USER MOD reduce.3.24.130724 H: found=0, std=0, add=1081, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 1080 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: A 46 HIS HD1 : A 46 HIS ND1 : A 155 CU1CU :(H bumps) USER MOD NoAdj-H: A 48 HIS HE2 : A 48 HIS NE2 : A 155 CU1CU :(H bumps) USER MOD NoAdj-H: A 63 HIS HD1 : A 63 HIS ND1 : A 154 ZNZN :(H bumps) USER MOD NoAdj-H: A 71 HIS HD1 : A 71 HIS ND1 : A 154 ZNZN :(H bumps) USER MOD NoAdj-H: A 80 HIS HD1 : A 80 HIS ND1 : A 154 ZNZN :(H bumps) USER MOD NoAdj-H: A 120 HIS HE2 : A 120 HIS NE2 : A 155 CU1CU :(H bumps) USER MOD Set 1.1: A 133 GLN : amide:sc= -1.97 X(o=-1.7,f=-1.6) USER MOD Set 1.2: A 139 ASN : amide:sc= 0.259 X(o=-1.7,f=-1.8) USER MOD Set 2.1: A 131 ASN : amide:sc= -3.43! K(o=-2.3!,f=2.3) USER MOD Set 2.2: A 134 SER OG : rot 102:sc= 1.09 USER MOD Set 3.1: A 39 THR OG1 : rot 31:sc= 1.22 USER MOD Set 3.2: A 43 HIS : no HE2:sc= -1.56! C(o=-0.34!,f=-13!) USER MOD Set 4.1: A 25 SER OG : rot 180:sc= 0 USER MOD Set 4.2: A 26 ASN : amide:sc=-0.00304 X(o=-0.003,f=0.055) USER MOD Set 5.1: A 9 LYS NZ :NH3+ 179:sc= 1.24 (180deg=0) USER MOD Set 5.2: A 15 GLN : amide:sc= 1.03 K(o=2.3,f=-8.7!) USER MOD Single : A 1 ALA N :NH3+ -122:sc= 0.312 (180deg=0) USER MOD Single : A 2 THR OG1 : rot 119:sc= -0.215 USER MOD Single : A 3 LYS NZ :NH3+ 180:sc=-0.00294 (180deg=-0.00294) USER MOD Single : A 19 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 22 GLN : amide:sc= -0.703 K(o=-0.7,f=-11!) USER MOD Single : A 23 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 34 SER OG : rot -76:sc= 1.21 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 54 THR OG1 : rot -150:sc= -0.46 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0.526 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 65 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00444) USER MOD Single : A 86 ASN : amide:sc= -0.0889 K(o=-0.089,f=-1.4) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ -158:sc= 1.1 (180deg=0.0089) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 110 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 111 SER OG : rot 180:sc= -0.0161 USER MOD Single : A 116 THR OG1 : rot -97:sc= 0.0247 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 LYS NZ :NH3+ -144:sc= -0.408 (180deg=-1.31!) USER MOD Single : A 135 THR OG1 : rot -61:sc= 0.157 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 THR OG1 : rot 40:sc= 0.222 USER MOD Single : A 142 SER OG : rot 180:sc= 0.0103 USER MOD Single : A 153 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 16.170 11.929 11.075 1.00 0.00 N ATOM 2 CA ALA A 1 16.494 10.522 10.773 1.00 0.00 C ATOM 3 C ALA A 1 15.250 9.900 10.152 1.00 0.00 C ATOM 4 O ALA A 1 14.312 10.648 9.890 1.00 0.00 O ATOM 5 CB ALA A 1 17.683 10.423 9.808 1.00 0.00 C ATOM 0 H1 ALA A 1 16.838 12.553 10.579 1.00 0.00 H new ATOM 0 H2 ALA A 1 15.201 12.138 10.759 1.00 0.00 H new ATOM 0 H3 ALA A 1 16.242 12.089 12.100 1.00 0.00 H new ATOM 0 HA ALA A 1 16.780 9.996 11.683 1.00 0.00 H new ATOM 0 HB1 ALA A 1 17.899 9.374 9.603 1.00 0.00 H new ATOM 0 HB2 ALA A 1 17.438 10.932 8.876 1.00 0.00 H new ATOM 0 HB3 ALA A 1 18.557 10.893 10.259 1.00 0.00 H new ATOM 13 N THR A 2 15.251 8.591 9.897 1.00 0.00 N ATOM 14 CA THR A 2 14.223 7.914 9.121 1.00 0.00 C ATOM 15 C THR A 2 13.559 6.832 9.979 1.00 0.00 C ATOM 16 O THR A 2 14.098 5.748 10.156 1.00 0.00 O ATOM 17 CB THR A 2 14.867 7.383 7.830 1.00 0.00 C ATOM 18 OG1 THR A 2 13.946 6.641 7.064 1.00 0.00 O ATOM 19 CG2 THR A 2 16.131 6.544 8.072 1.00 0.00 C ATOM 0 H THR A 2 15.982 7.964 10.232 1.00 0.00 H new ATOM 0 HA THR A 2 13.422 8.593 8.828 1.00 0.00 H new ATOM 0 HB THR A 2 15.172 8.271 7.276 1.00 0.00 H new ATOM 0 HG1 THR A 2 13.826 7.070 6.191 1.00 0.00 H new ATOM 0 HG21 THR A 2 16.530 6.203 7.117 1.00 0.00 H new ATOM 0 HG22 THR A 2 16.879 7.151 8.582 1.00 0.00 H new ATOM 0 HG23 THR A 2 15.882 5.681 8.690 1.00 0.00 H new ATOM 27 N LYS A 3 12.408 7.146 10.572 1.00 0.00 N ATOM 28 CA LYS A 3 11.613 6.190 11.330 1.00 0.00 C ATOM 29 C LYS A 3 10.153 6.598 11.184 1.00 0.00 C ATOM 30 O LYS A 3 9.656 7.404 11.968 1.00 0.00 O ATOM 31 CB LYS A 3 12.038 6.163 12.812 1.00 0.00 C ATOM 32 CG LYS A 3 13.355 5.414 13.066 1.00 0.00 C ATOM 33 CD LYS A 3 14.566 6.351 13.152 1.00 0.00 C ATOM 34 CE LYS A 3 14.910 6.732 14.601 1.00 0.00 C ATOM 35 NZ LYS A 3 13.809 7.445 15.284 1.00 0.00 N ATOM 0 H LYS A 3 12.000 8.080 10.538 1.00 0.00 H new ATOM 0 HA LYS A 3 11.766 5.181 10.947 1.00 0.00 H new ATOM 0 HB2 LYS A 3 12.139 7.188 13.170 1.00 0.00 H new ATOM 0 HB3 LYS A 3 11.247 5.697 13.399 1.00 0.00 H new ATOM 0 HG2 LYS A 3 13.273 4.849 13.994 1.00 0.00 H new ATOM 0 HG3 LYS A 3 13.517 4.692 12.266 1.00 0.00 H new ATOM 0 HD2 LYS A 3 15.428 5.869 12.691 1.00 0.00 H new ATOM 0 HD3 LYS A 3 14.363 7.256 12.580 1.00 0.00 H new ATOM 0 HE2 LYS A 3 15.154 5.829 15.161 1.00 0.00 H new ATOM 0 HE3 LYS A 3 15.801 7.360 14.605 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 14.096 7.677 16.256 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 13.591 8.322 14.769 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 12.965 6.838 15.308 1.00 0.00 H new ATOM 49 N ALA A 4 9.486 6.066 10.161 1.00 0.00 N ATOM 50 CA ALA A 4 8.081 6.320 9.896 1.00 0.00 C ATOM 51 C ALA A 4 7.320 4.998 9.933 1.00 0.00 C ATOM 52 O ALA A 4 7.904 3.941 9.690 1.00 0.00 O ATOM 53 CB ALA A 4 7.976 7.033 8.553 1.00 0.00 C ATOM 0 H ALA A 4 9.919 5.437 9.485 1.00 0.00 H new ATOM 0 HA ALA A 4 7.632 6.964 10.653 1.00 0.00 H new ATOM 0 HB1 ALA A 4 6.929 7.236 8.330 1.00 0.00 H new ATOM 0 HB2 ALA A 4 8.526 7.973 8.596 1.00 0.00 H new ATOM 0 HB3 ALA A 4 8.398 6.401 7.772 1.00 0.00 H new ATOM 59 N VAL A 5 6.032 5.051 10.273 1.00 0.00 N ATOM 60 CA VAL A 5 5.190 3.894 10.532 1.00 0.00 C ATOM 61 C VAL A 5 3.769 4.230 10.079 1.00 0.00 C ATOM 62 O VAL A 5 3.399 5.406 10.076 1.00 0.00 O ATOM 63 CB VAL A 5 5.267 3.547 12.036 1.00 0.00 C ATOM 64 CG1 VAL A 5 4.641 4.640 12.916 1.00 0.00 C ATOM 65 CG2 VAL A 5 4.642 2.198 12.407 1.00 0.00 C ATOM 0 H VAL A 5 5.533 5.935 10.378 1.00 0.00 H new ATOM 0 HA VAL A 5 5.524 3.016 9.978 1.00 0.00 H new ATOM 0 HB VAL A 5 6.337 3.478 12.232 1.00 0.00 H new ATOM 0 HG11 VAL A 5 4.719 4.352 13.964 1.00 0.00 H new ATOM 0 HG12 VAL A 5 5.169 5.581 12.758 1.00 0.00 H new ATOM 0 HG13 VAL A 5 3.591 4.764 12.651 1.00 0.00 H new ATOM 0 HG21 VAL A 5 4.740 2.035 13.480 1.00 0.00 H new ATOM 0 HG22 VAL A 5 3.587 2.199 12.135 1.00 0.00 H new ATOM 0 HG23 VAL A 5 5.154 1.400 11.870 1.00 0.00 H new ATOM 75 N ALA A 6 2.968 3.226 9.706 1.00 0.00 N ATOM 76 CA ALA A 6 1.533 3.427 9.527 1.00 0.00 C ATOM 77 C ALA A 6 0.760 2.236 10.075 1.00 0.00 C ATOM 78 O ALA A 6 0.847 1.139 9.529 1.00 0.00 O ATOM 79 CB ALA A 6 1.196 3.687 8.058 1.00 0.00 C ATOM 0 H ALA A 6 3.289 2.275 9.524 1.00 0.00 H new ATOM 0 HA ALA A 6 1.233 4.311 10.090 1.00 0.00 H new ATOM 0 HB1 ALA A 6 0.121 3.833 7.952 1.00 0.00 H new ATOM 0 HB2 ALA A 6 1.719 4.580 7.717 1.00 0.00 H new ATOM 0 HB3 ALA A 6 1.507 2.833 7.457 1.00 0.00 H new ATOM 85 N VAL A 7 0.020 2.434 11.165 1.00 0.00 N ATOM 86 CA VAL A 7 -0.766 1.392 11.792 1.00 0.00 C ATOM 87 C VAL A 7 -2.153 1.298 11.144 1.00 0.00 C ATOM 88 O VAL A 7 -3.069 2.049 11.470 1.00 0.00 O ATOM 89 CB VAL A 7 -0.790 1.595 13.316 1.00 0.00 C ATOM 90 CG1 VAL A 7 0.600 1.321 13.908 1.00 0.00 C ATOM 91 CG2 VAL A 7 -1.247 2.984 13.792 1.00 0.00 C ATOM 0 H VAL A 7 -0.046 3.336 11.637 1.00 0.00 H new ATOM 0 HA VAL A 7 -0.302 0.420 11.625 1.00 0.00 H new ATOM 0 HB VAL A 7 -1.537 0.885 13.671 1.00 0.00 H new ATOM 0 HG11 VAL A 7 0.571 1.468 14.988 1.00 0.00 H new ATOM 0 HG12 VAL A 7 0.893 0.294 13.689 1.00 0.00 H new ATOM 0 HG13 VAL A 7 1.324 2.006 13.468 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -1.227 3.020 14.881 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -0.577 3.745 13.392 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -2.261 3.173 13.441 1.00 0.00 H new ATOM 101 N LEU A 8 -2.310 0.361 10.211 1.00 0.00 N ATOM 102 CA LEU A 8 -3.586 -0.030 9.646 1.00 0.00 C ATOM 103 C LEU A 8 -4.467 -0.647 10.730 1.00 0.00 C ATOM 104 O LEU A 8 -3.950 -1.332 11.614 1.00 0.00 O ATOM 105 CB LEU A 8 -3.349 -1.013 8.488 1.00 0.00 C ATOM 106 CG LEU A 8 -3.144 -0.274 7.157 1.00 0.00 C ATOM 107 CD1 LEU A 8 -1.828 0.509 7.166 1.00 0.00 C ATOM 108 CD2 LEU A 8 -3.140 -1.292 6.016 1.00 0.00 C ATOM 0 H LEU A 8 -1.524 -0.159 9.820 1.00 0.00 H new ATOM 0 HA LEU A 8 -4.104 0.845 9.254 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -2.474 -1.627 8.703 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -4.200 -1.689 8.403 1.00 0.00 H new ATOM 0 HG LEU A 8 -3.959 0.436 7.016 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -1.705 1.024 6.213 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -1.845 1.240 7.974 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -0.996 -0.179 7.317 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -2.995 -0.775 5.068 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -2.330 -2.006 6.168 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -4.092 -1.822 5.998 1.00 0.00 H new ATOM 120 N LYS A 9 -5.783 -0.424 10.637 1.00 0.00 N ATOM 121 CA LYS A 9 -6.818 -0.992 11.488 1.00 0.00 C ATOM 122 C LYS A 9 -8.127 -0.989 10.684 1.00 0.00 C ATOM 123 O LYS A 9 -8.340 -0.074 9.891 1.00 0.00 O ATOM 124 CB LYS A 9 -6.906 -0.160 12.775 1.00 0.00 C ATOM 125 CG LYS A 9 -7.690 -0.856 13.899 1.00 0.00 C ATOM 126 CD LYS A 9 -7.012 -0.611 15.259 1.00 0.00 C ATOM 127 CE LYS A 9 -5.770 -1.497 15.476 1.00 0.00 C ATOM 128 NZ LYS A 9 -6.130 -2.895 15.795 1.00 0.00 N ATOM 0 H LYS A 9 -6.169 0.194 9.923 1.00 0.00 H new ATOM 0 HA LYS A 9 -6.600 -2.018 11.784 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -5.898 0.059 13.127 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -7.380 0.796 12.550 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -8.713 -0.481 13.923 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -7.747 -1.926 13.702 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -6.722 0.437 15.331 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -7.730 -0.799 16.057 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -5.151 -1.479 14.579 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -5.169 -1.085 16.286 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -5.264 -3.458 15.916 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -6.684 -2.919 16.675 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -6.696 -3.294 15.019 1.00 0.00 H new ATOM 142 N GLY A 10 -8.972 -2.017 10.809 1.00 0.00 N ATOM 143 CA GLY A 10 -10.229 -2.106 10.083 1.00 0.00 C ATOM 144 C GLY A 10 -11.419 -2.103 11.030 1.00 0.00 C ATOM 145 O GLY A 10 -11.321 -1.658 12.173 1.00 0.00 O ATOM 0 H GLY A 10 -8.796 -2.813 11.422 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -10.311 -1.268 9.391 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -10.241 -3.017 9.484 1.00 0.00 H new ATOM 149 N ASP A 11 -12.538 -2.630 10.535 1.00 0.00 N ATOM 150 CA ASP A 11 -13.716 -2.961 11.315 1.00 0.00 C ATOM 151 C ASP A 11 -13.369 -4.084 12.291 1.00 0.00 C ATOM 152 O ASP A 11 -13.766 -4.049 13.455 1.00 0.00 O ATOM 153 CB ASP A 11 -14.832 -3.406 10.352 1.00 0.00 C ATOM 154 CG ASP A 11 -14.474 -4.664 9.563 1.00 0.00 C ATOM 155 OD1 ASP A 11 -13.277 -4.784 9.204 1.00 0.00 O ATOM 156 OD2 ASP A 11 -15.386 -5.493 9.365 1.00 0.00 O ATOM 0 H ASP A 11 -12.647 -2.843 9.544 1.00 0.00 H new ATOM 0 HA ASP A 11 -14.057 -2.096 11.884 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -15.744 -3.588 10.921 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -15.047 -2.596 9.655 1.00 0.00 H new ATOM 161 N GLY A 12 -12.638 -5.088 11.803 1.00 0.00 N ATOM 162 CA GLY A 12 -12.314 -6.286 12.536 1.00 0.00 C ATOM 163 C GLY A 12 -10.866 -6.205 12.997 1.00 0.00 C ATOM 164 O GLY A 12 -10.302 -5.119 13.132 1.00 0.00 O ATOM 0 H GLY A 12 -12.250 -5.078 10.860 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -12.977 -6.394 13.394 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -12.461 -7.164 11.907 1.00 0.00 H new ATOM 168 N PRO A 13 -10.228 -7.360 13.217 1.00 0.00 N ATOM 169 CA PRO A 13 -8.880 -7.403 13.731 1.00 0.00 C ATOM 170 C PRO A 13 -7.848 -7.116 12.642 1.00 0.00 C ATOM 171 O PRO A 13 -6.667 -7.020 12.963 1.00 0.00 O ATOM 172 CB PRO A 13 -8.730 -8.803 14.325 1.00 0.00 C ATOM 173 CG PRO A 13 -9.642 -9.653 13.438 1.00 0.00 C ATOM 174 CD PRO A 13 -10.766 -8.694 13.032 1.00 0.00 C ATOM 0 HA PRO A 13 -8.703 -6.633 14.482 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -7.697 -9.148 14.289 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -9.040 -8.834 15.369 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -9.109 -10.034 12.567 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -10.030 -10.517 13.977 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -11.064 -8.856 11.996 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -11.653 -8.847 13.647 1.00 0.00 H new ATOM 182 N VAL A 14 -8.279 -6.955 11.379 1.00 0.00 N ATOM 183 CA VAL A 14 -7.437 -6.485 10.292 1.00 0.00 C ATOM 184 C VAL A 14 -6.692 -5.247 10.771 1.00 0.00 C ATOM 185 O VAL A 14 -7.283 -4.180 10.926 1.00 0.00 O ATOM 186 CB VAL A 14 -8.251 -6.168 9.023 1.00 0.00 C ATOM 187 CG1 VAL A 14 -7.267 -5.888 7.875 1.00 0.00 C ATOM 188 CG2 VAL A 14 -9.183 -7.304 8.590 1.00 0.00 C ATOM 0 H VAL A 14 -9.237 -7.154 11.092 1.00 0.00 H new ATOM 0 HA VAL A 14 -6.736 -7.274 10.021 1.00 0.00 H new ATOM 0 HB VAL A 14 -8.880 -5.308 9.254 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -7.824 -5.661 6.966 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -6.636 -5.038 8.136 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -6.643 -6.766 7.709 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -9.723 -7.009 7.690 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -8.595 -8.198 8.383 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -9.895 -7.515 9.388 1.00 0.00 H new ATOM 198 N GLN A 15 -5.399 -5.411 11.031 1.00 0.00 N ATOM 199 CA GLN A 15 -4.526 -4.336 11.457 1.00 0.00 C ATOM 200 C GLN A 15 -3.161 -4.581 10.849 1.00 0.00 C ATOM 201 O GLN A 15 -2.867 -5.728 10.522 1.00 0.00 O ATOM 202 CB GLN A 15 -4.466 -4.302 12.988 1.00 0.00 C ATOM 203 CG GLN A 15 -3.708 -5.519 13.543 1.00 0.00 C ATOM 204 CD GLN A 15 -4.109 -5.835 14.976 1.00 0.00 C ATOM 205 OE1 GLN A 15 -4.393 -4.928 15.759 1.00 0.00 O ATOM 206 NE2 GLN A 15 -4.155 -7.115 15.328 1.00 0.00 N ATOM 0 H GLN A 15 -4.926 -6.311 10.949 1.00 0.00 H new ATOM 0 HA GLN A 15 -4.898 -3.367 11.123 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -3.976 -3.385 13.315 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -5.478 -4.285 13.394 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -3.903 -6.386 12.912 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -2.636 -5.329 13.500 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -3.913 -7.839 14.652 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -4.433 -7.374 16.275 1.00 0.00 H new ATOM 215 N GLY A 16 -2.331 -3.549 10.696 1.00 0.00 N ATOM 216 CA GLY A 16 -1.022 -3.755 10.092 1.00 0.00 C ATOM 217 C GLY A 16 -0.043 -2.626 10.332 1.00 0.00 C ATOM 218 O GLY A 16 -0.300 -1.492 9.955 1.00 0.00 O ATOM 0 H GLY A 16 -2.536 -2.589 10.974 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -0.596 -4.679 10.482 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -1.147 -3.890 9.018 1.00 0.00 H new ATOM 222 N ILE A 17 1.098 -2.943 10.934 1.00 0.00 N ATOM 223 CA ILE A 17 2.129 -1.982 11.259 1.00 0.00 C ATOM 224 C ILE A 17 3.056 -1.851 10.046 1.00 0.00 C ATOM 225 O ILE A 17 3.991 -2.631 9.891 1.00 0.00 O ATOM 226 CB ILE A 17 2.844 -2.434 12.547 1.00 0.00 C ATOM 227 CG1 ILE A 17 1.839 -2.637 13.704 1.00 0.00 C ATOM 228 CG2 ILE A 17 3.873 -1.375 12.962 1.00 0.00 C ATOM 229 CD1 ILE A 17 1.413 -4.098 13.896 1.00 0.00 C ATOM 0 H ILE A 17 1.330 -3.896 11.213 1.00 0.00 H new ATOM 0 HA ILE A 17 1.724 -0.991 11.464 1.00 0.00 H new ATOM 0 HB ILE A 17 3.338 -3.384 12.343 1.00 0.00 H new ATOM 0 HG12 ILE A 17 2.284 -2.272 14.630 1.00 0.00 H new ATOM 0 HG13 ILE A 17 0.953 -2.030 13.516 1.00 0.00 H new ATOM 0 HG21 ILE A 17 4.378 -1.696 13.873 1.00 0.00 H new ATOM 0 HG22 ILE A 17 4.607 -1.249 12.166 1.00 0.00 H new ATOM 0 HG23 ILE A 17 3.367 -0.427 13.143 1.00 0.00 H new ATOM 0 HD11 ILE A 17 0.708 -4.165 14.724 1.00 0.00 H new ATOM 0 HD12 ILE A 17 0.938 -4.461 12.985 1.00 0.00 H new ATOM 0 HD13 ILE A 17 2.290 -4.707 14.116 1.00 0.00 H new ATOM 241 N ILE A 18 2.781 -0.882 9.171 1.00 0.00 N ATOM 242 CA ILE A 18 3.677 -0.506 8.081 1.00 0.00 C ATOM 243 C ILE A 18 4.885 0.183 8.691 1.00 0.00 C ATOM 244 O ILE A 18 4.710 0.921 9.657 1.00 0.00 O ATOM 245 CB ILE A 18 2.952 0.452 7.124 1.00 0.00 C ATOM 246 CG1 ILE A 18 1.760 -0.239 6.446 1.00 0.00 C ATOM 247 CG2 ILE A 18 3.884 1.097 6.089 1.00 0.00 C ATOM 248 CD1 ILE A 18 2.217 -1.136 5.297 1.00 0.00 C ATOM 0 H ILE A 18 1.922 -0.333 9.201 1.00 0.00 H new ATOM 0 HA ILE A 18 3.988 -1.386 7.518 1.00 0.00 H new ATOM 0 HB ILE A 18 2.574 1.268 7.739 1.00 0.00 H new ATOM 0 HG12 ILE A 18 1.216 -0.834 7.180 1.00 0.00 H new ATOM 0 HG13 ILE A 18 1.067 0.513 6.069 1.00 0.00 H new ATOM 0 HG21 ILE A 18 3.308 1.762 5.445 1.00 0.00 H new ATOM 0 HG22 ILE A 18 4.657 1.669 6.602 1.00 0.00 H new ATOM 0 HG23 ILE A 18 4.350 0.319 5.484 1.00 0.00 H new ATOM 0 HD11 ILE A 18 1.349 -1.610 4.838 1.00 0.00 H new ATOM 0 HD12 ILE A 18 2.738 -0.535 4.552 1.00 0.00 H new ATOM 0 HD13 ILE A 18 2.890 -1.903 5.680 1.00 0.00 H new ATOM 260 N ASN A 19 6.074 -0.008 8.113 1.00 0.00 N ATOM 261 CA ASN A 19 7.297 0.690 8.483 1.00 0.00 C ATOM 262 C ASN A 19 7.882 1.299 7.212 1.00 0.00 C ATOM 263 O ASN A 19 7.902 0.640 6.172 1.00 0.00 O ATOM 264 CB ASN A 19 8.320 -0.262 9.118 1.00 0.00 C ATOM 265 CG ASN A 19 7.719 -1.232 10.129 1.00 0.00 C ATOM 266 OD1 ASN A 19 7.703 -2.437 9.903 1.00 0.00 O ATOM 267 ND2 ASN A 19 7.229 -0.727 11.256 1.00 0.00 N ATOM 0 H ASN A 19 6.211 -0.674 7.352 1.00 0.00 H new ATOM 0 HA ASN A 19 7.067 1.458 9.221 1.00 0.00 H new ATOM 0 HB2 ASN A 19 8.809 -0.833 8.329 1.00 0.00 H new ATOM 0 HB3 ASN A 19 9.093 0.328 9.611 1.00 0.00 H new ATOM 0 HD21 ASN A 19 6.826 -1.346 11.960 1.00 0.00 H new ATOM 0 HD22 ASN A 19 7.255 0.280 11.418 1.00 0.00 H new ATOM 274 N PHE A 20 8.362 2.539 7.296 1.00 0.00 N ATOM 275 CA PHE A 20 9.058 3.216 6.212 1.00 0.00 C ATOM 276 C PHE A 20 10.444 3.613 6.707 1.00 0.00 C ATOM 277 O PHE A 20 10.542 4.358 7.687 1.00 0.00 O ATOM 278 CB PHE A 20 8.287 4.466 5.788 1.00 0.00 C ATOM 279 CG PHE A 20 7.040 4.214 4.976 1.00 0.00 C ATOM 280 CD1 PHE A 20 7.130 4.095 3.580 1.00 0.00 C ATOM 281 CD2 PHE A 20 5.782 4.219 5.603 1.00 0.00 C ATOM 282 CE1 PHE A 20 5.962 4.004 2.804 1.00 0.00 C ATOM 283 CE2 PHE A 20 4.616 4.091 4.829 1.00 0.00 C ATOM 284 CZ PHE A 20 4.705 3.979 3.430 1.00 0.00 C ATOM 0 H PHE A 20 8.274 3.109 8.137 1.00 0.00 H new ATOM 0 HA PHE A 20 9.138 2.551 5.352 1.00 0.00 H new ATOM 0 HB2 PHE A 20 8.011 5.023 6.683 1.00 0.00 H new ATOM 0 HB3 PHE A 20 8.954 5.105 5.209 1.00 0.00 H new ATOM 0 HD1 PHE A 20 8.098 4.073 3.102 1.00 0.00 H new ATOM 0 HD2 PHE A 20 5.712 4.321 6.676 1.00 0.00 H new ATOM 0 HE1 PHE A 20 6.031 3.953 1.727 1.00 0.00 H new ATOM 0 HE2 PHE A 20 3.649 4.079 5.310 1.00 0.00 H new ATOM 0 HZ PHE A 20 3.808 3.874 2.838 1.00 0.00 H new ATOM 294 N GLU A 21 11.488 3.143 6.014 1.00 0.00 N ATOM 295 CA GLU A 21 12.867 3.558 6.236 1.00 0.00 C ATOM 296 C GLU A 21 13.419 4.128 4.927 1.00 0.00 C ATOM 297 O GLU A 21 12.895 3.815 3.858 1.00 0.00 O ATOM 298 CB GLU A 21 13.712 2.364 6.709 1.00 0.00 C ATOM 299 CG GLU A 21 14.535 2.731 7.949 1.00 0.00 C ATOM 300 CD GLU A 21 15.620 1.699 8.217 1.00 0.00 C ATOM 301 OE1 GLU A 21 16.566 1.663 7.400 1.00 0.00 O ATOM 302 OE2 GLU A 21 15.484 0.974 9.224 1.00 0.00 O ATOM 0 H GLU A 21 11.390 2.451 5.271 1.00 0.00 H new ATOM 0 HA GLU A 21 12.907 4.322 7.012 1.00 0.00 H new ATOM 0 HB2 GLU A 21 13.061 1.520 6.937 1.00 0.00 H new ATOM 0 HB3 GLU A 21 14.378 2.045 5.907 1.00 0.00 H new ATOM 0 HG2 GLU A 21 14.989 3.712 7.809 1.00 0.00 H new ATOM 0 HG3 GLU A 21 13.878 2.805 8.816 1.00 0.00 H new ATOM 309 N GLN A 22 14.460 4.963 4.994 1.00 0.00 N ATOM 310 CA GLN A 22 15.047 5.602 3.819 1.00 0.00 C ATOM 311 C GLN A 22 16.563 5.764 3.987 1.00 0.00 C ATOM 312 O GLN A 22 17.330 5.119 3.277 1.00 0.00 O ATOM 313 CB GLN A 22 14.290 6.913 3.547 1.00 0.00 C ATOM 314 CG GLN A 22 14.250 7.308 2.064 1.00 0.00 C ATOM 315 CD GLN A 22 15.356 8.247 1.643 1.00 0.00 C ATOM 316 OE1 GLN A 22 16.386 8.336 2.300 1.00 0.00 O ATOM 317 NE2 GLN A 22 15.106 8.997 0.576 1.00 0.00 N ATOM 0 H GLN A 22 14.919 5.214 5.870 1.00 0.00 H new ATOM 0 HA GLN A 22 14.934 4.977 2.933 1.00 0.00 H new ATOM 0 HB2 GLN A 22 13.269 6.815 3.915 1.00 0.00 H new ATOM 0 HB3 GLN A 22 14.758 7.717 4.115 1.00 0.00 H new ATOM 0 HG2 GLN A 22 14.305 6.404 1.457 1.00 0.00 H new ATOM 0 HG3 GLN A 22 13.290 7.777 1.850 1.00 0.00 H new ATOM 0 HE21 GLN A 22 14.231 8.881 0.065 1.00 0.00 H new ATOM 0 HE22 GLN A 22 15.789 9.689 0.267 1.00 0.00 H new ATOM 326 N LYS A 23 17.000 6.595 4.943 1.00 0.00 N ATOM 327 CA LYS A 23 18.381 6.713 5.430 1.00 0.00 C ATOM 328 C LYS A 23 19.330 7.405 4.443 1.00 0.00 C ATOM 329 O LYS A 23 20.101 8.270 4.853 1.00 0.00 O ATOM 330 CB LYS A 23 18.902 5.361 5.964 1.00 0.00 C ATOM 331 CG LYS A 23 20.385 5.368 6.370 1.00 0.00 C ATOM 332 CD LYS A 23 21.219 4.658 5.293 1.00 0.00 C ATOM 333 CE LYS A 23 22.718 4.735 5.608 1.00 0.00 C ATOM 334 NZ LYS A 23 23.510 3.891 4.690 1.00 0.00 N ATOM 0 H LYS A 23 16.367 7.236 5.422 1.00 0.00 H new ATOM 0 HA LYS A 23 18.359 7.395 6.280 1.00 0.00 H new ATOM 0 HB2 LYS A 23 18.303 5.070 6.827 1.00 0.00 H new ATOM 0 HB3 LYS A 23 18.751 4.599 5.199 1.00 0.00 H new ATOM 0 HG2 LYS A 23 20.733 6.393 6.496 1.00 0.00 H new ATOM 0 HG3 LYS A 23 20.512 4.868 7.330 1.00 0.00 H new ATOM 0 HD2 LYS A 23 20.913 3.614 5.223 1.00 0.00 H new ATOM 0 HD3 LYS A 23 21.026 5.113 4.322 1.00 0.00 H new ATOM 0 HE2 LYS A 23 23.054 5.769 5.533 1.00 0.00 H new ATOM 0 HE3 LYS A 23 22.891 4.417 6.636 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 24.519 3.967 4.932 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 23.206 2.900 4.780 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 23.364 4.211 3.711 1.00 0.00 H new ATOM 348 N GLU A 24 19.284 7.057 3.158 1.00 0.00 N ATOM 349 CA GLU A 24 20.092 7.681 2.119 1.00 0.00 C ATOM 350 C GLU A 24 19.764 9.162 1.927 1.00 0.00 C ATOM 351 O GLU A 24 20.482 9.865 1.219 1.00 0.00 O ATOM 352 CB GLU A 24 19.929 6.871 0.830 1.00 0.00 C ATOM 353 CG GLU A 24 20.401 5.423 1.051 1.00 0.00 C ATOM 354 CD GLU A 24 20.486 4.620 -0.239 1.00 0.00 C ATOM 355 OE1 GLU A 24 20.850 5.228 -1.267 1.00 0.00 O ATOM 356 OE2 GLU A 24 20.184 3.408 -0.163 1.00 0.00 O ATOM 0 H GLU A 24 18.672 6.320 2.807 1.00 0.00 H new ATOM 0 HA GLU A 24 21.139 7.668 2.423 1.00 0.00 H new ATOM 0 HB2 GLU A 24 18.885 6.877 0.517 1.00 0.00 H new ATOM 0 HB3 GLU A 24 20.505 7.331 0.027 1.00 0.00 H new ATOM 0 HG2 GLU A 24 21.380 5.435 1.530 1.00 0.00 H new ATOM 0 HG3 GLU A 24 19.717 4.925 1.738 1.00 0.00 H new ATOM 363 N SER A 25 18.675 9.644 2.531 1.00 0.00 N ATOM 364 CA SER A 25 18.155 10.997 2.438 1.00 0.00 C ATOM 365 C SER A 25 17.486 11.184 1.080 1.00 0.00 C ATOM 366 O SER A 25 16.299 11.492 1.011 1.00 0.00 O ATOM 367 CB SER A 25 19.229 12.050 2.755 1.00 0.00 C ATOM 368 OG SER A 25 18.642 13.327 2.906 1.00 0.00 O ATOM 0 H SER A 25 18.101 9.056 3.135 1.00 0.00 H new ATOM 0 HA SER A 25 17.393 11.150 3.202 1.00 0.00 H new ATOM 0 HB2 SER A 25 19.757 11.776 3.668 1.00 0.00 H new ATOM 0 HB3 SER A 25 19.969 12.076 1.955 1.00 0.00 H new ATOM 0 HG SER A 25 19.339 13.985 3.109 1.00 0.00 H new ATOM 374 N ASN A 26 18.217 10.926 -0.005 1.00 0.00 N ATOM 375 CA ASN A 26 17.703 11.060 -1.365 1.00 0.00 C ATOM 376 C ASN A 26 18.000 9.778 -2.141 1.00 0.00 C ATOM 377 O ASN A 26 18.501 9.828 -3.260 1.00 0.00 O ATOM 378 CB ASN A 26 18.297 12.313 -2.031 1.00 0.00 C ATOM 379 CG ASN A 26 17.764 13.607 -1.419 1.00 0.00 C ATOM 380 OD1 ASN A 26 16.888 14.252 -1.986 1.00 0.00 O ATOM 381 ND2 ASN A 26 18.285 14.016 -0.265 1.00 0.00 N ATOM 0 H ASN A 26 19.188 10.616 0.037 1.00 0.00 H new ATOM 0 HA ASN A 26 16.621 11.195 -1.354 1.00 0.00 H new ATOM 0 HB2 ASN A 26 19.383 12.291 -1.937 1.00 0.00 H new ATOM 0 HB3 ASN A 26 18.069 12.297 -3.097 1.00 0.00 H new ATOM 0 HD21 ASN A 26 17.957 14.881 0.165 1.00 0.00 H new ATOM 0 HD22 ASN A 26 19.013 13.465 0.190 1.00 0.00 H new ATOM 388 N GLY A 27 17.684 8.628 -1.535 1.00 0.00 N ATOM 389 CA GLY A 27 17.788 7.317 -2.166 1.00 0.00 C ATOM 390 C GLY A 27 16.474 6.549 -2.002 1.00 0.00 C ATOM 391 O GLY A 27 15.463 7.145 -1.630 1.00 0.00 O ATOM 0 H GLY A 27 17.343 8.587 -0.575 1.00 0.00 H new ATOM 0 HA2 GLY A 27 18.022 7.432 -3.224 1.00 0.00 H new ATOM 0 HA3 GLY A 27 18.606 6.753 -1.718 1.00 0.00 H new ATOM 395 N PRO A 28 16.456 5.241 -2.296 1.00 0.00 N ATOM 396 CA PRO A 28 15.232 4.461 -2.317 1.00 0.00 C ATOM 397 C PRO A 28 14.655 4.292 -0.907 1.00 0.00 C ATOM 398 O PRO A 28 15.352 3.867 0.015 1.00 0.00 O ATOM 399 CB PRO A 28 15.611 3.123 -2.960 1.00 0.00 C ATOM 400 CG PRO A 28 17.103 2.987 -2.656 1.00 0.00 C ATOM 401 CD PRO A 28 17.598 4.433 -2.686 1.00 0.00 C ATOM 0 HA PRO A 28 14.443 4.954 -2.885 1.00 0.00 H new ATOM 0 HB2 PRO A 28 15.039 2.298 -2.536 1.00 0.00 H new ATOM 0 HB3 PRO A 28 15.419 3.125 -4.033 1.00 0.00 H new ATOM 0 HG2 PRO A 28 17.276 2.522 -1.685 1.00 0.00 H new ATOM 0 HG3 PRO A 28 17.611 2.372 -3.399 1.00 0.00 H new ATOM 0 HD2 PRO A 28 18.433 4.576 -2.000 1.00 0.00 H new ATOM 0 HD3 PRO A 28 17.951 4.707 -3.680 1.00 0.00 H new ATOM 409 N VAL A 29 13.367 4.600 -0.749 1.00 0.00 N ATOM 410 CA VAL A 29 12.590 4.254 0.424 1.00 0.00 C ATOM 411 C VAL A 29 12.425 2.747 0.445 1.00 0.00 C ATOM 412 O VAL A 29 12.144 2.162 -0.594 1.00 0.00 O ATOM 413 CB VAL A 29 11.220 4.948 0.343 1.00 0.00 C ATOM 414 CG1 VAL A 29 10.197 4.318 1.291 1.00 0.00 C ATOM 415 CG2 VAL A 29 11.370 6.408 0.747 1.00 0.00 C ATOM 0 H VAL A 29 12.831 5.108 -1.453 1.00 0.00 H new ATOM 0 HA VAL A 29 13.088 4.581 1.337 1.00 0.00 H new ATOM 0 HB VAL A 29 10.869 4.843 -0.683 1.00 0.00 H new ATOM 0 HG11 VAL A 29 9.245 4.841 1.199 1.00 0.00 H new ATOM 0 HG12 VAL A 29 10.060 3.268 1.033 1.00 0.00 H new ATOM 0 HG13 VAL A 29 10.556 4.396 2.317 1.00 0.00 H new ATOM 0 HG21 VAL A 29 10.400 6.903 0.691 1.00 0.00 H new ATOM 0 HG22 VAL A 29 11.748 6.466 1.768 1.00 0.00 H new ATOM 0 HG23 VAL A 29 12.069 6.902 0.072 1.00 0.00 H new ATOM 425 N LYS A 30 12.545 2.154 1.633 1.00 0.00 N ATOM 426 CA LYS A 30 12.110 0.815 1.951 1.00 0.00 C ATOM 427 C LYS A 30 10.706 0.924 2.546 1.00 0.00 C ATOM 428 O LYS A 30 10.524 1.574 3.578 1.00 0.00 O ATOM 429 CB LYS A 30 13.041 0.199 3.000 1.00 0.00 C ATOM 430 CG LYS A 30 14.265 -0.519 2.420 1.00 0.00 C ATOM 431 CD LYS A 30 15.378 0.454 2.015 1.00 0.00 C ATOM 432 CE LYS A 30 16.500 -0.315 1.300 1.00 0.00 C ATOM 433 NZ LYS A 30 17.791 0.396 1.333 1.00 0.00 N ATOM 0 H LYS A 30 12.970 2.626 2.431 1.00 0.00 H new ATOM 0 HA LYS A 30 12.120 0.190 1.058 1.00 0.00 H new ATOM 0 HB2 LYS A 30 13.382 0.987 3.672 1.00 0.00 H new ATOM 0 HB3 LYS A 30 12.471 -0.509 3.602 1.00 0.00 H new ATOM 0 HG2 LYS A 30 14.652 -1.223 3.157 1.00 0.00 H new ATOM 0 HG3 LYS A 30 13.962 -1.102 1.550 1.00 0.00 H new ATOM 0 HD2 LYS A 30 14.978 1.227 1.359 1.00 0.00 H new ATOM 0 HD3 LYS A 30 15.773 0.958 2.897 1.00 0.00 H new ATOM 0 HE2 LYS A 30 16.617 -1.294 1.766 1.00 0.00 H new ATOM 0 HE3 LYS A 30 16.212 -0.488 0.263 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 18.510 -0.168 0.837 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 17.691 1.319 0.865 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 18.084 0.539 2.321 1.00 0.00 H new ATOM 447 N VAL A 31 9.745 0.267 1.901 1.00 0.00 N ATOM 448 CA VAL A 31 8.397 0.033 2.373 1.00 0.00 C ATOM 449 C VAL A 31 8.357 -1.372 2.964 1.00 0.00 C ATOM 450 O VAL A 31 8.478 -2.358 2.236 1.00 0.00 O ATOM 451 CB VAL A 31 7.435 0.141 1.183 1.00 0.00 C ATOM 452 CG1 VAL A 31 6.000 -0.230 1.569 1.00 0.00 C ATOM 453 CG2 VAL A 31 7.482 1.556 0.606 1.00 0.00 C ATOM 0 H VAL A 31 9.904 -0.138 0.979 1.00 0.00 H new ATOM 0 HA VAL A 31 8.103 0.762 3.128 1.00 0.00 H new ATOM 0 HB VAL A 31 7.760 -0.573 0.426 1.00 0.00 H new ATOM 0 HG11 VAL A 31 5.353 -0.139 0.696 1.00 0.00 H new ATOM 0 HG12 VAL A 31 5.975 -1.257 1.934 1.00 0.00 H new ATOM 0 HG13 VAL A 31 5.649 0.442 2.352 1.00 0.00 H new ATOM 0 HG21 VAL A 31 6.797 1.627 -0.239 1.00 0.00 H new ATOM 0 HG22 VAL A 31 7.187 2.272 1.373 1.00 0.00 H new ATOM 0 HG23 VAL A 31 8.495 1.779 0.271 1.00 0.00 H new ATOM 463 N TRP A 32 8.150 -1.466 4.274 1.00 0.00 N ATOM 464 CA TRP A 32 7.880 -2.723 4.950 1.00 0.00 C ATOM 465 C TRP A 32 6.485 -2.677 5.557 1.00 0.00 C ATOM 466 O TRP A 32 5.948 -1.598 5.797 1.00 0.00 O ATOM 467 CB TRP A 32 8.899 -2.951 6.065 1.00 0.00 C ATOM 468 CG TRP A 32 10.167 -3.632 5.690 1.00 0.00 C ATOM 469 CD1 TRP A 32 10.281 -4.956 5.458 1.00 0.00 C ATOM 470 CD2 TRP A 32 11.520 -3.096 5.643 1.00 0.00 C ATOM 471 NE1 TRP A 32 11.599 -5.268 5.199 1.00 0.00 N ATOM 472 CE2 TRP A 32 12.413 -4.160 5.323 1.00 0.00 C ATOM 473 CE3 TRP A 32 12.090 -1.827 5.883 1.00 0.00 C ATOM 474 CZ2 TRP A 32 13.799 -3.972 5.222 1.00 0.00 C ATOM 475 CZ3 TRP A 32 13.482 -1.634 5.816 1.00 0.00 C ATOM 476 CH2 TRP A 32 14.335 -2.700 5.483 1.00 0.00 C ATOM 0 H TRP A 32 8.166 -0.661 4.900 1.00 0.00 H new ATOM 0 HA TRP A 32 7.949 -3.536 4.227 1.00 0.00 H new ATOM 0 HB2 TRP A 32 9.150 -1.983 6.499 1.00 0.00 H new ATOM 0 HB3 TRP A 32 8.419 -3.537 6.849 1.00 0.00 H new ATOM 0 HD1 TRP A 32 9.465 -5.663 5.473 1.00 0.00 H new ATOM 0 HE1 TRP A 32 11.930 -6.199 4.948 1.00 0.00 H new ATOM 0 HE3 TRP A 32 11.448 -0.992 6.122 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 14.445 -4.793 4.948 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 13.898 -0.659 6.022 1.00 0.00 H new ATOM 0 HH2 TRP A 32 15.402 -2.541 5.428 1.00 0.00 H new ATOM 487 N GLY A 33 5.914 -3.838 5.871 1.00 0.00 N ATOM 488 CA GLY A 33 4.762 -3.882 6.753 1.00 0.00 C ATOM 489 C GLY A 33 4.444 -5.304 7.155 1.00 0.00 C ATOM 490 O GLY A 33 5.141 -6.205 6.700 1.00 0.00 O ATOM 0 H GLY A 33 6.229 -4.747 5.531 1.00 0.00 H new ATOM 0 HA2 GLY A 33 4.957 -3.283 7.643 1.00 0.00 H new ATOM 0 HA3 GLY A 33 3.900 -3.440 6.254 1.00 0.00 H new ATOM 494 N SER A 34 3.396 -5.487 7.964 1.00 0.00 N ATOM 495 CA SER A 34 3.002 -6.770 8.513 1.00 0.00 C ATOM 496 C SER A 34 1.543 -6.636 8.921 1.00 0.00 C ATOM 497 O SER A 34 1.266 -6.191 10.037 1.00 0.00 O ATOM 498 CB SER A 34 3.863 -7.121 9.734 1.00 0.00 C ATOM 499 OG SER A 34 5.236 -7.169 9.413 1.00 0.00 O ATOM 0 H SER A 34 2.789 -4.722 8.257 1.00 0.00 H new ATOM 0 HA SER A 34 3.137 -7.566 7.780 1.00 0.00 H new ATOM 0 HB2 SER A 34 3.699 -6.382 10.518 1.00 0.00 H new ATOM 0 HB3 SER A 34 3.550 -8.085 10.134 1.00 0.00 H new ATOM 0 HG SER A 34 5.430 -8.000 8.931 1.00 0.00 H new ATOM 505 N ILE A 35 0.601 -6.952 8.027 1.00 0.00 N ATOM 506 CA ILE A 35 -0.792 -7.032 8.436 1.00 0.00 C ATOM 507 C ILE A 35 -0.970 -8.205 9.398 1.00 0.00 C ATOM 508 O ILE A 35 -0.087 -9.047 9.502 1.00 0.00 O ATOM 509 CB ILE A 35 -1.715 -7.052 7.204 1.00 0.00 C ATOM 510 CG1 ILE A 35 -2.572 -5.777 7.217 1.00 0.00 C ATOM 511 CG2 ILE A 35 -2.582 -8.304 7.065 1.00 0.00 C ATOM 512 CD1 ILE A 35 -3.431 -5.659 5.973 1.00 0.00 C ATOM 0 H ILE A 35 0.776 -7.151 7.042 1.00 0.00 H new ATOM 0 HA ILE A 35 -1.089 -6.142 8.990 1.00 0.00 H new ATOM 0 HB ILE A 35 -1.072 -7.082 6.325 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -3.211 -5.778 8.100 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -1.923 -4.905 7.294 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -3.196 -8.224 6.168 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -1.942 -9.183 6.989 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -3.227 -8.399 7.939 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -4.021 -4.744 6.023 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -2.792 -5.631 5.091 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -4.099 -6.518 5.909 1.00 0.00 H new ATOM 524 N LYS A 36 -2.102 -8.278 10.092 1.00 0.00 N ATOM 525 CA LYS A 36 -2.430 -9.411 10.936 1.00 0.00 C ATOM 526 C LYS A 36 -3.937 -9.438 11.152 1.00 0.00 C ATOM 527 O LYS A 36 -4.434 -8.943 12.163 1.00 0.00 O ATOM 528 CB LYS A 36 -1.657 -9.321 12.258 1.00 0.00 C ATOM 529 CG LYS A 36 -1.505 -10.699 12.919 1.00 0.00 C ATOM 530 CD LYS A 36 -1.854 -10.653 14.409 1.00 0.00 C ATOM 531 CE LYS A 36 -1.452 -11.976 15.087 1.00 0.00 C ATOM 532 NZ LYS A 36 -0.775 -11.754 16.380 1.00 0.00 N ATOM 0 H LYS A 36 -2.816 -7.549 10.082 1.00 0.00 H new ATOM 0 HA LYS A 36 -2.135 -10.345 10.457 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -0.671 -8.894 12.075 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -2.176 -8.646 12.938 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -2.152 -11.418 12.416 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -0.481 -11.051 12.796 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -1.338 -9.819 14.886 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -2.923 -10.481 14.535 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -2.341 -12.587 15.244 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -0.793 -12.537 14.425 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -0.522 -12.671 16.801 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 0.087 -11.193 16.228 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -1.413 -11.242 17.022 1.00 0.00 H new ATOM 546 N GLY A 37 -4.663 -10.001 10.188 1.00 0.00 N ATOM 547 CA GLY A 37 -6.113 -10.126 10.296 1.00 0.00 C ATOM 548 C GLY A 37 -6.814 -10.317 8.949 1.00 0.00 C ATOM 549 O GLY A 37 -8.007 -10.605 8.915 1.00 0.00 O ATOM 0 H GLY A 37 -4.270 -10.377 9.325 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -6.349 -10.972 10.942 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -6.511 -9.234 10.780 1.00 0.00 H new ATOM 553 N LEU A 38 -6.085 -10.108 7.850 1.00 0.00 N ATOM 554 CA LEU A 38 -6.539 -10.242 6.480 1.00 0.00 C ATOM 555 C LEU A 38 -6.713 -11.732 6.122 1.00 0.00 C ATOM 556 O LEU A 38 -6.990 -12.557 6.986 1.00 0.00 O ATOM 557 CB LEU A 38 -5.493 -9.475 5.649 1.00 0.00 C ATOM 558 CG LEU A 38 -5.958 -8.813 4.352 1.00 0.00 C ATOM 559 CD1 LEU A 38 -6.983 -7.693 4.564 1.00 0.00 C ATOM 560 CD2 LEU A 38 -4.744 -8.245 3.613 1.00 0.00 C ATOM 0 H LEU A 38 -5.107 -9.825 7.905 1.00 0.00 H new ATOM 0 HA LEU A 38 -7.525 -9.821 6.285 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -5.063 -8.701 6.284 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -4.689 -10.168 5.402 1.00 0.00 H new ATOM 0 HG LEU A 38 -6.455 -9.588 3.768 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -7.266 -7.271 3.600 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -7.867 -8.098 5.056 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -6.546 -6.913 5.187 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -5.070 -7.772 2.687 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -4.248 -7.507 4.243 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -4.048 -9.052 3.382 1.00 0.00 H new ATOM 572 N THR A 39 -6.564 -12.090 4.848 1.00 0.00 N ATOM 573 CA THR A 39 -6.836 -13.416 4.314 1.00 0.00 C ATOM 574 C THR A 39 -5.797 -13.732 3.257 1.00 0.00 C ATOM 575 O THR A 39 -5.446 -12.836 2.488 1.00 0.00 O ATOM 576 CB THR A 39 -8.220 -13.454 3.655 1.00 0.00 C ATOM 577 OG1 THR A 39 -8.445 -12.275 2.892 1.00 0.00 O ATOM 578 CG2 THR A 39 -9.304 -13.625 4.715 1.00 0.00 C ATOM 0 H THR A 39 -6.238 -11.437 4.135 1.00 0.00 H new ATOM 0 HA THR A 39 -6.804 -14.141 5.127 1.00 0.00 H new ATOM 0 HB THR A 39 -8.259 -14.308 2.978 1.00 0.00 H new ATOM 0 HG1 THR A 39 -7.592 -11.946 2.539 1.00 0.00 H new ATOM 0 HG21 THR A 39 -10.282 -13.650 4.234 1.00 0.00 H new ATOM 0 HG22 THR A 39 -9.141 -14.558 5.255 1.00 0.00 H new ATOM 0 HG23 THR A 39 -9.265 -12.789 5.414 1.00 0.00 H new ATOM 586 N GLU A 40 -5.353 -14.988 3.237 1.00 0.00 N ATOM 587 CA GLU A 40 -4.315 -15.498 2.351 1.00 0.00 C ATOM 588 C GLU A 40 -4.613 -15.166 0.890 1.00 0.00 C ATOM 589 O GLU A 40 -5.771 -15.007 0.501 1.00 0.00 O ATOM 590 CB GLU A 40 -4.186 -17.012 2.561 1.00 0.00 C ATOM 591 CG GLU A 40 -2.896 -17.669 2.040 1.00 0.00 C ATOM 592 CD GLU A 40 -3.062 -18.279 0.655 1.00 0.00 C ATOM 593 OE1 GLU A 40 -3.822 -19.267 0.570 1.00 0.00 O ATOM 594 OE2 GLU A 40 -2.430 -17.754 -0.283 1.00 0.00 O ATOM 0 H GLU A 40 -5.723 -15.704 3.863 1.00 0.00 H new ATOM 0 HA GLU A 40 -3.368 -15.016 2.594 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -4.266 -17.217 3.629 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -5.035 -17.497 2.079 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -2.101 -16.924 2.011 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -2.581 -18.445 2.738 1.00 0.00 H new ATOM 601 N GLY A 41 -3.555 -15.059 0.092 1.00 0.00 N ATOM 602 CA GLY A 41 -3.633 -14.864 -1.341 1.00 0.00 C ATOM 603 C GLY A 41 -2.969 -13.541 -1.628 1.00 0.00 C ATOM 604 O GLY A 41 -1.773 -13.424 -1.396 1.00 0.00 O ATOM 0 H GLY A 41 -2.597 -15.108 0.439 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -3.131 -15.673 -1.871 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -4.670 -14.859 -1.676 1.00 0.00 H new ATOM 608 N LEU A 42 -3.715 -12.522 -2.065 1.00 0.00 N ATOM 609 CA LEU A 42 -3.146 -11.198 -2.250 1.00 0.00 C ATOM 610 C LEU A 42 -4.210 -10.109 -2.145 1.00 0.00 C ATOM 611 O LEU A 42 -5.385 -10.367 -2.401 1.00 0.00 O ATOM 612 CB LEU A 42 -2.306 -11.122 -3.539 1.00 0.00 C ATOM 613 CG LEU A 42 -3.121 -10.989 -4.832 1.00 0.00 C ATOM 614 CD1 LEU A 42 -2.171 -10.939 -6.033 1.00 0.00 C ATOM 615 CD2 LEU A 42 -4.108 -12.144 -5.051 1.00 0.00 C ATOM 0 H LEU A 42 -4.706 -12.594 -2.294 1.00 0.00 H new ATOM 0 HA LEU A 42 -2.452 -11.008 -1.431 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -1.628 -10.272 -3.464 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -1.688 -12.017 -3.606 1.00 0.00 H new ATOM 0 HG LEU A 42 -3.700 -10.070 -4.737 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -2.750 -10.845 -6.951 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -1.505 -10.082 -5.934 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -1.581 -11.855 -6.069 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -4.651 -11.987 -5.983 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -3.561 -13.085 -5.104 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -4.814 -12.181 -4.221 1.00 0.00 H new ATOM 627 N HIS A 43 -3.805 -8.913 -1.707 1.00 0.00 N ATOM 628 CA HIS A 43 -4.694 -7.794 -1.423 1.00 0.00 C ATOM 629 C HIS A 43 -4.072 -6.485 -1.907 1.00 0.00 C ATOM 630 O HIS A 43 -2.884 -6.272 -1.672 1.00 0.00 O ATOM 631 CB HIS A 43 -4.895 -7.732 0.089 1.00 0.00 C ATOM 632 CG HIS A 43 -5.824 -8.799 0.607 1.00 0.00 C ATOM 633 ND1 HIS A 43 -7.150 -8.589 0.900 1.00 0.00 N ATOM 634 CD2 HIS A 43 -5.517 -10.090 0.939 1.00 0.00 C ATOM 635 CE1 HIS A 43 -7.663 -9.732 1.378 1.00 0.00 C ATOM 636 NE2 HIS A 43 -6.685 -10.651 1.424 1.00 0.00 N ATOM 0 H HIS A 43 -2.823 -8.696 -1.537 1.00 0.00 H new ATOM 0 HA HIS A 43 -5.645 -7.933 -1.937 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -3.928 -7.830 0.582 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -5.291 -6.753 0.357 1.00 0.00 H new ATOM 0 HD1 HIS A 43 -7.658 -7.713 0.775 1.00 0.00 H new ATOM 0 HD2 HIS A 43 -4.556 -10.574 0.842 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -8.689 -9.887 1.676 1.00 0.00 H new ATOM 645 N GLY A 44 -4.853 -5.610 -2.554 1.00 0.00 N ATOM 646 CA GLY A 44 -4.384 -4.306 -3.006 1.00 0.00 C ATOM 647 C GLY A 44 -3.962 -3.448 -1.817 1.00 0.00 C ATOM 648 O GLY A 44 -4.582 -3.553 -0.757 1.00 0.00 O ATOM 0 H GLY A 44 -5.831 -5.793 -2.777 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -3.543 -4.432 -3.688 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -5.174 -3.802 -3.563 1.00 0.00 H new ATOM 652 N PHE A 45 -2.926 -2.617 -1.985 1.00 0.00 N ATOM 653 CA PHE A 45 -2.302 -1.882 -0.886 1.00 0.00 C ATOM 654 C PHE A 45 -1.814 -0.523 -1.368 1.00 0.00 C ATOM 655 O PHE A 45 -0.985 -0.487 -2.278 1.00 0.00 O ATOM 656 CB PHE A 45 -1.107 -2.694 -0.373 1.00 0.00 C ATOM 657 CG PHE A 45 -1.121 -2.880 1.122 1.00 0.00 C ATOM 658 CD1 PHE A 45 -0.595 -1.896 1.973 1.00 0.00 C ATOM 659 CD2 PHE A 45 -1.706 -4.031 1.660 1.00 0.00 C ATOM 660 CE1 PHE A 45 -0.625 -2.090 3.365 1.00 0.00 C ATOM 661 CE2 PHE A 45 -1.621 -4.280 3.036 1.00 0.00 C ATOM 662 CZ PHE A 45 -1.080 -3.310 3.895 1.00 0.00 C ATOM 0 H PHE A 45 -2.497 -2.437 -2.893 1.00 0.00 H new ATOM 0 HA PHE A 45 -3.032 -1.731 -0.091 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -1.105 -3.671 -0.855 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -0.183 -2.193 -0.663 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -0.169 -0.993 1.560 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -2.223 -4.727 1.015 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -0.299 -1.302 4.027 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -1.972 -5.219 3.437 1.00 0.00 H new ATOM 0 HZ PHE A 45 -1.014 -3.500 4.956 1.00 0.00 H new ATOM 672 N HIS A 46 -2.312 0.592 -0.810 1.00 0.00 N ATOM 673 CA HIS A 46 -1.965 1.898 -1.374 1.00 0.00 C ATOM 674 C HIS A 46 -2.020 3.052 -0.380 1.00 0.00 C ATOM 675 O HIS A 46 -2.645 2.948 0.676 1.00 0.00 O ATOM 676 CB HIS A 46 -2.871 2.247 -2.568 1.00 0.00 C ATOM 677 CG HIS A 46 -3.491 1.076 -3.265 1.00 0.00 C ATOM 678 ND1 HIS A 46 -4.751 0.551 -2.996 1.00 0.00 N ATOM 679 CD2 HIS A 46 -2.944 0.339 -4.269 1.00 0.00 C ATOM 680 CE1 HIS A 46 -4.959 -0.464 -3.863 1.00 0.00 C ATOM 681 NE2 HIS A 46 -3.873 -0.583 -4.625 1.00 0.00 N ATOM 0 H HIS A 46 -2.932 0.615 -0.000 1.00 0.00 H new ATOM 0 HA HIS A 46 -0.927 1.787 -1.689 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -3.667 2.904 -2.219 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -2.286 2.813 -3.293 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -1.961 0.464 -4.699 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -5.849 -1.072 -3.927 1.00 0.00 H new ATOM 0 HE2 HIS A 46 -3.757 -1.270 -5.370 1.00 0.00 H new ATOM 689 N VAL A 47 -1.422 4.182 -0.784 1.00 0.00 N ATOM 690 CA VAL A 47 -1.578 5.472 -0.125 1.00 0.00 C ATOM 691 C VAL A 47 -2.749 6.220 -0.778 1.00 0.00 C ATOM 692 O VAL A 47 -2.784 6.417 -1.994 1.00 0.00 O ATOM 693 CB VAL A 47 -0.257 6.278 -0.086 1.00 0.00 C ATOM 694 CG1 VAL A 47 0.970 5.390 0.172 1.00 0.00 C ATOM 695 CG2 VAL A 47 -0.030 7.272 -1.235 1.00 0.00 C ATOM 0 H VAL A 47 -0.805 4.218 -1.596 1.00 0.00 H new ATOM 0 HA VAL A 47 -1.822 5.321 0.927 1.00 0.00 H new ATOM 0 HB VAL A 47 -0.390 6.925 0.781 1.00 0.00 H new ATOM 0 HG11 VAL A 47 1.868 6.007 0.189 1.00 0.00 H new ATOM 0 HG12 VAL A 47 0.858 4.885 1.131 1.00 0.00 H new ATOM 0 HG13 VAL A 47 1.055 4.647 -0.621 1.00 0.00 H new ATOM 0 HG21 VAL A 47 0.927 7.775 -1.097 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -0.025 6.736 -2.184 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -0.831 8.011 -1.240 1.00 0.00 H new ATOM 705 N HIS A 48 -3.747 6.573 0.027 1.00 0.00 N ATOM 706 CA HIS A 48 -4.903 7.368 -0.330 1.00 0.00 C ATOM 707 C HIS A 48 -4.702 8.824 0.079 1.00 0.00 C ATOM 708 O HIS A 48 -3.799 9.142 0.857 1.00 0.00 O ATOM 709 CB HIS A 48 -6.127 6.785 0.384 1.00 0.00 C ATOM 710 CG HIS A 48 -6.546 5.444 -0.159 1.00 0.00 C ATOM 711 ND1 HIS A 48 -7.816 5.135 -0.520 1.00 0.00 N ATOM 712 CD2 HIS A 48 -5.732 4.372 -0.398 1.00 0.00 C ATOM 713 CE1 HIS A 48 -7.816 3.892 -0.997 1.00 0.00 C ATOM 714 NE2 HIS A 48 -6.564 3.410 -0.968 1.00 0.00 N ATOM 0 H HIS A 48 -3.765 6.290 1.007 1.00 0.00 H new ATOM 0 HA HIS A 48 -5.048 7.341 -1.410 1.00 0.00 H new ATOM 0 HB2 HIS A 48 -5.907 6.687 1.447 1.00 0.00 H new ATOM 0 HB3 HIS A 48 -6.959 7.483 0.294 1.00 0.00 H new ATOM 0 HD1 HIS A 48 -8.628 5.747 -0.440 1.00 0.00 H new ATOM 0 HD2 HIS A 48 -4.675 4.289 -0.191 1.00 0.00 H new ATOM 0 HE1 HIS A 48 -8.685 3.357 -1.351 1.00 0.00 H new ATOM 722 N GLU A 49 -5.563 9.694 -0.453 1.00 0.00 N ATOM 723 CA GLU A 49 -5.648 11.093 -0.039 1.00 0.00 C ATOM 724 C GLU A 49 -6.086 11.257 1.425 1.00 0.00 C ATOM 725 O GLU A 49 -6.283 10.279 2.151 1.00 0.00 O ATOM 726 CB GLU A 49 -6.497 11.885 -1.051 1.00 0.00 C ATOM 727 CG GLU A 49 -5.583 12.738 -1.945 1.00 0.00 C ATOM 728 CD GLU A 49 -6.324 13.414 -3.092 1.00 0.00 C ATOM 729 OE1 GLU A 49 -7.481 13.011 -3.349 1.00 0.00 O ATOM 730 OE2 GLU A 49 -5.699 14.300 -3.712 1.00 0.00 O ATOM 0 H GLU A 49 -6.225 9.444 -1.188 1.00 0.00 H new ATOM 0 HA GLU A 49 -4.648 11.525 -0.055 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -7.082 11.199 -1.663 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -7.205 12.525 -0.524 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -5.098 13.500 -1.335 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -4.794 12.107 -2.353 1.00 0.00 H new ATOM 737 N GLU A 50 -6.190 12.519 1.847 1.00 0.00 N ATOM 738 CA GLU A 50 -6.465 12.946 3.206 1.00 0.00 C ATOM 739 C GLU A 50 -5.401 12.449 4.194 1.00 0.00 C ATOM 740 O GLU A 50 -4.294 12.070 3.804 1.00 0.00 O ATOM 741 CB GLU A 50 -7.912 12.591 3.594 1.00 0.00 C ATOM 742 CG GLU A 50 -8.923 12.891 2.473 1.00 0.00 C ATOM 743 CD GLU A 50 -8.850 14.335 1.992 1.00 0.00 C ATOM 744 OE1 GLU A 50 -7.939 14.616 1.181 1.00 0.00 O ATOM 745 OE2 GLU A 50 -9.695 15.127 2.459 1.00 0.00 O ATOM 0 H GLU A 50 -6.077 13.307 1.209 1.00 0.00 H new ATOM 0 HA GLU A 50 -6.392 14.032 3.258 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -7.965 11.533 3.851 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -8.191 13.150 4.487 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -8.738 12.222 1.633 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -9.931 12.681 2.831 1.00 0.00 H new ATOM 752 N GLU A 51 -5.745 12.506 5.481 1.00 0.00 N ATOM 753 CA GLU A 51 -4.927 12.130 6.621 1.00 0.00 C ATOM 754 C GLU A 51 -5.940 11.716 7.697 1.00 0.00 C ATOM 755 O GLU A 51 -6.650 10.731 7.491 1.00 0.00 O ATOM 756 CB GLU A 51 -3.983 13.308 6.945 1.00 0.00 C ATOM 757 CG GLU A 51 -2.827 12.996 7.914 1.00 0.00 C ATOM 758 CD GLU A 51 -3.149 13.235 9.379 1.00 0.00 C ATOM 759 OE1 GLU A 51 -4.086 14.022 9.631 1.00 0.00 O ATOM 760 OE2 GLU A 51 -2.442 12.639 10.215 1.00 0.00 O ATOM 0 H GLU A 51 -6.665 12.839 5.767 1.00 0.00 H new ATOM 0 HA GLU A 51 -4.245 11.291 6.480 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -3.559 13.676 6.011 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -4.577 14.119 7.367 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -2.533 11.954 7.785 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -1.966 13.606 7.640 1.00 0.00 H new ATOM 767 N ASP A 52 -6.122 12.473 8.781 1.00 0.00 N ATOM 768 CA ASP A 52 -7.248 12.225 9.674 1.00 0.00 C ATOM 769 C ASP A 52 -8.570 12.501 8.961 1.00 0.00 C ATOM 770 O ASP A 52 -8.677 13.475 8.218 1.00 0.00 O ATOM 771 CB ASP A 52 -7.149 13.038 10.964 1.00 0.00 C ATOM 772 CG ASP A 52 -8.299 12.658 11.887 1.00 0.00 C ATOM 773 OD1 ASP A 52 -8.141 11.641 12.596 1.00 0.00 O ATOM 774 OD2 ASP A 52 -9.345 13.335 11.811 1.00 0.00 O ATOM 0 H ASP A 52 -5.516 13.247 9.055 1.00 0.00 H new ATOM 0 HA ASP A 52 -7.214 11.172 9.954 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -6.195 12.847 11.455 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -7.185 14.104 10.739 1.00 0.00 H new ATOM 779 N ASN A 53 -9.545 11.608 9.184 1.00 0.00 N ATOM 780 CA ASN A 53 -10.918 11.635 8.689 1.00 0.00 C ATOM 781 C ASN A 53 -11.556 10.264 8.869 1.00 0.00 C ATOM 782 O ASN A 53 -12.742 10.151 9.170 1.00 0.00 O ATOM 783 CB ASN A 53 -11.011 12.001 7.203 1.00 0.00 C ATOM 784 CG ASN A 53 -12.472 12.017 6.770 1.00 0.00 C ATOM 785 OD1 ASN A 53 -12.932 11.136 6.046 1.00 0.00 O ATOM 786 ND2 ASN A 53 -13.225 13.004 7.249 1.00 0.00 N ATOM 0 H ASN A 53 -9.374 10.785 9.762 1.00 0.00 H new ATOM 0 HA ASN A 53 -11.437 12.401 9.265 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -10.559 12.978 7.030 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -10.452 11.281 6.605 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -14.218 13.046 7.018 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -12.810 13.718 7.847 1.00 0.00 H new ATOM 793 N THR A 54 -10.773 9.206 8.645 1.00 0.00 N ATOM 794 CA THR A 54 -11.267 7.845 8.484 1.00 0.00 C ATOM 795 C THR A 54 -11.596 7.170 9.828 1.00 0.00 C ATOM 796 O THR A 54 -11.301 5.995 10.035 1.00 0.00 O ATOM 797 CB THR A 54 -10.268 7.087 7.587 1.00 0.00 C ATOM 798 OG1 THR A 54 -10.886 5.985 6.963 1.00 0.00 O ATOM 799 CG2 THR A 54 -8.965 6.662 8.272 1.00 0.00 C ATOM 0 H THR A 54 -9.758 9.278 8.570 1.00 0.00 H new ATOM 0 HA THR A 54 -12.234 7.840 7.982 1.00 0.00 H new ATOM 0 HB THR A 54 -9.965 7.816 6.835 1.00 0.00 H new ATOM 0 HG1 THR A 54 -10.222 5.280 6.812 1.00 0.00 H new ATOM 0 HG21 THR A 54 -8.332 6.137 7.556 1.00 0.00 H new ATOM 0 HG22 THR A 54 -8.442 7.545 8.639 1.00 0.00 H new ATOM 0 HG23 THR A 54 -9.192 6.001 9.108 1.00 0.00 H new ATOM 807 N ALA A 55 -12.266 7.911 10.720 1.00 0.00 N ATOM 808 CA ALA A 55 -12.577 7.548 12.101 1.00 0.00 C ATOM 809 C ALA A 55 -13.015 6.091 12.260 1.00 0.00 C ATOM 810 O ALA A 55 -12.632 5.431 13.222 1.00 0.00 O ATOM 811 CB ALA A 55 -13.660 8.493 12.630 1.00 0.00 C ATOM 0 H ALA A 55 -12.625 8.835 10.478 1.00 0.00 H new ATOM 0 HA ALA A 55 -11.661 7.650 12.683 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -13.900 8.231 13.660 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -13.297 9.520 12.592 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -14.555 8.401 12.015 1.00 0.00 H new ATOM 817 N GLY A 56 -13.820 5.599 11.316 1.00 0.00 N ATOM 818 CA GLY A 56 -14.197 4.198 11.244 1.00 0.00 C ATOM 819 C GLY A 56 -14.197 3.724 9.796 1.00 0.00 C ATOM 820 O GLY A 56 -15.185 3.157 9.340 1.00 0.00 O ATOM 0 H GLY A 56 -14.228 6.172 10.577 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -13.502 3.597 11.831 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -15.186 4.058 11.680 1.00 0.00 H new ATOM 824 N CYS A 57 -13.097 3.961 9.067 1.00 0.00 N ATOM 825 CA CYS A 57 -12.918 3.436 7.710 1.00 0.00 C ATOM 826 C CYS A 57 -14.062 3.892 6.794 1.00 0.00 C ATOM 827 O CYS A 57 -14.562 3.142 5.960 1.00 0.00 O ATOM 828 CB CYS A 57 -12.699 1.909 7.765 1.00 0.00 C ATOM 829 SG CYS A 57 -11.045 1.321 7.306 1.00 0.00 S ATOM 0 H CYS A 57 -12.311 4.519 9.401 1.00 0.00 H new ATOM 0 HA CYS A 57 -12.017 3.851 7.258 1.00 0.00 H new ATOM 0 HB2 CYS A 57 -12.915 1.568 8.777 1.00 0.00 H new ATOM 0 HB3 CYS A 57 -13.426 1.434 7.107 1.00 0.00 H new ATOM 834 N THR A 58 -14.467 5.156 6.956 1.00 0.00 N ATOM 835 CA THR A 58 -15.646 5.742 6.343 1.00 0.00 C ATOM 836 C THR A 58 -15.407 5.971 4.847 1.00 0.00 C ATOM 837 O THR A 58 -15.770 5.154 4.001 1.00 0.00 O ATOM 838 CB THR A 58 -15.937 7.060 7.087 1.00 0.00 C ATOM 839 OG1 THR A 58 -14.725 7.795 7.196 1.00 0.00 O ATOM 840 CG2 THR A 58 -16.476 6.804 8.497 1.00 0.00 C ATOM 0 H THR A 58 -13.958 5.818 7.542 1.00 0.00 H new ATOM 0 HA THR A 58 -16.507 5.078 6.422 1.00 0.00 H new ATOM 0 HB THR A 58 -16.690 7.612 6.525 1.00 0.00 H new ATOM 0 HG1 THR A 58 -14.895 8.638 7.666 1.00 0.00 H new ATOM 0 HG21 THR A 58 -16.670 7.756 8.991 1.00 0.00 H new ATOM 0 HG22 THR A 58 -17.402 6.233 8.434 1.00 0.00 H new ATOM 0 HG23 THR A 58 -15.740 6.240 9.071 1.00 0.00 H new ATOM 848 N SER A 59 -14.797 7.113 4.524 1.00 0.00 N ATOM 849 CA SER A 59 -14.454 7.509 3.168 1.00 0.00 C ATOM 850 C SER A 59 -12.957 7.340 2.945 1.00 0.00 C ATOM 851 O SER A 59 -12.568 6.724 1.956 1.00 0.00 O ATOM 852 CB SER A 59 -14.920 8.939 2.897 1.00 0.00 C ATOM 853 OG SER A 59 -16.332 8.966 2.935 1.00 0.00 O ATOM 0 H SER A 59 -14.523 7.804 5.223 1.00 0.00 H new ATOM 0 HA SER A 59 -14.970 6.864 2.457 1.00 0.00 H new ATOM 0 HB2 SER A 59 -14.508 9.619 3.643 1.00 0.00 H new ATOM 0 HB3 SER A 59 -14.561 9.276 1.925 1.00 0.00 H new ATOM 0 HG SER A 59 -16.646 9.878 2.764 1.00 0.00 H new ATOM 859 N ALA A 60 -12.129 7.877 3.847 1.00 0.00 N ATOM 860 CA ALA A 60 -10.670 7.845 3.774 1.00 0.00 C ATOM 861 C ALA A 60 -10.146 8.702 2.622 1.00 0.00 C ATOM 862 O ALA A 60 -9.482 9.703 2.852 1.00 0.00 O ATOM 863 CB ALA A 60 -10.133 6.405 3.720 1.00 0.00 C ATOM 0 H ALA A 60 -12.471 8.362 4.676 1.00 0.00 H new ATOM 0 HA ALA A 60 -10.288 8.286 4.695 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -9.044 6.424 3.666 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -10.443 5.867 4.616 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -10.531 5.901 2.839 1.00 0.00 H new ATOM 869 N GLY A 61 -10.452 8.302 1.389 1.00 0.00 N ATOM 870 CA GLY A 61 -10.087 8.990 0.167 1.00 0.00 C ATOM 871 C GLY A 61 -9.985 7.966 -0.963 1.00 0.00 C ATOM 872 O GLY A 61 -10.058 6.754 -0.712 1.00 0.00 O ATOM 0 H GLY A 61 -10.985 7.450 1.214 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -10.832 9.748 -0.076 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -9.136 9.507 0.295 1.00 0.00 H new ATOM 876 N PRO A 62 -9.828 8.418 -2.212 1.00 0.00 N ATOM 877 CA PRO A 62 -9.378 7.577 -3.308 1.00 0.00 C ATOM 878 C PRO A 62 -7.862 7.370 -3.202 1.00 0.00 C ATOM 879 O PRO A 62 -7.232 7.885 -2.276 1.00 0.00 O ATOM 880 CB PRO A 62 -9.788 8.346 -4.567 1.00 0.00 C ATOM 881 CG PRO A 62 -9.669 9.811 -4.137 1.00 0.00 C ATOM 882 CD PRO A 62 -10.021 9.792 -2.647 1.00 0.00 C ATOM 0 HA PRO A 62 -9.812 6.577 -3.309 1.00 0.00 H new ATOM 0 HB2 PRO A 62 -9.133 8.119 -5.408 1.00 0.00 H new ATOM 0 HB3 PRO A 62 -10.803 8.099 -4.877 1.00 0.00 H new ATOM 0 HG2 PRO A 62 -8.663 10.195 -4.304 1.00 0.00 H new ATOM 0 HG3 PRO A 62 -10.351 10.448 -4.700 1.00 0.00 H new ATOM 0 HD2 PRO A 62 -9.382 10.473 -2.085 1.00 0.00 H new ATOM 0 HD3 PRO A 62 -11.050 10.113 -2.484 1.00 0.00 H new ATOM 890 N HIS A 63 -7.275 6.607 -4.138 1.00 0.00 N ATOM 891 CA HIS A 63 -5.820 6.518 -4.267 1.00 0.00 C ATOM 892 C HIS A 63 -5.246 7.928 -4.424 1.00 0.00 C ATOM 893 O HIS A 63 -5.871 8.777 -5.054 1.00 0.00 O ATOM 894 CB HIS A 63 -5.401 5.699 -5.502 1.00 0.00 C ATOM 895 CG HIS A 63 -5.445 4.192 -5.384 1.00 0.00 C ATOM 896 ND1 HIS A 63 -4.701 3.267 -6.134 1.00 0.00 N ATOM 897 CD2 HIS A 63 -6.341 3.471 -4.653 1.00 0.00 C ATOM 898 CE1 HIS A 63 -5.168 2.024 -5.851 1.00 0.00 C ATOM 899 NE2 HIS A 63 -6.168 2.157 -4.965 1.00 0.00 N ATOM 0 H HIS A 63 -7.790 6.044 -4.815 1.00 0.00 H new ATOM 0 HA HIS A 63 -5.440 6.025 -3.373 1.00 0.00 H new ATOM 0 HB2 HIS A 63 -6.043 5.991 -6.333 1.00 0.00 H new ATOM 0 HB3 HIS A 63 -4.384 5.987 -5.768 1.00 0.00 H new ATOM 0 HD2 HIS A 63 -7.059 3.870 -3.952 1.00 0.00 H new ATOM 0 HE1 HIS A 63 -4.801 1.096 -6.264 1.00 0.00 H new ATOM 0 HE2 HIS A 63 -6.717 1.387 -4.582 1.00 0.00 H new ATOM 907 N PHE A 64 -4.049 8.156 -3.882 1.00 0.00 N ATOM 908 CA PHE A 64 -3.324 9.406 -4.068 1.00 0.00 C ATOM 909 C PHE A 64 -2.929 9.582 -5.540 1.00 0.00 C ATOM 910 O PHE A 64 -3.061 8.648 -6.329 1.00 0.00 O ATOM 911 CB PHE A 64 -2.084 9.373 -3.167 1.00 0.00 C ATOM 912 CG PHE A 64 -1.561 10.726 -2.741 1.00 0.00 C ATOM 913 CD1 PHE A 64 -2.175 11.367 -1.655 1.00 0.00 C ATOM 914 CD2 PHE A 64 -0.499 11.358 -3.410 1.00 0.00 C ATOM 915 CE1 PHE A 64 -1.805 12.671 -1.294 1.00 0.00 C ATOM 916 CE2 PHE A 64 -0.091 12.646 -3.020 1.00 0.00 C ATOM 917 CZ PHE A 64 -0.750 13.307 -1.969 1.00 0.00 C ATOM 0 H PHE A 64 -3.557 7.476 -3.302 1.00 0.00 H new ATOM 0 HA PHE A 64 -3.954 10.253 -3.798 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -2.319 8.795 -2.274 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -1.289 8.842 -3.690 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -2.939 10.852 -1.092 1.00 0.00 H new ATOM 0 HD2 PHE A 64 0.003 10.855 -4.223 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -2.329 13.184 -0.501 1.00 0.00 H new ATOM 0 HE2 PHE A 64 0.730 13.128 -3.529 1.00 0.00 H new ATOM 0 HZ PHE A 64 -0.446 14.302 -1.681 1.00 0.00 H new ATOM 927 N ASN A 65 -2.375 10.744 -5.902 1.00 0.00 N ATOM 928 CA ASN A 65 -1.830 11.021 -7.234 1.00 0.00 C ATOM 929 C ASN A 65 -0.481 11.745 -7.099 1.00 0.00 C ATOM 930 O ASN A 65 -0.385 12.654 -6.281 1.00 0.00 O ATOM 931 CB ASN A 65 -2.804 11.887 -8.039 1.00 0.00 C ATOM 932 CG ASN A 65 -4.020 11.105 -8.532 1.00 0.00 C ATOM 933 OD1 ASN A 65 -5.064 11.104 -7.895 1.00 0.00 O ATOM 934 ND2 ASN A 65 -3.918 10.436 -9.681 1.00 0.00 N ATOM 0 H ASN A 65 -2.292 11.535 -5.263 1.00 0.00 H new ATOM 0 HA ASN A 65 -1.685 10.077 -7.759 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -3.139 12.720 -7.421 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -2.281 12.315 -8.894 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -4.717 9.914 -10.040 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -3.041 10.446 -10.201 1.00 0.00 H new ATOM 941 N PRO A 66 0.567 11.374 -7.863 1.00 0.00 N ATOM 942 CA PRO A 66 1.864 12.034 -7.814 1.00 0.00 C ATOM 943 C PRO A 66 1.852 13.246 -8.745 1.00 0.00 C ATOM 944 O PRO A 66 1.826 14.386 -8.297 1.00 0.00 O ATOM 945 CB PRO A 66 2.877 10.981 -8.275 1.00 0.00 C ATOM 946 CG PRO A 66 2.080 9.995 -9.138 1.00 0.00 C ATOM 947 CD PRO A 66 0.608 10.249 -8.781 1.00 0.00 C ATOM 0 HA PRO A 66 2.114 12.401 -6.819 1.00 0.00 H new ATOM 0 HB2 PRO A 66 3.685 11.438 -8.846 1.00 0.00 H new ATOM 0 HB3 PRO A 66 3.334 10.477 -7.423 1.00 0.00 H new ATOM 0 HG2 PRO A 66 2.263 10.163 -10.199 1.00 0.00 H new ATOM 0 HG3 PRO A 66 2.365 8.965 -8.925 1.00 0.00 H new ATOM 0 HD2 PRO A 66 0.028 10.466 -9.678 1.00 0.00 H new ATOM 0 HD3 PRO A 66 0.167 9.364 -8.322 1.00 0.00 H new ATOM 955 N LEU A 67 1.860 12.977 -10.055 1.00 0.00 N ATOM 956 CA LEU A 67 1.776 13.958 -11.126 1.00 0.00 C ATOM 957 C LEU A 67 0.492 13.702 -11.925 1.00 0.00 C ATOM 958 O LEU A 67 0.459 13.894 -13.136 1.00 0.00 O ATOM 959 CB LEU A 67 3.028 13.852 -12.015 1.00 0.00 C ATOM 960 CG LEU A 67 4.324 14.214 -11.263 1.00 0.00 C ATOM 961 CD1 LEU A 67 5.262 13.006 -11.165 1.00 0.00 C ATOM 962 CD2 LEU A 67 5.054 15.356 -11.977 1.00 0.00 C ATOM 0 H LEU A 67 1.929 12.022 -10.407 1.00 0.00 H new ATOM 0 HA LEU A 67 1.738 14.970 -10.723 1.00 0.00 H new ATOM 0 HB2 LEU A 67 3.109 12.836 -12.402 1.00 0.00 H new ATOM 0 HB3 LEU A 67 2.915 14.512 -12.875 1.00 0.00 H new ATOM 0 HG LEU A 67 4.044 14.528 -10.257 1.00 0.00 H new ATOM 0 HD11 LEU A 67 6.168 13.291 -10.630 1.00 0.00 H new ATOM 0 HD12 LEU A 67 4.762 12.200 -10.628 1.00 0.00 H new ATOM 0 HD13 LEU A 67 5.524 12.667 -12.167 1.00 0.00 H new ATOM 0 HD21 LEU A 67 5.967 15.600 -11.434 1.00 0.00 H new ATOM 0 HD22 LEU A 67 5.307 15.048 -12.992 1.00 0.00 H new ATOM 0 HD23 LEU A 67 4.408 16.233 -12.014 1.00 0.00 H new ATOM 974 N SER A 68 -0.570 13.252 -11.245 1.00 0.00 N ATOM 975 CA SER A 68 -1.891 13.076 -11.845 1.00 0.00 C ATOM 976 C SER A 68 -1.865 12.074 -13.009 1.00 0.00 C ATOM 977 O SER A 68 -2.385 12.334 -14.091 1.00 0.00 O ATOM 978 CB SER A 68 -2.478 14.445 -12.223 1.00 0.00 C ATOM 979 OG SER A 68 -3.890 14.395 -12.168 1.00 0.00 O ATOM 0 H SER A 68 -0.533 12.999 -10.257 1.00 0.00 H new ATOM 0 HA SER A 68 -2.560 12.630 -11.109 1.00 0.00 H new ATOM 0 HB2 SER A 68 -2.106 15.211 -11.542 1.00 0.00 H new ATOM 0 HB3 SER A 68 -2.154 14.725 -13.225 1.00 0.00 H new ATOM 0 HG SER A 68 -4.258 15.271 -12.408 1.00 0.00 H new ATOM 985 N ARG A 69 -1.268 10.903 -12.765 1.00 0.00 N ATOM 986 CA ARG A 69 -1.332 9.753 -13.665 1.00 0.00 C ATOM 987 C ARG A 69 -2.523 8.885 -13.252 1.00 0.00 C ATOM 988 O ARG A 69 -3.057 9.078 -12.157 1.00 0.00 O ATOM 989 CB ARG A 69 -0.025 8.953 -13.568 1.00 0.00 C ATOM 990 CG ARG A 69 1.187 9.791 -13.994 1.00 0.00 C ATOM 991 CD ARG A 69 2.488 9.081 -13.605 1.00 0.00 C ATOM 992 NE ARG A 69 3.638 9.702 -14.282 1.00 0.00 N ATOM 993 CZ ARG A 69 4.872 9.894 -13.784 1.00 0.00 C ATOM 994 NH1 ARG A 69 5.160 9.562 -12.520 1.00 0.00 N ATOM 995 NH2 ARG A 69 5.822 10.424 -14.563 1.00 0.00 N ATOM 0 H ARG A 69 -0.719 10.728 -11.923 1.00 0.00 H new ATOM 0 HA ARG A 69 -1.459 10.081 -14.697 1.00 0.00 H new ATOM 0 HB2 ARG A 69 0.114 8.606 -12.544 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -0.094 8.066 -14.198 1.00 0.00 H new ATOM 0 HG2 ARG A 69 1.163 9.956 -15.071 1.00 0.00 H new ATOM 0 HG3 ARG A 69 1.144 10.772 -13.520 1.00 0.00 H new ATOM 0 HD2 ARG A 69 2.626 9.128 -12.525 1.00 0.00 H new ATOM 0 HD3 ARG A 69 2.427 8.026 -13.873 1.00 0.00 H new ATOM 0 HE ARG A 69 3.481 10.023 -15.237 1.00 0.00 H new ATOM 0 HH11 ARG A 69 4.439 9.158 -11.922 1.00 0.00 H new ATOM 0 HH12 ARG A 69 6.100 9.713 -12.155 1.00 0.00 H new ATOM 0 HH21 ARG A 69 5.607 10.679 -15.527 1.00 0.00 H new ATOM 0 HH22 ARG A 69 6.761 10.573 -14.193 1.00 0.00 H new ATOM 1009 N LYS A 70 -2.931 7.919 -14.082 1.00 0.00 N ATOM 1010 CA LYS A 70 -3.876 6.907 -13.657 1.00 0.00 C ATOM 1011 C LYS A 70 -3.194 5.879 -12.749 1.00 0.00 C ATOM 1012 O LYS A 70 -1.991 5.927 -12.488 1.00 0.00 O ATOM 1013 CB LYS A 70 -4.440 6.231 -14.903 1.00 0.00 C ATOM 1014 CG LYS A 70 -5.490 7.094 -15.612 1.00 0.00 C ATOM 1015 CD LYS A 70 -5.428 6.907 -17.136 1.00 0.00 C ATOM 1016 CE LYS A 70 -6.834 6.783 -17.738 1.00 0.00 C ATOM 1017 NZ LYS A 70 -6.819 6.962 -19.202 1.00 0.00 N ATOM 0 H LYS A 70 -2.617 7.825 -15.048 1.00 0.00 H new ATOM 0 HA LYS A 70 -4.682 7.367 -13.085 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -3.626 6.013 -15.594 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -4.886 5.276 -14.625 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -6.484 6.831 -15.251 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -5.329 8.143 -15.365 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -4.909 7.753 -17.588 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -4.849 6.015 -17.372 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -7.249 5.805 -17.495 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -7.490 7.528 -17.287 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -7.786 6.871 -19.573 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -6.447 7.905 -19.433 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -6.213 6.236 -19.634 1.00 0.00 H new ATOM 1031 N HIS A 71 -4.017 4.960 -12.248 1.00 0.00 N ATOM 1032 CA HIS A 71 -3.613 3.845 -11.419 1.00 0.00 C ATOM 1033 C HIS A 71 -2.830 2.818 -12.230 1.00 0.00 C ATOM 1034 O HIS A 71 -3.013 2.708 -13.440 1.00 0.00 O ATOM 1035 CB HIS A 71 -4.873 3.169 -10.873 1.00 0.00 C ATOM 1036 CG HIS A 71 -4.590 2.074 -9.894 1.00 0.00 C ATOM 1037 ND1 HIS A 71 -3.852 2.182 -8.721 1.00 0.00 N ATOM 1038 CD2 HIS A 71 -4.824 0.745 -10.079 1.00 0.00 C ATOM 1039 CE1 HIS A 71 -3.490 0.951 -8.347 1.00 0.00 C ATOM 1040 NE2 HIS A 71 -4.209 0.095 -9.059 1.00 0.00 N ATOM 0 H HIS A 71 -5.022 4.980 -12.420 1.00 0.00 H new ATOM 0 HA HIS A 71 -2.979 4.216 -10.614 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -5.499 3.921 -10.393 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -5.446 2.761 -11.706 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -5.389 0.296 -10.882 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -2.749 0.700 -7.603 1.00 0.00 H new ATOM 0 HE2 HIS A 71 -4.288 -0.904 -8.869 1.00 0.00 H new ATOM 1048 N GLY A 72 -2.043 2.004 -11.531 1.00 0.00 N ATOM 1049 CA GLY A 72 -1.491 0.778 -12.065 1.00 0.00 C ATOM 1050 C GLY A 72 -0.614 0.151 -10.994 1.00 0.00 C ATOM 1051 O GLY A 72 -0.910 0.308 -9.812 1.00 0.00 O ATOM 0 H GLY A 72 -1.772 2.187 -10.565 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -2.290 0.094 -12.352 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -0.908 0.982 -12.963 1.00 0.00 H new ATOM 1055 N GLY A 73 0.457 -0.540 -11.387 1.00 0.00 N ATOM 1056 CA GLY A 73 1.409 -1.150 -10.466 1.00 0.00 C ATOM 1057 C GLY A 73 2.814 -0.614 -10.709 1.00 0.00 C ATOM 1058 O GLY A 73 3.062 0.010 -11.739 1.00 0.00 O ATOM 0 H GLY A 73 0.688 -0.692 -12.369 1.00 0.00 H new ATOM 0 HA2 GLY A 73 1.110 -0.946 -9.438 1.00 0.00 H new ATOM 0 HA3 GLY A 73 1.401 -2.233 -10.591 1.00 0.00 H new ATOM 1062 N PRO A 74 3.762 -0.876 -9.799 1.00 0.00 N ATOM 1063 CA PRO A 74 5.096 -0.304 -9.870 1.00 0.00 C ATOM 1064 C PRO A 74 5.806 -0.715 -11.160 1.00 0.00 C ATOM 1065 O PRO A 74 6.556 0.072 -11.736 1.00 0.00 O ATOM 1066 CB PRO A 74 5.814 -0.777 -8.604 1.00 0.00 C ATOM 1067 CG PRO A 74 5.082 -2.066 -8.222 1.00 0.00 C ATOM 1068 CD PRO A 74 3.650 -1.817 -8.697 1.00 0.00 C ATOM 0 HA PRO A 74 5.078 0.785 -9.906 1.00 0.00 H new ATOM 0 HB2 PRO A 74 6.872 -0.959 -8.790 1.00 0.00 H new ATOM 0 HB3 PRO A 74 5.754 -0.033 -7.809 1.00 0.00 H new ATOM 0 HG2 PRO A 74 5.521 -2.936 -8.709 1.00 0.00 H new ATOM 0 HG3 PRO A 74 5.123 -2.248 -7.148 1.00 0.00 H new ATOM 0 HD2 PRO A 74 3.177 -2.745 -9.020 1.00 0.00 H new ATOM 0 HD3 PRO A 74 3.036 -1.409 -7.894 1.00 0.00 H new ATOM 1076 N LYS A 75 5.534 -1.938 -11.626 1.00 0.00 N ATOM 1077 CA LYS A 75 6.063 -2.502 -12.843 1.00 0.00 C ATOM 1078 C LYS A 75 5.449 -1.843 -14.085 1.00 0.00 C ATOM 1079 O LYS A 75 6.085 -1.849 -15.140 1.00 0.00 O ATOM 1080 CB LYS A 75 5.788 -4.015 -12.781 1.00 0.00 C ATOM 1081 CG LYS A 75 5.980 -4.666 -14.145 1.00 0.00 C ATOM 1082 CD LYS A 75 5.987 -6.197 -14.053 1.00 0.00 C ATOM 1083 CE LYS A 75 5.949 -6.844 -15.447 1.00 0.00 C ATOM 1084 NZ LYS A 75 7.122 -6.486 -16.270 1.00 0.00 N ATOM 0 H LYS A 75 4.911 -2.579 -11.134 1.00 0.00 H new ATOM 0 HA LYS A 75 7.134 -2.318 -12.928 1.00 0.00 H new ATOM 0 HB2 LYS A 75 6.457 -4.479 -12.056 1.00 0.00 H new ATOM 0 HB3 LYS A 75 4.770 -4.188 -12.432 1.00 0.00 H new ATOM 0 HG2 LYS A 75 5.182 -4.346 -14.815 1.00 0.00 H new ATOM 0 HG3 LYS A 75 6.919 -4.324 -14.581 1.00 0.00 H new ATOM 0 HD2 LYS A 75 6.880 -6.527 -13.522 1.00 0.00 H new ATOM 0 HD3 LYS A 75 5.128 -6.532 -13.472 1.00 0.00 H new ATOM 0 HE2 LYS A 75 5.902 -7.928 -15.340 1.00 0.00 H new ATOM 0 HE3 LYS A 75 5.040 -6.535 -15.963 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 7.056 -6.961 -17.193 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 7.145 -5.456 -16.411 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 7.991 -6.789 -15.786 1.00 0.00 H new ATOM 1098 N ASP A 76 4.215 -1.337 -13.995 1.00 0.00 N ATOM 1099 CA ASP A 76 3.564 -0.699 -15.120 1.00 0.00 C ATOM 1100 C ASP A 76 4.087 0.733 -15.199 1.00 0.00 C ATOM 1101 O ASP A 76 4.634 1.283 -14.239 1.00 0.00 O ATOM 1102 CB ASP A 76 2.036 -0.748 -14.968 1.00 0.00 C ATOM 1103 CG ASP A 76 1.407 -2.137 -15.065 1.00 0.00 C ATOM 1104 OD1 ASP A 76 1.956 -3.043 -15.730 1.00 0.00 O ATOM 1105 OD2 ASP A 76 0.298 -2.300 -14.513 1.00 0.00 O ATOM 0 H ASP A 76 3.652 -1.362 -13.145 1.00 0.00 H new ATOM 0 HA ASP A 76 3.792 -1.223 -16.048 1.00 0.00 H new ATOM 0 HB2 ASP A 76 1.771 -0.315 -14.003 1.00 0.00 H new ATOM 0 HB3 ASP A 76 1.592 -0.113 -15.735 1.00 0.00 H new ATOM 1110 N GLU A 77 3.937 1.330 -16.378 1.00 0.00 N ATOM 1111 CA GLU A 77 4.401 2.687 -16.625 1.00 0.00 C ATOM 1112 C GLU A 77 3.510 3.665 -15.854 1.00 0.00 C ATOM 1113 O GLU A 77 3.991 4.631 -15.260 1.00 0.00 O ATOM 1114 CB GLU A 77 4.390 2.978 -18.134 1.00 0.00 C ATOM 1115 CG GLU A 77 5.446 4.032 -18.485 1.00 0.00 C ATOM 1116 CD GLU A 77 5.247 4.563 -19.897 1.00 0.00 C ATOM 1117 OE1 GLU A 77 5.748 3.896 -20.827 1.00 0.00 O ATOM 1118 OE2 GLU A 77 4.589 5.618 -20.012 1.00 0.00 O ATOM 0 H GLU A 77 3.493 0.888 -17.183 1.00 0.00 H new ATOM 0 HA GLU A 77 5.427 2.805 -16.276 1.00 0.00 H new ATOM 0 HB2 GLU A 77 4.585 2.060 -18.689 1.00 0.00 H new ATOM 0 HB3 GLU A 77 3.403 3.329 -18.436 1.00 0.00 H new ATOM 0 HG2 GLU A 77 5.392 4.856 -17.773 1.00 0.00 H new ATOM 0 HG3 GLU A 77 6.441 3.597 -18.394 1.00 0.00 H new ATOM 1125 N GLU A 78 2.205 3.377 -15.860 1.00 0.00 N ATOM 1126 CA GLU A 78 1.184 4.185 -15.209 1.00 0.00 C ATOM 1127 C GLU A 78 0.920 3.562 -13.843 1.00 0.00 C ATOM 1128 O GLU A 78 0.886 2.339 -13.726 1.00 0.00 O ATOM 1129 CB GLU A 78 -0.082 4.287 -16.086 1.00 0.00 C ATOM 1130 CG GLU A 78 -0.396 5.769 -16.341 1.00 0.00 C ATOM 1131 CD GLU A 78 -1.665 6.036 -17.139 1.00 0.00 C ATOM 1132 OE1 GLU A 78 -2.170 5.099 -17.793 1.00 0.00 O ATOM 1133 OE2 GLU A 78 -2.145 7.188 -17.020 1.00 0.00 O ATOM 0 H GLU A 78 1.826 2.555 -16.330 1.00 0.00 H new ATOM 0 HA GLU A 78 1.519 5.213 -15.072 1.00 0.00 H new ATOM 0 HB2 GLU A 78 0.072 3.767 -17.031 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -0.924 3.804 -15.590 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -0.477 6.277 -15.380 1.00 0.00 H new ATOM 0 HG3 GLU A 78 0.446 6.217 -16.868 1.00 0.00 H new ATOM 1140 N ARG A 79 0.823 4.406 -12.815 1.00 0.00 N ATOM 1141 CA ARG A 79 0.839 4.048 -11.404 1.00 0.00 C ATOM 1142 C ARG A 79 0.929 5.345 -10.599 1.00 0.00 C ATOM 1143 O ARG A 79 1.716 6.235 -10.929 1.00 0.00 O ATOM 1144 CB ARG A 79 1.987 3.087 -11.063 1.00 0.00 C ATOM 1145 CG ARG A 79 3.349 3.522 -11.618 1.00 0.00 C ATOM 1146 CD ARG A 79 4.330 3.836 -10.482 1.00 0.00 C ATOM 1147 NE ARG A 79 5.499 4.597 -10.945 1.00 0.00 N ATOM 1148 CZ ARG A 79 6.355 4.257 -11.925 1.00 0.00 C ATOM 1149 NH1 ARG A 79 6.292 3.066 -12.532 1.00 0.00 N ATOM 1150 NH2 ARG A 79 7.291 5.140 -12.293 1.00 0.00 N ATOM 0 H ARG A 79 0.726 5.411 -12.957 1.00 0.00 H new ATOM 0 HA ARG A 79 -0.075 3.510 -11.151 1.00 0.00 H new ATOM 0 HB2 ARG A 79 2.060 2.995 -9.979 1.00 0.00 H new ATOM 0 HB3 ARG A 79 1.747 2.097 -11.452 1.00 0.00 H new ATOM 0 HG2 ARG A 79 3.758 2.732 -12.249 1.00 0.00 H new ATOM 0 HG3 ARG A 79 3.224 4.402 -12.249 1.00 0.00 H new ATOM 0 HD2 ARG A 79 3.815 4.403 -9.707 1.00 0.00 H new ATOM 0 HD3 ARG A 79 4.664 2.904 -10.026 1.00 0.00 H new ATOM 0 HE ARG A 79 5.681 5.481 -10.470 1.00 0.00 H new ATOM 0 HH11 ARG A 79 5.581 2.389 -12.254 1.00 0.00 H new ATOM 0 HH12 ARG A 79 6.955 2.835 -13.272 1.00 0.00 H new ATOM 0 HH21 ARG A 79 7.344 6.049 -11.833 1.00 0.00 H new ATOM 0 HH22 ARG A 79 7.951 4.904 -13.034 1.00 0.00 H new ATOM 1164 N HIS A 80 0.106 5.465 -9.559 1.00 0.00 N ATOM 1165 CA HIS A 80 0.124 6.585 -8.638 1.00 0.00 C ATOM 1166 C HIS A 80 1.306 6.473 -7.662 1.00 0.00 C ATOM 1167 O HIS A 80 1.998 5.458 -7.629 1.00 0.00 O ATOM 1168 CB HIS A 80 -1.178 6.652 -7.834 1.00 0.00 C ATOM 1169 CG HIS A 80 -2.480 6.500 -8.584 1.00 0.00 C ATOM 1170 ND1 HIS A 80 -3.502 5.586 -8.311 1.00 0.00 N ATOM 1171 CD2 HIS A 80 -2.945 7.303 -9.583 1.00 0.00 C ATOM 1172 CE1 HIS A 80 -4.585 5.964 -9.007 1.00 0.00 C ATOM 1173 NE2 HIS A 80 -4.226 6.919 -9.864 1.00 0.00 N ATOM 0 H HIS A 80 -0.604 4.769 -9.334 1.00 0.00 H new ATOM 0 HA HIS A 80 0.230 7.493 -9.232 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -1.140 5.876 -7.070 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -1.201 7.610 -7.314 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -2.399 8.100 -10.066 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -5.581 5.562 -8.892 1.00 0.00 H new ATOM 0 HE2 HIS A 80 -4.811 7.301 -10.607 1.00 0.00 H new ATOM 1181 N VAL A 81 1.511 7.501 -6.824 1.00 0.00 N ATOM 1182 CA VAL A 81 2.647 7.567 -5.907 1.00 0.00 C ATOM 1183 C VAL A 81 2.677 6.342 -4.991 1.00 0.00 C ATOM 1184 O VAL A 81 3.706 5.694 -4.841 1.00 0.00 O ATOM 1185 CB VAL A 81 2.655 8.913 -5.137 1.00 0.00 C ATOM 1186 CG1 VAL A 81 1.977 8.890 -3.762 1.00 0.00 C ATOM 1187 CG2 VAL A 81 4.088 9.419 -4.939 1.00 0.00 C ATOM 0 H VAL A 81 0.890 8.308 -6.767 1.00 0.00 H new ATOM 0 HA VAL A 81 3.572 7.540 -6.482 1.00 0.00 H new ATOM 0 HB VAL A 81 2.069 9.577 -5.773 1.00 0.00 H new ATOM 0 HG11 VAL A 81 2.038 9.880 -3.309 1.00 0.00 H new ATOM 0 HG12 VAL A 81 0.930 8.608 -3.877 1.00 0.00 H new ATOM 0 HG13 VAL A 81 2.480 8.166 -3.121 1.00 0.00 H new ATOM 0 HG21 VAL A 81 4.068 10.364 -4.397 1.00 0.00 H new ATOM 0 HG22 VAL A 81 4.657 8.685 -4.369 1.00 0.00 H new ATOM 0 HG23 VAL A 81 4.559 9.568 -5.911 1.00 0.00 H new ATOM 1197 N GLY A 82 1.527 6.017 -4.393 1.00 0.00 N ATOM 1198 CA GLY A 82 1.399 4.907 -3.472 1.00 0.00 C ATOM 1199 C GLY A 82 0.874 3.653 -4.146 1.00 0.00 C ATOM 1200 O GLY A 82 0.239 2.847 -3.471 1.00 0.00 O ATOM 0 H GLY A 82 0.657 6.528 -4.542 1.00 0.00 H new ATOM 0 HA2 GLY A 82 2.370 4.696 -3.024 1.00 0.00 H new ATOM 0 HA3 GLY A 82 0.728 5.188 -2.660 1.00 0.00 H new ATOM 1204 N ASP A 83 1.080 3.465 -5.452 1.00 0.00 N ATOM 1205 CA ASP A 83 0.603 2.254 -6.099 1.00 0.00 C ATOM 1206 C ASP A 83 1.594 1.131 -5.886 1.00 0.00 C ATOM 1207 O ASP A 83 2.248 0.653 -6.810 1.00 0.00 O ATOM 1208 CB ASP A 83 0.255 2.532 -7.553 1.00 0.00 C ATOM 1209 CG ASP A 83 -1.084 3.236 -7.632 1.00 0.00 C ATOM 1210 OD1 ASP A 83 -1.682 3.533 -6.576 1.00 0.00 O ATOM 1211 OD2 ASP A 83 -1.544 3.474 -8.763 1.00 0.00 O ATOM 0 H ASP A 83 1.563 4.122 -6.065 1.00 0.00 H new ATOM 0 HA ASP A 83 -0.327 1.917 -5.642 1.00 0.00 H new ATOM 0 HB2 ASP A 83 1.029 3.149 -8.011 1.00 0.00 H new ATOM 0 HB3 ASP A 83 0.219 1.598 -8.113 1.00 0.00 H new ATOM 1216 N LEU A 84 1.613 0.654 -4.646 1.00 0.00 N ATOM 1217 CA LEU A 84 2.452 -0.431 -4.178 1.00 0.00 C ATOM 1218 C LEU A 84 1.742 -1.749 -4.502 1.00 0.00 C ATOM 1219 O LEU A 84 1.648 -2.634 -3.656 1.00 0.00 O ATOM 1220 CB LEU A 84 2.673 -0.231 -2.672 1.00 0.00 C ATOM 1221 CG LEU A 84 3.157 1.189 -2.314 1.00 0.00 C ATOM 1222 CD1 LEU A 84 3.071 1.400 -0.804 1.00 0.00 C ATOM 1223 CD2 LEU A 84 4.570 1.452 -2.837 1.00 0.00 C ATOM 0 H LEU A 84 1.016 1.033 -3.911 1.00 0.00 H new ATOM 0 HA LEU A 84 3.428 -0.451 -4.663 1.00 0.00 H new ATOM 0 HB2 LEU A 84 1.741 -0.435 -2.144 1.00 0.00 H new ATOM 0 HB3 LEU A 84 3.405 -0.957 -2.319 1.00 0.00 H new ATOM 0 HG LEU A 84 2.503 1.910 -2.804 1.00 0.00 H new ATOM 0 HD11 LEU A 84 3.414 2.405 -0.557 1.00 0.00 H new ATOM 0 HD12 LEU A 84 2.038 1.279 -0.478 1.00 0.00 H new ATOM 0 HD13 LEU A 84 3.699 0.667 -0.298 1.00 0.00 H new ATOM 0 HD21 LEU A 84 4.876 2.462 -2.565 1.00 0.00 H new ATOM 0 HD22 LEU A 84 5.261 0.733 -2.397 1.00 0.00 H new ATOM 0 HD23 LEU A 84 4.581 1.349 -3.922 1.00 0.00 H new ATOM 1235 N GLY A 85 1.216 -1.838 -5.732 1.00 0.00 N ATOM 1236 CA GLY A 85 0.261 -2.827 -6.210 1.00 0.00 C ATOM 1237 C GLY A 85 -0.555 -3.497 -5.103 1.00 0.00 C ATOM 1238 O GLY A 85 -1.537 -2.952 -4.588 1.00 0.00 O ATOM 0 H GLY A 85 1.469 -1.172 -6.462 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -0.423 -2.347 -6.910 1.00 0.00 H new ATOM 0 HA3 GLY A 85 0.798 -3.595 -6.766 1.00 0.00 H new ATOM 1242 N ASN A 86 -0.140 -4.717 -4.773 1.00 0.00 N ATOM 1243 CA ASN A 86 -0.813 -5.615 -3.859 1.00 0.00 C ATOM 1244 C ASN A 86 0.241 -6.378 -3.059 1.00 0.00 C ATOM 1245 O ASN A 86 1.408 -6.404 -3.447 1.00 0.00 O ATOM 1246 CB ASN A 86 -1.755 -6.546 -4.644 1.00 0.00 C ATOM 1247 CG ASN A 86 -1.064 -7.264 -5.803 1.00 0.00 C ATOM 1248 OD1 ASN A 86 -0.108 -8.000 -5.593 1.00 0.00 O ATOM 1249 ND2 ASN A 86 -1.530 -7.075 -7.039 1.00 0.00 N ATOM 0 H ASN A 86 0.715 -5.118 -5.157 1.00 0.00 H new ATOM 0 HA ASN A 86 -1.433 -5.062 -3.153 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -2.173 -7.288 -3.963 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -2.590 -5.963 -5.032 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -1.089 -7.547 -7.828 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -2.327 -6.458 -7.195 1.00 0.00 H new ATOM 1256 N VAL A 87 -0.169 -6.955 -1.927 1.00 0.00 N ATOM 1257 CA VAL A 87 0.683 -7.714 -1.021 1.00 0.00 C ATOM 1258 C VAL A 87 0.107 -9.113 -0.905 1.00 0.00 C ATOM 1259 O VAL A 87 -1.062 -9.305 -1.226 1.00 0.00 O ATOM 1260 CB VAL A 87 0.735 -7.063 0.370 1.00 0.00 C ATOM 1261 CG1 VAL A 87 1.223 -5.616 0.276 1.00 0.00 C ATOM 1262 CG2 VAL A 87 -0.622 -7.149 1.079 1.00 0.00 C ATOM 0 H VAL A 87 -1.137 -6.902 -1.609 1.00 0.00 H new ATOM 0 HA VAL A 87 1.699 -7.739 -1.414 1.00 0.00 H new ATOM 0 HB VAL A 87 1.452 -7.620 0.973 1.00 0.00 H new ATOM 0 HG11 VAL A 87 1.251 -5.176 1.273 1.00 0.00 H new ATOM 0 HG12 VAL A 87 2.223 -5.597 -0.158 1.00 0.00 H new ATOM 0 HG13 VAL A 87 0.543 -5.043 -0.354 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -0.550 -6.679 2.060 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -1.376 -6.634 0.484 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -0.905 -8.195 1.197 1.00 0.00 H new ATOM 1272 N THR A 88 0.900 -10.047 -0.391 1.00 0.00 N ATOM 1273 CA THR A 88 0.567 -11.461 -0.269 1.00 0.00 C ATOM 1274 C THR A 88 0.404 -11.795 1.210 1.00 0.00 C ATOM 1275 O THR A 88 1.386 -11.791 1.947 1.00 0.00 O ATOM 1276 CB THR A 88 1.692 -12.286 -0.917 1.00 0.00 C ATOM 1277 OG1 THR A 88 2.063 -11.695 -2.147 1.00 0.00 O ATOM 1278 CG2 THR A 88 1.277 -13.737 -1.177 1.00 0.00 C ATOM 0 H THR A 88 1.830 -9.830 -0.033 1.00 0.00 H new ATOM 0 HA THR A 88 -0.368 -11.696 -0.778 1.00 0.00 H new ATOM 0 HB THR A 88 2.528 -12.294 -0.218 1.00 0.00 H new ATOM 0 HG1 THR A 88 2.781 -12.220 -2.559 1.00 0.00 H new ATOM 0 HG21 THR A 88 2.106 -14.276 -1.635 1.00 0.00 H new ATOM 0 HG22 THR A 88 1.011 -14.214 -0.234 1.00 0.00 H new ATOM 0 HG23 THR A 88 0.418 -13.755 -1.848 1.00 0.00 H new ATOM 1286 N ALA A 89 -0.828 -12.055 1.655 1.00 0.00 N ATOM 1287 CA ALA A 89 -1.069 -12.545 3.002 1.00 0.00 C ATOM 1288 C ALA A 89 -0.775 -14.044 3.085 1.00 0.00 C ATOM 1289 O ALA A 89 -1.008 -14.769 2.121 1.00 0.00 O ATOM 1290 CB ALA A 89 -2.504 -12.226 3.416 1.00 0.00 C ATOM 0 H ALA A 89 -1.672 -11.932 1.096 1.00 0.00 H new ATOM 0 HA ALA A 89 -0.396 -12.043 3.698 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -2.682 -12.595 4.426 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -2.659 -11.147 3.391 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -3.197 -12.708 2.727 1.00 0.00 H new ATOM 1296 N ASP A 90 -0.288 -14.482 4.249 1.00 0.00 N ATOM 1297 CA ASP A 90 -0.141 -15.871 4.654 1.00 0.00 C ATOM 1298 C ASP A 90 -1.506 -16.459 5.016 1.00 0.00 C ATOM 1299 O ASP A 90 -2.489 -15.749 5.210 1.00 0.00 O ATOM 1300 CB ASP A 90 0.810 -15.970 5.872 1.00 0.00 C ATOM 1301 CG ASP A 90 2.208 -16.454 5.519 1.00 0.00 C ATOM 1302 OD1 ASP A 90 2.316 -17.652 5.169 1.00 0.00 O ATOM 1303 OD2 ASP A 90 3.159 -15.670 5.679 1.00 0.00 O ATOM 0 H ASP A 90 0.031 -13.835 4.971 1.00 0.00 H new ATOM 0 HA ASP A 90 0.282 -16.436 3.823 1.00 0.00 H new ATOM 0 HB2 ASP A 90 0.883 -14.991 6.345 1.00 0.00 H new ATOM 0 HB3 ASP A 90 0.375 -16.648 6.607 1.00 0.00 H new ATOM 1308 N LYS A 91 -1.505 -17.775 5.226 1.00 0.00 N ATOM 1309 CA LYS A 91 -2.550 -18.607 5.799 1.00 0.00 C ATOM 1310 C LYS A 91 -3.020 -18.109 7.172 1.00 0.00 C ATOM 1311 O LYS A 91 -4.133 -18.411 7.591 1.00 0.00 O ATOM 1312 CB LYS A 91 -2.040 -20.061 5.826 1.00 0.00 C ATOM 1313 CG LYS A 91 -1.007 -20.415 6.921 1.00 0.00 C ATOM 1314 CD LYS A 91 0.195 -21.212 6.372 1.00 0.00 C ATOM 1315 CE LYS A 91 1.137 -20.300 5.569 1.00 0.00 C ATOM 1316 NZ LYS A 91 2.413 -19.986 6.240 1.00 0.00 N ATOM 0 H LYS A 91 -0.691 -18.335 4.973 1.00 0.00 H new ATOM 0 HA LYS A 91 -3.443 -18.551 5.177 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -2.900 -20.721 5.943 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -1.597 -20.284 4.855 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -0.647 -19.497 7.385 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -1.497 -20.996 7.702 1.00 0.00 H new ATOM 0 HD2 LYS A 91 0.741 -21.669 7.197 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -0.161 -22.023 5.737 1.00 0.00 H new ATOM 0 HE2 LYS A 91 1.353 -20.776 4.612 1.00 0.00 H new ATOM 0 HE3 LYS A 91 0.618 -19.367 5.351 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 2.810 -19.112 5.839 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 2.247 -19.856 7.258 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 3.083 -20.768 6.096 1.00 0.00 H new ATOM 1330 N ASP A 92 -2.170 -17.335 7.856 1.00 0.00 N ATOM 1331 CA ASP A 92 -2.443 -16.729 9.154 1.00 0.00 C ATOM 1332 C ASP A 92 -3.124 -15.368 8.975 1.00 0.00 C ATOM 1333 O ASP A 92 -3.516 -14.721 9.944 1.00 0.00 O ATOM 1334 CB ASP A 92 -1.115 -16.582 9.919 1.00 0.00 C ATOM 1335 CG ASP A 92 -1.086 -17.448 11.169 1.00 0.00 C ATOM 1336 OD1 ASP A 92 -0.852 -18.664 11.000 1.00 0.00 O ATOM 1337 OD2 ASP A 92 -1.290 -16.879 12.263 1.00 0.00 O ATOM 0 H ASP A 92 -1.240 -17.108 7.503 1.00 0.00 H new ATOM 0 HA ASP A 92 -3.120 -17.365 9.725 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -0.287 -16.858 9.266 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -0.969 -15.538 10.196 1.00 0.00 H new ATOM 1342 N GLY A 93 -3.234 -14.903 7.729 1.00 0.00 N ATOM 1343 CA GLY A 93 -3.792 -13.606 7.399 1.00 0.00 C ATOM 1344 C GLY A 93 -2.829 -12.473 7.756 1.00 0.00 C ATOM 1345 O GLY A 93 -3.267 -11.371 8.100 1.00 0.00 O ATOM 0 H GLY A 93 -2.930 -15.433 6.912 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -4.021 -13.568 6.334 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -4.732 -13.467 7.933 1.00 0.00 H new ATOM 1349 N VAL A 94 -1.523 -12.747 7.645 1.00 0.00 N ATOM 1350 CA VAL A 94 -0.433 -11.800 7.845 1.00 0.00 C ATOM 1351 C VAL A 94 0.172 -11.505 6.479 1.00 0.00 C ATOM 1352 O VAL A 94 0.669 -12.424 5.843 1.00 0.00 O ATOM 1353 CB VAL A 94 0.626 -12.399 8.790 1.00 0.00 C ATOM 1354 CG1 VAL A 94 1.918 -11.559 8.856 1.00 0.00 C ATOM 1355 CG2 VAL A 94 0.049 -12.550 10.202 1.00 0.00 C ATOM 0 H VAL A 94 -1.188 -13.679 7.402 1.00 0.00 H new ATOM 0 HA VAL A 94 -0.800 -10.881 8.303 1.00 0.00 H new ATOM 0 HB VAL A 94 0.890 -13.374 8.381 1.00 0.00 H new ATOM 0 HG11 VAL A 94 2.625 -12.032 9.538 1.00 0.00 H new ATOM 0 HG12 VAL A 94 2.361 -11.493 7.862 1.00 0.00 H new ATOM 0 HG13 VAL A 94 1.683 -10.557 9.215 1.00 0.00 H new ATOM 0 HG21 VAL A 94 0.806 -12.974 10.861 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -0.253 -11.573 10.578 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -0.817 -13.211 10.172 1.00 0.00 H new ATOM 1365 N ALA A 95 0.126 -10.254 6.012 1.00 0.00 N ATOM 1366 CA ALA A 95 0.818 -9.846 4.798 1.00 0.00 C ATOM 1367 C ALA A 95 2.043 -9.055 5.213 1.00 0.00 C ATOM 1368 O ALA A 95 1.915 -7.895 5.609 1.00 0.00 O ATOM 1369 CB ALA A 95 -0.085 -9.032 3.866 1.00 0.00 C ATOM 0 H ALA A 95 -0.392 -9.502 6.467 1.00 0.00 H new ATOM 0 HA ALA A 95 1.111 -10.728 4.228 1.00 0.00 H new ATOM 0 HB1 ALA A 95 0.474 -8.749 2.974 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -0.948 -9.633 3.579 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -0.424 -8.133 4.381 1.00 0.00 H new ATOM 1375 N ASP A 96 3.203 -9.709 5.132 1.00 0.00 N ATOM 1376 CA ASP A 96 4.494 -9.087 5.337 1.00 0.00 C ATOM 1377 C ASP A 96 4.917 -8.429 4.026 1.00 0.00 C ATOM 1378 O ASP A 96 5.052 -9.103 3.007 1.00 0.00 O ATOM 1379 CB ASP A 96 5.522 -10.104 5.848 1.00 0.00 C ATOM 1380 CG ASP A 96 5.310 -10.421 7.324 1.00 0.00 C ATOM 1381 OD1 ASP A 96 5.341 -9.458 8.122 1.00 0.00 O ATOM 1382 OD2 ASP A 96 5.120 -11.614 7.634 1.00 0.00 O ATOM 0 H ASP A 96 3.263 -10.704 4.918 1.00 0.00 H new ATOM 0 HA ASP A 96 4.430 -8.321 6.110 1.00 0.00 H new ATOM 0 HB2 ASP A 96 5.449 -11.021 5.264 1.00 0.00 H new ATOM 0 HB3 ASP A 96 6.528 -9.711 5.700 1.00 0.00 H new ATOM 1387 N VAL A 97 5.074 -7.106 4.045 1.00 0.00 N ATOM 1388 CA VAL A 97 5.495 -6.303 2.906 1.00 0.00 C ATOM 1389 C VAL A 97 6.981 -6.005 3.073 1.00 0.00 C ATOM 1390 O VAL A 97 7.458 -5.905 4.202 1.00 0.00 O ATOM 1391 CB VAL A 97 4.684 -4.996 2.819 1.00 0.00 C ATOM 1392 CG1 VAL A 97 4.801 -4.372 1.421 1.00 0.00 C ATOM 1393 CG2 VAL A 97 3.212 -5.220 3.181 1.00 0.00 C ATOM 0 H VAL A 97 4.905 -6.549 4.883 1.00 0.00 H new ATOM 0 HA VAL A 97 5.319 -6.849 1.979 1.00 0.00 H new ATOM 0 HB VAL A 97 5.106 -4.303 3.547 1.00 0.00 H new ATOM 0 HG11 VAL A 97 4.220 -3.450 1.384 1.00 0.00 H new ATOM 0 HG12 VAL A 97 5.847 -4.151 1.208 1.00 0.00 H new ATOM 0 HG13 VAL A 97 4.419 -5.071 0.677 1.00 0.00 H new ATOM 0 HG21 VAL A 97 2.672 -4.276 3.108 1.00 0.00 H new ATOM 0 HG22 VAL A 97 2.774 -5.943 2.493 1.00 0.00 H new ATOM 0 HG23 VAL A 97 3.142 -5.601 4.200 1.00 0.00 H new ATOM 1403 N SER A 98 7.686 -5.846 1.956 1.00 0.00 N ATOM 1404 CA SER A 98 9.129 -5.677 1.883 1.00 0.00 C ATOM 1405 C SER A 98 9.491 -5.292 0.443 1.00 0.00 C ATOM 1406 O SER A 98 9.956 -6.127 -0.329 1.00 0.00 O ATOM 1407 CB SER A 98 9.815 -6.979 2.325 1.00 0.00 C ATOM 1408 OG SER A 98 9.141 -8.113 1.803 1.00 0.00 O ATOM 0 H SER A 98 7.244 -5.831 1.037 1.00 0.00 H new ATOM 0 HA SER A 98 9.473 -4.886 2.550 1.00 0.00 H new ATOM 0 HB2 SER A 98 10.851 -6.981 1.987 1.00 0.00 H new ATOM 0 HB3 SER A 98 9.834 -7.032 3.414 1.00 0.00 H new ATOM 0 HG SER A 98 9.598 -8.929 2.097 1.00 0.00 H new ATOM 1414 N ILE A 99 9.244 -4.035 0.068 1.00 0.00 N ATOM 1415 CA ILE A 99 9.508 -3.514 -1.273 1.00 0.00 C ATOM 1416 C ILE A 99 10.174 -2.144 -1.135 1.00 0.00 C ATOM 1417 O ILE A 99 10.235 -1.621 -0.025 1.00 0.00 O ATOM 1418 CB ILE A 99 8.192 -3.508 -2.082 1.00 0.00 C ATOM 1419 CG1 ILE A 99 8.454 -3.416 -3.595 1.00 0.00 C ATOM 1420 CG2 ILE A 99 7.223 -2.412 -1.621 1.00 0.00 C ATOM 1421 CD1 ILE A 99 7.216 -3.744 -4.437 1.00 0.00 C ATOM 0 H ILE A 99 8.848 -3.339 0.700 1.00 0.00 H new ATOM 0 HA ILE A 99 10.200 -4.144 -1.833 1.00 0.00 H new ATOM 0 HB ILE A 99 7.707 -4.464 -1.884 1.00 0.00 H new ATOM 0 HG12 ILE A 99 8.796 -2.410 -3.839 1.00 0.00 H new ATOM 0 HG13 ILE A 99 9.260 -4.100 -3.861 1.00 0.00 H new ATOM 0 HG21 ILE A 99 6.315 -2.453 -2.223 1.00 0.00 H new ATOM 0 HG22 ILE A 99 6.971 -2.567 -0.572 1.00 0.00 H new ATOM 0 HG23 ILE A 99 7.694 -1.436 -1.740 1.00 0.00 H new ATOM 0 HD11 ILE A 99 7.464 -3.662 -5.495 1.00 0.00 H new ATOM 0 HD12 ILE A 99 6.886 -4.760 -4.219 1.00 0.00 H new ATOM 0 HD13 ILE A 99 6.416 -3.044 -4.196 1.00 0.00 H new ATOM 1433 N GLU A 100 10.689 -1.566 -2.221 1.00 0.00 N ATOM 1434 CA GLU A 100 11.411 -0.304 -2.212 1.00 0.00 C ATOM 1435 C GLU A 100 10.938 0.555 -3.382 1.00 0.00 C ATOM 1436 O GLU A 100 10.722 0.017 -4.468 1.00 0.00 O ATOM 1437 CB GLU A 100 12.914 -0.583 -2.351 1.00 0.00 C ATOM 1438 CG GLU A 100 13.517 -1.209 -1.087 1.00 0.00 C ATOM 1439 CD GLU A 100 14.457 -2.365 -1.402 1.00 0.00 C ATOM 1440 OE1 GLU A 100 13.927 -3.432 -1.775 1.00 0.00 O ATOM 1441 OE2 GLU A 100 15.681 -2.163 -1.249 1.00 0.00 O ATOM 0 H GLU A 100 10.611 -1.977 -3.151 1.00 0.00 H new ATOM 0 HA GLU A 100 11.224 0.224 -1.277 1.00 0.00 H new ATOM 0 HB2 GLU A 100 13.079 -1.250 -3.197 1.00 0.00 H new ATOM 0 HB3 GLU A 100 13.434 0.349 -2.574 1.00 0.00 H new ATOM 0 HG2 GLU A 100 14.059 -0.445 -0.530 1.00 0.00 H new ATOM 0 HG3 GLU A 100 12.713 -1.564 -0.442 1.00 0.00 H new ATOM 1448 N ASP A 101 10.819 1.869 -3.167 1.00 0.00 N ATOM 1449 CA ASP A 101 10.441 2.830 -4.197 1.00 0.00 C ATOM 1450 C ASP A 101 11.379 4.030 -4.165 1.00 0.00 C ATOM 1451 O ASP A 101 11.981 4.331 -3.135 1.00 0.00 O ATOM 1452 CB ASP A 101 9.026 3.342 -3.935 1.00 0.00 C ATOM 1453 CG ASP A 101 7.946 2.391 -4.418 1.00 0.00 C ATOM 1454 OD1 ASP A 101 7.556 1.513 -3.620 1.00 0.00 O ATOM 1455 OD2 ASP A 101 7.520 2.587 -5.577 1.00 0.00 O ATOM 0 H ASP A 101 10.986 2.297 -2.256 1.00 0.00 H new ATOM 0 HA ASP A 101 10.496 2.331 -5.164 1.00 0.00 H new ATOM 0 HB2 ASP A 101 8.900 3.511 -2.866 1.00 0.00 H new ATOM 0 HB3 ASP A 101 8.899 4.306 -4.427 1.00 0.00 H new ATOM 1460 N SER A 102 11.433 4.755 -5.285 1.00 0.00 N ATOM 1461 CA SER A 102 12.147 6.015 -5.425 1.00 0.00 C ATOM 1462 C SER A 102 11.204 7.212 -5.592 1.00 0.00 C ATOM 1463 O SER A 102 11.683 8.341 -5.650 1.00 0.00 O ATOM 1464 CB SER A 102 13.119 5.926 -6.607 1.00 0.00 C ATOM 1465 OG SER A 102 14.070 4.906 -6.369 1.00 0.00 O ATOM 0 H SER A 102 10.964 4.467 -6.144 1.00 0.00 H new ATOM 0 HA SER A 102 12.702 6.184 -4.502 1.00 0.00 H new ATOM 0 HB2 SER A 102 12.571 5.718 -7.526 1.00 0.00 H new ATOM 0 HB3 SER A 102 13.624 6.882 -6.747 1.00 0.00 H new ATOM 0 HG SER A 102 14.688 4.851 -7.128 1.00 0.00 H new ATOM 1471 N VAL A 103 9.890 6.989 -5.724 1.00 0.00 N ATOM 1472 CA VAL A 103 8.939 8.073 -5.965 1.00 0.00 C ATOM 1473 C VAL A 103 8.443 8.671 -4.646 1.00 0.00 C ATOM 1474 O VAL A 103 8.371 9.890 -4.505 1.00 0.00 O ATOM 1475 CB VAL A 103 7.805 7.607 -6.898 1.00 0.00 C ATOM 1476 CG1 VAL A 103 6.795 6.657 -6.240 1.00 0.00 C ATOM 1477 CG2 VAL A 103 7.079 8.824 -7.486 1.00 0.00 C ATOM 0 H VAL A 103 9.464 6.064 -5.667 1.00 0.00 H new ATOM 0 HA VAL A 103 9.447 8.884 -6.487 1.00 0.00 H new ATOM 0 HB VAL A 103 8.284 7.029 -7.688 1.00 0.00 H new ATOM 0 HG11 VAL A 103 6.031 6.378 -6.966 1.00 0.00 H new ATOM 0 HG12 VAL A 103 7.310 5.761 -5.893 1.00 0.00 H new ATOM 0 HG13 VAL A 103 6.325 7.156 -5.392 1.00 0.00 H new ATOM 0 HG21 VAL A 103 6.279 8.487 -8.145 1.00 0.00 H new ATOM 0 HG22 VAL A 103 6.657 9.421 -6.678 1.00 0.00 H new ATOM 0 HG23 VAL A 103 7.785 9.430 -8.054 1.00 0.00 H new ATOM 1487 N ILE A 104 8.084 7.819 -3.683 1.00 0.00 N ATOM 1488 CA ILE A 104 7.694 8.234 -2.350 1.00 0.00 C ATOM 1489 C ILE A 104 8.940 8.632 -1.551 1.00 0.00 C ATOM 1490 O ILE A 104 9.990 8.009 -1.706 1.00 0.00 O ATOM 1491 CB ILE A 104 6.923 7.088 -1.682 1.00 0.00 C ATOM 1492 CG1 ILE A 104 7.492 5.719 -2.085 1.00 0.00 C ATOM 1493 CG2 ILE A 104 5.437 7.163 -2.061 1.00 0.00 C ATOM 1494 CD1 ILE A 104 7.114 4.660 -1.075 1.00 0.00 C ATOM 0 H ILE A 104 8.058 6.808 -3.818 1.00 0.00 H new ATOM 0 HA ILE A 104 7.041 9.106 -2.392 1.00 0.00 H new ATOM 0 HB ILE A 104 7.031 7.197 -0.603 1.00 0.00 H new ATOM 0 HG12 ILE A 104 7.116 5.440 -3.069 1.00 0.00 H new ATOM 0 HG13 ILE A 104 8.577 5.781 -2.164 1.00 0.00 H new ATOM 0 HG21 ILE A 104 4.898 6.346 -1.582 1.00 0.00 H new ATOM 0 HG22 ILE A 104 5.024 8.115 -1.727 1.00 0.00 H new ATOM 0 HG23 ILE A 104 5.333 7.082 -3.143 1.00 0.00 H new ATOM 0 HD11 ILE A 104 7.528 3.700 -1.382 1.00 0.00 H new ATOM 0 HD12 ILE A 104 7.512 4.931 -0.097 1.00 0.00 H new ATOM 0 HD13 ILE A 104 6.028 4.584 -1.016 1.00 0.00 H new ATOM 1506 N SER A 105 8.814 9.648 -0.693 1.00 0.00 N ATOM 1507 CA SER A 105 9.893 10.167 0.134 1.00 0.00 C ATOM 1508 C SER A 105 9.390 10.361 1.563 1.00 0.00 C ATOM 1509 O SER A 105 8.203 10.199 1.845 1.00 0.00 O ATOM 1510 CB SER A 105 10.396 11.481 -0.475 1.00 0.00 C ATOM 1511 OG SER A 105 10.905 11.233 -1.770 1.00 0.00 O ATOM 0 H SER A 105 7.932 10.142 -0.555 1.00 0.00 H new ATOM 0 HA SER A 105 10.725 9.464 0.168 1.00 0.00 H new ATOM 0 HB2 SER A 105 9.584 12.206 -0.524 1.00 0.00 H new ATOM 0 HB3 SER A 105 11.172 11.914 0.156 1.00 0.00 H new ATOM 0 HG SER A 105 11.226 12.072 -2.162 1.00 0.00 H new ATOM 1517 N LEU A 106 10.303 10.728 2.467 1.00 0.00 N ATOM 1518 CA LEU A 106 10.002 11.111 3.845 1.00 0.00 C ATOM 1519 C LEU A 106 10.037 12.642 3.958 1.00 0.00 C ATOM 1520 O LEU A 106 10.194 13.186 5.049 1.00 0.00 O ATOM 1521 CB LEU A 106 11.046 10.469 4.783 1.00 0.00 C ATOM 1522 CG LEU A 106 10.875 8.965 5.068 1.00 0.00 C ATOM 1523 CD1 LEU A 106 9.730 8.710 6.050 1.00 0.00 C ATOM 1524 CD2 LEU A 106 10.674 8.108 3.817 1.00 0.00 C ATOM 0 H LEU A 106 11.299 10.767 2.252 1.00 0.00 H new ATOM 0 HA LEU A 106 9.010 10.761 4.132 1.00 0.00 H new ATOM 0 HB2 LEU A 106 12.035 10.625 4.352 1.00 0.00 H new ATOM 0 HB3 LEU A 106 11.025 11.002 5.734 1.00 0.00 H new ATOM 0 HG LEU A 106 11.822 8.658 5.512 1.00 0.00 H new ATOM 0 HD11 LEU A 106 9.636 7.639 6.229 1.00 0.00 H new ATOM 0 HD12 LEU A 106 9.938 9.219 6.991 1.00 0.00 H new ATOM 0 HD13 LEU A 106 8.799 9.090 5.630 1.00 0.00 H new ATOM 0 HD21 LEU A 106 10.562 7.063 4.106 1.00 0.00 H new ATOM 0 HD22 LEU A 106 9.778 8.437 3.291 1.00 0.00 H new ATOM 0 HD23 LEU A 106 11.539 8.212 3.162 1.00 0.00 H new ATOM 1536 N SER A 107 9.942 13.348 2.828 1.00 0.00 N ATOM 1537 CA SER A 107 10.261 14.763 2.744 1.00 0.00 C ATOM 1538 C SER A 107 9.800 15.295 1.390 1.00 0.00 C ATOM 1539 O SER A 107 9.635 14.510 0.454 1.00 0.00 O ATOM 1540 CB SER A 107 11.776 14.932 2.919 1.00 0.00 C ATOM 1541 OG SER A 107 12.465 13.942 2.173 1.00 0.00 O ATOM 0 H SER A 107 9.638 12.944 1.942 1.00 0.00 H new ATOM 0 HA SER A 107 9.752 15.326 3.526 1.00 0.00 H new ATOM 0 HB2 SER A 107 12.080 15.925 2.588 1.00 0.00 H new ATOM 0 HB3 SER A 107 12.039 14.853 3.974 1.00 0.00 H new ATOM 0 HG SER A 107 13.431 14.058 2.289 1.00 0.00 H new ATOM 1547 N GLY A 108 9.597 16.611 1.293 1.00 0.00 N ATOM 1548 CA GLY A 108 9.046 17.246 0.104 1.00 0.00 C ATOM 1549 C GLY A 108 7.573 16.876 -0.076 1.00 0.00 C ATOM 1550 O GLY A 108 6.981 16.209 0.773 1.00 0.00 O ATOM 0 H GLY A 108 9.813 17.266 2.045 1.00 0.00 H new ATOM 0 HA2 GLY A 108 9.147 18.328 0.185 1.00 0.00 H new ATOM 0 HA3 GLY A 108 9.613 16.938 -0.774 1.00 0.00 H new ATOM 1554 N ASP A 109 6.974 17.292 -1.190 1.00 0.00 N ATOM 1555 CA ASP A 109 5.590 16.999 -1.542 1.00 0.00 C ATOM 1556 C ASP A 109 5.326 15.493 -1.481 1.00 0.00 C ATOM 1557 O ASP A 109 4.287 15.045 -1.004 1.00 0.00 O ATOM 1558 CB ASP A 109 5.306 17.551 -2.946 1.00 0.00 C ATOM 1559 CG ASP A 109 5.702 19.015 -3.070 1.00 0.00 C ATOM 1560 OD1 ASP A 109 6.927 19.260 -2.967 1.00 0.00 O ATOM 1561 OD2 ASP A 109 4.789 19.851 -3.232 1.00 0.00 O ATOM 0 H ASP A 109 7.453 17.858 -1.891 1.00 0.00 H new ATOM 0 HA ASP A 109 4.921 17.478 -0.827 1.00 0.00 H new ATOM 0 HB2 ASP A 109 5.851 16.963 -3.684 1.00 0.00 H new ATOM 0 HB3 ASP A 109 4.245 17.441 -3.172 1.00 0.00 H new ATOM 1566 N HIS A 110 6.309 14.707 -1.931 1.00 0.00 N ATOM 1567 CA HIS A 110 6.268 13.251 -1.915 1.00 0.00 C ATOM 1568 C HIS A 110 6.461 12.653 -0.514 1.00 0.00 C ATOM 1569 O HIS A 110 6.595 11.435 -0.401 1.00 0.00 O ATOM 1570 CB HIS A 110 7.323 12.705 -2.885 1.00 0.00 C ATOM 1571 CG HIS A 110 7.228 13.269 -4.280 1.00 0.00 C ATOM 1572 ND1 HIS A 110 6.070 13.493 -4.991 1.00 0.00 N ATOM 1573 CD2 HIS A 110 8.277 13.687 -5.055 1.00 0.00 C ATOM 1574 CE1 HIS A 110 6.419 14.037 -6.170 1.00 0.00 C ATOM 1575 NE2 HIS A 110 7.751 14.173 -6.256 1.00 0.00 N ATOM 0 H HIS A 110 7.173 15.079 -2.325 1.00 0.00 H new ATOM 0 HA HIS A 110 5.270 12.950 -2.234 1.00 0.00 H new ATOM 0 HB2 HIS A 110 8.314 12.919 -2.485 1.00 0.00 H new ATOM 0 HB3 HIS A 110 7.227 11.620 -2.936 1.00 0.00 H new ATOM 0 HD2 HIS A 110 9.322 13.648 -4.787 1.00 0.00 H new ATOM 0 HE1 HIS A 110 5.722 14.325 -6.943 1.00 0.00 H new ATOM 0 HE2 HIS A 110 8.276 14.555 -7.042 1.00 0.00 H new ATOM 1583 N SER A 111 6.482 13.468 0.549 1.00 0.00 N ATOM 1584 CA SER A 111 6.487 12.967 1.911 1.00 0.00 C ATOM 1585 C SER A 111 5.237 12.122 2.148 1.00 0.00 C ATOM 1586 O SER A 111 4.123 12.646 2.116 1.00 0.00 O ATOM 1587 CB SER A 111 6.558 14.103 2.934 1.00 0.00 C ATOM 1588 OG SER A 111 6.804 13.545 4.211 1.00 0.00 O ATOM 0 H SER A 111 6.496 14.486 0.480 1.00 0.00 H new ATOM 0 HA SER A 111 7.378 12.353 2.043 1.00 0.00 H new ATOM 0 HB2 SER A 111 7.350 14.803 2.668 1.00 0.00 H new ATOM 0 HB3 SER A 111 5.624 14.666 2.940 1.00 0.00 H new ATOM 0 HG SER A 111 6.854 14.262 4.877 1.00 0.00 H new ATOM 1594 N ILE A 112 5.411 10.823 2.406 1.00 0.00 N ATOM 1595 CA ILE A 112 4.283 9.964 2.748 1.00 0.00 C ATOM 1596 C ILE A 112 3.764 10.232 4.165 1.00 0.00 C ATOM 1597 O ILE A 112 2.647 9.843 4.497 1.00 0.00 O ATOM 1598 CB ILE A 112 4.585 8.476 2.507 1.00 0.00 C ATOM 1599 CG1 ILE A 112 5.407 7.774 3.601 1.00 0.00 C ATOM 1600 CG2 ILE A 112 5.170 8.262 1.111 1.00 0.00 C ATOM 1601 CD1 ILE A 112 6.872 8.179 3.716 1.00 0.00 C ATOM 0 H ILE A 112 6.314 10.350 2.384 1.00 0.00 H new ATOM 0 HA ILE A 112 3.475 10.225 2.065 1.00 0.00 H new ATOM 0 HB ILE A 112 3.618 7.977 2.568 1.00 0.00 H new ATOM 0 HG12 ILE A 112 4.925 7.959 4.561 1.00 0.00 H new ATOM 0 HG13 ILE A 112 5.363 6.699 3.424 1.00 0.00 H new ATOM 0 HG21 ILE A 112 5.376 7.202 0.961 1.00 0.00 H new ATOM 0 HG22 ILE A 112 4.456 8.602 0.361 1.00 0.00 H new ATOM 0 HG23 ILE A 112 6.096 8.829 1.014 1.00 0.00 H new ATOM 0 HD11 ILE A 112 7.343 7.616 4.521 1.00 0.00 H new ATOM 0 HD12 ILE A 112 7.383 7.966 2.777 1.00 0.00 H new ATOM 0 HD13 ILE A 112 6.939 9.245 3.932 1.00 0.00 H new ATOM 1613 N ILE A 113 4.561 10.894 5.008 1.00 0.00 N ATOM 1614 CA ILE A 113 4.148 11.313 6.330 1.00 0.00 C ATOM 1615 C ILE A 113 2.936 12.218 6.140 1.00 0.00 C ATOM 1616 O ILE A 113 3.002 13.227 5.436 1.00 0.00 O ATOM 1617 CB ILE A 113 5.317 12.012 7.052 1.00 0.00 C ATOM 1618 CG1 ILE A 113 6.448 11.027 7.400 1.00 0.00 C ATOM 1619 CG2 ILE A 113 4.865 12.774 8.308 1.00 0.00 C ATOM 1620 CD1 ILE A 113 6.005 9.890 8.326 1.00 0.00 C ATOM 0 H ILE A 113 5.521 11.152 4.779 1.00 0.00 H new ATOM 0 HA ILE A 113 3.871 10.470 6.964 1.00 0.00 H new ATOM 0 HB ILE A 113 5.707 12.745 6.346 1.00 0.00 H new ATOM 0 HG12 ILE A 113 6.844 10.601 6.478 1.00 0.00 H new ATOM 0 HG13 ILE A 113 7.263 11.574 7.874 1.00 0.00 H new ATOM 0 HG21 ILE A 113 5.728 13.247 8.777 1.00 0.00 H new ATOM 0 HG22 ILE A 113 4.140 13.538 8.029 1.00 0.00 H new ATOM 0 HG23 ILE A 113 4.406 12.078 9.010 1.00 0.00 H new ATOM 0 HD11 ILE A 113 6.852 9.235 8.529 1.00 0.00 H new ATOM 0 HD12 ILE A 113 5.636 10.307 9.263 1.00 0.00 H new ATOM 0 HD13 ILE A 113 5.211 9.318 7.846 1.00 0.00 H new ATOM 1632 N GLY A 114 1.816 11.817 6.731 1.00 0.00 N ATOM 1633 CA GLY A 114 0.565 12.531 6.632 1.00 0.00 C ATOM 1634 C GLY A 114 -0.295 12.090 5.445 1.00 0.00 C ATOM 1635 O GLY A 114 -1.083 12.890 4.936 1.00 0.00 O ATOM 0 H GLY A 114 1.759 10.972 7.300 1.00 0.00 H new ATOM 0 HA2 GLY A 114 0.000 12.388 7.553 1.00 0.00 H new ATOM 0 HA3 GLY A 114 0.770 13.598 6.546 1.00 0.00 H new ATOM 1639 N ARG A 115 -0.141 10.845 4.980 1.00 0.00 N ATOM 1640 CA ARG A 115 -1.081 10.191 4.070 1.00 0.00 C ATOM 1641 C ARG A 115 -1.906 9.155 4.834 1.00 0.00 C ATOM 1642 O ARG A 115 -1.542 8.756 5.940 1.00 0.00 O ATOM 1643 CB ARG A 115 -0.332 9.479 2.934 1.00 0.00 C ATOM 1644 CG ARG A 115 0.546 10.362 2.039 1.00 0.00 C ATOM 1645 CD ARG A 115 -0.277 11.376 1.240 1.00 0.00 C ATOM 1646 NE ARG A 115 -0.553 12.579 2.040 1.00 0.00 N ATOM 1647 CZ ARG A 115 0.324 13.564 2.291 1.00 0.00 C ATOM 1648 NH1 ARG A 115 1.516 13.582 1.684 1.00 0.00 N ATOM 1649 NH2 ARG A 115 0.007 14.505 3.180 1.00 0.00 N ATOM 0 H ARG A 115 0.653 10.257 5.231 1.00 0.00 H new ATOM 0 HA ARG A 115 -1.733 10.956 3.649 1.00 0.00 H new ATOM 0 HB2 ARG A 115 0.297 8.704 3.372 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -1.065 8.976 2.304 1.00 0.00 H new ATOM 0 HG2 ARG A 115 1.273 10.892 2.655 1.00 0.00 H new ATOM 0 HG3 ARG A 115 1.110 9.732 1.351 1.00 0.00 H new ATOM 0 HD2 ARG A 115 0.262 11.653 0.334 1.00 0.00 H new ATOM 0 HD3 ARG A 115 -1.216 10.921 0.926 1.00 0.00 H new ATOM 0 HE ARG A 115 -1.488 12.673 2.437 1.00 0.00 H new ATOM 0 HH11 ARG A 115 1.764 12.844 1.025 1.00 0.00 H new ATOM 0 HH12 ARG A 115 2.177 14.334 1.880 1.00 0.00 H new ATOM 0 HH21 ARG A 115 -0.892 14.471 3.660 1.00 0.00 H new ATOM 0 HH22 ARG A 115 0.664 15.259 3.380 1.00 0.00 H new ATOM 1663 N THR A 116 -2.980 8.683 4.197 1.00 0.00 N ATOM 1664 CA THR A 116 -3.860 7.637 4.675 1.00 0.00 C ATOM 1665 C THR A 116 -3.522 6.340 3.934 1.00 0.00 C ATOM 1666 O THR A 116 -3.770 6.255 2.736 1.00 0.00 O ATOM 1667 CB THR A 116 -5.304 8.084 4.413 1.00 0.00 C ATOM 1668 OG1 THR A 116 -5.504 9.341 5.013 1.00 0.00 O ATOM 1669 CG2 THR A 116 -6.334 7.111 4.985 1.00 0.00 C ATOM 0 H THR A 116 -3.266 9.045 3.287 1.00 0.00 H new ATOM 0 HA THR A 116 -3.738 7.456 5.743 1.00 0.00 H new ATOM 0 HB THR A 116 -5.443 8.123 3.333 1.00 0.00 H new ATOM 0 HG1 THR A 116 -5.926 9.222 5.889 1.00 0.00 H new ATOM 0 HG21 THR A 116 -7.338 7.477 4.771 1.00 0.00 H new ATOM 0 HG22 THR A 116 -6.200 6.130 4.529 1.00 0.00 H new ATOM 0 HG23 THR A 116 -6.199 7.031 6.064 1.00 0.00 H new ATOM 1677 N LEU A 117 -2.944 5.332 4.593 1.00 0.00 N ATOM 1678 CA LEU A 117 -2.537 4.082 3.953 1.00 0.00 C ATOM 1679 C LEU A 117 -3.632 3.038 4.173 1.00 0.00 C ATOM 1680 O LEU A 117 -4.118 2.893 5.294 1.00 0.00 O ATOM 1681 CB LEU A 117 -1.177 3.648 4.512 1.00 0.00 C ATOM 1682 CG LEU A 117 -0.304 2.889 3.497 1.00 0.00 C ATOM 1683 CD1 LEU A 117 1.122 2.801 4.044 1.00 0.00 C ATOM 1684 CD2 LEU A 117 -0.802 1.479 3.185 1.00 0.00 C ATOM 0 H LEU A 117 -2.745 5.362 5.593 1.00 0.00 H new ATOM 0 HA LEU A 117 -2.415 4.208 2.877 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -0.637 4.531 4.854 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -1.338 3.015 5.384 1.00 0.00 H new ATOM 0 HG LEU A 117 -0.349 3.449 2.563 1.00 0.00 H new ATOM 0 HD11 LEU A 117 1.752 2.265 3.334 1.00 0.00 H new ATOM 0 HD12 LEU A 117 1.517 3.806 4.193 1.00 0.00 H new ATOM 0 HD13 LEU A 117 1.115 2.269 4.996 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -0.135 1.009 2.462 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -0.819 0.888 4.101 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -1.808 1.532 2.769 1.00 0.00 H new ATOM 1696 N VAL A 118 -4.076 2.361 3.109 1.00 0.00 N ATOM 1697 CA VAL A 118 -5.289 1.553 3.126 1.00 0.00 C ATOM 1698 C VAL A 118 -5.072 0.256 2.328 1.00 0.00 C ATOM 1699 O VAL A 118 -4.346 0.264 1.329 1.00 0.00 O ATOM 1700 CB VAL A 118 -6.443 2.409 2.563 1.00 0.00 C ATOM 1701 CG1 VAL A 118 -7.810 1.782 2.814 1.00 0.00 C ATOM 1702 CG2 VAL A 118 -6.491 3.824 3.160 1.00 0.00 C ATOM 0 H VAL A 118 -3.597 2.362 2.208 1.00 0.00 H new ATOM 0 HA VAL A 118 -5.545 1.251 4.142 1.00 0.00 H new ATOM 0 HB VAL A 118 -6.234 2.461 1.495 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -8.587 2.424 2.398 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -7.854 0.803 2.337 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -7.968 1.670 3.887 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -7.324 4.375 2.723 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -6.625 3.759 4.240 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -5.558 4.343 2.941 1.00 0.00 H new ATOM 1712 N VAL A 119 -5.694 -0.848 2.776 1.00 0.00 N ATOM 1713 CA VAL A 119 -5.652 -2.166 2.141 1.00 0.00 C ATOM 1714 C VAL A 119 -7.040 -2.518 1.593 1.00 0.00 C ATOM 1715 O VAL A 119 -8.045 -2.043 2.122 1.00 0.00 O ATOM 1716 CB VAL A 119 -5.158 -3.221 3.149 1.00 0.00 C ATOM 1717 CG1 VAL A 119 -6.121 -3.390 4.323 1.00 0.00 C ATOM 1718 CG2 VAL A 119 -4.995 -4.600 2.507 1.00 0.00 C ATOM 0 H VAL A 119 -6.261 -0.841 3.624 1.00 0.00 H new ATOM 0 HA VAL A 119 -4.951 -2.150 1.306 1.00 0.00 H new ATOM 0 HB VAL A 119 -4.195 -2.848 3.497 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -5.732 -4.144 5.007 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -6.224 -2.441 4.849 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -7.096 -3.706 3.951 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -4.645 -5.311 3.256 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -5.955 -4.933 2.111 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -4.269 -4.540 1.696 1.00 0.00 H new ATOM 1728 N HIS A 120 -7.104 -3.365 0.559 1.00 0.00 N ATOM 1729 CA HIS A 120 -8.323 -3.718 -0.165 1.00 0.00 C ATOM 1730 C HIS A 120 -8.689 -5.178 0.015 1.00 0.00 C ATOM 1731 O HIS A 120 -7.841 -6.005 0.348 1.00 0.00 O ATOM 1732 CB HIS A 120 -8.183 -3.396 -1.655 1.00 0.00 C ATOM 1733 CG HIS A 120 -8.139 -1.921 -1.859 1.00 0.00 C ATOM 1734 ND1 HIS A 120 -9.203 -1.092 -2.069 1.00 0.00 N ATOM 1735 CD2 HIS A 120 -7.008 -1.200 -1.679 1.00 0.00 C ATOM 1736 CE1 HIS A 120 -8.735 0.160 -2.093 1.00 0.00 C ATOM 1737 NE2 HIS A 120 -7.408 0.122 -1.835 1.00 0.00 N ATOM 0 H HIS A 120 -6.278 -3.838 0.193 1.00 0.00 H new ATOM 0 HA HIS A 120 -9.128 -3.117 0.257 1.00 0.00 H new ATOM 0 HB2 HIS A 120 -7.275 -3.853 -2.050 1.00 0.00 H new ATOM 0 HB3 HIS A 120 -9.020 -3.822 -2.207 1.00 0.00 H new ATOM 0 HD1 HIS A 120 -10.176 -1.376 -2.186 1.00 0.00 H new ATOM 0 HD2 HIS A 120 -6.016 -1.569 -1.463 1.00 0.00 H new ATOM 0 HE1 HIS A 120 -9.317 1.049 -2.285 1.00 0.00 H new ATOM 1745 N GLU A 121 -9.963 -5.489 -0.222 1.00 0.00 N ATOM 1746 CA GLU A 121 -10.454 -6.849 -0.193 1.00 0.00 C ATOM 1747 C GLU A 121 -9.736 -7.677 -1.250 1.00 0.00 C ATOM 1748 O GLU A 121 -9.115 -8.682 -0.920 1.00 0.00 O ATOM 1749 CB GLU A 121 -11.973 -6.872 -0.429 1.00 0.00 C ATOM 1750 CG GLU A 121 -12.542 -8.299 -0.351 1.00 0.00 C ATOM 1751 CD GLU A 121 -13.995 -8.326 -0.803 1.00 0.00 C ATOM 1752 OE1 GLU A 121 -14.832 -7.818 -0.029 1.00 0.00 O ATOM 1753 OE2 GLU A 121 -14.228 -8.827 -1.926 1.00 0.00 O ATOM 0 H GLU A 121 -10.679 -4.796 -0.439 1.00 0.00 H new ATOM 0 HA GLU A 121 -10.254 -7.280 0.788 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -12.466 -6.243 0.313 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -12.195 -6.445 -1.407 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -11.949 -8.967 -0.976 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -12.467 -8.670 0.671 1.00 0.00 H new ATOM 1760 N LYS A 122 -9.843 -7.278 -2.515 1.00 0.00 N ATOM 1761 CA LYS A 122 -9.339 -8.082 -3.611 1.00 0.00 C ATOM 1762 C LYS A 122 -7.941 -7.606 -4.006 1.00 0.00 C ATOM 1763 O LYS A 122 -7.391 -6.656 -3.436 1.00 0.00 O ATOM 1764 CB LYS A 122 -10.353 -8.063 -4.771 1.00 0.00 C ATOM 1765 CG LYS A 122 -11.784 -8.437 -4.333 1.00 0.00 C ATOM 1766 CD LYS A 122 -11.929 -9.940 -4.039 1.00 0.00 C ATOM 1767 CE LYS A 122 -12.386 -10.718 -5.279 1.00 0.00 C ATOM 1768 NZ LYS A 122 -13.860 -10.716 -5.395 1.00 0.00 N ATOM 0 H LYS A 122 -10.276 -6.400 -2.801 1.00 0.00 H new ATOM 0 HA LYS A 122 -9.231 -9.124 -3.308 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -10.365 -7.069 -5.218 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -10.024 -8.757 -5.544 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -12.050 -7.867 -3.443 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -12.487 -8.152 -5.115 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -10.975 -10.337 -3.691 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -12.648 -10.086 -3.233 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -11.947 -10.274 -6.173 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -12.024 -11.745 -5.222 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -14.142 -11.249 -6.242 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -14.275 -11.161 -4.552 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -14.201 -9.737 -5.473 1.00 0.00 H new ATOM 1782 N ALA A 123 -7.357 -8.302 -4.981 1.00 0.00 N ATOM 1783 CA ALA A 123 -6.097 -7.919 -5.578 1.00 0.00 C ATOM 1784 C ALA A 123 -6.270 -6.611 -6.343 1.00 0.00 C ATOM 1785 O ALA A 123 -7.363 -6.288 -6.801 1.00 0.00 O ATOM 1786 CB ALA A 123 -5.636 -9.021 -6.532 1.00 0.00 C ATOM 0 H ALA A 123 -7.756 -9.154 -5.376 1.00 0.00 H new ATOM 0 HA ALA A 123 -5.349 -7.779 -4.798 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -4.686 -8.737 -6.985 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -5.510 -9.952 -5.979 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -6.383 -9.161 -7.314 1.00 0.00 H new ATOM 1792 N ASP A 124 -5.168 -5.886 -6.502 1.00 0.00 N ATOM 1793 CA ASP A 124 -5.059 -4.759 -7.399 1.00 0.00 C ATOM 1794 C ASP A 124 -4.763 -5.311 -8.797 1.00 0.00 C ATOM 1795 O ASP A 124 -3.730 -5.959 -8.973 1.00 0.00 O ATOM 1796 CB ASP A 124 -3.904 -3.914 -6.863 1.00 0.00 C ATOM 1797 CG ASP A 124 -3.758 -2.626 -7.624 1.00 0.00 C ATOM 1798 OD1 ASP A 124 -4.055 -2.602 -8.835 1.00 0.00 O ATOM 1799 OD2 ASP A 124 -3.401 -1.627 -6.974 1.00 0.00 O ATOM 0 H ASP A 124 -4.306 -6.078 -5.992 1.00 0.00 H new ATOM 0 HA ASP A 124 -5.962 -4.152 -7.460 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -4.071 -3.697 -5.808 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -2.976 -4.482 -6.928 1.00 0.00 H new ATOM 1804 N ASP A 125 -5.655 -5.071 -9.766 1.00 0.00 N ATOM 1805 CA ASP A 125 -5.517 -5.479 -11.164 1.00 0.00 C ATOM 1806 C ASP A 125 -4.555 -4.580 -11.951 1.00 0.00 C ATOM 1807 O ASP A 125 -4.513 -4.646 -13.182 1.00 0.00 O ATOM 1808 CB ASP A 125 -6.902 -5.518 -11.845 1.00 0.00 C ATOM 1809 CG ASP A 125 -7.414 -4.159 -12.335 1.00 0.00 C ATOM 1810 OD1 ASP A 125 -6.905 -3.121 -11.867 1.00 0.00 O ATOM 1811 OD2 ASP A 125 -8.318 -4.150 -13.195 1.00 0.00 O ATOM 0 H ASP A 125 -6.524 -4.568 -9.588 1.00 0.00 H new ATOM 0 HA ASP A 125 -5.083 -6.479 -11.166 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -6.855 -6.201 -12.693 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -7.626 -5.932 -11.143 1.00 0.00 H new ATOM 1816 N LEU A 126 -3.807 -3.710 -11.267 1.00 0.00 N ATOM 1817 CA LEU A 126 -2.963 -2.689 -11.838 1.00 0.00 C ATOM 1818 C LEU A 126 -3.664 -1.926 -12.963 1.00 0.00 C ATOM 1819 O LEU A 126 -3.068 -1.618 -13.992 1.00 0.00 O ATOM 1820 CB LEU A 126 -1.629 -3.307 -12.240 1.00 0.00 C ATOM 1821 CG LEU A 126 -1.089 -4.280 -11.181 1.00 0.00 C ATOM 1822 CD1 LEU A 126 0.244 -4.815 -11.669 1.00 0.00 C ATOM 1823 CD2 LEU A 126 -0.976 -3.701 -9.763 1.00 0.00 C ATOM 0 H LEU A 126 -3.781 -3.710 -10.247 1.00 0.00 H new ATOM 0 HA LEU A 126 -2.754 -1.926 -11.088 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -1.747 -3.834 -13.187 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -0.900 -2.514 -12.406 1.00 0.00 H new ATOM 0 HG LEU A 126 -1.821 -5.081 -11.074 1.00 0.00 H new ATOM 0 HD11 LEU A 126 0.649 -5.510 -10.933 1.00 0.00 H new ATOM 0 HD12 LEU A 126 0.103 -5.333 -12.618 1.00 0.00 H new ATOM 0 HD13 LEU A 126 0.940 -3.987 -11.808 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -0.586 -4.463 -9.089 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -0.301 -2.845 -9.772 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -1.961 -3.383 -9.420 1.00 0.00 H new ATOM 1835 N GLY A 127 -4.937 -1.594 -12.748 1.00 0.00 N ATOM 1836 CA GLY A 127 -5.714 -0.726 -13.608 1.00 0.00 C ATOM 1837 C GLY A 127 -6.321 -1.448 -14.806 1.00 0.00 C ATOM 1838 O GLY A 127 -7.160 -0.861 -15.497 1.00 0.00 O ATOM 0 H GLY A 127 -5.464 -1.936 -11.945 1.00 0.00 H new ATOM 0 HA2 GLY A 127 -6.514 -0.270 -13.025 1.00 0.00 H new ATOM 0 HA3 GLY A 127 -5.078 0.084 -13.965 1.00 0.00 H new ATOM 1842 N LYS A 128 -5.907 -2.690 -15.072 1.00 0.00 N ATOM 1843 CA LYS A 128 -6.047 -3.278 -16.394 1.00 0.00 C ATOM 1844 C LYS A 128 -7.495 -3.627 -16.770 1.00 0.00 C ATOM 1845 O LYS A 128 -7.757 -3.843 -17.950 1.00 0.00 O ATOM 1846 CB LYS A 128 -5.074 -4.456 -16.558 1.00 0.00 C ATOM 1847 CG LYS A 128 -3.606 -4.038 -16.323 1.00 0.00 C ATOM 1848 CD LYS A 128 -2.639 -5.149 -16.769 1.00 0.00 C ATOM 1849 CE LYS A 128 -1.509 -5.439 -15.763 1.00 0.00 C ATOM 1850 NZ LYS A 128 -0.453 -4.398 -15.711 1.00 0.00 N ATOM 0 H LYS A 128 -5.472 -3.304 -14.383 1.00 0.00 H new ATOM 0 HA LYS A 128 -5.770 -2.512 -17.119 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -5.342 -5.246 -15.857 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -5.175 -4.872 -17.560 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -3.392 -3.122 -16.874 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -3.451 -3.818 -15.267 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -3.206 -6.065 -16.936 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -2.197 -4.869 -17.725 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -1.943 -5.549 -14.769 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -1.049 -6.394 -16.017 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 0.471 -4.848 -15.553 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -0.435 -3.877 -16.611 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -0.654 -3.738 -14.933 1.00 0.00 H new ATOM 1864 N GLY A 129 -8.437 -3.650 -15.818 1.00 0.00 N ATOM 1865 CA GLY A 129 -9.861 -3.812 -16.089 1.00 0.00 C ATOM 1866 C GLY A 129 -10.340 -2.881 -17.208 1.00 0.00 C ATOM 1867 O GLY A 129 -11.072 -3.303 -18.100 1.00 0.00 O ATOM 0 H GLY A 129 -8.222 -3.555 -14.825 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -10.062 -4.847 -16.367 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -10.429 -3.610 -15.181 1.00 0.00 H new ATOM 1871 N GLY A 130 -9.898 -1.620 -17.170 1.00 0.00 N ATOM 1872 CA GLY A 130 -10.044 -0.686 -18.278 1.00 0.00 C ATOM 1873 C GLY A 130 -11.239 0.238 -18.085 1.00 0.00 C ATOM 1874 O GLY A 130 -12.077 0.384 -18.972 1.00 0.00 O ATOM 0 H GLY A 130 -9.425 -1.221 -16.359 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -9.136 -0.091 -18.374 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -10.161 -1.241 -19.209 1.00 0.00 H new ATOM 1878 N ASN A 131 -11.307 0.889 -16.922 1.00 0.00 N ATOM 1879 CA ASN A 131 -12.362 1.838 -16.571 1.00 0.00 C ATOM 1880 C ASN A 131 -11.865 2.728 -15.450 1.00 0.00 C ATOM 1881 O ASN A 131 -10.957 2.300 -14.745 1.00 0.00 O ATOM 1882 CB ASN A 131 -13.657 1.106 -16.165 1.00 0.00 C ATOM 1883 CG ASN A 131 -13.358 -0.108 -15.295 1.00 0.00 C ATOM 1884 OD1 ASN A 131 -13.858 -1.200 -15.535 1.00 0.00 O ATOM 1885 ND2 ASN A 131 -12.450 0.049 -14.341 1.00 0.00 N ATOM 0 H ASN A 131 -10.615 0.768 -16.183 1.00 0.00 H new ATOM 0 HA ASN A 131 -12.601 2.450 -17.441 1.00 0.00 H new ATOM 0 HB2 ASN A 131 -14.310 1.791 -15.625 1.00 0.00 H new ATOM 0 HB3 ASN A 131 -14.195 0.791 -17.059 1.00 0.00 H new ATOM 0 HD21 ASN A 131 -12.151 -0.752 -13.785 1.00 0.00 H new ATOM 0 HD22 ASN A 131 -12.051 0.971 -14.164 1.00 0.00 H new ATOM 1892 N GLU A 132 -12.493 3.878 -15.205 1.00 0.00 N ATOM 1893 CA GLU A 132 -12.147 4.745 -14.092 1.00 0.00 C ATOM 1894 C GLU A 132 -11.933 3.957 -12.805 1.00 0.00 C ATOM 1895 O GLU A 132 -10.985 4.239 -12.090 1.00 0.00 O ATOM 1896 CB GLU A 132 -13.190 5.852 -13.875 1.00 0.00 C ATOM 1897 CG GLU A 132 -13.330 6.791 -15.083 1.00 0.00 C ATOM 1898 CD GLU A 132 -14.393 6.311 -16.058 1.00 0.00 C ATOM 1899 OE1 GLU A 132 -14.101 5.319 -16.765 1.00 0.00 O ATOM 1900 OE2 GLU A 132 -15.480 6.910 -16.047 1.00 0.00 O ATOM 0 H GLU A 132 -13.259 4.231 -15.779 1.00 0.00 H new ATOM 0 HA GLU A 132 -11.204 5.223 -14.358 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -14.157 5.396 -13.663 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -12.914 6.437 -12.998 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -13.583 7.793 -14.736 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -12.372 6.864 -15.598 1.00 0.00 H new ATOM 1907 N GLN A 133 -12.783 2.969 -12.516 1.00 0.00 N ATOM 1908 CA GLN A 133 -12.698 2.169 -11.311 1.00 0.00 C ATOM 1909 C GLN A 133 -11.299 1.551 -11.154 1.00 0.00 C ATOM 1910 O GLN A 133 -10.508 2.026 -10.351 1.00 0.00 O ATOM 1911 CB GLN A 133 -13.855 1.153 -11.295 1.00 0.00 C ATOM 1912 CG GLN A 133 -14.532 1.151 -9.925 1.00 0.00 C ATOM 1913 CD GLN A 133 -13.552 0.873 -8.815 1.00 0.00 C ATOM 1914 OE1 GLN A 133 -13.329 1.703 -7.936 1.00 0.00 O ATOM 1915 NE2 GLN A 133 -12.926 -0.284 -8.894 1.00 0.00 N ATOM 0 H GLN A 133 -13.557 2.706 -13.126 1.00 0.00 H new ATOM 0 HA GLN A 133 -12.821 2.795 -10.427 1.00 0.00 H new ATOM 0 HB2 GLN A 133 -14.581 1.405 -12.068 1.00 0.00 H new ATOM 0 HB3 GLN A 133 -13.478 0.156 -11.524 1.00 0.00 H new ATOM 0 HG2 GLN A 133 -15.010 2.116 -9.755 1.00 0.00 H new ATOM 0 HG3 GLN A 133 -15.320 0.398 -9.911 1.00 0.00 H new ATOM 0 HE21 GLN A 133 -13.151 -0.936 -9.646 1.00 0.00 H new ATOM 0 HE22 GLN A 133 -12.216 -0.528 -8.203 1.00 0.00 H new ATOM 1924 N SER A 134 -10.966 0.521 -11.926 1.00 0.00 N ATOM 1925 CA SER A 134 -9.629 -0.028 -12.086 1.00 0.00 C ATOM 1926 C SER A 134 -8.579 1.076 -12.190 1.00 0.00 C ATOM 1927 O SER A 134 -7.674 1.115 -11.361 1.00 0.00 O ATOM 1928 CB SER A 134 -9.563 -1.065 -13.221 1.00 0.00 C ATOM 1929 OG SER A 134 -9.709 -0.488 -14.507 1.00 0.00 O ATOM 0 H SER A 134 -11.659 0.023 -12.484 1.00 0.00 H new ATOM 0 HA SER A 134 -9.383 -0.583 -11.181 1.00 0.00 H new ATOM 0 HB2 SER A 134 -8.609 -1.590 -13.171 1.00 0.00 H new ATOM 0 HB3 SER A 134 -10.345 -1.809 -13.072 1.00 0.00 H new ATOM 0 HG SER A 134 -8.830 -0.417 -14.935 1.00 0.00 H new ATOM 1935 N THR A 135 -8.713 2.009 -13.135 1.00 0.00 N ATOM 1936 CA THR A 135 -7.687 3.011 -13.393 1.00 0.00 C ATOM 1937 C THR A 135 -7.614 4.062 -12.273 1.00 0.00 C ATOM 1938 O THR A 135 -6.795 4.976 -12.352 1.00 0.00 O ATOM 1939 CB THR A 135 -7.831 3.636 -14.792 1.00 0.00 C ATOM 1940 OG1 THR A 135 -9.012 4.393 -14.910 1.00 0.00 O ATOM 1941 CG2 THR A 135 -7.811 2.585 -15.909 1.00 0.00 C ATOM 0 H THR A 135 -9.532 2.088 -13.738 1.00 0.00 H new ATOM 0 HA THR A 135 -6.726 2.496 -13.388 1.00 0.00 H new ATOM 0 HB THR A 135 -6.966 4.290 -14.906 1.00 0.00 H new ATOM 0 HG1 THR A 135 -9.789 3.811 -14.776 1.00 0.00 H new ATOM 0 HG21 THR A 135 -7.916 3.079 -16.875 1.00 0.00 H new ATOM 0 HG22 THR A 135 -6.867 2.041 -15.880 1.00 0.00 H new ATOM 0 HG23 THR A 135 -8.636 1.887 -15.767 1.00 0.00 H new ATOM 1949 N LYS A 136 -8.428 3.921 -11.222 1.00 0.00 N ATOM 1950 CA LYS A 136 -8.368 4.663 -9.982 1.00 0.00 C ATOM 1951 C LYS A 136 -7.951 3.733 -8.840 1.00 0.00 C ATOM 1952 O LYS A 136 -7.289 4.230 -7.931 1.00 0.00 O ATOM 1953 CB LYS A 136 -9.762 5.235 -9.701 1.00 0.00 C ATOM 1954 CG LYS A 136 -9.945 5.931 -8.349 1.00 0.00 C ATOM 1955 CD LYS A 136 -11.408 6.364 -8.159 1.00 0.00 C ATOM 1956 CE LYS A 136 -12.398 5.185 -8.270 1.00 0.00 C ATOM 1957 NZ LYS A 136 -13.757 5.548 -7.819 1.00 0.00 N ATOM 0 H LYS A 136 -9.189 3.242 -11.226 1.00 0.00 H new ATOM 0 HA LYS A 136 -7.637 5.468 -10.060 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -10.006 5.947 -10.489 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -10.486 4.423 -9.770 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -9.652 5.257 -7.544 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -9.292 6.801 -8.290 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -11.519 6.835 -7.183 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -11.660 7.116 -8.907 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -12.440 4.845 -9.305 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -12.032 4.349 -7.675 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -14.385 4.725 -7.912 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -13.724 5.847 -6.824 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -14.120 6.328 -8.403 1.00 0.00 H new ATOM 1971 N THR A 137 -8.365 2.449 -8.816 1.00 0.00 N ATOM 1972 CA THR A 137 -8.168 1.651 -7.587 1.00 0.00 C ATOM 1973 C THR A 137 -7.529 0.282 -7.766 1.00 0.00 C ATOM 1974 O THR A 137 -6.987 -0.274 -6.810 1.00 0.00 O ATOM 1975 CB THR A 137 -9.428 1.573 -6.709 1.00 0.00 C ATOM 1976 OG1 THR A 137 -9.095 1.384 -5.346 1.00 0.00 O ATOM 1977 CG2 THR A 137 -10.388 0.480 -7.155 1.00 0.00 C ATOM 0 H THR A 137 -8.815 1.961 -9.590 1.00 0.00 H new ATOM 0 HA THR A 137 -7.416 2.231 -7.053 1.00 0.00 H new ATOM 0 HB THR A 137 -9.935 2.531 -6.827 1.00 0.00 H new ATOM 0 HG1 THR A 137 -8.309 1.925 -5.123 1.00 0.00 H new ATOM 0 HG21 THR A 137 -11.259 0.471 -6.500 1.00 0.00 H new ATOM 0 HG22 THR A 137 -10.707 0.672 -8.180 1.00 0.00 H new ATOM 0 HG23 THR A 137 -9.887 -0.487 -7.106 1.00 0.00 H new ATOM 1985 N GLY A 138 -7.637 -0.283 -8.960 1.00 0.00 N ATOM 1986 CA GLY A 138 -7.171 -1.616 -9.256 1.00 0.00 C ATOM 1987 C GLY A 138 -8.328 -2.607 -9.241 1.00 0.00 C ATOM 1988 O GLY A 138 -8.102 -3.808 -9.131 1.00 0.00 O ATOM 0 H GLY A 138 -8.060 0.187 -9.760 1.00 0.00 H new ATOM 0 HA2 GLY A 138 -6.687 -1.629 -10.233 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -6.420 -1.915 -8.525 1.00 0.00 H new ATOM 1992 N ASN A 139 -9.582 -2.122 -9.259 1.00 0.00 N ATOM 1993 CA ASN A 139 -10.750 -2.975 -9.171 1.00 0.00 C ATOM 1994 C ASN A 139 -10.740 -3.854 -7.919 1.00 0.00 C ATOM 1995 O ASN A 139 -11.380 -4.901 -7.871 1.00 0.00 O ATOM 1996 CB ASN A 139 -10.977 -3.736 -10.488 1.00 0.00 C ATOM 1997 CG ASN A 139 -12.408 -3.563 -10.992 1.00 0.00 C ATOM 1998 OD1 ASN A 139 -12.983 -2.477 -10.886 1.00 0.00 O ATOM 1999 ND2 ASN A 139 -12.990 -4.616 -11.558 1.00 0.00 N ATOM 0 H ASN A 139 -9.800 -1.128 -9.335 1.00 0.00 H new ATOM 0 HA ASN A 139 -11.627 -2.341 -9.041 1.00 0.00 H new ATOM 0 HB2 ASN A 139 -10.278 -3.376 -11.243 1.00 0.00 H new ATOM 0 HB3 ASN A 139 -10.768 -4.795 -10.339 1.00 0.00 H new ATOM 0 HD21 ASN A 139 -13.940 -4.540 -11.921 1.00 0.00 H new ATOM 0 HD22 ASN A 139 -12.486 -5.500 -11.630 1.00 0.00 H new ATOM 2006 N ALA A 140 -10.035 -3.381 -6.884 1.00 0.00 N ATOM 2007 CA ALA A 140 -9.741 -4.152 -5.689 1.00 0.00 C ATOM 2008 C ALA A 140 -10.901 -4.116 -4.691 1.00 0.00 C ATOM 2009 O ALA A 140 -10.963 -4.937 -3.775 1.00 0.00 O ATOM 2010 CB ALA A 140 -8.446 -3.622 -5.076 1.00 0.00 C ATOM 0 H ALA A 140 -9.651 -2.436 -6.862 1.00 0.00 H new ATOM 0 HA ALA A 140 -9.610 -5.200 -5.957 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -8.210 -4.190 -4.176 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -7.634 -3.727 -5.795 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -8.569 -2.570 -4.819 1.00 0.00 H new ATOM 2016 N GLY A 141 -11.817 -3.158 -4.865 1.00 0.00 N ATOM 2017 CA GLY A 141 -13.059 -3.112 -4.116 1.00 0.00 C ATOM 2018 C GLY A 141 -12.846 -2.523 -2.727 1.00 0.00 C ATOM 2019 O GLY A 141 -11.886 -1.785 -2.488 1.00 0.00 O ATOM 0 H GLY A 141 -11.710 -2.395 -5.533 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -13.791 -2.514 -4.658 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -13.471 -4.117 -4.028 1.00 0.00 H new ATOM 2023 N SER A 142 -13.781 -2.823 -1.825 1.00 0.00 N ATOM 2024 CA SER A 142 -13.845 -2.269 -0.488 1.00 0.00 C ATOM 2025 C SER A 142 -12.551 -2.455 0.301 1.00 0.00 C ATOM 2026 O SER A 142 -11.773 -3.382 0.074 1.00 0.00 O ATOM 2027 CB SER A 142 -15.046 -2.885 0.233 1.00 0.00 C ATOM 2028 OG SER A 142 -16.182 -2.747 -0.601 1.00 0.00 O ATOM 0 H SER A 142 -14.536 -3.481 -2.019 1.00 0.00 H new ATOM 0 HA SER A 142 -13.972 -1.189 -0.565 1.00 0.00 H new ATOM 0 HB2 SER A 142 -14.860 -3.937 0.451 1.00 0.00 H new ATOM 0 HB3 SER A 142 -15.213 -2.386 1.188 1.00 0.00 H new ATOM 0 HG SER A 142 -16.963 -3.138 -0.157 1.00 0.00 H new ATOM 2034 N ARG A 143 -12.325 -1.515 1.217 1.00 0.00 N ATOM 2035 CA ARG A 143 -11.128 -1.418 2.023 1.00 0.00 C ATOM 2036 C ARG A 143 -11.300 -2.270 3.281 1.00 0.00 C ATOM 2037 O ARG A 143 -12.162 -1.964 4.100 1.00 0.00 O ATOM 2038 CB ARG A 143 -10.898 0.050 2.395 1.00 0.00 C ATOM 2039 CG ARG A 143 -10.873 1.001 1.181 1.00 0.00 C ATOM 2040 CD ARG A 143 -11.815 2.176 1.474 1.00 0.00 C ATOM 2041 NE ARG A 143 -11.694 3.271 0.497 1.00 0.00 N ATOM 2042 CZ ARG A 143 -12.586 4.269 0.375 1.00 0.00 C ATOM 2043 NH1 ARG A 143 -13.744 4.217 1.046 1.00 0.00 N ATOM 2044 NH2 ARG A 143 -12.318 5.323 -0.404 1.00 0.00 N ATOM 0 H ARG A 143 -13.000 -0.777 1.419 1.00 0.00 H new ATOM 0 HA ARG A 143 -10.264 -1.783 1.467 1.00 0.00 H new ATOM 0 HB2 ARG A 143 -11.684 0.370 3.079 1.00 0.00 H new ATOM 0 HB3 ARG A 143 -9.953 0.136 2.932 1.00 0.00 H new ATOM 0 HG2 ARG A 143 -9.860 1.361 1.001 1.00 0.00 H new ATOM 0 HG3 ARG A 143 -11.189 0.476 0.280 1.00 0.00 H new ATOM 0 HD2 ARG A 143 -12.844 1.816 1.482 1.00 0.00 H new ATOM 0 HD3 ARG A 143 -11.605 2.562 2.471 1.00 0.00 H new ATOM 0 HE ARG A 143 -10.885 3.272 -0.124 1.00 0.00 H new ATOM 0 HH11 ARG A 143 -13.949 3.420 1.649 1.00 0.00 H new ATOM 0 HH12 ARG A 143 -14.421 4.974 0.954 1.00 0.00 H new ATOM 0 HH21 ARG A 143 -11.433 5.372 -0.909 1.00 0.00 H new ATOM 0 HH22 ARG A 143 -12.999 6.078 -0.493 1.00 0.00 H new ATOM 2058 N LEU A 144 -10.495 -3.322 3.448 1.00 0.00 N ATOM 2059 CA LEU A 144 -10.537 -4.137 4.666 1.00 0.00 C ATOM 2060 C LEU A 144 -10.027 -3.336 5.871 1.00 0.00 C ATOM 2061 O LEU A 144 -10.503 -3.544 6.982 1.00 0.00 O ATOM 2062 CB LEU A 144 -9.737 -5.448 4.519 1.00 0.00 C ATOM 2063 CG LEU A 144 -10.463 -6.670 3.909 1.00 0.00 C ATOM 2064 CD1 LEU A 144 -11.057 -7.549 5.016 1.00 0.00 C ATOM 2065 CD2 LEU A 144 -11.595 -6.284 2.954 1.00 0.00 C ATOM 0 H LEU A 144 -9.809 -3.629 2.759 1.00 0.00 H new ATOM 0 HA LEU A 144 -11.580 -4.408 4.833 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -8.860 -5.239 3.906 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -9.375 -5.732 5.507 1.00 0.00 H new ATOM 0 HG LEU A 144 -9.705 -7.210 3.342 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -11.564 -8.404 4.569 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -10.258 -7.901 5.669 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -11.772 -6.967 5.598 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -12.063 -7.187 2.561 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -12.338 -5.694 3.490 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -11.191 -5.696 2.130 1.00 0.00 H new ATOM 2077 N ALA A 145 -9.045 -2.447 5.682 1.00 0.00 N ATOM 2078 CA ALA A 145 -8.500 -1.655 6.778 1.00 0.00 C ATOM 2079 C ALA A 145 -7.826 -0.390 6.263 1.00 0.00 C ATOM 2080 O ALA A 145 -7.426 -0.324 5.099 1.00 0.00 O ATOM 2081 CB ALA A 145 -7.536 -2.491 7.625 1.00 0.00 C ATOM 0 H ALA A 145 -8.614 -2.262 4.776 1.00 0.00 H new ATOM 0 HA ALA A 145 -9.329 -1.348 7.416 1.00 0.00 H new ATOM 0 HB1 ALA A 145 -7.141 -1.880 8.437 1.00 0.00 H new ATOM 0 HB2 ALA A 145 -8.066 -3.348 8.040 1.00 0.00 H new ATOM 0 HB3 ALA A 145 -6.713 -2.841 7.001 1.00 0.00 H new ATOM 2087 N CYS A 146 -7.727 0.601 7.151 1.00 0.00 N ATOM 2088 CA CYS A 146 -7.276 1.962 6.918 1.00 0.00 C ATOM 2089 C CYS A 146 -6.321 2.330 8.052 1.00 0.00 C ATOM 2090 O CYS A 146 -6.480 1.868 9.177 1.00 0.00 O ATOM 2091 CB CYS A 146 -8.477 2.926 6.913 1.00 0.00 C ATOM 2092 SG CYS A 146 -9.706 2.646 8.221 1.00 0.00 S ATOM 0 H CYS A 146 -7.982 0.454 8.128 1.00 0.00 H new ATOM 0 HA CYS A 146 -6.777 2.037 5.952 1.00 0.00 H new ATOM 0 HB2 CYS A 146 -8.103 3.946 7.002 1.00 0.00 H new ATOM 0 HB3 CYS A 146 -8.976 2.852 5.947 1.00 0.00 H new ATOM 2097 N GLY A 147 -5.303 3.135 7.759 1.00 0.00 N ATOM 2098 CA GLY A 147 -4.353 3.646 8.735 1.00 0.00 C ATOM 2099 C GLY A 147 -3.808 4.982 8.249 1.00 0.00 C ATOM 2100 O GLY A 147 -4.040 5.359 7.101 1.00 0.00 O ATOM 0 H GLY A 147 -5.114 3.457 6.810 1.00 0.00 H new ATOM 0 HA2 GLY A 147 -4.838 3.768 9.703 1.00 0.00 H new ATOM 0 HA3 GLY A 147 -3.538 2.936 8.874 1.00 0.00 H new ATOM 2104 N VAL A 148 -3.078 5.690 9.111 1.00 0.00 N ATOM 2105 CA VAL A 148 -2.481 6.984 8.805 1.00 0.00 C ATOM 2106 C VAL A 148 -0.967 6.857 8.968 1.00 0.00 C ATOM 2107 O VAL A 148 -0.516 6.136 9.859 1.00 0.00 O ATOM 2108 CB VAL A 148 -3.121 8.062 9.700 1.00 0.00 C ATOM 2109 CG1 VAL A 148 -2.589 8.042 11.140 1.00 0.00 C ATOM 2110 CG2 VAL A 148 -2.944 9.456 9.091 1.00 0.00 C ATOM 0 H VAL A 148 -2.883 5.371 10.060 1.00 0.00 H new ATOM 0 HA VAL A 148 -2.671 7.294 7.777 1.00 0.00 H new ATOM 0 HB VAL A 148 -4.183 7.823 9.749 1.00 0.00 H new ATOM 0 HG11 VAL A 148 -3.079 8.825 11.720 1.00 0.00 H new ATOM 0 HG12 VAL A 148 -2.797 7.072 11.591 1.00 0.00 H new ATOM 0 HG13 VAL A 148 -1.513 8.215 11.133 1.00 0.00 H new ATOM 0 HG21 VAL A 148 -3.405 10.199 9.742 1.00 0.00 H new ATOM 0 HG22 VAL A 148 -1.881 9.675 8.986 1.00 0.00 H new ATOM 0 HG23 VAL A 148 -3.420 9.488 8.111 1.00 0.00 H new ATOM 2120 N ILE A 149 -0.188 7.489 8.087 1.00 0.00 N ATOM 2121 CA ILE A 149 1.264 7.363 8.078 1.00 0.00 C ATOM 2122 C ILE A 149 1.878 8.499 8.896 1.00 0.00 C ATOM 2123 O ILE A 149 1.637 9.668 8.591 1.00 0.00 O ATOM 2124 CB ILE A 149 1.815 7.365 6.641 1.00 0.00 C ATOM 2125 CG1 ILE A 149 1.031 6.445 5.687 1.00 0.00 C ATOM 2126 CG2 ILE A 149 3.301 6.983 6.710 1.00 0.00 C ATOM 2127 CD1 ILE A 149 1.587 6.446 4.260 1.00 0.00 C ATOM 0 H ILE A 149 -0.552 8.104 7.359 1.00 0.00 H new ATOM 0 HA ILE A 149 1.536 6.408 8.529 1.00 0.00 H new ATOM 0 HB ILE A 149 1.697 8.363 6.218 1.00 0.00 H new ATOM 0 HG12 ILE A 149 1.049 5.427 6.077 1.00 0.00 H new ATOM 0 HG13 ILE A 149 -0.012 6.759 5.664 1.00 0.00 H new ATOM 0 HG21 ILE A 149 3.722 6.975 5.705 1.00 0.00 H new ATOM 0 HG22 ILE A 149 3.836 7.710 7.322 1.00 0.00 H new ATOM 0 HG23 ILE A 149 3.402 5.992 7.153 1.00 0.00 H new ATOM 0 HD11 ILE A 149 0.991 5.779 3.637 1.00 0.00 H new ATOM 0 HD12 ILE A 149 1.544 7.456 3.854 1.00 0.00 H new ATOM 0 HD13 ILE A 149 2.622 6.104 4.272 1.00 0.00 H new ATOM 2139 N GLY A 150 2.684 8.169 9.910 1.00 0.00 N ATOM 2140 CA GLY A 150 3.254 9.126 10.840 1.00 0.00 C ATOM 2141 C GLY A 150 4.666 8.702 11.232 1.00 0.00 C ATOM 2142 O GLY A 150 5.175 7.678 10.779 1.00 0.00 O ATOM 0 H GLY A 150 2.959 7.206 10.104 1.00 0.00 H new ATOM 0 HA2 GLY A 150 3.277 10.117 10.386 1.00 0.00 H new ATOM 0 HA3 GLY A 150 2.628 9.197 11.729 1.00 0.00 H new ATOM 2146 N ILE A 151 5.308 9.513 12.066 1.00 0.00 N ATOM 2147 CA ILE A 151 6.614 9.247 12.635 1.00 0.00 C ATOM 2148 C ILE A 151 6.455 8.113 13.649 1.00 0.00 C ATOM 2149 O ILE A 151 5.478 8.077 14.391 1.00 0.00 O ATOM 2150 CB ILE A 151 7.137 10.532 13.301 1.00 0.00 C ATOM 2151 CG1 ILE A 151 7.215 11.690 12.286 1.00 0.00 C ATOM 2152 CG2 ILE A 151 8.520 10.301 13.929 1.00 0.00 C ATOM 2153 CD1 ILE A 151 7.061 13.049 12.975 1.00 0.00 C ATOM 0 H ILE A 151 4.915 10.403 12.372 1.00 0.00 H new ATOM 0 HA ILE A 151 7.334 8.947 11.874 1.00 0.00 H new ATOM 0 HB ILE A 151 6.433 10.802 14.088 1.00 0.00 H new ATOM 0 HG12 ILE A 151 8.170 11.652 11.762 1.00 0.00 H new ATOM 0 HG13 ILE A 151 6.434 11.571 11.535 1.00 0.00 H new ATOM 0 HG21 ILE A 151 8.868 11.224 14.393 1.00 0.00 H new ATOM 0 HG22 ILE A 151 8.450 9.519 14.685 1.00 0.00 H new ATOM 0 HG23 ILE A 151 9.225 9.996 13.155 1.00 0.00 H new ATOM 0 HD11 ILE A 151 7.121 13.843 12.231 1.00 0.00 H new ATOM 0 HD12 ILE A 151 6.095 13.095 13.478 1.00 0.00 H new ATOM 0 HD13 ILE A 151 7.858 13.178 13.708 1.00 0.00 H new ATOM 2165 N ALA A 152 7.418 7.195 13.682 1.00 0.00 N ATOM 2166 CA ALA A 152 7.465 6.139 14.681 1.00 0.00 C ATOM 2167 C ALA A 152 8.046 6.698 15.974 1.00 0.00 C ATOM 2168 O ALA A 152 9.266 6.744 16.143 1.00 0.00 O ATOM 2169 CB ALA A 152 8.273 4.950 14.156 1.00 0.00 C ATOM 0 H ALA A 152 8.188 7.165 13.014 1.00 0.00 H new ATOM 0 HA ALA A 152 6.458 5.776 14.889 1.00 0.00 H new ATOM 0 HB1 ALA A 152 8.301 4.166 14.913 1.00 0.00 H new ATOM 0 HB2 ALA A 152 7.805 4.564 13.251 1.00 0.00 H new ATOM 0 HB3 ALA A 152 9.289 5.272 13.930 1.00 0.00 H new ATOM 2175 N GLN A 153 7.165 7.124 16.877 1.00 0.00 N ATOM 2176 CA GLN A 153 7.472 7.500 18.237 1.00 0.00 C ATOM 2177 C GLN A 153 6.162 7.337 19.009 1.00 0.00 C ATOM 2178 O GLN A 153 6.215 7.354 20.256 1.00 0.00 O ATOM 2179 CB GLN A 153 8.004 8.939 18.272 1.00 0.00 C ATOM 2180 CG GLN A 153 8.562 9.307 19.652 1.00 0.00 C ATOM 2181 CD GLN A 153 9.235 10.672 19.619 1.00 0.00 C ATOM 2182 OE1 GLN A 153 10.434 10.778 19.383 1.00 0.00 O ATOM 2183 NE2 GLN A 153 8.470 11.736 19.849 1.00 0.00 N ATOM 2184 OXT GLN A 153 5.130 7.183 18.313 1.00 0.00 O ATOM 0 H GLN A 153 6.173 7.217 16.660 1.00 0.00 H new ATOM 0 HA GLN A 153 8.252 6.884 18.684 1.00 0.00 H new ATOM 0 HB2 GLN A 153 8.785 9.056 17.521 1.00 0.00 H new ATOM 0 HB3 GLN A 153 7.203 9.629 18.008 1.00 0.00 H new ATOM 0 HG2 GLN A 153 7.756 9.312 20.385 1.00 0.00 H new ATOM 0 HG3 GLN A 153 9.279 8.551 19.972 1.00 0.00 H new ATOM 0 HE21 GLN A 153 7.476 11.617 20.043 1.00 0.00 H new ATOM 0 HE22 GLN A 153 8.878 12.671 19.832 1.00 0.00 H new TER 2193 GLN A 153 HETATM 2194 ZN ZN A 154 -3.277 3.698 -7.600 1.00 0.00 ZN HETATM 2195 CU CU1 A 155 -5.952 1.518 -1.572 1.00 0.00 CU