASN A 110 5.414 -8.587 -14.199 1.00 0.00 C ATOM 1695 OD1 ASN A 110 6.573 -8.319 -14.448 1.00 0.00 O ATOM 1696 ND2 ASN A 110 4.458 -8.106 -14.946 1.00 0.00 N ATOM 0 H ASN A 110 5.112 -11.162 -11.060 1.00 0.00 H new ATOM 0 HA ASN A 110 7.045 -10.313 -13.155 1.00 0.00 H new ATOM 0 HB2 ASN A 110 4.441 -10.323 -13.353 1.00 0.00 H new ATOM 0 HB3 ASN A 110 4.476 -8.936 -12.282 1.00 0.00 H new ATOM 0 HD21 ASN A 110 4.684 -7.505 -15.739 1.00 0.00 H new ATOM 0 HD22 ASN A 110 3.485 -8.331 -14.737 1.00 0.00 H new ATOM 1703 N ASN A 111 7.594 -9.293 -10.425 1.00 0.00 N ATOM 1704 CA ASN A 111 8.235 -8.278 -9.536 1.00 0.00 C ATOM 1705 C ASN A 111 7.174 -7.314 -8.996 1.00 0.00 C ATOM 1706 O ASN A 111 7.465 -6.448 -8.195 1.00 0.00 O ATOM 1707 CB ASN A 111 9.283 -7.489 -10.326 1.00 0.00 C ATOM 1708 CG ASN A 111 10.040 -8.435 -11.259 1.00 0.00 C ATOM 1709 OD1 ASN A 111 9.873 -9.637 -11.193 1.00 0.00 O ATOM 1710 ND2 ASN A 111 10.873 -7.939 -12.133 1.00 0.00 N ATOM 0 H ASN A 111 7.684 -10.259 -10.111 1.00 0.00 H new ATOM 0 HA ASN A 111 8.716 -8.789 -8.702 1.00 0.00 H new ATOM 0 HB2 ASN A 111 8.800 -6.701 -10.904 1.00 0.00 H new ATOM 0 HB3 ASN A 111 9.979 -7.002 -9.642 1.00 0.00 H new ATOM 0 HD21 ASN A 111 11.384 -8.560 -12.760 1.00 0.00 H new ATOM 0 HD22 ASN A 111 11.013 -6.930 -12.189 1.00 0.00 H new ATOM 1717 N TYR A 112 5.948 -7.458 -9.422 1.00 0.00 N ATOM 1718 CA TYR A 112 4.875 -6.548 -8.929 1.00 0.00 C ATOM 1719 C TYR A 112 4.162 -7.199 -7.743 1.00 0.00 C ATOM 1720 O TYR A 112 4.549 -8.251 -7.275 1.00 0.00 O ATOM 1721 CB TYR A 112 3.869 -6.288 -10.052 1.00 0.00 C ATOM 1722 CG TYR A 112 4.416 -5.233 -10.984 1.00 0.00 C ATOM 1723 CD1 TYR A 112 4.447 -3.893 -10.580 1.00 0.00 C ATOM 1724 CD2 TYR A 112 4.890 -5.593 -12.250 1.00 0.00 C ATOM 1725 CE1 TYR A 112 4.952 -2.913 -11.441 1.00 0.00 C ATOM 1726 CE2 TYR A 112 5.395 -4.613 -13.113 1.00 0.00 C ATOM 1727 CZ TYR A 112 5.426 -3.273 -12.708 1.00 0.00 C ATOM 1728 OH TYR A 112 5.925 -2.307 -13.559 1.00 0.00 O ATOM 0 H TYR A 112 5.643 -8.166 -10.090 1.00 0.00 H new ATOM 0 HA TYR A 112 5.316 -5.603 -8.613 1.00 0.00 H new ATOM 0 HB2 TYR A 112 3.676 -7.209 -10.602 1.00 0.00 H new ATOM 0 HB3 TYR A 112 2.917 -5.961 -9.634 1.00 0.00 H new ATOM 0 HD1 TYR A 112 4.081 -3.616 -9.603 1.00 0.00 H new ATOM 0 HD2 TYR A 112 4.866 -6.627 -12.562 1.00 0.00 H new ATOM 0 HE1 TYR A 112 4.976 -1.879 -11.129 1.00 0.00 H new ATOM 0 HE2 TYR A 112 5.760 -4.890 -14.091 1.00 0.00 H new ATOM 0 HH TYR A 112 6.213 -2.726 -14.397 1.00 0.00 H new ATOM 1738 N ASN A 113 3.122 -6.581 -7.250 1.00 0.00 N ATOM 1739 CA ASN A 113 2.389 -7.167 -6.094 1.00 0.00 C ATOM 1740 C ASN A 113 0.904 -6.814 -6.195 1.00 0.00 C ATOM 1741 O ASN A 113 0.513 -5.941 -6.944 1.00 0.00 O ATOM 1742 CB ASN A 113 2.959 -6.603 -4.790 1.00 0.00 C ATOM 1743 CG ASN A 113 4.254 -7.339 -4.439 1.00 0.00 C ATOM 1744 OD1 ASN A 113 4.305 -8.074 -3.473 1.00 0.00 O ATOM 1745 ND2 ASN A 113 5.310 -7.171 -5.187 1.00 0.00 N ATOM 0 H ASN A 113 2.750 -5.697 -7.598 1.00 0.00 H new ATOM 0 HA ASN A 113 2.505 -8.251 -6.104 1.00 0.00 H new ATOM 0 HB2 ASN A 113 3.152 -5.536 -4.897 1.00 0.00 H new ATOM 0 HB3 ASN A 113 2.234 -6.717 -3.984 1.00 0.00 H new ATOM 0 HD21 ASN A 113 6.178 -7.657 -4.961 1.00 0.00 H new ATOM 0 HD22 ASN A 113 5.268 -6.554 -5.998 1.00 0.00 H new ATOM 1752 N THR A 114 0.074 -7.489 -5.445 1.00 0.00 N ATOM 1753 CA THR A 114 -1.387 -7.198 -5.493 1.00 0.00 C ATOM 1754 C THR A 114 -1.984 -7.352 -4.094 1.00 0.00 C ATOM 1755 O THR A 114 -1.920 -8.408 -3.493 1.00 0.00 O ATOM 1756 CB THR A 114 -2.072 -8.178 -6.449 1.00 0.00 C ATOM 1757 OG1 THR A 114 -2.273 -9.419 -5.788 1.00 0.00 O ATOM 1758 CG2 THR A 114 -1.191 -8.391 -7.682 1.00 0.00 C ATOM 0 H THR A 114 0.346 -8.231 -4.800 1.00 0.00 H new ATOM 0 HA THR A 114 -1.542 -6.178 -5.845 1.00 0.00 H new ATOM 0 HB THR A 114 -3.034 -7.771 -6.759 1.00 0.00 H new ATOM 0 HG1 THR A 114 -1.826 -9.401 -4.916 1.00 0.00 H new ATOM 0 HG21 THR A 114 -1.679 -9.089 -8.362 1.00 0.00 H new ATOM 0 HG22 THR A 114 -1.037 -7.438 -8.188 1.00 0.00 H new ATOM 0 HG23 THR A 114 -0.228 -8.798 -7.375 1.00 0.00 H new ATOM 1766 N TYR A 115 -2.566 -6.309 -3.568 1.00 0.00 N ATOM 1767 CA TYR A 115 -3.167 -6.395 -2.207 1.00 0.00 C ATOM 1768 C TYR A 115 -4.652 -6.740 -2.326 1.00 0.00 C ATOM 1769 O TYR A 115 -5.464 -5.909 -2.685 1.00 0.00 O ATOM 1770 CB TYR A 115 -3.017 -5.049 -1.496 1.00 0.00 C ATOM 1771 CG TYR A 115 -1.561 -4.809 -1.175 1.00 0.00 C ATOM 1772 CD1 TYR A 115 -0.980 -5.422 -0.058 1.00 0.00 C ATOM 1773 CD2 TYR A 115 -0.792 -3.972 -1.994 1.00 0.00 C ATOM 1774 CE1 TYR A 115 0.369 -5.200 0.240 1.00 0.00 C ATOM 1775 CE2 TYR A 115 0.558 -3.750 -1.695 1.00 0.00 C ATOM 1776 CZ TYR A 115 1.138 -4.363 -0.578 1.00 0.00 C ATOM 1777 OH TYR A 115 2.468 -4.143 -0.283 1.00 0.00 O ATOM 0 H TYR A 115 -2.651 -5.400 -4.023 1.00 0.00 H new ATOM 0 HA TYR A 115 -2.656 -7.169 -1.635 1.00 0.00 H new ATOM 0 HB2 TYR A 115 -3.398 -4.247 -2.128 1.00 0.00 H new ATOM 0 HB3 TYR A 115 -3.608 -5.041 -0.580 1.00 0.00 H new ATOM 0 HD1 TYR A 115 -1.573 -6.066 0.574 1.00 0.00 H new ATOM 0 HD2 TYR A 115 -1.240 -3.498 -2.855 1.00 0.00 H new ATOM 0 HE1 TYR A 115 0.817 -5.674 1.101 1.00 0.00 H new ATOM 0 HE2 TYR A 115 1.152 -3.106 -2.326 1.00 0.00 H new ATOM 0 HH TYR A 115 2.942 -5.000 -0.250 1.00 0.00 H new ATOM 1787 N ARG A 116 -5.014 -7.956 -2.025 1.00 0.00 N ATOM 1788 CA ARG A 116 -6.447 -8.350 -2.119 1.00 0.00 C ATOM 1789 C ARG A 116 -7.115 -8.161 -0.756 1.00 0.00 C ATOM 1790 O ARG A 116 -6.545 -8.464 0.273 1.00 0.00 O ATOM 1791 CB ARG A 116 -6.545 -9.818 -2.538 1.00 0.00 C ATOM 1792 CG ARG A 116 -7.977 -10.314 -2.328 1.00 0.00 C ATOM 1793 CD ARG A 116 -8.322 -11.349 -3.401 1.00 0.00 C ATOM 1794 NE ARG A 116 -7.117 -12.170 -3.705 1.00 0.00 N ATOM 1795 CZ ARG A 116 -7.240 -13.292 -4.359 1.00 0.00 C ATOM 1796 NH1 ARG A 116 -8.419 -13.695 -4.749 1.00 0.00 N ATOM 1797 NH2 ARG A 116 -6.184 -14.013 -4.624 1.00 0.00 N ATOM 0 H ARG A 116 -4.380 -8.694 -1.718 1.00 0.00 H new ATOM 0 HA ARG A 116 -6.949 -7.728 -2.860 1.00 0.00 H new ATOM 0 HB2 ARG A 116 -6.260 -9.928 -3.584 1.00 0.00 H new ATOM 0 HB3 ARG A 116 -5.850 -10.421 -1.953 1.00 0.00 H new ATOM 0 HG2 ARG A 116 -8.078 -10.755 -1.336 1.00 0.00 H new ATOM 0 HG3 ARG A 116 -8.674 -9.477 -2.378 1.00 0.00 H new ATOM 0 HD2 ARG A 116 -9.134 -11.989 -3.056 1.00 0.00 H new ATOM 0 HD3 ARG A 116 -8.672 -10.849 -4.304 1.00 0.00 H new ATOM 0 HE ARG A 116 -6.196 -11.855 -3.402 1.00 0.00 H new ATOM 0 HH11 ARG A 116 -9.244 -13.132 -4.542 1.00 0.00 H new ATOM 0 HH12 ARG A 116 -8.515 -14.572 -5.260 1.00 0.00 H new ATOM 0 HH21 ARG A 116 -5.263 -13.699 -4.320 1.00 0.00 H new ATOM 0 HH22 ARG A 116 -6.281 -14.890 -5.135 1.00 0.00 H new ATOM 1811 N SER A 117 -8.320 -7.660 -0.740 1.00 0.00 N ATOM 1812 CA SER A 117 -9.020 -7.451 0.560 1.00 0.00 C ATOM 1813 C SER A 117 -9.394 -8.807 1.163 1.00 0.00 C ATOM 1814 O SER A 117 -9.671 -9.756 0.456 1.00 0.00 O ATOM 1815 CB SER A 117 -10.287 -6.628 0.330 1.00 0.00 C ATOM 1816 OG SER A 117 -11.174 -6.818 1.423 1.00 0.00 O ATOM 0 H SER A 117 -8.849 -7.387 -1.568 1.00 0.00 H new ATOM 0 HA SER A 117 -8.361 -6.919 1.246 1.00 0.00 H new ATOM 0 HB2 SER A 117 -10.036 -5.572 0.230 1.00 0.00 H new ATOM 0 HB3 SER A 117 -10.768 -6.931 -0.600 1.00 0.00 H new ATOM 0 HG SER A 117 -11.103 -6.058 2.038 1.00 0.00 H new ATOM 1822 N ARG A 118 -9.405 -8.905 2.464 1.00 0.00 N ATOM 1823 CA ARG A 118 -9.762 -10.200 3.112 1.00 0.00 C ATOM 1824 C ARG A 118 -11.285 -10.342 3.165 1.00 0.00 C ATOM 1825 O ARG A 118 -11.873 -11.104 2.423 1.00 0.00 O ATOM 1826 CB ARG A 118 -9.196 -10.231 4.533 1.00 0.00 C ATOM 1827 CG ARG A 118 -9.844 -11.374 5.316 1.00 0.00 C ATOM 1828 CD ARG A 118 -8.990 -11.703 6.542 1.00 0.00 C ATOM 1829 NE ARG A 118 -9.600 -12.844 7.280 1.00 0.00 N ATOM 1830 CZ ARG A 118 -8.904 -13.489 8.176 1.00 0.00 C ATOM 1831 NH1 ARG A 118 -7.673 -13.135 8.424 1.00 0.00 N ATOM 1832 NH2 ARG A 118 -9.440 -14.487 8.824 1.00 0.00 N ATOM 0 H ARG A 118 -9.182 -8.145 3.107 1.00 0.00 H new ATOM 0 HA ARG A 118 -9.341 -11.024 2.535 1.00 0.00 H new ATOM 0 HB2 ARG A 118 -8.115 -10.365 4.502 1.00 0.00 H new ATOM 0 HB3 ARG A 118 -9.386 -9.281 5.032 1.00 0.00 H new ATOM 0 HG2 ARG A 118 -10.850 -11.092 5.626 1.00 0.00 H new ATOM 0 HG3 ARG A 118 -9.941 -12.254 4.681 1.00 0.00 H new ATOM 0 HD2 ARG A 118 -7.975 -11.956 6.234 1.00 0.00 H new ATOM 0 HD3 ARG A 118 -8.918 -10.832 7.193 1.00 0.00 H new ATOM 0 HE ARG A 118 -10.562 -13.121 7.085 1.00 0.00 H new ATOM 0 HH11 ARG A 118 -7.255 -12.354 7.918 1.00 0.00 H new ATOM 0 HH12 ARG A 118 -7.129 -13.639 9.124 1.00 0.00 H new ATOM 0 HH21 ARG A 118 -10.403 -14.763 8.630 1.00 0.00 H new ATOM 0 HH22 ARG A 118 -8.896 -14.991 9.524 1.00 0.00 H new ATOM 1846 N LYS A 119 -11.930 -9.612 4.034 1.00 0.00 N ATOM 1847 CA LYS A 119 -13.414 -9.706 4.132 1.00 0.00 C ATOM 1848 C LYS A 119 -14.027 -9.525 2.741 1.00 0.00 C ATOM 1849 O LYS A 119 -15.206 -9.737 2.541 1.00 0.00 O ATOM 1850 CB LYS A 119 -13.934 -8.610 5.065 1.00 0.00 C ATOM 1851 CG LYS A 119 -15.350 -8.960 5.524 1.00 0.00 C ATOM 1852 CD LYS A 119 -15.295 -9.576 6.923 1.00 0.00 C ATOM 1853 CE LYS A 119 -16.703 -9.988 7.357 1.00 0.00 C ATOM 1854 NZ LYS A 119 -16.852 -9.775 8.825 1.00 0.00 N ATOM 0 H LYS A 119 -11.493 -8.955 4.680 1.00 0.00 H new ATOM 0 HA LYS A 119 -13.692 -10.682 4.529 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -13.275 -8.509 5.928 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -13.934 -7.649 4.550 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -15.972 -8.065 5.533 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -15.808 -9.660 4.825 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -14.635 -10.443 6.924 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -14.880 -8.859 7.631 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -17.448 -9.404 6.816 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -16.879 -11.035 7.111 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -17.809 -10.055 9.121 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -16.150 -10.351 9.332 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -16.701 -8.770 9.047 1.00 0.00 H new ATOM 1868 N TYR A 120 -13.231 -9.132 1.783 1.00 0.00 N ATOM 1869 CA TYR A 120 -13.753 -8.932 0.400 1.00 0.00 C ATOM 1870 C TYR A 120 -12.733 -9.471 -0.605 1.00 0.00 C ATOM 1871 O TYR A 120 -12.112 -8.725 -1.336 1.00 0.00 O ATOM 1872 CB TYR A 120 -13.979 -7.437 0.156 1.00 0.00 C ATOM 1873 CG TYR A 120 -14.631 -6.821 1.373 1.00 0.00 C ATOM 1874 CD1 TYR A 120 -15.871 -7.296 1.815 1.00 0.00 C ATOM 1875 CD2 TYR A 120 -13.997 -5.775 2.058 1.00 0.00 C ATOM 1876 CE1 TYR A 120 -16.480 -6.727 2.941 1.00 0.00 C ATOM 1877 CE2 TYR A 120 -14.606 -5.207 3.184 1.00 0.00 C ATOM 1878 CZ TYR A 120 -15.847 -5.683 3.625 1.00 0.00 C ATOM 1879 OH TYR A 120 -16.446 -5.122 4.735 1.00 0.00 O ATOM 0 H TYR A 120 -12.236 -8.940 1.900 1.00 0.00 H new ATOM 0 HA TYR A 120 -14.697 -9.464 0.280 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -13.029 -6.944 -0.050 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -14.610 -7.292 -0.721 1.00 0.00 H new ATOM 0 HD1 TYR A 120 -16.359 -8.102 1.287 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -13.040 -5.408 1.718 1.00 0.00 H new ATOM 0 HE1 TYR A 120 -17.437 -7.094 3.281 1.00 0.00 H new ATOM 0 HE2 TYR A 120 -14.118 -4.401 3.713 1.00 0.00 H new ATOM 0 HH TYR A 120 -15.874 -4.411 5.091 1.00 0.00 H new ATOM 1889 N THR A 121 -12.552 -10.763 -0.642 1.00 0.00 N ATOM 1890 CA THR A 121 -11.569 -11.357 -1.593 1.00 0.00 C ATOM 1891 C THR A 121 -12.010 -11.087 -3.033 1.00 0.00 C ATOM 1892 O THR A 121 -11.237 -11.212 -3.962 1.00 0.00 O ATOM 1893 CB THR A 121 -11.486 -12.868 -1.361 1.00 0.00 C ATOM 1894 OG1 THR A 121 -12.769 -13.446 -1.560 1.00 0.00 O ATOM 1895 CG2 THR A 121 -11.017 -13.142 0.069 1.00 0.00 C ATOM 0 H THR A 121 -13.044 -11.435 -0.053 1.00 0.00 H new ATOM 0 HA THR A 121 -10.591 -10.906 -1.427 1.00 0.00 H new ATOM 0 HB THR A 121 -10.776 -13.306 -2.063 1.00 0.00 H new ATOM 0 HG1 THR A 121 -12.718 -14.414 -1.414 1.00 0.00 H new ATOM 0 HG21 THR A 121 -10.958 -14.218 0.233 1.00 0.00 H new ATOM 0 HG22 THR A 121 -10.033 -12.698 0.221 1.00 0.00 H new ATOM 0 HG23 THR A 121 -11.725 -12.706 0.774 1.00 0.00 H new ATOM 1903 N SER A 122 -13.246 -10.718 -3.229 1.00 0.00 N ATOM 1904 CA SER A 122 -13.729 -10.443 -4.612 1.00 0.00 C ATOM 1905 C SER A 122 -13.501 -8.967 -4.946 1.00 0.00 C ATOM 1906 O SER A 122 -14.095 -8.427 -5.857 1.00 0.00 O ATOM 1907 CB SER A 122 -15.220 -10.766 -4.704 1.00 0.00 C ATOM 1908 OG SER A 122 -15.387 -12.169 -4.863 1.00 0.00 O ATOM 0 H SER A 122 -13.941 -10.595 -2.493 1.00 0.00 H new ATOM 0 HA SER A 122 -13.181 -11.064 -5.321 1.00 0.00 H new ATOM 0 HB2 SER A 122 -15.734 -10.426 -3.805 1.00 0.00 H new ATOM 0 HB3 SER A 122 -15.667 -10.237 -5.546 1.00 0.00 H new ATOM 0 HG SER A 122 -16.342 -12.380 -4.921 1.00 0.00 H new ATOM 1914 N TRP A 123 -12.638 -8.314 -4.217 1.00 0.00 N ATOM 1915 CA TRP A 123 -12.362 -6.876 -4.490 1.00 0.00 C ATOM 1916 C TRP A 123 -10.909 -6.555 -4.135 1.00 0.00 C ATOM 1917 O TRP A 123 -10.469 -6.768 -3.020 1.00 0.00 O ATOM 1918 CB TRP A 123 -13.299 -6.003 -3.650 1.00 0.00 C ATOM 1919 CG TRP A 123 -14.632 -5.901 -4.323 1.00 0.00 C ATOM 1920 CD1 TRP A 123 -14.963 -4.960 -5.236 1.00 0.00 C ATOM 1921 CD2 TRP A 123 -15.813 -6.740 -4.154 1.00 0.00 C ATOM 1922 NE1 TRP A 123 -16.269 -5.167 -5.640 1.00 0.00 N ATOM 1923 CE2 TRP A 123 -16.836 -6.252 -5.002 1.00 0.00 C ATOM 1924 CE3 TRP A 123 -16.094 -7.865 -3.359 1.00 0.00 C ATOM 1925 CZ2 TRP A 123 -18.092 -6.856 -5.058 1.00 0.00 C ATOM 1926 CZ3 TRP A 123 -17.358 -8.477 -3.413 1.00 0.00 C ATOM 1927 CH2 TRP A 123 -18.355 -7.972 -4.259 1.00 0.00 C ATOM 0 H TRP A 123 -12.111 -8.716 -3.442 1.00 0.00 H new ATOM 0 HA TRP A 123 -12.530 -6.672 -5.548 1.00 0.00 H new ATOM 0 HB2 TRP A 123 -13.415 -6.431 -2.654 1.00 0.00 H new ATOM 0 HB3 TRP A 123 -12.869 -5.010 -3.522 1.00 0.00 H new ATOM 0 HD1 TRP A 123 -14.313 -4.174 -5.592 1.00 0.00 H new ATOM 0 HE1 TRP A 123 -16.754 -4.589 -6.326 1.00 0.00 H new ATOM 0 HE3 TRP A 123 -15.334 -8.261 -2.703 1.00 0.00 H new ATOM 0 HZ2 TRP A 123 -18.855 -6.464 -5.714 1.00 0.00 H new ATOM 0 HZ3 TRP A 123 -17.562 -9.342 -2.799 1.00 0.00 H new ATOM 0 HH2 TRP A 123 -19.325 -8.445 -4.293 1.00 0.00 H new ATOM 1938 N TYR A 124 -10.161 -6.042 -5.078 1.00 0.00 N ATOM 1939 CA TYR A 124 -8.733 -5.703 -4.809 1.00 0.00 C ATOM 1940 C TYR A 124 -8.604 -4.198 -4.566 1.00 0.00 C ATOM 1941 O TYR A 124 -9.494 -3.431 -4.875 1.00 0.00 O ATOM 1942 CB TYR A 124 -7.881 -6.094 -6.019 1.00 0.00 C ATOM 1943 CG TYR A 124 -8.059 -7.566 -6.309 1.00 0.00 C ATOM 1944 CD1 TYR A 124 -9.231 -8.022 -6.924 1.00 0.00 C ATOM 1945 CD2 TYR A 124 -7.050 -8.473 -5.965 1.00 0.00 C ATOM 1946 CE1 TYR A 124 -9.395 -9.385 -7.194 1.00 0.00 C ATOM 1947 CE2 TYR A 124 -7.214 -9.837 -6.236 1.00 0.00 C ATOM 1948 CZ TYR A 124 -8.387 -10.293 -6.850 1.00 0.00 C ATOM 1949 OH TYR A 124 -8.548 -11.638 -7.117 1.00 0.00 O ATOM 0 H TYR A 124 -10.480 -5.843 -6.026 1.00 0.00 H new ATOM 0 HA TYR A 124 -8.390 -6.246 -3.928 1.00 0.00 H new ATOM 0 HB2 TYR A 124 -8.173 -5.504 -6.888 1.00 0.00 H new ATOM 0 HB3 TYR A 124 -6.831 -5.876 -5.823 1.00 0.00 H new ATOM 0 HD1 TYR A 124 -10.009 -7.322 -7.190 1.00 0.00 H new ATOM 0 HD2 TYR A 124 -6.146 -8.121 -5.491 1.00 0.00 H new ATOM 0 HE1 TYR A 124 -10.300 -9.737 -7.668 1.00 0.00 H new ATOM 0 HE2 TYR A 124 -6.436 -10.537 -5.971 1.00 0.00 H new ATOM 0 HH TYR A 124 -7.755 -12.129 -6.816 1.00 0.00 H new ATOM 1959 N VAL A 125 -7.499 -3.770 -4.016 1.00 0.00 N ATOM 1960 CA VAL A 125 -7.309 -2.314 -3.754 1.00 0.00 C ATOM 1961 C VAL A 125 -6.539 -1.686 -4.918 1.00 0.00 C ATOM 1962 O VAL A 125 -5.610 -2.265 -5.444 1.00 0.00 O ATOM 1963 CB VAL A 125 -6.512 -2.129 -2.460 1.00 0.00 C ATOM 1964 CG1 VAL A 125 -6.331 -0.637 -2.180 1.00 0.00 C ATOM 1965 CG2 VAL A 125 -7.271 -2.776 -1.298 1.00 0.00 C ATOM 0 H VAL A 125 -6.720 -4.366 -3.737 1.00 0.00 H new ATOM 0 HA VAL A 125 -8.281 -1.831 -3.655 1.00 0.00 H new ATOM 0 HB VAL A 125 -5.535 -2.600 -2.565 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -5.764 -0.506 -1.259 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -5.792 -0.174 -3.007 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -7.308 -0.165 -2.075 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -6.705 -2.645 -0.376 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -8.248 -2.304 -1.194 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -7.401 -3.840 -1.496 1.00 0.00 H new ATOM 1975 N ALA A 126 -6.918 -0.506 -5.327 1.00 0.00 N ATOM 1976 CA ALA A 126 -6.207 0.154 -6.458 1.00 0.00 C ATOM 1977 C ALA A 126 -6.375 1.672 -6.355 1.00 0.00 C ATOM 1978 O ALA A 126 -6.936 2.180 -5.404 1.00 0.00 O ATOM 1979 CB ALA A 126 -6.793 -0.335 -7.783 1.00 0.00 C ATOM 0 H ALA A 126 -7.689 0.029 -4.927 1.00 0.00 H new ATOM 0 HA ALA A 126 -5.147 -0.096 -6.414 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -6.273 0.147 -8.611 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -6.671 -1.416 -7.858 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -7.853 -0.086 -7.826 1.00 0.00 H new ATOM 1985 N LEU A 127 -5.890 2.398 -7.327 1.00 0.00 N ATOM 1986 CA LEU A 127 -6.016 3.886 -7.293 1.00 0.00 C ATOM 1987 C LEU A 127 -6.311 4.401 -8.704 1.00 0.00 C ATOM 1988 O LEU A 127 -6.168 3.689 -9.678 1.00 0.00 O ATOM 1989 CB LEU A 127 -4.704 4.502 -6.796 1.00 0.00 C ATOM 1990 CG LEU A 127 -4.507 4.191 -5.306 1.00 0.00 C ATOM 1991 CD1 LEU A 127 -3.132 4.692 -4.861 1.00 0.00 C ATOM 1992 CD2 LEU A 127 -5.591 4.885 -4.472 1.00 0.00 C ATOM 0 H LEU A 127 -5.410 2.024 -8.146 1.00 0.00 H new ATOM 0 HA LEU A 127 -6.827 4.165 -6.620 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -3.867 4.107 -7.372 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -4.718 5.581 -6.952 1.00 0.00 H new ATOM 0 HG LEU A 127 -4.577 3.114 -5.157 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -2.990 4.472 -3.803 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -2.357 4.193 -5.443 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -3.068 5.768 -5.020 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -5.440 4.657 -3.417 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -5.531 5.963 -4.622 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -6.573 4.529 -4.783 1.00 0.00 H new ATOM 2004 N LYS A 128 -6.719 5.636 -8.819 1.00 0.00 N ATOM 2005 CA LYS A 128 -7.021 6.201 -10.166 1.00 0.00 C ATOM 2006 C LYS A 128 -5.784 6.925 -10.700 1.00 0.00 C ATOM 2007 O LYS A 128 -4.769 7.015 -10.037 1.00 0.00 O ATOM 2008 CB LYS A 128 -8.182 7.190 -10.056 1.00 0.00 C ATOM 2009 CG LYS A 128 -9.441 6.451 -9.599 1.00 0.00 C ATOM 2010 CD LYS A 128 -10.652 7.379 -9.716 1.00 0.00 C ATOM 2011 CE LYS A 128 -11.571 6.880 -10.832 1.00 0.00 C ATOM 2012 NZ LYS A 128 -10.801 6.787 -12.105 1.00 0.00 N ATOM 0 H LYS A 128 -6.856 6.278 -8.039 1.00 0.00 H new ATOM 0 HA LYS A 128 -7.295 5.395 -10.847 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -7.934 7.980 -9.348 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -8.358 7.669 -11.019 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -9.593 5.560 -10.208 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -9.325 6.117 -8.568 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -11.193 7.409 -8.770 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -10.324 8.397 -9.928 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -11.982 5.905 -10.571 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -12.415 7.559 -10.954 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -11.456 6.835 -12.911 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -10.126 7.576 -12.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -10.283 5.885 -12.132 1.00 0.00 H new ATOM 2026 N ARG A 129 -5.859 7.446 -11.894 1.00 0.00 N ATOM 2027 CA ARG A 129 -4.689 8.168 -12.467 1.00 0.00 C ATOM 2028 C ARG A 129 -4.797 9.656 -12.128 1.00 0.00 C ATOM 2029 O ARG A 129 -3.889 10.426 -12.373 1.00 0.00 O ATOM 2030 CB ARG A 129 -4.668 7.979 -13.989 1.00 0.00 C ATOM 2031 CG ARG A 129 -5.905 8.651 -14.612 1.00 0.00 C ATOM 2032 CD ARG A 129 -5.585 10.087 -15.066 1.00 0.00 C ATOM 2033 NE ARG A 129 -6.700 11.009 -14.671 1.00 0.00 N ATOM 2034 CZ ARG A 129 -7.951 10.701 -14.896 1.00 0.00 C ATOM 2035 NH1 ARG A 129 -8.257 9.633 -15.579 1.00 0.00 N ATOM 2036 NH2 ARG A 129 -8.899 11.487 -14.465 1.00 0.00 N ATOM 0 H ARG A 129 -6.680 7.403 -12.497 1.00 0.00 H new ATOM 0 HA ARG A 129 -3.767 7.769 -12.044 1.00 0.00 H new ATOM 0 HB2 ARG A 129 -3.758 8.411 -14.406 1.00 0.00 H new ATOM 0 HB3 ARG A 129 -4.657 6.917 -14.233 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -6.251 8.065 -15.464 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -6.718 8.668 -13.886 1.00 0.00 H new ATOM 0 HD2 ARG A 129 -4.650 10.420 -14.616 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -5.446 10.113 -16.147 1.00 0.00 H new ATOM 0 HE ARG A 129 -6.478 11.895 -14.217 1.00 0.00 H new ATOM 0 HH11 ARG A 129 -7.518 9.031 -15.942 1.00 0.00 H new ATOM 0 HH12 ARG A 129 -9.235 9.400 -15.750 1.00 0.00 H new ATOM 0 HH21 ARG A 129 -8.663 12.338 -13.955 1.00 0.00 H new ATOM 0 HH22 ARG A 129 -9.876 11.250 -14.638 1.00 0.00 H new ATOM 2050 N THR A 130 -5.901 10.065 -11.566 1.00 0.00 N ATOM 2051 CA THR A 130 -6.070 11.502 -11.210 1.00 0.00 C ATOM 2052 C THR A 130 -5.649 11.721 -9.755 1.00 0.00 C ATOM 2053 O THR A 130 -5.689 12.823 -9.248 1.00 0.00 O ATOM 2054 CB THR A 130 -7.539 11.898 -11.381 1.00 0.00 C ATOM 2055 OG1 THR A 130 -7.797 13.081 -10.638 1.00 0.00 O ATOM 2056 CG2 THR A 130 -8.437 10.769 -10.874 1.00 0.00 C ATOM 0 H THR A 130 -6.694 9.466 -11.338 1.00 0.00 H new ATOM 0 HA THR A 130 -5.448 12.114 -11.863 1.00 0.00 H new ATOM 0 HB THR A 130 -7.747 12.077 -12.436 1.00 0.00 H new ATOM 0 HG1 THR A 130 -6.972 13.379 -10.200 1.00 0.00 H new ATOM 0 HG21 THR A 130 -9.482 11.053 -10.996 1.00 0.00 H new ATOM 0 HG22 THR A 130 -8.238 9.862 -11.444 1.00 0.00 H new ATOM 0 HG23 THR A 130 -8.232 10.587 -9.819 1.00 0.00 H new ATOM 2064 N GLY A 131 -5.244 10.678 -9.082 1.00 0.00 N ATOM 2065 CA GLY A 131 -4.819 10.825 -7.660 1.00 0.00 C ATOM 2066 C GLY A 131 -6.000 10.520 -6.738 1.00 0.00 C ATOM 2067 O GLY A 131 -5.884 10.566 -5.529 1.00 0.00 O ATOM 0 H GLY A 131 -5.189 9.730 -9.455 1.00 0.00 H new ATOM 0 HA2 GLY A 131 -3.992 10.148 -7.445 1.00 0.00 H new ATOM 0 HA3 GLY A 131 -4.457 11.837 -7.481 1.00 0.00 H new ATOM 2071 N GLN A 132 -7.137 10.207 -7.297 1.00 0.00 N ATOM 2072 CA GLN A 132 -8.325 9.900 -6.450 1.00 0.00 C ATOM 2073 C GLN A 132 -8.361 8.400 -6.151 1.00 0.00 C ATOM 2074 O GLN A 132 -7.665 7.618 -6.769 1.00 0.00 O ATOM 2075 CB GLN A 132 -9.600 10.303 -7.194 1.00 0.00 C ATOM 2076 CG GLN A 132 -9.631 11.823 -7.367 1.00 0.00 C ATOM 2077 CD GLN A 132 -10.846 12.396 -6.635 1.00 0.00 C ATOM 2078 OE1 GLN A 132 -11.781 12.862 -7.256 1.00 0.00 O ATOM 2079 NE2 GLN A 132 -10.874 12.381 -5.330 1.00 0.00 N ATOM 0 H GLN A 132 -7.295 10.151 -8.303 1.00 0.00 H new ATOM 0 HA GLN A 132 -8.260 10.456 -5.515 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -9.635 9.815 -8.168 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -10.478 9.971 -6.639 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -8.715 12.263 -6.973 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -9.677 12.078 -8.426 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -10.090 11.990 -4.808 1.00 0.00 H new ATOM 0 HE22 GLN A 132 -11.680 12.760 -4.833 1.00 0.00 H new ATOM 2088 N TYR A 133 -9.165 7.991 -5.208 1.00 0.00 N ATOM 2089 CA TYR A 133 -9.240 6.541 -4.874 1.00 0.00 C ATOM 2090 C TYR A 133 -10.238 5.852 -5.810 1.00 0.00 C ATOM 2091 O TYR A 133 -11.403 6.193 -5.855 1.00 0.00 O ATOM 2092 CB TYR A 133 -9.688 6.370 -3.419 1.00 0.00 C ATOM 2093 CG TYR A 133 -11.164 6.666 -3.298 1.00 0.00 C ATOM 2094 CD1 TYR A 133 -11.614 7.992 -3.287 1.00 0.00 C ATOM 2095 CD2 TYR A 133 -12.083 5.615 -3.195 1.00 0.00 C ATOM 2096 CE1 TYR A 133 -12.982 8.266 -3.174 1.00 0.00 C ATOM 2097 CE2 TYR A 133 -13.451 5.889 -3.081 1.00 0.00 C ATOM 2098 CZ TYR A 133 -13.901 7.214 -3.071 1.00 0.00 C ATOM 2099 OH TYR A 133 -15.249 7.484 -2.959 1.00 0.00 O ATOM 0 H TYR A 133 -9.772 8.597 -4.656 1.00 0.00 H new ATOM 0 HA TYR A 133 -8.257 6.088 -5.000 1.00 0.00 H new ATOM 0 HB2 TYR A 133 -9.483 5.353 -3.083 1.00 0.00 H new ATOM 0 HB3 TYR A 133 -9.120 7.039 -2.773 1.00 0.00 H new ATOM 0 HD1 TYR A 133 -10.906 8.803 -3.366 1.00 0.00 H new ATOM 0 HD2 TYR A 133 -11.736 4.592 -3.203 1.00 0.00 H new ATOM 0 HE1 TYR A 133 -13.329 9.289 -3.166 1.00 0.00 H new ATOM 0 HE2 TYR A 133 -14.159 5.078 -3.001 1.00 0.00 H new ATOM 0 HH TYR A 133 -15.747 6.642 -2.898 1.00 0.00 H new ATOM 2109 N LYS A 134 -9.786 4.887 -6.563 1.00 0.00 N ATOM 2110 CA LYS A 134 -10.703 4.177 -7.500 1.00 0.00 C ATOM 2111 C LYS A 134 -11.683 3.315 -6.702 1.00 0.00 C ATOM 2112 O LYS A 134 -11.288 2.463 -5.930 1.00 0.00 O ATOM 2113 CB LYS A 134 -9.881 3.284 -8.432 1.00 0.00 C ATOM 2114 CG LYS A 134 -10.731 2.876 -9.637 1.00 0.00 C ATOM 2115 CD LYS A 134 -9.872 2.073 -10.617 1.00 0.00 C ATOM 2116 CE LYS A 134 -10.775 1.368 -11.630 1.00 0.00 C ATOM 2117 NZ LYS A 134 -11.657 2.371 -12.292 1.00 0.00 N ATOM 0 H LYS A 134 -8.820 4.559 -6.570 1.00 0.00 H new ATOM 0 HA LYS A 134 -11.259 4.907 -8.088 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -8.989 3.814 -8.767 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -9.542 2.397 -7.897 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -11.583 2.280 -9.310 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -11.132 3.762 -10.129 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -9.176 2.734 -11.133 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -9.273 1.340 -10.076 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -10.170 0.852 -12.375 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -11.379 0.611 -11.130 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -12.186 1.914 -13.062 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -12.325 2.759 -11.596 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -11.076 3.141 -12.681 1.00 0.00 H new ATOM 2131 N LEU A 135 -12.957 3.527 -6.881 1.00 0.00 N ATOM 2132 CA LEU A 135 -13.958 2.716 -6.132 1.00 0.00 C ATOM 2133 C LEU A 135 -13.587 1.236 -6.239 1.00 0.00 C ATOM 2134 O LEU A 135 -12.851 0.834 -7.118 1.00 0.00 O ATOM 2135 CB LEU A 135 -15.350 2.937 -6.733 1.00 0.00 C ATOM 2136 CG LEU A 135 -16.426 2.545 -5.712 1.00 0.00 C ATOM 2137 CD1 LEU A 135 -16.441 3.537 -4.542 1.00 0.00 C ATOM 2138 CD2 LEU A 135 -17.795 2.550 -6.396 1.00 0.00 C ATOM 0 H LEU A 135 -13.348 4.226 -7.513 1.00 0.00 H new ATOM 0 HA LEU A 135 -13.964 3.019 -5.085 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -15.471 3.982 -7.019 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -15.463 2.343 -7.640 1.00 0.00 H new ATOM 0 HG LEU A 135 -16.203 1.550 -5.328 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -17.210 3.245 -3.827 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -15.468 3.534 -4.050 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -16.656 4.538 -4.916 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -18.563 2.272 -5.674 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -18.005 3.547 -6.783 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -17.794 1.834 -7.218 1.00 0.00 H new ATOM 2150 N GLY A 136 -14.087 0.421 -5.350 1.00 0.00 N ATOM 2151 CA GLY A 136 -13.758 -1.031 -5.403 1.00 0.00 C ATOM 2152 C GLY A 136 -14.571 -1.706 -6.511 1.00 0.00 C ATOM 2153 O GLY A 136 -14.066 -2.525 -7.252 1.00 0.00 O ATOM 0 H GLY A 136 -14.708 0.698 -4.590 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -12.692 -1.165 -5.588 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -13.976 -1.498 -4.443 1.00 0.00 H new ATOM 2157 N SER A 137 -15.827 -1.371 -6.628 1.00 0.00 N ATOM 2158 CA SER A 137 -16.667 -1.999 -7.687 1.00 0.00 C ATOM 2159 C SER A 137 -16.061 -1.713 -9.063 1.00 0.00 C ATOM 2160 O SER A 137 -16.375 -2.366 -10.038 1.00 0.00 O ATOM 2161 CB SER A 137 -18.081 -1.421 -7.625 1.00 0.00 C ATOM 2162 OG SER A 137 -18.099 -0.156 -8.274 1.00 0.00 O ATOM 0 H SER A 137 -16.307 -0.691 -6.038 1.00 0.00 H new ATOM 0 HA SER A 137 -16.705 -3.076 -7.525 1.00 0.00 H new ATOM 0 HB2 SER A 137 -18.785 -2.100 -8.106 1.00 0.00 H new ATOM 0 HB3 SER A 137 -18.398 -1.315 -6.588 1.00 0.00 H new ATOM 0 HG SER A 137 -19.004 0.217 -8.238 1.00 0.00 H new ATOM 2168 N LYS A 138 -15.195 -0.740 -9.151 1.00 0.00 N ATOM 2169 CA LYS A 138 -14.574 -0.413 -10.466 1.00 0.00 C ATOM 2170 C LYS A 138 -13.285 -1.220 -10.646 1.00 0.00 C ATOM 2171 O LYS A 138 -12.705 -1.247 -11.713 1.00 0.00 O ATOM 2172 CB LYS A 138 -14.253 1.082 -10.518 1.00 0.00 C ATOM 2173 CG LYS A 138 -15.553 1.879 -10.650 1.00 0.00 C ATOM 2174 CD LYS A 138 -15.228 3.369 -10.771 1.00 0.00 C ATOM 2175 CE LYS A 138 -16.482 4.131 -11.203 1.00 0.00 C ATOM 2176 NZ LYS A 138 -17.695 3.379 -10.773 1.00 0.00 N ATOM 0 H LYS A 138 -14.891 -0.158 -8.370 1.00 0.00 H new ATOM 0 HA LYS A 138 -15.269 -0.666 -11.266 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -13.720 1.382 -9.616 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -13.596 1.295 -11.362 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -16.109 1.545 -11.526 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -16.189 1.704 -9.782 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -14.867 3.752 -9.816 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -14.429 3.520 -11.497 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -16.484 5.128 -10.762 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -16.487 4.261 -12.285 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -18.530 3.994 -10.849 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -17.822 2.546 -11.383 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -17.581 3.071 -9.786 1.00 0.00 H new ATOM 2190 N THR A 139 -12.831 -1.878 -9.614 1.00 0.00 N ATOM 2191 CA THR A 139 -11.578 -2.678 -9.736 1.00 0.00 C ATOM 2192 C THR A 139 -11.891 -4.023 -10.394 1.00 0.00 C ATOM 2193 O THR A 139 -13.028 -4.331 -10.693 1.00 0.00 O ATOM 2194 CB THR A 139 -10.984 -2.920 -8.347 1.00 0.00 C ATOM 2195 OG1 THR A 139 -11.953 -3.549 -7.521 1.00 0.00 O ATOM 2196 CG2 THR A 139 -10.570 -1.586 -7.726 1.00 0.00 C ATOM 0 H THR A 139 -13.272 -1.897 -8.694 1.00 0.00 H new ATOM 0 HA THR A 139 -10.861 -2.130 -10.347 1.00 0.00 H new ATOM 0 HB THR A 139 -10.109 -3.564 -8.435 1.00 0.00 H new ATOM 0 HG1 THR A 139 -12.634 -2.895 -7.260 1.00 0.00 H new ATOM 0 HG21 THR A 139 -10.147 -1.761 -6.737 1.00 0.00 H new ATOM 0 HG22 THR A 139 -9.824 -1.106 -8.360 1.00 0.00 H new ATOM 0 HG23 THR A 139 -11.443 -0.939 -7.638 1.00 0.00 H new ATOM 2204 N GLY A 140 -10.888 -4.828 -10.621 1.00 0.00 N ATOM 2205 CA GLY A 140 -11.124 -6.154 -11.258 1.00 0.00 C ATOM 2206 C GLY A 140 -9.919 -6.517 -12.133 1.00 0.00 C ATOM 2207 O GLY A 140 -8.984 -5.748 -12.235 1.00 0.00 O ATOM 0 H GLY A 140 -9.915 -4.624 -10.392 1.00 0.00 H new ATOM 0 HA2 GLY A 140 -11.275 -6.916 -10.493 1.00 0.00 H new ATOM 0 HA3 GLY A 140 -12.031 -6.124 -11.862 1.00 0.00 H new ATOM 2211 N PRO A 141 -9.973 -7.677 -12.740 1.00 0.00 N ATOM 2212 CA PRO A 141 -8.882 -8.151 -13.612 1.00 0.00 C ATOM 2213 C PRO A 141 -8.688 -7.187 -14.786 1.00 0.00 C ATOM 2214 O PRO A 141 -9.525 -6.350 -15.059 1.00 0.00 O ATOM 2215 CB PRO A 141 -9.346 -9.524 -14.114 1.00 0.00 C ATOM 2216 CG PRO A 141 -10.742 -9.804 -13.499 1.00 0.00 C ATOM 2217 CD PRO A 141 -11.111 -8.607 -12.610 1.00 0.00 C ATOM 0 HA PRO A 141 -7.928 -8.209 -13.088 1.00 0.00 H new ATOM 0 HB2 PRO A 141 -9.398 -9.535 -15.203 1.00 0.00 H new ATOM 0 HB3 PRO A 141 -8.637 -10.298 -13.821 1.00 0.00 H new ATOM 0 HG2 PRO A 141 -11.485 -9.940 -14.285 1.00 0.00 H new ATOM 0 HG3 PRO A 141 -10.724 -10.724 -12.914 1.00 0.00 H new ATOM 0 HD2 PRO A 141 -12.041 -8.143 -12.938 1.00 0.00 H new ATOM 0 HD3 PRO A 141 -11.255 -8.913 -11.574 1.00 0.00 H new ATOM 2225 N GLY A 142 -7.589 -7.297 -15.481 1.00 0.00 N ATOM 2226 CA GLY A 142 -7.344 -6.388 -16.637 1.00 0.00 C ATOM 2227 C GLY A 142 -6.908 -5.014 -16.126 1.00 0.00 C ATOM 2228 O GLY A 142 -6.064 -4.364 -16.708 1.00 0.00 O ATOM 0 H GLY A 142 -6.850 -7.976 -15.299 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -6.574 -6.807 -17.285 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -8.249 -6.294 -17.237 1.00 0.00 H new ATOM 2232 N GLN A 143 -7.479 -4.566 -15.040 1.00 0.00 N ATOM 2233 CA GLN A 143 -7.098 -3.233 -14.495 1.00 0.00 C ATOM 2234 C GLN A 143 -5.648 -3.276 -14.007 1.00 0.00 C ATOM 2235 O GLN A 143 -5.293 -4.067 -13.156 1.00 0.00 O ATOM 2236 CB GLN A 143 -8.018 -2.877 -13.326 1.00 0.00 C ATOM 2237 CG GLN A 143 -9.472 -3.136 -13.723 1.00 0.00 C ATOM 2238 CD GLN A 143 -9.804 -2.345 -14.989 1.00 0.00 C ATOM 2239 OE1 GLN A 143 -9.551 -2.799 -16.087 1.00 0.00 O ATOM 2240 NE2 GLN A 143 -10.367 -1.173 -14.883 1.00 0.00 N ATOM 0 H GLN A 143 -8.192 -5.065 -14.508 1.00 0.00 H new ATOM 0 HA GLN A 143 -7.196 -2.480 -15.277 1.00 0.00 H new ATOM 0 HB2 GLN A 143 -7.758 -3.472 -12.450 1.00 0.00 H new ATOM 0 HB3 GLN A 143 -7.886 -1.831 -13.051 1.00 0.00 H new ATOM 0 HG2 GLN A 143 -9.629 -4.201 -13.895 1.00 0.00 H new ATOM 0 HG3 GLN A 143 -10.139 -2.842 -12.913 1.00 0.00 H new ATOM 0 HE21 GLN A 143 -10.580 -0.791 -13.962 1.00 0.00 H new ATOM 0 HE22 GLN A 143 -10.594 -0.639 -15.722 1.00 0.00 H new ATOM 2249 N LYS A 144 -4.808 -2.431 -14.539 1.00 0.00 N ATOM 2250 CA LYS A 144 -3.381 -2.425 -14.104 1.00 0.00 C ATOM 2251 C LYS A 144 -3.252 -1.641 -12.796 1.00 0.00 C ATOM 2252 O LYS A 144 -2.209 -1.619 -12.175 1.00 0.00 O ATOM 2253 CB LYS A 144 -2.522 -1.761 -15.183 1.00 0.00 C ATOM 2254 CG LYS A 144 -2.999 -2.212 -16.566 1.00 0.00 C ATOM 2255 CD LYS A 144 -1.901 -1.943 -17.598 1.00 0.00 C ATOM 2256 CE LYS A 144 -1.531 -0.459 -17.575 1.00 0.00 C ATOM 2257 NZ LYS A 144 -0.880 -0.089 -18.863 1.00 0.00 N ATOM 0 H LYS A 144 -5.047 -1.745 -15.255 1.00 0.00 H new ATOM 0 HA LYS A 144 -3.043 -3.450 -13.950 1.00 0.00 H new ATOM 0 HB2 LYS A 144 -2.589 -0.676 -15.100 1.00 0.00 H new ATOM 0 HB3 LYS A 144 -1.474 -2.027 -15.043 1.00 0.00 H new ATOM 0 HG2 LYS A 144 -3.245 -3.274 -16.549 1.00 0.00 H new ATOM 0 HG3 LYS A 144 -3.909 -1.679 -16.840 1.00 0.00 H new ATOM 0 HD2 LYS A 144 -1.023 -2.551 -17.378 1.00 0.00 H new ATOM 0 HD3 LYS A 144 -2.244 -2.228 -18.593 1.00 0.00 H new ATOM 0 HE2 LYS A 144 -2.424 0.147 -17.419 1.00 0.00 H new ATOM 0 HE3 LYS A 144 -0.857 -0.254 -16.743 1.00 0.00 H new ATOM 0 HZ1 LYS A 144 -0.628 0.920 -18.848 1.00 0.00 H new ATOM 0 HZ2 LYS A 144 -0.020 -0.658 -18.993 1.00 0.00 H new ATOM 0 HZ3 LYS A 144 -1.537 -0.270 -19.649 1.00 0.00 H new ATOM 2271 N ALA A 145 -4.307 -0.998 -12.374 1.00 0.00 N ATOM 2272 CA ALA A 145 -4.247 -0.216 -11.106 1.00 0.00 C ATOM 2273 C ALA A 145 -3.890 -1.148 -9.945 1.00 0.00 C ATOM 2274 O ALA A 145 -3.673 -0.712 -8.833 1.00 0.00 O ATOM 2275 CB ALA A 145 -5.607 0.430 -10.842 1.00 0.00 C ATOM 0 H ALA A 145 -5.208 -0.980 -12.852 1.00 0.00 H new ATOM 0 HA ALA A 145 -3.486 0.560 -11.194 1.00 0.00 H new ATOM 0 HB1 ALA A 145 -5.564 1.002 -9.915 1.00 0.00 H new ATOM 0 HB2 ALA A 145 -5.860 1.095 -11.668 1.00 0.00 H new ATOM 0 HB3 ALA A 145 -6.368 -0.346 -10.755 1.00 0.00 H new ATOM 2281 N ILE A 146 -3.830 -2.428 -10.197 1.00 0.00 N ATOM 2282 CA ILE A 146 -3.489 -3.390 -9.110 1.00 0.00 C ATOM 2283 C ILE A 146 -1.988 -3.689 -9.141 1.00 0.00 C ATOM 2284 O ILE A 146 -1.507 -4.562 -8.448 1.00 0.00 O ATOM 2285 CB ILE A 146 -4.272 -4.688 -9.313 1.00 0.00 C ATOM 2286 CG1 ILE A 146 -3.894 -5.307 -10.662 1.00 0.00 C ATOM 2287 CG2 ILE A 146 -5.771 -4.389 -9.294 1.00 0.00 C ATOM 2288 CD1 ILE A 146 -4.992 -6.274 -11.106 1.00 0.00 C ATOM 0 H ILE A 146 -4.003 -2.849 -11.110 1.00 0.00 H new ATOM 0 HA ILE A 146 -3.751 -2.954 -8.146 1.00 0.00 H new ATOM 0 HB ILE A 146 -4.030 -5.386 -8.511 1.00 0.00 H new ATOM 0 HG12 ILE A 146 -3.761 -4.524 -11.409 1.00 0.00 H new ATOM 0 HG13 ILE A 146 -2.943 -5.833 -10.579 1.00 0.00 H new ATOM 0 HG21 ILE A 146 -6.328 -5.314 -9.439 1.00 0.00 H new ATOM 0 HG22 ILE A 146 -6.042 -3.948 -8.335 1.00 0.00 H new ATOM 0 HG23 ILE A 146 -6.013 -3.691 -10.095 1.00 0.00 H new ATOM 0 HD11 ILE A 146 -4.723 -6.714 -12.066 1.00 0.00 H new ATOM 0 HD12 ILE A 146 -5.104 -7.064 -10.363 1.00 0.00 H new ATOM 0 HD13 ILE A 146 -5.934 -5.734 -11.206 1.00 0.00 H new ATOM 2300 N LEU A 147 -1.246 -2.971 -9.940 1.00 0.00 N ATOM 2301 CA LEU A 147 0.224 -3.214 -10.016 1.00 0.00 C ATOM 2302 C LEU A 147 0.953 -2.251 -9.077 1.00 0.00 C ATOM 2303 O LEU A 147 1.197 -1.110 -9.416 1.00 0.00 O ATOM 2304 CB LEU A 147 0.707 -2.984 -11.451 1.00 0.00 C ATOM 2305 CG LEU A 147 -0.049 -3.910 -12.408 1.00 0.00 C ATOM 2306 CD1 LEU A 147 0.413 -3.648 -13.843 1.00 0.00 C ATOM 2307 CD2 LEU A 147 0.230 -5.372 -12.045 1.00 0.00 C ATOM 0 H LEU A 147 -1.594 -2.226 -10.544 1.00 0.00 H new ATOM 0 HA LEU A 147 0.435 -4.241 -9.719 1.00 0.00 H new ATOM 0 HB2 LEU A 147 0.548 -1.944 -11.736 1.00 0.00 H new ATOM 0 HB3 LEU A 147 1.778 -3.173 -11.518 1.00 0.00 H new ATOM 0 HG LEU A 147 -1.118 -3.715 -12.325 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -0.125 -4.307 -14.524 1.00 0.00 H new ATOM 0 HD12 LEU A 147 0.211 -2.610 -14.107 1.00 0.00 H new ATOM 0 HD13 LEU A 147 1.483 -3.840 -13.922 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -0.310 -6.026 -12.729 1.00 0.00 H new ATOM 0 HD22 LEU A 147 1.299 -5.569 -12.123 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -0.100 -5.563 -11.024 1.00 0.00 H new ATOM 2319 N PHE A 148 1.305 -2.709 -7.902 1.00 0.00 N ATOM 2320 CA PHE A 148 2.023 -1.832 -6.932 1.00 0.00 C ATOM 2321 C PHE A 148 3.489 -2.261 -6.844 1.00 0.00 C ATOM 2322 O PHE A 148 3.857 -3.336 -7.276 1.00 0.00 O ATOM 2323 CB PHE A 148 1.374 -1.964 -5.552 1.00 0.00 C ATOM 2324 CG PHE A 148 0.095 -1.164 -5.517 1.00 0.00 C ATOM 2325 CD1 PHE A 148 -1.058 -1.660 -6.138 1.00 0.00 C ATOM 2326 CD2 PHE A 148 0.060 0.073 -4.863 1.00 0.00 C ATOM 2327 CE1 PHE A 148 -2.245 -0.918 -6.104 1.00 0.00 C ATOM 2328 CE2 PHE A 148 -1.126 0.814 -4.829 1.00 0.00 C ATOM 2329 CZ PHE A 148 -2.279 0.319 -5.450 1.00 0.00 C ATOM 0 H PHE A 148 1.124 -3.657 -7.573 1.00 0.00 H new ATOM 0 HA PHE A 148 1.966 -0.796 -7.267 1.00 0.00 H new ATOM 0 HB2 PHE A 148 1.166 -3.012 -5.335 1.00 0.00 H new ATOM 0 HB3 PHE A 148 2.058 -1.609 -4.781 1.00 0.00 H new ATOM 0 HD1 PHE A 148 -1.032 -2.614 -6.643 1.00 0.00 H new ATOM 0 HD2 PHE A 148 0.949 0.456 -4.384 1.00 0.00 H new ATOM 0 HE1 PHE A 148 -3.135 -1.300 -6.583 1.00 0.00 H new ATOM 0 HE2 PHE A 148 -1.152 1.768 -4.324 1.00 0.00 H new ATOM 0 HZ PHE A 148 -3.194 0.891 -5.424 1.00 0.00 H new ATOM 2339 N LEU A 149 4.327 -1.428 -6.288 1.00 0.00 N ATOM 2340 CA LEU A 149 5.773 -1.779 -6.169 1.00 0.00 C ATOM 2341 C LEU A 149 6.311 -1.273 -4.824 1.00 0.00 C ATOM 2342 O LEU A 149 7.081 -0.334 -4.788 1.00 0.00 O ATOM 2343 CB LEU A 149 6.548 -1.111 -7.310 1.00 0.00 C ATOM 2344 CG LEU A 149 7.999 -1.612 -7.322 1.00 0.00 C ATOM 2345 CD1 LEU A 149 8.042 -3.108 -7.655 1.00 0.00 C ATOM 2346 CD2 LEU A 149 8.792 -0.836 -8.375 1.00 0.00 C ATOM 0 H LEU A 149 4.072 -0.516 -5.909 1.00 0.00 H new ATOM 0 HA LEU A 149 5.894 -2.861 -6.226 1.00 0.00 H new ATOM 0 HB2 LEU A 149 6.070 -1.333 -8.264 1.00 0.00 H new ATOM 0 HB3 LEU A 149 6.529 -0.028 -7.188 1.00 0.00 H new ATOM 0 HG LEU A 149 8.437 -1.456 -6.336 1.00 0.00 H new ATOM 0 HD11 LEU A 149 9.077 -3.450 -7.660 1.00 0.00 H new ATOM 0 HD12 LEU A 149 7.480 -3.664 -6.905 1.00 0.00 H new ATOM 0 HD13 LEU A 149 7.600 -3.275 -8.637 1.00 0.00 H new ATOM 0 HD21 LEU A 149 9.823 -1.189 -8.387 1.00 0.00 H new ATOM 0 HD22 LEU A 149 8.344 -0.992 -9.356 1.00 0.00 H new ATOM 0 HD23 LEU A 149 8.775 0.227 -8.133 1.00 0.00 H new ATOM 2358 N PRO A 150 5.883 -1.901 -3.753 1.00 0.00 N ATOM 2359 CA PRO A 150 6.314 -1.512 -2.398 1.00 0.00 C ATOM 2360 C PRO A 150 7.827 -1.697 -2.243 1.00 0.00 C ATOM 2361 O PRO A 150 8.320 -2.805 -2.163 1.00 0.00 O ATOM 2362 CB PRO A 150 5.555 -2.456 -1.456 1.00 0.00 C ATOM 2363 CG PRO A 150 4.653 -3.365 -2.327 1.00 0.00 C ATOM 2364 CD PRO A 150 4.944 -3.040 -3.800 1.00 0.00 C ATOM 0 HA PRO A 150 6.104 -0.464 -2.184 1.00 0.00 H new ATOM 0 HB2 PRO A 150 6.253 -3.056 -0.872 1.00 0.00 H new ATOM 0 HB3 PRO A 150 4.954 -1.887 -0.747 1.00 0.00 H new ATOM 0 HG2 PRO A 150 4.856 -4.416 -2.120 1.00 0.00 H new ATOM 0 HG3 PRO A 150 3.601 -3.192 -2.098 1.00 0.00 H new ATOM 0 HD2 PRO A 150 5.383 -3.894 -4.315 1.00 0.00 H new ATOM 0 HD3 PRO A 150 4.031 -2.779 -4.336 1.00 0.00 H new ATOM 2372 N MET A 151 8.562 -0.618 -2.198 1.00 0.00 N ATOM 2373 CA MET A 151 10.042 -0.722 -2.045 1.00 0.00 C ATOM 2374 C MET A 151 10.417 -0.508 -0.577 1.00 0.00 C ATOM 2375 O MET A 151 10.193 0.546 -0.017 1.00 0.00 O ATOM 2376 CB MET A 151 10.718 0.349 -2.904 1.00 0.00 C ATOM 2377 CG MET A 151 9.986 0.469 -4.242 1.00 0.00 C ATOM 2378 SD MET A 151 10.988 1.444 -5.392 1.00 0.00 S ATOM 2379 CE MET A 151 9.623 2.097 -6.384 1.00 0.00 C ATOM 0 H MET A 151 8.200 0.333 -2.261 1.00 0.00 H new ATOM 0 HA MET A 151 10.374 -1.709 -2.366 1.00 0.00 H new ATOM 0 HB2 MET A 151 10.707 1.307 -2.384 1.00 0.00 H new ATOM 0 HB3 MET A 151 11.763 0.089 -3.072 1.00 0.00 H new ATOM 0 HG2 MET A 151 9.798 -0.522 -4.656 1.00 0.00 H new ATOM 0 HG3 MET A 151 9.015 0.943 -4.097 1.00 0.00 H new ATOM 0 HE1 MET A 151 9.900 2.082 -7.438 1.00 0.00 H new ATOM 0 HE2 MET A 151 8.736 1.481 -6.233 1.00 0.00 H new ATOM 0 HE3 MET A 151 9.410 3.122 -6.079 1.00 0.00 H new ATOM 2389 N SER A 152 10.986 -1.501 0.051 1.00 0.00 N ATOM 2390 CA SER A 152 11.372 -1.352 1.482 1.00 0.00 C ATOM 2391 C SER A 152 12.547 -0.379 1.597 1.00 0.00 C ATOM 2392 O SER A 152 13.433 -0.360 0.766 1.00 0.00 O ATOM 2393 CB SER A 152 11.781 -2.714 2.043 1.00 0.00 C ATOM 2394 OG SER A 152 12.292 -2.545 3.359 1.00 0.00 O ATOM 0 H SER A 152 11.200 -2.408 -0.365 1.00 0.00 H new ATOM 0 HA SER A 152 10.525 -0.965 2.048 1.00 0.00 H new ATOM 0 HB2 SER A 152 10.924 -3.387 2.057 1.00 0.00 H new ATOM 0 HB3 SER A 152 12.535 -3.172 1.403 1.00 0.00 H new ATOM 0 HG SER A 152 11.548 -2.458 3.990 1.00 0.00 H new ATOM 2400 N ALA A 153 12.560 0.429 2.623 1.00 0.00 N ATOM 2401 CA ALA A 153 13.678 1.400 2.794 1.00 0.00 C ATOM 2402 C ALA A 153 14.750 0.790 3.698 1.00 0.00 C ATOM 2403 O ALA A 153 15.082 1.328 4.736 1.00 0.00 O ATOM 2404 CB ALA A 153 13.142 2.683 3.434 1.00 0.00 C ATOM 0 H ALA A 153 11.845 0.458 3.350 1.00 0.00 H new ATOM 0 HA ALA A 153 14.112 1.631 1.821 1.00 0.00 H new ATOM 0 HB1 ALA A 153 13.958 3.395 3.560 1.00 0.00 H new ATOM 0 HB2 ALA A 153 12.377 3.118 2.791 1.00 0.00 H new ATOM 0 HB3 ALA A 153 12.709 2.451 4.407 1.00 0.00 H new ATOM 2410 N LYS A 154 15.298 -0.331 3.312 1.00 0.00 N ATOM 2411 CA LYS A 154 16.348 -0.975 4.151 1.00 0.00 C ATOM 2412 C LYS A 154 17.483 0.020 4.404 1.00 0.00 C ATOM 2413 O LYS A 154 17.457 0.776 5.355 1.00 0.00 O ATOM 2414 CB LYS A 154 16.901 -2.202 3.423 1.00 0.00 C ATOM 2415 CG LYS A 154 15.858 -3.322 3.445 1.00 0.00 C ATOM 2416 CD LYS A 154 16.408 -4.545 2.708 1.00 0.00 C ATOM 2417 CE LYS A 154 16.372 -5.759 3.638 1.00 0.00 C ATOM 2418 NZ LYS A 154 16.944 -6.942 2.933 1.00 0.00 N ATOM 0 H LYS A 154 15.064 -0.828 2.453 1.00 0.00 H new ATOM 0 HA LYS A 154 15.914 -1.281 5.103 1.00 0.00 H new ATOM 0 HB2 LYS A 154 17.152 -1.945 2.394 1.00 0.00 H new ATOM 0 HB3 LYS A 154 17.821 -2.538 3.901 1.00 0.00 H new ATOM 0 HG2 LYS A 154 15.612 -3.584 4.474 1.00 0.00 H new ATOM 0 HG3 LYS A 154 14.936 -2.984 2.973 1.00 0.00 H new ATOM 0 HD2 LYS A 154 15.816 -4.741 1.814 1.00 0.00 H new ATOM 0 HD3 LYS A 154 17.430 -4.356 2.379 1.00 0.00 H new ATOM 0 HE2 LYS A 154 16.940 -5.553 4.545 1.00 0.00 H new ATOM 0 HE3 LYS A 154 15.347 -5.966 3.944 1.00 0.00 H new ATOM 0 HZ1 LYS A 154 16.920 -7.768 3.565 1.00 0.00 H new ATOM 0 HZ2 LYS A 154 16.384 -7.142 2.080 1.00 0.00 H new ATOM 0 HZ3 LYS A 154 17.928 -6.742 2.662 1.00 0.00 H new ATOM 2432 N SER A 155 18.479 0.027 3.561 1.00 0.00 N ATOM 2433 CA SER A 155 19.613 0.973 3.755 1.00 0.00 C ATOM 2434 C SER A 155 19.112 2.410 3.603 1.00 0.00 C ATOM 2435 O SER A 155 19.894 3.248 3.184 1.00 0.00 O ATOM 2436 CB SER A 155 20.693 0.697 2.708 1.00 0.00 C ATOM 2437 OG SER A 155 21.917 1.283 3.130 1.00 0.00 O ATOM 2438 OXT SER A 155 17.955 2.649 3.909 1.00 0.00 O ATOM 0 H SER A 155 18.556 -0.582 2.746 1.00 0.00 H new ATOM 0 HA SER A 155 20.031 0.838 4.753 1.00 0.00 H new ATOM 0 HB2 SER A 155 20.818 -0.377 2.573 1.00 0.00 H new ATOM 0 HB3 SER A 155 20.394 1.107 1.743 1.00 0.00 H new ATOM 0 HG SER A 155 21.772 2.229 3.339 1.00 0.00 H new TER 2444 SER A 155