USER MOD reduce.3.24.130724 H: found=0, std=0, add=842, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 841 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 119 LYS NZ :NH3+ -143:sc= 0.0863 (180deg=0) USER MOD Set 1.2: A 121 TYR OH : rot 180:sc= -0.759 USER MOD Set 2.1: A 77 HIS : no HD1:sc= -4.17! C(o=-4.2!,f=-7.1!) USER MOD Set 2.2: A 105 SER OG : rot 153:sc= -0.0725 USER MOD Set 3.1: A 67 SER OG : rot 36:sc= 0.352 USER MOD Set 3.2: A 70 GLN : amide:sc= -0.464 X(o=-0.11,f=-0.23) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot 39:sc= 0.579 USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 71 LYS NZ :NH3+ -108:sc= 0.774 (180deg=-0.202) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 THR OG1 : rot 52:sc= -0.0968 USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 76 ASN : amide:sc= 0 X(o=0,f=-0.014) USER MOD Single : A 79 HIS : no HD1:sc= -0.305 K(o=-0.31,f=-2!) USER MOD Single : A 86 SER OG : rot 124:sc= -1.68 USER MOD Single : A 90 THR OG1 : rot 180:sc= -0.0955 USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 MET CE :methyl -161:sc= -0.0767 (180deg=-0.479) USER MOD Single : A 115 THR OG1 : rot 180:sc=-0.00949 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 SER OG : rot 180:sc=-0.00725 USER MOD Single : A 125 SER OG : rot -115:sc= -0.661 USER MOD Single : A 128 ASN : amide:sc= -0.0907 K(o=-0.091,f=-1.4) USER MOD Single : A 129 LYS NZ :NH3+ 147:sc= 1.09 (180deg=-0.00434) USER MOD Single : A 134 ASN : amide:sc= -0.0155 K(o=-0.016,f=-0.8) USER MOD Single : A 137 GLN :FLIP amide:sc= -0.37 F(o=-1.6,f=-0.37) USER MOD Single : A 138 GLN : amide:sc= 0 K(o=0,f=-2.2!) USER MOD Single : A 139 MET CE :methyl -169:sc= -3.19 (180deg=-4.52!) USER MOD Single : A 142 GLN : amide:sc= -0.037 K(o=-0.037,f=-1.2!) USER MOD Single : A 148 GLN : amide:sc= 0.0214 X(o=0.021,f=0) USER MOD Single : A 151 THR OG1 : rot 84:sc= -1.88! USER MOD Single : A 152 ASN : amide:sc= -0.539 X(o=-0.54,f=-0.63) USER MOD Single : A 155 THR OG1 : rot 180:sc= 0 USER MOD Single : A 157 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 162 LYS NZ :NH3+ -157:sc= -1.24 (180deg=-2.18!) USER MOD Single : A 163 SER OG : rot 32:sc= 0.0779 USER MOD Single : A 164 THR OG1 : rot 180:sc= -0.197 USER MOD Single : A 165 TYR OH : rot 180:sc= 0 USER MOD Single : A 167 SER OG : rot 40:sc= 0.251 USER MOD Single : A 168 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 169 THR OG1 : rot 180:sc= 0 USER MOD Single : A 170 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 171 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 172 SER OG : rot 180:sc= 0 USER MOD Single : A 175 SER OG : rot 180:sc= 0 USER MOD Single : A 176 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 63 14.283 7.803 -10.940 1.00 0.00 N ATOM 2 CA GLY A 63 15.453 8.450 -10.375 1.00 0.00 C ATOM 3 C GLY A 63 16.667 8.342 -11.278 1.00 0.00 C ATOM 4 O GLY A 63 16.587 8.626 -12.473 1.00 0.00 O ATOM 0 HA2 GLY A 63 15.231 9.502 -10.194 1.00 0.00 H new ATOM 0 HA3 GLY A 63 15.682 8.001 -9.408 1.00 0.00 H new ATOM 8 N SER A 64 17.794 7.933 -10.704 1.00 0.00 N ATOM 9 CA SER A 64 19.031 7.794 -11.464 1.00 0.00 C ATOM 10 C SER A 64 19.429 6.327 -11.590 1.00 0.00 C ATOM 11 O SER A 64 18.772 5.444 -11.039 1.00 0.00 O ATOM 12 CB SER A 64 20.157 8.584 -10.794 1.00 0.00 C ATOM 13 OG SER A 64 20.019 9.974 -11.036 1.00 0.00 O ATOM 0 H SER A 64 17.876 7.692 -9.716 1.00 0.00 H new ATOM 0 HA SER A 64 18.861 8.193 -12.464 1.00 0.00 H new ATOM 0 HB2 SER A 64 20.148 8.396 -9.720 1.00 0.00 H new ATOM 0 HB3 SER A 64 21.121 8.240 -11.170 1.00 0.00 H new ATOM 0 HG SER A 64 20.750 10.457 -10.596 1.00 0.00 H new ATOM 19 N SER A 65 20.511 6.074 -12.319 1.00 0.00 N ATOM 20 CA SER A 65 20.997 4.714 -12.522 1.00 0.00 C ATOM 21 C SER A 65 22.195 4.425 -11.622 1.00 0.00 C ATOM 22 O SER A 65 23.308 4.877 -11.888 1.00 0.00 O ATOM 23 CB SER A 65 21.381 4.500 -13.987 1.00 0.00 C ATOM 24 OG SER A 65 22.337 5.458 -14.409 1.00 0.00 O ATOM 0 H SER A 65 21.068 6.794 -12.779 1.00 0.00 H new ATOM 0 HA SER A 65 20.194 4.025 -12.261 1.00 0.00 H new ATOM 0 HB2 SER A 65 21.785 3.496 -14.117 1.00 0.00 H new ATOM 0 HB3 SER A 65 20.491 4.569 -14.613 1.00 0.00 H new ATOM 0 HG SER A 65 22.980 5.619 -13.687 1.00 0.00 H new ATOM 30 N GLY A 66 21.957 3.669 -10.555 1.00 0.00 N ATOM 31 CA GLY A 66 23.025 3.332 -9.632 1.00 0.00 C ATOM 32 C GLY A 66 22.591 3.433 -8.183 1.00 0.00 C ATOM 33 O GLY A 66 22.813 2.512 -7.396 1.00 0.00 O ATOM 0 H GLY A 66 21.044 3.284 -10.313 1.00 0.00 H new ATOM 0 HA2 GLY A 66 23.370 2.318 -9.835 1.00 0.00 H new ATOM 0 HA3 GLY A 66 23.872 3.997 -9.802 1.00 0.00 H new ATOM 37 N SER A 67 21.973 4.554 -7.828 1.00 0.00 N ATOM 38 CA SER A 67 21.512 4.774 -6.462 1.00 0.00 C ATOM 39 C SER A 67 20.569 3.660 -6.021 1.00 0.00 C ATOM 40 O SER A 67 19.454 3.538 -6.529 1.00 0.00 O ATOM 41 CB SER A 67 20.809 6.128 -6.350 1.00 0.00 C ATOM 42 OG SER A 67 19.786 6.253 -7.323 1.00 0.00 O ATOM 0 H SER A 67 21.780 5.325 -8.467 1.00 0.00 H new ATOM 0 HA SER A 67 22.382 4.770 -5.806 1.00 0.00 H new ATOM 0 HB2 SER A 67 20.383 6.239 -5.353 1.00 0.00 H new ATOM 0 HB3 SER A 67 21.536 6.930 -6.477 1.00 0.00 H new ATOM 0 HG SER A 67 19.353 5.384 -7.456 1.00 0.00 H new ATOM 48 N SER A 68 21.024 2.849 -5.072 1.00 0.00 N ATOM 49 CA SER A 68 20.223 1.741 -4.564 1.00 0.00 C ATOM 50 C SER A 68 19.015 2.256 -3.787 1.00 0.00 C ATOM 51 O SER A 68 17.896 1.779 -3.969 1.00 0.00 O ATOM 52 CB SER A 68 21.072 0.838 -3.668 1.00 0.00 C ATOM 53 OG SER A 68 20.614 -0.502 -3.714 1.00 0.00 O ATOM 0 H SER A 68 21.943 2.938 -4.639 1.00 0.00 H new ATOM 0 HA SER A 68 19.866 1.163 -5.416 1.00 0.00 H new ATOM 0 HB2 SER A 68 22.114 0.881 -3.986 1.00 0.00 H new ATOM 0 HB3 SER A 68 21.037 1.203 -2.641 1.00 0.00 H new ATOM 0 HG SER A 68 21.174 -1.059 -3.134 1.00 0.00 H new ATOM 59 N GLY A 69 19.251 3.234 -2.918 1.00 0.00 N ATOM 60 CA GLY A 69 18.174 3.799 -2.125 1.00 0.00 C ATOM 61 C GLY A 69 18.226 5.313 -2.071 1.00 0.00 C ATOM 62 O GLY A 69 19.198 5.889 -1.583 1.00 0.00 O ATOM 0 H GLY A 69 20.169 3.645 -2.749 1.00 0.00 H new ATOM 0 HA2 GLY A 69 17.217 3.486 -2.542 1.00 0.00 H new ATOM 0 HA3 GLY A 69 18.225 3.400 -1.112 1.00 0.00 H new ATOM 66 N GLN A 70 17.178 5.957 -2.575 1.00 0.00 N ATOM 67 CA GLN A 70 17.110 7.414 -2.583 1.00 0.00 C ATOM 68 C GLN A 70 17.350 7.978 -1.187 1.00 0.00 C ATOM 69 O GLN A 70 18.118 8.925 -1.012 1.00 0.00 O ATOM 70 CB GLN A 70 15.751 7.879 -3.108 1.00 0.00 C ATOM 71 CG GLN A 70 15.674 7.945 -4.624 1.00 0.00 C ATOM 72 CD GLN A 70 16.795 8.767 -5.230 1.00 0.00 C ATOM 73 OE1 GLN A 70 17.152 9.826 -4.715 1.00 0.00 O ATOM 74 NE2 GLN A 70 17.358 8.280 -6.330 1.00 0.00 N ATOM 0 H GLN A 70 16.366 5.494 -2.982 1.00 0.00 H new ATOM 0 HA GLN A 70 17.893 7.786 -3.244 1.00 0.00 H new ATOM 0 HB2 GLN A 70 14.979 7.202 -2.743 1.00 0.00 H new ATOM 0 HB3 GLN A 70 15.531 8.865 -2.698 1.00 0.00 H new ATOM 0 HG2 GLN A 70 15.709 6.934 -5.030 1.00 0.00 H new ATOM 0 HG3 GLN A 70 14.715 8.373 -4.917 1.00 0.00 H new ATOM 0 HE21 GLN A 70 17.030 7.398 -6.723 1.00 0.00 H new ATOM 0 HE22 GLN A 70 18.118 8.788 -6.782 1.00 0.00 H new ATOM 83 N LYS A 71 16.689 7.392 -0.195 1.00 0.00 N ATOM 84 CA LYS A 71 16.830 7.835 1.187 1.00 0.00 C ATOM 85 C LYS A 71 17.056 6.648 2.118 1.00 0.00 C ATOM 86 O LYS A 71 17.149 5.504 1.672 1.00 0.00 O ATOM 87 CB LYS A 71 15.585 8.610 1.625 1.00 0.00 C ATOM 88 CG LYS A 71 15.611 10.076 1.228 1.00 0.00 C ATOM 89 CD LYS A 71 16.648 10.851 2.024 1.00 0.00 C ATOM 90 CE LYS A 71 17.195 12.027 1.230 1.00 0.00 C ATOM 91 NZ LYS A 71 18.042 11.580 0.090 1.00 0.00 N ATOM 0 H LYS A 71 16.049 6.608 -0.323 1.00 0.00 H new ATOM 0 HA LYS A 71 17.698 8.491 1.245 1.00 0.00 H new ATOM 0 HB2 LYS A 71 14.703 8.140 1.190 1.00 0.00 H new ATOM 0 HB3 LYS A 71 15.484 8.537 2.708 1.00 0.00 H new ATOM 0 HG2 LYS A 71 15.829 10.162 0.164 1.00 0.00 H new ATOM 0 HG3 LYS A 71 14.626 10.515 1.388 1.00 0.00 H new ATOM 0 HD2 LYS A 71 16.202 11.212 2.950 1.00 0.00 H new ATOM 0 HD3 LYS A 71 17.466 10.186 2.302 1.00 0.00 H new ATOM 0 HE2 LYS A 71 16.367 12.628 0.854 1.00 0.00 H new ATOM 0 HE3 LYS A 71 17.781 12.669 1.888 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 19.040 11.786 0.297 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 17.922 10.557 -0.051 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 17.756 12.084 -0.773 1.00 0.00 H new ATOM 105 N LYS A 72 17.144 6.927 3.414 1.00 0.00 N ATOM 106 CA LYS A 72 17.357 5.883 4.409 1.00 0.00 C ATOM 107 C LYS A 72 16.110 5.686 5.266 1.00 0.00 C ATOM 108 O LYS A 72 15.698 4.556 5.528 1.00 0.00 O ATOM 109 CB LYS A 72 18.550 6.235 5.300 1.00 0.00 C ATOM 110 CG LYS A 72 18.858 5.181 6.350 1.00 0.00 C ATOM 111 CD LYS A 72 20.279 5.311 6.870 1.00 0.00 C ATOM 112 CE LYS A 72 20.388 6.398 7.928 1.00 0.00 C ATOM 113 NZ LYS A 72 21.759 6.476 8.504 1.00 0.00 N ATOM 0 H LYS A 72 17.071 7.868 3.800 1.00 0.00 H new ATOM 0 HA LYS A 72 17.566 4.952 3.883 1.00 0.00 H new ATOM 0 HB2 LYS A 72 19.430 6.380 4.674 1.00 0.00 H new ATOM 0 HB3 LYS A 72 18.353 7.185 5.798 1.00 0.00 H new ATOM 0 HG2 LYS A 72 18.156 5.276 7.179 1.00 0.00 H new ATOM 0 HG3 LYS A 72 18.715 4.188 5.923 1.00 0.00 H new ATOM 0 HD2 LYS A 72 20.602 4.359 7.291 1.00 0.00 H new ATOM 0 HD3 LYS A 72 20.951 5.538 6.043 1.00 0.00 H new ATOM 0 HE2 LYS A 72 20.123 7.360 7.489 1.00 0.00 H new ATOM 0 HE3 LYS A 72 19.670 6.203 8.725 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 21.792 7.229 9.221 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 22.002 5.566 8.945 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 22.442 6.688 7.748 1.00 0.00 H new ATOM 127 N ASP A 73 15.514 6.792 5.698 1.00 0.00 N ATOM 128 CA ASP A 73 14.312 6.740 6.523 1.00 0.00 C ATOM 129 C ASP A 73 13.084 7.161 5.722 1.00 0.00 C ATOM 130 O ASP A 73 12.245 7.921 6.204 1.00 0.00 O ATOM 131 CB ASP A 73 14.470 7.641 7.749 1.00 0.00 C ATOM 132 CG ASP A 73 15.349 7.018 8.816 1.00 0.00 C ATOM 133 OD1 ASP A 73 15.047 5.885 9.246 1.00 0.00 O ATOM 134 OD2 ASP A 73 16.339 7.663 9.220 1.00 0.00 O ATOM 0 H ASP A 73 15.843 7.735 5.491 1.00 0.00 H new ATOM 0 HA ASP A 73 14.172 5.711 6.853 1.00 0.00 H new ATOM 0 HB2 ASP A 73 14.897 8.596 7.442 1.00 0.00 H new ATOM 0 HB3 ASP A 73 13.487 7.852 8.170 1.00 0.00 H new ATOM 139 N THR A 74 12.986 6.662 4.493 1.00 0.00 N ATOM 140 CA THR A 74 11.863 6.988 3.624 1.00 0.00 C ATOM 141 C THR A 74 11.412 8.430 3.825 1.00 0.00 C ATOM 142 O THR A 74 10.217 8.708 3.928 1.00 0.00 O ATOM 143 CB THR A 74 10.668 6.048 3.874 1.00 0.00 C ATOM 144 OG1 THR A 74 10.428 5.925 5.281 1.00 0.00 O ATOM 145 CG2 THR A 74 10.926 4.673 3.276 1.00 0.00 C ATOM 0 H THR A 74 13.671 6.031 4.078 1.00 0.00 H new ATOM 0 HA THR A 74 12.209 6.859 2.599 1.00 0.00 H new ATOM 0 HB THR A 74 9.790 6.477 3.392 1.00 0.00 H new ATOM 0 HG1 THR A 74 10.357 6.817 5.680 1.00 0.00 H new ATOM 0 HG21 THR A 74 10.069 4.027 3.465 1.00 0.00 H new ATOM 0 HG22 THR A 74 11.079 4.767 2.201 1.00 0.00 H new ATOM 0 HG23 THR A 74 11.815 4.239 3.733 1.00 0.00 H new ATOM 153 N SER A 75 12.375 9.344 3.879 1.00 0.00 N ATOM 154 CA SER A 75 12.077 10.758 4.071 1.00 0.00 C ATOM 155 C SER A 75 11.246 11.301 2.912 1.00 0.00 C ATOM 156 O SER A 75 10.132 11.784 3.105 1.00 0.00 O ATOM 157 CB SER A 75 13.372 11.561 4.205 1.00 0.00 C ATOM 158 OG SER A 75 13.179 12.711 5.009 1.00 0.00 O ATOM 0 H SER A 75 13.369 9.130 3.792 1.00 0.00 H new ATOM 0 HA SER A 75 11.498 10.860 4.989 1.00 0.00 H new ATOM 0 HB2 SER A 75 14.149 10.934 4.643 1.00 0.00 H new ATOM 0 HB3 SER A 75 13.722 11.859 3.217 1.00 0.00 H new ATOM 0 HG SER A 75 14.022 13.206 5.080 1.00 0.00 H new ATOM 164 N ASN A 76 11.799 11.216 1.706 1.00 0.00 N ATOM 165 CA ASN A 76 11.111 11.698 0.514 1.00 0.00 C ATOM 166 C ASN A 76 10.659 10.534 -0.362 1.00 0.00 C ATOM 167 O ASN A 76 10.983 10.473 -1.549 1.00 0.00 O ATOM 168 CB ASN A 76 12.024 12.629 -0.286 1.00 0.00 C ATOM 169 CG ASN A 76 12.080 14.027 0.297 1.00 0.00 C ATOM 170 OD1 ASN A 76 11.075 14.739 0.329 1.00 0.00 O ATOM 171 ND2 ASN A 76 13.257 14.428 0.763 1.00 0.00 N ATOM 0 H ASN A 76 12.721 10.818 1.529 1.00 0.00 H new ATOM 0 HA ASN A 76 10.229 12.252 0.834 1.00 0.00 H new ATOM 0 HB2 ASN A 76 13.030 12.210 -0.315 1.00 0.00 H new ATOM 0 HB3 ASN A 76 11.671 12.682 -1.316 1.00 0.00 H new ATOM 0 HD21 ASN A 76 13.355 15.359 1.168 1.00 0.00 H new ATOM 0 HD22 ASN A 76 14.063 13.805 0.716 1.00 0.00 H new ATOM 178 N HIS A 77 9.908 9.611 0.231 1.00 0.00 N ATOM 179 CA HIS A 77 9.410 8.448 -0.495 1.00 0.00 C ATOM 180 C HIS A 77 7.897 8.526 -0.673 1.00 0.00 C ATOM 181 O HIS A 77 7.223 9.312 -0.007 1.00 0.00 O ATOM 182 CB HIS A 77 9.784 7.162 0.241 1.00 0.00 C ATOM 183 CG HIS A 77 11.122 6.614 -0.150 1.00 0.00 C ATOM 184 ND1 HIS A 77 11.569 5.370 0.241 1.00 0.00 N ATOM 185 CD2 HIS A 77 12.111 7.149 -0.902 1.00 0.00 C ATOM 186 CE1 HIS A 77 12.777 5.164 -0.253 1.00 0.00 C ATOM 187 NE2 HIS A 77 13.129 6.228 -0.952 1.00 0.00 N ATOM 0 H HIS A 77 9.631 9.646 1.212 1.00 0.00 H new ATOM 0 HA HIS A 77 9.874 8.440 -1.481 1.00 0.00 H new ATOM 0 HB2 HIS A 77 9.779 7.353 1.314 1.00 0.00 H new ATOM 0 HB3 HIS A 77 9.021 6.408 0.048 1.00 0.00 H new ATOM 0 HD2 HIS A 77 12.102 8.120 -1.375 1.00 0.00 H new ATOM 0 HE1 HIS A 77 13.375 4.276 -0.110 1.00 0.00 H new ATOM 0 HE2 HIS A 77 14.012 6.346 -1.448 1.00 0.00 H new ATOM 195 N PHE A 78 7.369 7.706 -1.576 1.00 0.00 N ATOM 196 CA PHE A 78 5.935 7.683 -1.842 1.00 0.00 C ATOM 197 C PHE A 78 5.315 6.372 -1.366 1.00 0.00 C ATOM 198 O PHE A 78 5.538 5.316 -1.958 1.00 0.00 O ATOM 199 CB PHE A 78 5.670 7.873 -3.337 1.00 0.00 C ATOM 200 CG PHE A 78 6.417 9.030 -3.936 1.00 0.00 C ATOM 201 CD1 PHE A 78 6.020 10.333 -3.683 1.00 0.00 C ATOM 202 CD2 PHE A 78 7.516 8.815 -4.751 1.00 0.00 C ATOM 203 CE1 PHE A 78 6.705 11.400 -4.234 1.00 0.00 C ATOM 204 CE2 PHE A 78 8.205 9.877 -5.304 1.00 0.00 C ATOM 205 CZ PHE A 78 7.800 11.172 -5.044 1.00 0.00 C ATOM 0 H PHE A 78 7.912 7.049 -2.136 1.00 0.00 H new ATOM 0 HA PHE A 78 5.474 8.503 -1.291 1.00 0.00 H new ATOM 0 HB2 PHE A 78 5.945 6.960 -3.865 1.00 0.00 H new ATOM 0 HB3 PHE A 78 4.601 8.021 -3.492 1.00 0.00 H new ATOM 0 HD1 PHE A 78 5.166 10.517 -3.048 1.00 0.00 H new ATOM 0 HD2 PHE A 78 7.838 7.805 -4.957 1.00 0.00 H new ATOM 0 HE1 PHE A 78 6.384 12.411 -4.031 1.00 0.00 H new ATOM 0 HE2 PHE A 78 9.059 9.695 -5.939 1.00 0.00 H new ATOM 0 HZ PHE A 78 8.338 12.004 -5.473 1.00 0.00 H new ATOM 215 N HIS A 79 4.534 6.449 -0.293 1.00 0.00 N ATOM 216 CA HIS A 79 3.881 5.270 0.263 1.00 0.00 C ATOM 217 C HIS A 79 2.551 5.005 -0.436 1.00 0.00 C ATOM 218 O HIS A 79 1.941 5.916 -0.997 1.00 0.00 O ATOM 219 CB HIS A 79 3.654 5.447 1.765 1.00 0.00 C ATOM 220 CG HIS A 79 4.860 5.951 2.497 1.00 0.00 C ATOM 221 ND1 HIS A 79 5.914 5.139 2.859 1.00 0.00 N ATOM 222 CD2 HIS A 79 5.176 7.192 2.934 1.00 0.00 C ATOM 223 CE1 HIS A 79 6.826 5.859 3.488 1.00 0.00 C ATOM 224 NE2 HIS A 79 6.402 7.109 3.546 1.00 0.00 N ATOM 0 H HIS A 79 4.338 7.315 0.208 1.00 0.00 H new ATOM 0 HA HIS A 79 4.534 4.413 0.100 1.00 0.00 H new ATOM 0 HB2 HIS A 79 2.828 6.141 1.920 1.00 0.00 H new ATOM 0 HB3 HIS A 79 3.352 4.492 2.194 1.00 0.00 H new ATOM 0 HD2 HIS A 79 4.575 8.082 2.822 1.00 0.00 H new ATOM 0 HE1 HIS A 79 7.759 5.489 3.887 1.00 0.00 H new ATOM 0 HE2 HIS A 79 6.904 7.886 3.976 1.00 0.00 H new ATOM 232 N VAL A 80 2.107 3.753 -0.398 1.00 0.00 N ATOM 233 CA VAL A 80 0.849 3.369 -1.028 1.00 0.00 C ATOM 234 C VAL A 80 -0.038 2.597 -0.057 1.00 0.00 C ATOM 235 O VAL A 80 0.446 1.785 0.731 1.00 0.00 O ATOM 236 CB VAL A 80 1.089 2.507 -2.282 1.00 0.00 C ATOM 237 CG1 VAL A 80 -0.211 1.872 -2.751 1.00 0.00 C ATOM 238 CG2 VAL A 80 1.715 3.342 -3.389 1.00 0.00 C ATOM 0 H VAL A 80 2.599 2.987 0.062 1.00 0.00 H new ATOM 0 HA VAL A 80 0.347 4.291 -1.321 1.00 0.00 H new ATOM 0 HB VAL A 80 1.783 1.707 -2.025 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -0.021 1.267 -3.638 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -0.613 1.240 -1.960 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -0.931 2.654 -2.992 1.00 0.00 H new ATOM 0 HG21 VAL A 80 1.878 2.718 -4.268 1.00 0.00 H new ATOM 0 HG22 VAL A 80 1.047 4.164 -3.647 1.00 0.00 H new ATOM 0 HG23 VAL A 80 2.669 3.743 -3.047 1.00 0.00 H new ATOM 248 N PHE A 81 -1.340 2.856 -0.121 1.00 0.00 N ATOM 249 CA PHE A 81 -2.296 2.186 0.753 1.00 0.00 C ATOM 250 C PHE A 81 -2.824 0.910 0.105 1.00 0.00 C ATOM 251 O PHE A 81 -3.201 0.905 -1.067 1.00 0.00 O ATOM 252 CB PHE A 81 -3.460 3.123 1.083 1.00 0.00 C ATOM 253 CG PHE A 81 -4.694 2.404 1.551 1.00 0.00 C ATOM 254 CD1 PHE A 81 -4.722 1.782 2.788 1.00 0.00 C ATOM 255 CD2 PHE A 81 -5.825 2.350 0.752 1.00 0.00 C ATOM 256 CE1 PHE A 81 -5.855 1.120 3.222 1.00 0.00 C ATOM 257 CE2 PHE A 81 -6.961 1.690 1.181 1.00 0.00 C ATOM 258 CZ PHE A 81 -6.976 1.073 2.416 1.00 0.00 C ATOM 0 H PHE A 81 -1.757 3.525 -0.769 1.00 0.00 H new ATOM 0 HA PHE A 81 -1.781 1.918 1.675 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -3.144 3.825 1.854 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -3.705 3.711 0.198 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -3.848 1.815 3.421 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -5.819 2.829 -0.216 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -5.864 0.640 4.190 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -7.837 1.657 0.550 1.00 0.00 H new ATOM 0 HZ PHE A 81 -7.862 0.555 2.751 1.00 0.00 H new ATOM 268 N VAL A 82 -2.846 -0.173 0.876 1.00 0.00 N ATOM 269 CA VAL A 82 -3.328 -1.456 0.378 1.00 0.00 C ATOM 270 C VAL A 82 -4.354 -2.063 1.327 1.00 0.00 C ATOM 271 O VAL A 82 -4.018 -2.494 2.430 1.00 0.00 O ATOM 272 CB VAL A 82 -2.170 -2.453 0.186 1.00 0.00 C ATOM 273 CG1 VAL A 82 -2.621 -3.641 -0.650 1.00 0.00 C ATOM 274 CG2 VAL A 82 -0.974 -1.764 -0.455 1.00 0.00 C ATOM 0 H VAL A 82 -2.536 -0.187 1.848 1.00 0.00 H new ATOM 0 HA VAL A 82 -3.798 -1.265 -0.587 1.00 0.00 H new ATOM 0 HB VAL A 82 -1.866 -2.822 1.165 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -1.789 -4.335 -0.775 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -3.444 -4.148 -0.147 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -2.953 -3.293 -1.628 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -0.165 -2.483 -0.583 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -1.262 -1.365 -1.428 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -0.637 -0.949 0.186 1.00 0.00 H new ATOM 284 N GLY A 83 -5.610 -2.095 0.891 1.00 0.00 N ATOM 285 CA GLY A 83 -6.668 -2.652 1.714 1.00 0.00 C ATOM 286 C GLY A 83 -7.330 -3.855 1.071 1.00 0.00 C ATOM 287 O GLY A 83 -7.116 -4.132 -0.109 1.00 0.00 O ATOM 0 H GLY A 83 -5.914 -1.745 -0.018 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -6.258 -2.941 2.682 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -7.419 -1.885 1.903 1.00 0.00 H new ATOM 291 N ASP A 84 -8.135 -4.571 1.848 1.00 0.00 N ATOM 292 CA ASP A 84 -8.830 -5.751 1.348 1.00 0.00 C ATOM 293 C ASP A 84 -7.846 -6.881 1.062 1.00 0.00 C ATOM 294 O ASP A 84 -7.831 -7.442 -0.034 1.00 0.00 O ATOM 295 CB ASP A 84 -9.615 -5.408 0.081 1.00 0.00 C ATOM 296 CG ASP A 84 -10.850 -6.270 -0.087 1.00 0.00 C ATOM 297 OD1 ASP A 84 -10.738 -7.353 -0.699 1.00 0.00 O ATOM 298 OD2 ASP A 84 -11.928 -5.863 0.393 1.00 0.00 O ATOM 0 H ASP A 84 -8.322 -4.355 2.827 1.00 0.00 H new ATOM 0 HA ASP A 84 -9.526 -6.086 2.117 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -9.909 -4.359 0.113 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -8.969 -5.532 -0.788 1.00 0.00 H new ATOM 303 N LEU A 85 -7.026 -7.209 2.054 1.00 0.00 N ATOM 304 CA LEU A 85 -6.037 -8.272 1.909 1.00 0.00 C ATOM 305 C LEU A 85 -6.416 -9.487 2.750 1.00 0.00 C ATOM 306 O LEU A 85 -6.738 -9.360 3.931 1.00 0.00 O ATOM 307 CB LEU A 85 -4.652 -7.766 2.318 1.00 0.00 C ATOM 308 CG LEU A 85 -4.227 -6.422 1.726 1.00 0.00 C ATOM 309 CD1 LEU A 85 -3.006 -5.881 2.455 1.00 0.00 C ATOM 310 CD2 LEU A 85 -3.944 -6.560 0.238 1.00 0.00 C ATOM 0 H LEU A 85 -7.026 -6.755 2.967 1.00 0.00 H new ATOM 0 HA LEU A 85 -6.013 -8.572 0.861 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -4.622 -7.687 3.405 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -3.914 -8.516 2.032 1.00 0.00 H new ATOM 0 HG LEU A 85 -5.046 -5.714 1.855 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -2.717 -4.924 2.021 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -3.243 -5.744 3.510 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -2.181 -6.587 2.357 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -3.643 -5.594 -0.166 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -3.142 -7.283 0.086 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -4.844 -6.903 -0.273 1.00 0.00 H new ATOM 322 N SER A 86 -6.373 -10.663 2.133 1.00 0.00 N ATOM 323 CA SER A 86 -6.714 -11.901 2.825 1.00 0.00 C ATOM 324 C SER A 86 -5.892 -12.055 4.101 1.00 0.00 C ATOM 325 O SER A 86 -4.795 -11.511 4.232 1.00 0.00 O ATOM 326 CB SER A 86 -6.482 -13.103 1.907 1.00 0.00 C ATOM 327 OG SER A 86 -6.098 -14.246 2.651 1.00 0.00 O ATOM 0 H SER A 86 -6.106 -10.785 1.156 1.00 0.00 H new ATOM 0 HA SER A 86 -7.769 -11.858 3.097 1.00 0.00 H new ATOM 0 HB2 SER A 86 -7.392 -13.318 1.348 1.00 0.00 H new ATOM 0 HB3 SER A 86 -5.709 -12.863 1.177 1.00 0.00 H new ATOM 0 HG SER A 86 -6.716 -14.982 2.462 1.00 0.00 H new ATOM 333 N PRO A 87 -6.434 -12.813 5.065 1.00 0.00 N ATOM 334 CA PRO A 87 -5.769 -13.057 6.348 1.00 0.00 C ATOM 335 C PRO A 87 -4.539 -13.948 6.204 1.00 0.00 C ATOM 336 O PRO A 87 -3.717 -14.038 7.115 1.00 0.00 O ATOM 337 CB PRO A 87 -6.845 -13.763 7.177 1.00 0.00 C ATOM 338 CG PRO A 87 -7.738 -14.404 6.172 1.00 0.00 C ATOM 339 CD PRO A 87 -7.738 -13.492 4.977 1.00 0.00 C ATOM 0 HA PRO A 87 -5.401 -12.135 6.798 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -6.407 -14.503 7.846 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -7.393 -13.055 7.799 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -7.376 -15.397 5.905 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -8.746 -14.528 6.568 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -7.838 -14.050 4.046 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -8.564 -12.782 5.014 1.00 0.00 H new ATOM 347 N GLU A 88 -4.420 -14.602 5.053 1.00 0.00 N ATOM 348 CA GLU A 88 -3.290 -15.485 4.790 1.00 0.00 C ATOM 349 C GLU A 88 -2.168 -14.736 4.076 1.00 0.00 C ATOM 350 O GLU A 88 -1.088 -15.283 3.850 1.00 0.00 O ATOM 351 CB GLU A 88 -3.735 -16.683 3.949 1.00 0.00 C ATOM 352 CG GLU A 88 -3.906 -16.361 2.474 1.00 0.00 C ATOM 353 CD GLU A 88 -3.551 -17.531 1.576 1.00 0.00 C ATOM 354 OE1 GLU A 88 -2.643 -18.305 1.941 1.00 0.00 O ATOM 355 OE2 GLU A 88 -4.184 -17.671 0.508 1.00 0.00 O ATOM 0 H GLU A 88 -5.092 -14.537 4.288 1.00 0.00 H new ATOM 0 HA GLU A 88 -2.912 -15.843 5.747 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -3.002 -17.483 4.055 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -4.679 -17.061 4.342 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -4.938 -16.065 2.288 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -3.279 -15.507 2.217 1.00 0.00 H new ATOM 362 N ILE A 89 -2.433 -13.483 3.723 1.00 0.00 N ATOM 363 CA ILE A 89 -1.447 -12.659 3.035 1.00 0.00 C ATOM 364 C ILE A 89 -0.406 -12.118 4.010 1.00 0.00 C ATOM 365 O ILE A 89 -0.738 -11.690 5.116 1.00 0.00 O ATOM 366 CB ILE A 89 -2.112 -11.478 2.304 1.00 0.00 C ATOM 367 CG1 ILE A 89 -3.046 -11.990 1.206 1.00 0.00 C ATOM 368 CG2 ILE A 89 -1.054 -10.554 1.719 1.00 0.00 C ATOM 369 CD1 ILE A 89 -2.329 -12.739 0.104 1.00 0.00 C ATOM 0 H ILE A 89 -3.322 -13.016 3.902 1.00 0.00 H new ATOM 0 HA ILE A 89 -0.957 -13.300 2.302 1.00 0.00 H new ATOM 0 HB ILE A 89 -2.704 -10.912 3.023 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -3.794 -12.645 1.653 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -3.581 -11.145 0.772 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -1.539 -9.724 1.205 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -0.426 -10.167 2.521 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -0.438 -11.108 1.011 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -3.053 -13.073 -0.640 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -1.600 -12.081 -0.369 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -1.817 -13.604 0.526 1.00 0.00 H new ATOM 381 N THR A 90 0.855 -12.138 3.591 1.00 0.00 N ATOM 382 CA THR A 90 1.945 -11.649 4.426 1.00 0.00 C ATOM 383 C THR A 90 2.694 -10.511 3.743 1.00 0.00 C ATOM 384 O THR A 90 2.474 -10.229 2.564 1.00 0.00 O ATOM 385 CB THR A 90 2.942 -12.774 4.764 1.00 0.00 C ATOM 386 OG1 THR A 90 3.835 -12.343 5.797 1.00 0.00 O ATOM 387 CG2 THR A 90 3.740 -13.178 3.533 1.00 0.00 C ATOM 0 H THR A 90 1.147 -12.488 2.678 1.00 0.00 H new ATOM 0 HA THR A 90 1.495 -11.282 5.349 1.00 0.00 H new ATOM 0 HB THR A 90 2.376 -13.639 5.111 1.00 0.00 H new ATOM 0 HG1 THR A 90 4.464 -13.064 6.007 1.00 0.00 H new ATOM 0 HG21 THR A 90 4.437 -13.973 3.796 1.00 0.00 H new ATOM 0 HG22 THR A 90 3.060 -13.533 2.759 1.00 0.00 H new ATOM 0 HG23 THR A 90 4.296 -12.317 3.161 1.00 0.00 H new ATOM 395 N THR A 91 3.580 -9.859 4.489 1.00 0.00 N ATOM 396 CA THR A 91 4.361 -8.751 3.954 1.00 0.00 C ATOM 397 C THR A 91 4.889 -9.072 2.561 1.00 0.00 C ATOM 398 O THR A 91 4.737 -8.278 1.632 1.00 0.00 O ATOM 399 CB THR A 91 5.548 -8.405 4.873 1.00 0.00 C ATOM 400 OG1 THR A 91 5.075 -8.090 6.188 1.00 0.00 O ATOM 401 CG2 THR A 91 6.339 -7.230 4.318 1.00 0.00 C ATOM 0 H THR A 91 3.775 -10.079 5.466 1.00 0.00 H new ATOM 0 HA THR A 91 3.692 -7.892 3.897 1.00 0.00 H new ATOM 0 HB THR A 91 6.205 -9.273 4.922 1.00 0.00 H new ATOM 0 HG1 THR A 91 5.836 -7.873 6.766 1.00 0.00 H new ATOM 0 HG21 THR A 91 7.172 -7.005 4.984 1.00 0.00 H new ATOM 0 HG22 THR A 91 6.723 -7.484 3.330 1.00 0.00 H new ATOM 0 HG23 THR A 91 5.690 -6.358 4.241 1.00 0.00 H new ATOM 409 N GLU A 92 5.509 -10.240 2.422 1.00 0.00 N ATOM 410 CA GLU A 92 6.059 -10.664 1.140 1.00 0.00 C ATOM 411 C GLU A 92 5.009 -10.564 0.037 1.00 0.00 C ATOM 412 O GLU A 92 5.188 -9.839 -0.941 1.00 0.00 O ATOM 413 CB GLU A 92 6.581 -12.099 1.234 1.00 0.00 C ATOM 414 CG GLU A 92 7.689 -12.278 2.258 1.00 0.00 C ATOM 415 CD GLU A 92 8.415 -13.601 2.107 1.00 0.00 C ATOM 416 OE1 GLU A 92 7.748 -14.615 1.816 1.00 0.00 O ATOM 417 OE2 GLU A 92 9.652 -13.620 2.278 1.00 0.00 O ATOM 0 H GLU A 92 5.643 -10.909 3.181 1.00 0.00 H new ATOM 0 HA GLU A 92 6.886 -9.999 0.891 1.00 0.00 H new ATOM 0 HB2 GLU A 92 5.753 -12.762 1.487 1.00 0.00 H new ATOM 0 HB3 GLU A 92 6.949 -12.408 0.255 1.00 0.00 H new ATOM 0 HG2 GLU A 92 8.405 -11.462 2.160 1.00 0.00 H new ATOM 0 HG3 GLU A 92 7.266 -12.212 3.261 1.00 0.00 H new ATOM 424 N ASP A 93 3.914 -11.298 0.203 1.00 0.00 N ATOM 425 CA ASP A 93 2.834 -11.292 -0.777 1.00 0.00 C ATOM 426 C ASP A 93 2.681 -9.913 -1.409 1.00 0.00 C ATOM 427 O ASP A 93 2.777 -9.764 -2.628 1.00 0.00 O ATOM 428 CB ASP A 93 1.519 -11.714 -0.120 1.00 0.00 C ATOM 429 CG ASP A 93 1.314 -13.216 -0.147 1.00 0.00 C ATOM 430 OD1 ASP A 93 1.561 -13.830 -1.206 1.00 0.00 O ATOM 431 OD2 ASP A 93 0.907 -13.779 0.892 1.00 0.00 O ATOM 0 H ASP A 93 3.751 -11.904 1.007 1.00 0.00 H new ATOM 0 HA ASP A 93 3.085 -12.005 -1.562 1.00 0.00 H new ATOM 0 HB2 ASP A 93 1.505 -11.367 0.913 1.00 0.00 H new ATOM 0 HB3 ASP A 93 0.688 -11.228 -0.631 1.00 0.00 H new ATOM 436 N ILE A 94 2.443 -8.907 -0.574 1.00 0.00 N ATOM 437 CA ILE A 94 2.277 -7.540 -1.052 1.00 0.00 C ATOM 438 C ILE A 94 3.408 -7.147 -1.996 1.00 0.00 C ATOM 439 O ILE A 94 3.179 -6.854 -3.169 1.00 0.00 O ATOM 440 CB ILE A 94 2.225 -6.538 0.116 1.00 0.00 C ATOM 441 CG1 ILE A 94 1.091 -6.899 1.078 1.00 0.00 C ATOM 442 CG2 ILE A 94 2.050 -5.121 -0.409 1.00 0.00 C ATOM 443 CD1 ILE A 94 0.722 -5.779 2.024 1.00 0.00 C ATOM 0 H ILE A 94 2.361 -9.013 0.437 1.00 0.00 H new ATOM 0 HA ILE A 94 1.330 -7.506 -1.591 1.00 0.00 H new ATOM 0 HB ILE A 94 3.168 -6.589 0.661 1.00 0.00 H new ATOM 0 HG12 ILE A 94 0.211 -7.180 0.500 1.00 0.00 H new ATOM 0 HG13 ILE A 94 1.383 -7.773 1.659 1.00 0.00 H new ATOM 0 HG21 ILE A 94 2.015 -4.424 0.429 1.00 0.00 H new ATOM 0 HG22 ILE A 94 2.889 -4.867 -1.057 1.00 0.00 H new ATOM 0 HG23 ILE A 94 1.121 -5.055 -0.975 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -0.088 -6.106 2.676 1.00 0.00 H new ATOM 0 HD12 ILE A 94 1.589 -5.513 2.628 1.00 0.00 H new ATOM 0 HD13 ILE A 94 0.398 -4.910 1.451 1.00 0.00 H new ATOM 455 N LYS A 95 4.631 -7.144 -1.475 1.00 0.00 N ATOM 456 CA LYS A 95 5.800 -6.790 -2.271 1.00 0.00 C ATOM 457 C LYS A 95 5.774 -7.497 -3.622 1.00 0.00 C ATOM 458 O LYS A 95 6.120 -6.911 -4.647 1.00 0.00 O ATOM 459 CB LYS A 95 7.083 -7.152 -1.519 1.00 0.00 C ATOM 460 CG LYS A 95 7.611 -6.030 -0.641 1.00 0.00 C ATOM 461 CD LYS A 95 8.765 -6.499 0.229 1.00 0.00 C ATOM 462 CE LYS A 95 8.275 -7.033 1.565 1.00 0.00 C ATOM 463 NZ LYS A 95 9.384 -7.617 2.370 1.00 0.00 N ATOM 0 H LYS A 95 4.838 -7.383 -0.505 1.00 0.00 H new ATOM 0 HA LYS A 95 5.778 -5.714 -2.444 1.00 0.00 H new ATOM 0 HB2 LYS A 95 6.896 -8.029 -0.900 1.00 0.00 H new ATOM 0 HB3 LYS A 95 7.851 -7.429 -2.241 1.00 0.00 H new ATOM 0 HG2 LYS A 95 7.940 -5.201 -1.267 1.00 0.00 H new ATOM 0 HG3 LYS A 95 6.807 -5.653 -0.009 1.00 0.00 H new ATOM 0 HD2 LYS A 95 9.322 -7.277 -0.293 1.00 0.00 H new ATOM 0 HD3 LYS A 95 9.454 -5.672 0.398 1.00 0.00 H new ATOM 0 HE2 LYS A 95 7.804 -6.227 2.127 1.00 0.00 H new ATOM 0 HE3 LYS A 95 7.511 -7.792 1.395 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 9.009 -7.970 3.273 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 9.818 -8.403 1.845 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 10.101 -6.887 2.555 1.00 0.00 H new ATOM 477 N ALA A 96 5.360 -8.760 -3.616 1.00 0.00 N ATOM 478 CA ALA A 96 5.284 -9.545 -4.841 1.00 0.00 C ATOM 479 C ALA A 96 4.305 -8.925 -5.832 1.00 0.00 C ATOM 480 O ALA A 96 4.484 -9.031 -7.045 1.00 0.00 O ATOM 481 CB ALA A 96 4.883 -10.979 -4.526 1.00 0.00 C ATOM 0 H ALA A 96 5.072 -9.261 -2.776 1.00 0.00 H new ATOM 0 HA ALA A 96 6.272 -9.549 -5.302 1.00 0.00 H new ATOM 0 HB1 ALA A 96 4.830 -11.554 -5.451 1.00 0.00 H new ATOM 0 HB2 ALA A 96 5.623 -11.426 -3.863 1.00 0.00 H new ATOM 0 HB3 ALA A 96 3.908 -10.985 -4.039 1.00 0.00 H new ATOM 487 N ALA A 97 3.269 -8.279 -5.307 1.00 0.00 N ATOM 488 CA ALA A 97 2.262 -7.641 -6.145 1.00 0.00 C ATOM 489 C ALA A 97 2.809 -6.374 -6.793 1.00 0.00 C ATOM 490 O ALA A 97 2.754 -6.214 -8.012 1.00 0.00 O ATOM 491 CB ALA A 97 1.019 -7.323 -5.327 1.00 0.00 C ATOM 0 H ALA A 97 3.105 -8.184 -4.305 1.00 0.00 H new ATOM 0 HA ALA A 97 1.993 -8.337 -6.940 1.00 0.00 H new ATOM 0 HB1 ALA A 97 0.275 -6.847 -5.966 1.00 0.00 H new ATOM 0 HB2 ALA A 97 0.608 -8.245 -4.917 1.00 0.00 H new ATOM 0 HB3 ALA A 97 1.282 -6.649 -4.512 1.00 0.00 H new ATOM 497 N PHE A 98 3.337 -5.474 -5.969 1.00 0.00 N ATOM 498 CA PHE A 98 3.893 -4.219 -6.462 1.00 0.00 C ATOM 499 C PHE A 98 5.365 -4.384 -6.829 1.00 0.00 C ATOM 500 O PHE A 98 6.050 -3.411 -7.142 1.00 0.00 O ATOM 501 CB PHE A 98 3.737 -3.120 -5.410 1.00 0.00 C ATOM 502 CG PHE A 98 2.327 -2.954 -4.919 1.00 0.00 C ATOM 503 CD1 PHE A 98 1.777 -3.865 -4.033 1.00 0.00 C ATOM 504 CD2 PHE A 98 1.553 -1.887 -5.346 1.00 0.00 C ATOM 505 CE1 PHE A 98 0.479 -3.715 -3.579 1.00 0.00 C ATOM 506 CE2 PHE A 98 0.255 -1.732 -4.896 1.00 0.00 C ATOM 507 CZ PHE A 98 -0.282 -2.648 -4.012 1.00 0.00 C ATOM 0 H PHE A 98 3.391 -5.591 -4.957 1.00 0.00 H new ATOM 0 HA PHE A 98 3.343 -3.934 -7.359 1.00 0.00 H new ATOM 0 HB2 PHE A 98 4.384 -3.346 -4.562 1.00 0.00 H new ATOM 0 HB3 PHE A 98 4.080 -2.175 -5.830 1.00 0.00 H new ATOM 0 HD1 PHE A 98 2.368 -4.702 -3.693 1.00 0.00 H new ATOM 0 HD2 PHE A 98 1.968 -1.169 -6.038 1.00 0.00 H new ATOM 0 HE1 PHE A 98 0.062 -4.432 -2.887 1.00 0.00 H new ATOM 0 HE2 PHE A 98 -0.339 -0.896 -5.235 1.00 0.00 H new ATOM 0 HZ PHE A 98 -1.296 -2.529 -3.660 1.00 0.00 H new ATOM 517 N ALA A 99 5.844 -5.623 -6.787 1.00 0.00 N ATOM 518 CA ALA A 99 7.233 -5.916 -7.115 1.00 0.00 C ATOM 519 C ALA A 99 7.555 -5.513 -8.551 1.00 0.00 C ATOM 520 O ALA A 99 8.427 -4.684 -8.808 1.00 0.00 O ATOM 521 CB ALA A 99 7.526 -7.394 -6.902 1.00 0.00 C ATOM 0 H ALA A 99 5.290 -6.440 -6.529 1.00 0.00 H new ATOM 0 HA ALA A 99 7.868 -5.331 -6.450 1.00 0.00 H new ATOM 0 HB1 ALA A 99 8.567 -7.598 -7.151 1.00 0.00 H new ATOM 0 HB2 ALA A 99 7.345 -7.654 -5.859 1.00 0.00 H new ATOM 0 HB3 ALA A 99 6.876 -7.990 -7.543 1.00 0.00 H new ATOM 527 N PRO A 100 6.835 -6.114 -9.510 1.00 0.00 N ATOM 528 CA PRO A 100 7.026 -5.834 -10.936 1.00 0.00 C ATOM 529 C PRO A 100 6.553 -4.436 -11.320 1.00 0.00 C ATOM 530 O PRO A 100 6.654 -4.033 -12.479 1.00 0.00 O ATOM 531 CB PRO A 100 6.167 -6.897 -11.625 1.00 0.00 C ATOM 532 CG PRO A 100 5.123 -7.249 -10.622 1.00 0.00 C ATOM 533 CD PRO A 100 5.779 -7.114 -9.276 1.00 0.00 C ATOM 0 HA PRO A 100 8.078 -5.867 -11.220 1.00 0.00 H new ATOM 0 HB2 PRO A 100 5.721 -6.512 -12.542 1.00 0.00 H new ATOM 0 HB3 PRO A 100 6.761 -7.768 -11.901 1.00 0.00 H new ATOM 0 HG2 PRO A 100 4.263 -6.585 -10.705 1.00 0.00 H new ATOM 0 HG3 PRO A 100 4.758 -8.264 -10.778 1.00 0.00 H new ATOM 0 HD2 PRO A 100 5.072 -6.782 -8.516 1.00 0.00 H new ATOM 0 HD3 PRO A 100 6.193 -8.063 -8.934 1.00 0.00 H new ATOM 541 N PHE A 101 6.037 -3.701 -10.341 1.00 0.00 N ATOM 542 CA PHE A 101 5.548 -2.348 -10.577 1.00 0.00 C ATOM 543 C PHE A 101 6.581 -1.312 -10.143 1.00 0.00 C ATOM 544 O PHE A 101 6.396 -0.113 -10.344 1.00 0.00 O ATOM 545 CB PHE A 101 4.234 -2.120 -9.827 1.00 0.00 C ATOM 546 CG PHE A 101 3.064 -2.839 -10.435 1.00 0.00 C ATOM 547 CD1 PHE A 101 2.803 -4.161 -10.114 1.00 0.00 C ATOM 548 CD2 PHE A 101 2.224 -2.192 -11.328 1.00 0.00 C ATOM 549 CE1 PHE A 101 1.728 -4.825 -10.673 1.00 0.00 C ATOM 550 CE2 PHE A 101 1.147 -2.851 -11.889 1.00 0.00 C ATOM 551 CZ PHE A 101 0.898 -4.169 -11.560 1.00 0.00 C ATOM 0 H PHE A 101 5.947 -4.020 -9.376 1.00 0.00 H new ATOM 0 HA PHE A 101 5.373 -2.234 -11.647 1.00 0.00 H new ATOM 0 HB2 PHE A 101 4.353 -2.446 -8.794 1.00 0.00 H new ATOM 0 HB3 PHE A 101 4.020 -1.051 -9.801 1.00 0.00 H new ATOM 0 HD1 PHE A 101 3.447 -4.679 -9.419 1.00 0.00 H new ATOM 0 HD2 PHE A 101 2.414 -1.161 -11.588 1.00 0.00 H new ATOM 0 HE1 PHE A 101 1.537 -5.857 -10.416 1.00 0.00 H new ATOM 0 HE2 PHE A 101 0.500 -2.336 -12.584 1.00 0.00 H new ATOM 0 HZ PHE A 101 0.056 -4.686 -11.996 1.00 0.00 H new ATOM 561 N GLY A 102 7.670 -1.786 -9.545 1.00 0.00 N ATOM 562 CA GLY A 102 8.717 -0.890 -9.091 1.00 0.00 C ATOM 563 C GLY A 102 9.360 -1.356 -7.800 1.00 0.00 C ATOM 564 O GLY A 102 8.670 -1.777 -6.872 1.00 0.00 O ATOM 0 H GLY A 102 7.846 -2.775 -9.367 1.00 0.00 H new ATOM 0 HA2 GLY A 102 9.481 -0.807 -9.864 1.00 0.00 H new ATOM 0 HA3 GLY A 102 8.300 0.107 -8.947 1.00 0.00 H new ATOM 568 N ARG A 103 10.686 -1.283 -7.742 1.00 0.00 N ATOM 569 CA ARG A 103 11.423 -1.705 -6.557 1.00 0.00 C ATOM 570 C ARG A 103 10.788 -1.137 -5.291 1.00 0.00 C ATOM 571 O ARG A 103 10.612 0.076 -5.163 1.00 0.00 O ATOM 572 CB ARG A 103 12.883 -1.258 -6.652 1.00 0.00 C ATOM 573 CG ARG A 103 13.730 -2.134 -7.560 1.00 0.00 C ATOM 574 CD ARG A 103 14.888 -1.355 -8.164 1.00 0.00 C ATOM 575 NE ARG A 103 15.348 -1.944 -9.419 1.00 0.00 N ATOM 576 CZ ARG A 103 16.288 -1.400 -10.185 1.00 0.00 C ATOM 577 NH1 ARG A 103 16.864 -0.262 -9.825 1.00 0.00 N ATOM 578 NH2 ARG A 103 16.653 -1.996 -11.313 1.00 0.00 N ATOM 0 H ARG A 103 11.272 -0.936 -8.502 1.00 0.00 H new ATOM 0 HA ARG A 103 11.386 -2.793 -6.505 1.00 0.00 H new ATOM 0 HB2 ARG A 103 12.917 -0.231 -7.017 1.00 0.00 H new ATOM 0 HB3 ARG A 103 13.319 -1.256 -5.653 1.00 0.00 H new ATOM 0 HG2 ARG A 103 14.116 -2.981 -6.993 1.00 0.00 H new ATOM 0 HG3 ARG A 103 13.109 -2.541 -8.358 1.00 0.00 H new ATOM 0 HD2 ARG A 103 14.580 -0.324 -8.339 1.00 0.00 H new ATOM 0 HD3 ARG A 103 15.714 -1.324 -7.454 1.00 0.00 H new ATOM 0 HE ARG A 103 14.925 -2.820 -9.724 1.00 0.00 H new ATOM 0 HH11 ARG A 103 16.586 0.198 -8.958 1.00 0.00 H new ATOM 0 HH12 ARG A 103 17.585 0.153 -10.415 1.00 0.00 H new ATOM 0 HH21 ARG A 103 16.212 -2.872 -11.593 1.00 0.00 H new ATOM 0 HH22 ARG A 103 17.374 -1.578 -11.900 1.00 0.00 H new ATOM 592 N ILE A 104 10.444 -2.020 -4.360 1.00 0.00 N ATOM 593 CA ILE A 104 9.829 -1.606 -3.105 1.00 0.00 C ATOM 594 C ILE A 104 10.854 -1.568 -1.976 1.00 0.00 C ATOM 595 O ILE A 104 11.697 -2.457 -1.860 1.00 0.00 O ATOM 596 CB ILE A 104 8.677 -2.547 -2.705 1.00 0.00 C ATOM 597 CG1 ILE A 104 7.776 -2.825 -3.910 1.00 0.00 C ATOM 598 CG2 ILE A 104 7.873 -1.944 -1.563 1.00 0.00 C ATOM 599 CD1 ILE A 104 6.887 -4.037 -3.733 1.00 0.00 C ATOM 0 H ILE A 104 10.581 -3.027 -4.451 1.00 0.00 H new ATOM 0 HA ILE A 104 9.431 -0.604 -3.265 1.00 0.00 H new ATOM 0 HB ILE A 104 9.100 -3.492 -2.365 1.00 0.00 H new ATOM 0 HG12 ILE A 104 7.152 -1.951 -4.096 1.00 0.00 H new ATOM 0 HG13 ILE A 104 8.398 -2.967 -4.794 1.00 0.00 H new ATOM 0 HG21 ILE A 104 7.063 -2.621 -1.292 1.00 0.00 H new ATOM 0 HG22 ILE A 104 8.523 -1.792 -0.701 1.00 0.00 H new ATOM 0 HG23 ILE A 104 7.457 -0.987 -1.877 1.00 0.00 H new ATOM 0 HD11 ILE A 104 6.276 -4.174 -4.625 1.00 0.00 H new ATOM 0 HD12 ILE A 104 7.505 -4.922 -3.577 1.00 0.00 H new ATOM 0 HD13 ILE A 104 6.239 -3.890 -2.869 1.00 0.00 H new ATOM 611 N SER A 105 10.775 -0.533 -1.147 1.00 0.00 N ATOM 612 CA SER A 105 11.697 -0.377 -0.028 1.00 0.00 C ATOM 613 C SER A 105 10.996 -0.662 1.297 1.00 0.00 C ATOM 614 O SER A 105 11.367 -1.585 2.022 1.00 0.00 O ATOM 615 CB SER A 105 12.282 1.036 -0.015 1.00 0.00 C ATOM 616 OG SER A 105 11.256 2.013 -0.019 1.00 0.00 O ATOM 0 H SER A 105 10.082 0.211 -1.229 1.00 0.00 H new ATOM 0 HA SER A 105 12.506 -1.096 -0.153 1.00 0.00 H new ATOM 0 HB2 SER A 105 12.908 1.166 0.868 1.00 0.00 H new ATOM 0 HB3 SER A 105 12.924 1.175 -0.885 1.00 0.00 H new ATOM 0 HG SER A 105 11.582 2.832 0.409 1.00 0.00 H new ATOM 622 N ASP A 106 9.982 0.138 1.607 1.00 0.00 N ATOM 623 CA ASP A 106 9.227 -0.027 2.844 1.00 0.00 C ATOM 624 C ASP A 106 7.915 -0.760 2.586 1.00 0.00 C ATOM 625 O ASP A 106 6.965 -0.185 2.055 1.00 0.00 O ATOM 626 CB ASP A 106 8.949 1.335 3.482 1.00 0.00 C ATOM 627 CG ASP A 106 8.196 1.217 4.792 1.00 0.00 C ATOM 628 OD1 ASP A 106 8.807 0.781 5.791 1.00 0.00 O ATOM 629 OD2 ASP A 106 6.996 1.562 4.820 1.00 0.00 O ATOM 0 H ASP A 106 9.664 0.908 1.018 1.00 0.00 H new ATOM 0 HA ASP A 106 9.827 -0.625 3.530 1.00 0.00 H new ATOM 0 HB2 ASP A 106 9.893 1.852 3.654 1.00 0.00 H new ATOM 0 HB3 ASP A 106 8.372 1.947 2.789 1.00 0.00 H new ATOM 634 N ALA A 107 7.869 -2.033 2.965 1.00 0.00 N ATOM 635 CA ALA A 107 6.673 -2.844 2.775 1.00 0.00 C ATOM 636 C ALA A 107 6.355 -3.653 4.028 1.00 0.00 C ATOM 637 O ALA A 107 7.210 -4.368 4.551 1.00 0.00 O ATOM 638 CB ALA A 107 6.846 -3.768 1.578 1.00 0.00 C ATOM 0 H ALA A 107 8.646 -2.525 3.406 1.00 0.00 H new ATOM 0 HA ALA A 107 5.835 -2.173 2.584 1.00 0.00 H new ATOM 0 HB1 ALA A 107 5.945 -4.368 1.448 1.00 0.00 H new ATOM 0 HB2 ALA A 107 7.018 -3.173 0.681 1.00 0.00 H new ATOM 0 HB3 ALA A 107 7.699 -4.426 1.746 1.00 0.00 H new ATOM 644 N ARG A 108 5.120 -3.535 4.505 1.00 0.00 N ATOM 645 CA ARG A 108 4.689 -4.254 5.698 1.00 0.00 C ATOM 646 C ARG A 108 3.167 -4.330 5.767 1.00 0.00 C ATOM 647 O ARG A 108 2.466 -3.523 5.156 1.00 0.00 O ATOM 648 CB ARG A 108 5.234 -3.572 6.954 1.00 0.00 C ATOM 649 CG ARG A 108 4.521 -2.276 7.301 1.00 0.00 C ATOM 650 CD ARG A 108 4.645 -1.950 8.781 1.00 0.00 C ATOM 651 NE ARG A 108 4.537 -0.517 9.038 1.00 0.00 N ATOM 652 CZ ARG A 108 5.450 0.369 8.655 1.00 0.00 C ATOM 653 NH1 ARG A 108 6.533 -0.030 8.003 1.00 0.00 N ATOM 654 NH2 ARG A 108 5.281 1.657 8.925 1.00 0.00 N ATOM 0 H ARG A 108 4.400 -2.948 4.083 1.00 0.00 H new ATOM 0 HA ARG A 108 5.084 -5.269 5.643 1.00 0.00 H new ATOM 0 HB2 ARG A 108 5.150 -4.259 7.796 1.00 0.00 H new ATOM 0 HB3 ARG A 108 6.295 -3.367 6.814 1.00 0.00 H new ATOM 0 HG2 ARG A 108 4.940 -1.460 6.712 1.00 0.00 H new ATOM 0 HG3 ARG A 108 3.468 -2.356 7.032 1.00 0.00 H new ATOM 0 HD2 ARG A 108 3.868 -2.477 9.334 1.00 0.00 H new ATOM 0 HD3 ARG A 108 5.603 -2.314 9.153 1.00 0.00 H new ATOM 0 HE ARG A 108 3.716 -0.177 9.539 1.00 0.00 H new ATOM 0 HH11 ARG A 108 6.667 -1.019 7.794 1.00 0.00 H new ATOM 0 HH12 ARG A 108 7.232 0.652 7.710 1.00 0.00 H new ATOM 0 HH21 ARG A 108 4.449 1.968 9.427 1.00 0.00 H new ATOM 0 HH22 ARG A 108 5.983 2.336 8.630 1.00 0.00 H new ATOM 668 N VAL A 109 2.661 -5.307 6.514 1.00 0.00 N ATOM 669 CA VAL A 109 1.223 -5.488 6.663 1.00 0.00 C ATOM 670 C VAL A 109 0.768 -5.136 8.075 1.00 0.00 C ATOM 671 O VAL A 109 1.149 -5.794 9.044 1.00 0.00 O ATOM 672 CB VAL A 109 0.804 -6.937 6.347 1.00 0.00 C ATOM 673 CG1 VAL A 109 -0.695 -7.112 6.534 1.00 0.00 C ATOM 674 CG2 VAL A 109 1.221 -7.315 4.934 1.00 0.00 C ATOM 0 H VAL A 109 3.227 -5.985 7.025 1.00 0.00 H new ATOM 0 HA VAL A 109 0.744 -4.815 5.952 1.00 0.00 H new ATOM 0 HB VAL A 109 1.313 -7.604 7.043 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -0.972 -8.141 6.306 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -0.962 -6.884 7.566 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -1.227 -6.436 5.864 1.00 0.00 H new ATOM 0 HG21 VAL A 109 0.917 -8.341 4.727 1.00 0.00 H new ATOM 0 HG22 VAL A 109 0.741 -6.644 4.221 1.00 0.00 H new ATOM 0 HG23 VAL A 109 2.304 -7.231 4.839 1.00 0.00 H new ATOM 684 N VAL A 110 -0.050 -4.094 8.185 1.00 0.00 N ATOM 685 CA VAL A 110 -0.559 -3.655 9.479 1.00 0.00 C ATOM 686 C VAL A 110 -1.077 -4.834 10.295 1.00 0.00 C ATOM 687 O VAL A 110 -1.763 -5.712 9.771 1.00 0.00 O ATOM 688 CB VAL A 110 -1.688 -2.621 9.316 1.00 0.00 C ATOM 689 CG1 VAL A 110 -2.161 -2.127 10.675 1.00 0.00 C ATOM 690 CG2 VAL A 110 -1.226 -1.459 8.449 1.00 0.00 C ATOM 0 H VAL A 110 -0.374 -3.538 7.394 1.00 0.00 H new ATOM 0 HA VAL A 110 0.275 -3.191 10.006 1.00 0.00 H new ATOM 0 HB VAL A 110 -2.529 -3.104 8.819 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -2.959 -1.397 10.539 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -2.535 -2.969 11.258 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -1.329 -1.661 11.203 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -2.037 -0.738 8.345 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -0.368 -0.975 8.916 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -0.942 -1.830 7.464 1.00 0.00 H new ATOM 700 N LYS A 111 -0.746 -4.847 11.582 1.00 0.00 N ATOM 701 CA LYS A 111 -1.180 -5.916 12.473 1.00 0.00 C ATOM 702 C LYS A 111 -1.639 -5.355 13.814 1.00 0.00 C ATOM 703 O LYS A 111 -1.132 -4.332 14.276 1.00 0.00 O ATOM 704 CB LYS A 111 -0.044 -6.919 12.690 1.00 0.00 C ATOM 705 CG LYS A 111 0.059 -7.967 11.595 1.00 0.00 C ATOM 706 CD LYS A 111 1.432 -8.619 11.575 1.00 0.00 C ATOM 707 CE LYS A 111 1.698 -9.317 10.250 1.00 0.00 C ATOM 708 NZ LYS A 111 3.014 -10.013 10.245 1.00 0.00 N ATOM 0 H LYS A 111 -0.178 -4.129 12.031 1.00 0.00 H new ATOM 0 HA LYS A 111 -2.023 -6.425 12.005 1.00 0.00 H new ATOM 0 HB2 LYS A 111 0.900 -6.378 12.754 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -0.190 -7.419 13.647 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -0.705 -8.730 11.747 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -0.140 -7.505 10.628 1.00 0.00 H new ATOM 0 HD2 LYS A 111 2.198 -7.863 11.749 1.00 0.00 H new ATOM 0 HD3 LYS A 111 1.505 -9.340 12.389 1.00 0.00 H new ATOM 0 HE2 LYS A 111 0.905 -10.038 10.054 1.00 0.00 H new ATOM 0 HE3 LYS A 111 1.671 -8.586 9.442 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 3.158 -10.476 9.325 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 3.773 -9.321 10.407 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 3.031 -10.729 10.999 1.00 0.00 H new ATOM 722 N ASP A 112 -2.600 -6.030 14.435 1.00 0.00 N ATOM 723 CA ASP A 112 -3.126 -5.599 15.725 1.00 0.00 C ATOM 724 C ASP A 112 -2.016 -5.532 16.770 1.00 0.00 C ATOM 725 O ASP A 112 -1.245 -6.478 16.932 1.00 0.00 O ATOM 726 CB ASP A 112 -4.228 -6.550 16.195 1.00 0.00 C ATOM 727 CG ASP A 112 -4.828 -6.131 17.522 1.00 0.00 C ATOM 728 OD1 ASP A 112 -5.174 -4.941 17.667 1.00 0.00 O ATOM 729 OD2 ASP A 112 -4.949 -6.994 18.417 1.00 0.00 O ATOM 0 H ASP A 112 -3.031 -6.878 14.066 1.00 0.00 H new ATOM 0 HA ASP A 112 -3.546 -4.601 15.602 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -5.014 -6.591 15.441 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -3.820 -7.557 16.286 1.00 0.00 H new ATOM 734 N MET A 113 -1.940 -4.408 17.474 1.00 0.00 N ATOM 735 CA MET A 113 -0.924 -4.218 18.503 1.00 0.00 C ATOM 736 C MET A 113 -1.313 -4.938 19.790 1.00 0.00 C ATOM 737 O MET A 113 -0.597 -4.872 20.789 1.00 0.00 O ATOM 738 CB MET A 113 -0.720 -2.727 18.780 1.00 0.00 C ATOM 739 CG MET A 113 -1.946 -2.045 19.367 1.00 0.00 C ATOM 740 SD MET A 113 -1.674 -0.294 19.697 1.00 0.00 S ATOM 741 CE MET A 113 -0.464 -0.381 21.014 1.00 0.00 C ATOM 0 H MET A 113 -2.569 -3.615 17.351 1.00 0.00 H new ATOM 0 HA MET A 113 0.011 -4.643 18.138 1.00 0.00 H new ATOM 0 HB2 MET A 113 0.118 -2.605 19.467 1.00 0.00 H new ATOM 0 HB3 MET A 113 -0.446 -2.227 17.851 1.00 0.00 H new ATOM 0 HG2 MET A 113 -2.783 -2.155 18.678 1.00 0.00 H new ATOM 0 HG3 MET A 113 -2.227 -2.546 20.293 1.00 0.00 H new ATOM 0 HE1 MET A 113 -0.442 0.567 21.551 1.00 0.00 H new ATOM 0 HE2 MET A 113 -0.733 -1.182 21.703 1.00 0.00 H new ATOM 0 HE3 MET A 113 0.520 -0.581 20.591 1.00 0.00 H new ATOM 751 N ALA A 114 -2.451 -5.624 19.759 1.00 0.00 N ATOM 752 CA ALA A 114 -2.933 -6.357 20.923 1.00 0.00 C ATOM 753 C ALA A 114 -2.677 -7.853 20.774 1.00 0.00 C ATOM 754 O ALA A 114 -2.285 -8.525 21.729 1.00 0.00 O ATOM 755 CB ALA A 114 -4.416 -6.092 21.137 1.00 0.00 C ATOM 0 H ALA A 114 -3.056 -5.687 18.940 1.00 0.00 H new ATOM 0 HA ALA A 114 -2.383 -6.006 21.796 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -4.762 -6.646 22.010 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -4.576 -5.026 21.297 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -4.974 -6.414 20.258 1.00 0.00 H new ATOM 761 N THR A 115 -2.903 -8.370 19.570 1.00 0.00 N ATOM 762 CA THR A 115 -2.699 -9.787 19.297 1.00 0.00 C ATOM 763 C THR A 115 -1.563 -9.998 18.303 1.00 0.00 C ATOM 764 O THR A 115 -0.885 -11.024 18.328 1.00 0.00 O ATOM 765 CB THR A 115 -3.978 -10.442 18.743 1.00 0.00 C ATOM 766 OG1 THR A 115 -4.283 -9.907 17.451 1.00 0.00 O ATOM 767 CG2 THR A 115 -5.153 -10.214 19.682 1.00 0.00 C ATOM 0 H THR A 115 -3.227 -7.828 18.769 1.00 0.00 H new ATOM 0 HA THR A 115 -2.440 -10.257 20.246 1.00 0.00 H new ATOM 0 HB THR A 115 -3.803 -11.515 18.659 1.00 0.00 H new ATOM 0 HG1 THR A 115 -5.097 -10.330 17.106 1.00 0.00 H new ATOM 0 HG21 THR A 115 -6.045 -10.686 19.270 1.00 0.00 H new ATOM 0 HG22 THR A 115 -4.930 -10.649 20.656 1.00 0.00 H new ATOM 0 HG23 THR A 115 -5.327 -9.144 19.794 1.00 0.00 H new ATOM 775 N GLY A 116 -1.359 -9.018 17.428 1.00 0.00 N ATOM 776 CA GLY A 116 -0.303 -9.115 16.437 1.00 0.00 C ATOM 777 C GLY A 116 -0.735 -9.881 15.202 1.00 0.00 C ATOM 778 O GLY A 116 0.100 -10.394 14.457 1.00 0.00 O ATOM 0 H GLY A 116 -1.906 -8.158 17.388 1.00 0.00 H new ATOM 0 HA2 GLY A 116 0.012 -8.113 16.147 1.00 0.00 H new ATOM 0 HA3 GLY A 116 0.563 -9.606 16.881 1.00 0.00 H new ATOM 782 N LYS A 117 -2.043 -9.960 14.985 1.00 0.00 N ATOM 783 CA LYS A 117 -2.586 -10.669 13.832 1.00 0.00 C ATOM 784 C LYS A 117 -2.802 -9.717 12.660 1.00 0.00 C ATOM 785 O LYS A 117 -3.153 -8.552 12.851 1.00 0.00 O ATOM 786 CB LYS A 117 -3.906 -11.349 14.201 1.00 0.00 C ATOM 787 CG LYS A 117 -3.804 -12.258 15.413 1.00 0.00 C ATOM 788 CD LYS A 117 -3.236 -13.618 15.044 1.00 0.00 C ATOM 789 CE LYS A 117 -2.774 -14.382 16.275 1.00 0.00 C ATOM 790 NZ LYS A 117 -1.933 -15.557 15.915 1.00 0.00 N ATOM 0 H LYS A 117 -2.747 -9.542 15.593 1.00 0.00 H new ATOM 0 HA LYS A 117 -1.865 -11.429 13.531 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -4.658 -10.584 14.394 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -4.255 -11.932 13.349 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -3.171 -11.791 16.167 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -4.791 -12.384 15.859 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -3.993 -14.199 14.517 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -2.398 -13.490 14.359 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -2.207 -13.715 16.925 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -3.643 -14.717 16.842 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -1.638 -16.051 16.781 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -2.482 -16.206 15.316 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -1.091 -15.235 15.396 1.00 0.00 H new ATOM 804 N SER A 118 -2.592 -10.220 11.448 1.00 0.00 N ATOM 805 CA SER A 118 -2.762 -9.413 10.245 1.00 0.00 C ATOM 806 C SER A 118 -4.072 -8.633 10.295 1.00 0.00 C ATOM 807 O SER A 118 -5.157 -9.211 10.233 1.00 0.00 O ATOM 808 CB SER A 118 -2.733 -10.303 9.001 1.00 0.00 C ATOM 809 OG SER A 118 -2.438 -9.546 7.840 1.00 0.00 O ATOM 0 H SER A 118 -2.304 -11.183 11.273 1.00 0.00 H new ATOM 0 HA SER A 118 -1.937 -8.702 10.194 1.00 0.00 H new ATOM 0 HB2 SER A 118 -1.986 -11.087 9.128 1.00 0.00 H new ATOM 0 HB3 SER A 118 -3.697 -10.798 8.881 1.00 0.00 H new ATOM 0 HG SER A 118 -2.423 -10.137 7.059 1.00 0.00 H new ATOM 815 N LYS A 119 -3.963 -7.313 10.409 1.00 0.00 N ATOM 816 CA LYS A 119 -5.136 -6.450 10.467 1.00 0.00 C ATOM 817 C LYS A 119 -5.945 -6.544 9.177 1.00 0.00 C ATOM 818 O LYS A 119 -7.153 -6.773 9.206 1.00 0.00 O ATOM 819 CB LYS A 119 -4.716 -4.999 10.713 1.00 0.00 C ATOM 820 CG LYS A 119 -4.636 -4.630 12.184 1.00 0.00 C ATOM 821 CD LYS A 119 -4.950 -3.160 12.408 1.00 0.00 C ATOM 822 CE LYS A 119 -4.602 -2.725 13.823 1.00 0.00 C ATOM 823 NZ LYS A 119 -5.128 -1.366 14.131 1.00 0.00 N ATOM 0 H LYS A 119 -3.073 -6.818 10.463 1.00 0.00 H new ATOM 0 HA LYS A 119 -5.762 -6.786 11.294 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -3.744 -4.828 10.251 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -5.425 -4.335 10.219 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -5.335 -5.243 12.752 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -3.638 -4.852 12.562 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -4.393 -2.555 11.693 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -6.009 -2.980 12.221 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -5.011 -3.442 14.534 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -3.519 -2.733 13.949 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -4.444 -0.856 14.726 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -5.275 -0.842 13.245 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -6.032 -1.450 14.638 1.00 0.00 H new ATOM 837 N GLY A 120 -5.269 -6.368 8.046 1.00 0.00 N ATOM 838 CA GLY A 120 -5.942 -6.438 6.761 1.00 0.00 C ATOM 839 C GLY A 120 -5.326 -5.511 5.733 1.00 0.00 C ATOM 840 O GLY A 120 -5.166 -5.882 4.569 1.00 0.00 O ATOM 0 H GLY A 120 -4.268 -6.178 7.996 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -5.905 -7.462 6.390 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -6.994 -6.184 6.891 1.00 0.00 H new ATOM 844 N TYR A 121 -4.980 -4.302 6.160 1.00 0.00 N ATOM 845 CA TYR A 121 -4.382 -3.317 5.267 1.00 0.00 C ATOM 846 C TYR A 121 -2.868 -3.267 5.447 1.00 0.00 C ATOM 847 O TYR A 121 -2.348 -3.579 6.517 1.00 0.00 O ATOM 848 CB TYR A 121 -4.983 -1.934 5.522 1.00 0.00 C ATOM 849 CG TYR A 121 -5.063 -1.569 6.987 1.00 0.00 C ATOM 850 CD1 TYR A 121 -6.031 -2.129 7.812 1.00 0.00 C ATOM 851 CD2 TYR A 121 -4.168 -0.665 7.547 1.00 0.00 C ATOM 852 CE1 TYR A 121 -6.107 -1.798 9.151 1.00 0.00 C ATOM 853 CE2 TYR A 121 -4.237 -0.329 8.886 1.00 0.00 C ATOM 854 CZ TYR A 121 -5.208 -0.898 9.683 1.00 0.00 C ATOM 855 OH TYR A 121 -5.280 -0.567 11.017 1.00 0.00 O ATOM 0 H TYR A 121 -5.104 -3.980 7.120 1.00 0.00 H new ATOM 0 HA TYR A 121 -4.598 -3.616 4.241 1.00 0.00 H new ATOM 0 HB2 TYR A 121 -4.385 -1.186 5.002 1.00 0.00 H new ATOM 0 HB3 TYR A 121 -5.984 -1.897 5.092 1.00 0.00 H new ATOM 0 HD1 TYR A 121 -6.736 -2.835 7.399 1.00 0.00 H new ATOM 0 HD2 TYR A 121 -3.406 -0.218 6.926 1.00 0.00 H new ATOM 0 HE1 TYR A 121 -6.866 -2.242 9.778 1.00 0.00 H new ATOM 0 HE2 TYR A 121 -3.534 0.375 9.306 1.00 0.00 H new ATOM 0 HH TYR A 121 -4.575 0.078 11.232 1.00 0.00 H new ATOM 865 N GLY A 122 -2.165 -2.870 4.390 1.00 0.00 N ATOM 866 CA GLY A 122 -0.718 -2.785 4.451 1.00 0.00 C ATOM 867 C GLY A 122 -0.183 -1.530 3.790 1.00 0.00 C ATOM 868 O GLY A 122 -0.936 -0.771 3.179 1.00 0.00 O ATOM 0 H GLY A 122 -2.572 -2.606 3.493 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -0.399 -2.807 5.493 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -0.285 -3.660 3.967 1.00 0.00 H new ATOM 872 N PHE A 123 1.122 -1.308 3.914 1.00 0.00 N ATOM 873 CA PHE A 123 1.757 -0.135 3.326 1.00 0.00 C ATOM 874 C PHE A 123 2.873 -0.542 2.369 1.00 0.00 C ATOM 875 O PHE A 123 3.624 -1.481 2.636 1.00 0.00 O ATOM 876 CB PHE A 123 2.317 0.772 4.424 1.00 0.00 C ATOM 877 CG PHE A 123 1.255 1.416 5.269 1.00 0.00 C ATOM 878 CD1 PHE A 123 0.481 2.448 4.765 1.00 0.00 C ATOM 879 CD2 PHE A 123 1.031 0.988 6.568 1.00 0.00 C ATOM 880 CE1 PHE A 123 -0.498 3.042 5.541 1.00 0.00 C ATOM 881 CE2 PHE A 123 0.054 1.578 7.348 1.00 0.00 C ATOM 882 CZ PHE A 123 -0.710 2.607 6.834 1.00 0.00 C ATOM 0 H PHE A 123 1.760 -1.925 4.416 1.00 0.00 H new ATOM 0 HA PHE A 123 1.001 0.412 2.762 1.00 0.00 H new ATOM 0 HB2 PHE A 123 2.976 0.188 5.066 1.00 0.00 H new ATOM 0 HB3 PHE A 123 2.927 1.550 3.965 1.00 0.00 H new ATOM 0 HD1 PHE A 123 0.644 2.793 3.755 1.00 0.00 H new ATOM 0 HD2 PHE A 123 1.626 0.184 6.976 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -1.096 3.845 5.136 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -0.112 1.234 8.358 1.00 0.00 H new ATOM 0 HZ PHE A 123 -1.472 3.071 7.443 1.00 0.00 H new ATOM 892 N VAL A 124 2.976 0.170 1.251 1.00 0.00 N ATOM 893 CA VAL A 124 4.001 -0.116 0.254 1.00 0.00 C ATOM 894 C VAL A 124 4.626 1.170 -0.276 1.00 0.00 C ATOM 895 O VAL A 124 3.950 1.990 -0.898 1.00 0.00 O ATOM 896 CB VAL A 124 3.425 -0.919 -0.927 1.00 0.00 C ATOM 897 CG1 VAL A 124 4.517 -1.244 -1.935 1.00 0.00 C ATOM 898 CG2 VAL A 124 2.752 -2.189 -0.430 1.00 0.00 C ATOM 0 H VAL A 124 2.362 0.949 1.013 1.00 0.00 H new ATOM 0 HA VAL A 124 4.768 -0.712 0.749 1.00 0.00 H new ATOM 0 HB VAL A 124 2.673 -0.308 -1.426 1.00 0.00 H new ATOM 0 HG11 VAL A 124 4.091 -1.812 -2.762 1.00 0.00 H new ATOM 0 HG12 VAL A 124 4.949 -0.318 -2.315 1.00 0.00 H new ATOM 0 HG13 VAL A 124 5.294 -1.835 -1.451 1.00 0.00 H new ATOM 0 HG21 VAL A 124 2.351 -2.744 -1.278 1.00 0.00 H new ATOM 0 HG22 VAL A 124 3.481 -2.806 0.095 1.00 0.00 H new ATOM 0 HG23 VAL A 124 1.941 -1.929 0.250 1.00 0.00 H new ATOM 908 N SER A 125 5.920 1.339 -0.026 1.00 0.00 N ATOM 909 CA SER A 125 6.636 2.527 -0.475 1.00 0.00 C ATOM 910 C SER A 125 7.522 2.206 -1.675 1.00 0.00 C ATOM 911 O SER A 125 8.052 1.100 -1.792 1.00 0.00 O ATOM 912 CB SER A 125 7.486 3.097 0.662 1.00 0.00 C ATOM 913 OG SER A 125 8.009 4.369 0.320 1.00 0.00 O ATOM 0 H SER A 125 6.494 0.668 0.485 1.00 0.00 H new ATOM 0 HA SER A 125 5.900 3.272 -0.777 1.00 0.00 H new ATOM 0 HB2 SER A 125 6.882 3.180 1.566 1.00 0.00 H new ATOM 0 HB3 SER A 125 8.304 2.413 0.887 1.00 0.00 H new ATOM 0 HG SER A 125 8.986 4.317 0.266 1.00 0.00 H new ATOM 919 N PHE A 126 7.679 3.180 -2.565 1.00 0.00 N ATOM 920 CA PHE A 126 8.500 3.002 -3.757 1.00 0.00 C ATOM 921 C PHE A 126 9.541 4.112 -3.871 1.00 0.00 C ATOM 922 O PHE A 126 9.319 5.236 -3.419 1.00 0.00 O ATOM 923 CB PHE A 126 7.621 2.981 -5.009 1.00 0.00 C ATOM 924 CG PHE A 126 6.496 1.988 -4.935 1.00 0.00 C ATOM 925 CD1 PHE A 126 5.512 2.107 -3.967 1.00 0.00 C ATOM 926 CD2 PHE A 126 6.423 0.937 -5.834 1.00 0.00 C ATOM 927 CE1 PHE A 126 4.477 1.194 -3.896 1.00 0.00 C ATOM 928 CE2 PHE A 126 5.390 0.021 -5.768 1.00 0.00 C ATOM 929 CZ PHE A 126 4.415 0.150 -4.799 1.00 0.00 C ATOM 0 H PHE A 126 7.248 4.101 -2.483 1.00 0.00 H new ATOM 0 HA PHE A 126 9.020 2.048 -3.671 1.00 0.00 H new ATOM 0 HB2 PHE A 126 7.207 3.976 -5.169 1.00 0.00 H new ATOM 0 HB3 PHE A 126 8.242 2.751 -5.875 1.00 0.00 H new ATOM 0 HD1 PHE A 126 5.554 2.922 -3.260 1.00 0.00 H new ATOM 0 HD2 PHE A 126 7.182 0.832 -6.595 1.00 0.00 H new ATOM 0 HE1 PHE A 126 3.717 1.296 -3.135 1.00 0.00 H new ATOM 0 HE2 PHE A 126 5.346 -0.795 -6.474 1.00 0.00 H new ATOM 0 HZ PHE A 126 3.606 -0.563 -4.747 1.00 0.00 H new ATOM 939 N PHE A 127 10.678 3.789 -4.478 1.00 0.00 N ATOM 940 CA PHE A 127 11.754 4.757 -4.651 1.00 0.00 C ATOM 941 C PHE A 127 11.261 5.992 -5.399 1.00 0.00 C ATOM 942 O PHE A 127 11.564 7.122 -5.021 1.00 0.00 O ATOM 943 CB PHE A 127 12.923 4.122 -5.408 1.00 0.00 C ATOM 944 CG PHE A 127 13.571 2.987 -4.668 1.00 0.00 C ATOM 945 CD1 PHE A 127 13.789 3.068 -3.302 1.00 0.00 C ATOM 946 CD2 PHE A 127 13.961 1.839 -5.338 1.00 0.00 C ATOM 947 CE1 PHE A 127 14.385 2.025 -2.618 1.00 0.00 C ATOM 948 CE2 PHE A 127 14.557 0.792 -4.659 1.00 0.00 C ATOM 949 CZ PHE A 127 14.768 0.885 -3.298 1.00 0.00 C ATOM 0 H PHE A 127 10.878 2.864 -4.858 1.00 0.00 H new ATOM 0 HA PHE A 127 12.094 5.065 -3.662 1.00 0.00 H new ATOM 0 HB2 PHE A 127 12.567 3.760 -6.373 1.00 0.00 H new ATOM 0 HB3 PHE A 127 13.672 4.887 -5.611 1.00 0.00 H new ATOM 0 HD1 PHE A 127 13.490 3.956 -2.765 1.00 0.00 H new ATOM 0 HD2 PHE A 127 13.798 1.761 -6.403 1.00 0.00 H new ATOM 0 HE1 PHE A 127 14.551 2.101 -1.554 1.00 0.00 H new ATOM 0 HE2 PHE A 127 14.857 -0.097 -5.193 1.00 0.00 H new ATOM 0 HZ PHE A 127 15.232 0.068 -2.766 1.00 0.00 H new ATOM 959 N ASN A 128 10.498 5.766 -6.464 1.00 0.00 N ATOM 960 CA ASN A 128 9.962 6.859 -7.267 1.00 0.00 C ATOM 961 C ASN A 128 8.444 6.934 -7.140 1.00 0.00 C ATOM 962 O ASN A 128 7.805 6.007 -6.642 1.00 0.00 O ATOM 963 CB ASN A 128 10.354 6.681 -8.735 1.00 0.00 C ATOM 964 CG ASN A 128 11.841 6.441 -8.911 1.00 0.00 C ATOM 965 OD1 ASN A 128 12.647 6.810 -8.056 1.00 0.00 O ATOM 966 ND2 ASN A 128 12.212 5.819 -10.025 1.00 0.00 N ATOM 0 H ASN A 128 10.237 4.836 -6.791 1.00 0.00 H new ATOM 0 HA ASN A 128 10.386 7.792 -6.895 1.00 0.00 H new ATOM 0 HB2 ASN A 128 9.801 5.842 -9.157 1.00 0.00 H new ATOM 0 HB3 ASN A 128 10.063 7.569 -9.296 1.00 0.00 H new ATOM 0 HD21 ASN A 128 13.199 5.630 -10.199 1.00 0.00 H new ATOM 0 HD22 ASN A 128 11.510 5.531 -10.706 1.00 0.00 H new ATOM 973 N LYS A 129 7.872 8.044 -7.594 1.00 0.00 N ATOM 974 CA LYS A 129 6.428 8.241 -7.535 1.00 0.00 C ATOM 975 C LYS A 129 5.713 7.335 -8.532 1.00 0.00 C ATOM 976 O LYS A 129 4.891 6.503 -8.150 1.00 0.00 O ATOM 977 CB LYS A 129 6.080 9.704 -7.818 1.00 0.00 C ATOM 978 CG LYS A 129 4.587 9.978 -7.851 1.00 0.00 C ATOM 979 CD LYS A 129 4.030 10.206 -6.455 1.00 0.00 C ATOM 980 CE LYS A 129 2.666 10.878 -6.502 1.00 0.00 C ATOM 981 NZ LYS A 129 2.186 11.252 -5.143 1.00 0.00 N ATOM 0 H LYS A 129 8.387 8.822 -8.007 1.00 0.00 H new ATOM 0 HA LYS A 129 6.092 7.982 -6.531 1.00 0.00 H new ATOM 0 HB2 LYS A 129 6.539 10.332 -7.055 1.00 0.00 H new ATOM 0 HB3 LYS A 129 6.515 9.994 -8.774 1.00 0.00 H new ATOM 0 HG2 LYS A 129 4.391 10.854 -8.469 1.00 0.00 H new ATOM 0 HG3 LYS A 129 4.072 9.137 -8.316 1.00 0.00 H new ATOM 0 HD2 LYS A 129 3.949 9.252 -5.934 1.00 0.00 H new ATOM 0 HD3 LYS A 129 4.722 10.824 -5.883 1.00 0.00 H new ATOM 0 HE2 LYS A 129 2.722 11.770 -7.126 1.00 0.00 H new ATOM 0 HE3 LYS A 129 1.946 10.206 -6.970 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 1.622 12.124 -5.202 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 1.598 10.485 -4.759 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 3.002 11.409 -4.518 1.00 0.00 H new ATOM 995 N TRP A 130 6.034 7.501 -9.810 1.00 0.00 N ATOM 996 CA TRP A 130 5.423 6.697 -10.862 1.00 0.00 C ATOM 997 C TRP A 130 5.292 5.241 -10.428 1.00 0.00 C ATOM 998 O TRP A 130 4.189 4.698 -10.370 1.00 0.00 O ATOM 999 CB TRP A 130 6.250 6.787 -12.146 1.00 0.00 C ATOM 1000 CG TRP A 130 7.160 7.977 -12.185 1.00 0.00 C ATOM 1001 CD1 TRP A 130 8.518 7.966 -12.328 1.00 0.00 C ATOM 1002 CD2 TRP A 130 6.777 9.353 -12.077 1.00 0.00 C ATOM 1003 NE1 TRP A 130 9.002 9.252 -12.315 1.00 0.00 N ATOM 1004 CE2 TRP A 130 7.954 10.121 -12.163 1.00 0.00 C ATOM 1005 CE3 TRP A 130 5.554 10.010 -11.918 1.00 0.00 C ATOM 1006 CZ2 TRP A 130 7.942 11.511 -12.095 1.00 0.00 C ATOM 1007 CZ3 TRP A 130 5.543 11.390 -11.849 1.00 0.00 C ATOM 1008 CH2 TRP A 130 6.731 12.129 -11.938 1.00 0.00 C ATOM 0 H TRP A 130 6.714 8.185 -10.143 1.00 0.00 H new ATOM 0 HA TRP A 130 4.425 7.091 -11.053 1.00 0.00 H new ATOM 0 HB2 TRP A 130 6.845 5.880 -12.250 1.00 0.00 H new ATOM 0 HB3 TRP A 130 5.576 6.826 -13.002 1.00 0.00 H new ATOM 0 HD1 TRP A 130 9.123 7.078 -12.435 1.00 0.00 H new ATOM 0 HE1 TRP A 130 9.983 9.517 -12.404 1.00 0.00 H new ATOM 0 HE3 TRP A 130 4.634 9.449 -11.850 1.00 0.00 H new ATOM 0 HZ2 TRP A 130 8.856 12.082 -12.164 1.00 0.00 H new ATOM 0 HZ3 TRP A 130 4.604 11.908 -11.724 1.00 0.00 H new ATOM 0 HH2 TRP A 130 6.690 13.207 -11.882 1.00 0.00 H new ATOM 1019 N ASP A 131 6.424 4.615 -10.124 1.00 0.00 N ATOM 1020 CA ASP A 131 6.435 3.222 -9.694 1.00 0.00 C ATOM 1021 C ASP A 131 5.210 2.907 -8.841 1.00 0.00 C ATOM 1022 O ASP A 131 4.625 1.830 -8.951 1.00 0.00 O ATOM 1023 CB ASP A 131 7.711 2.919 -8.907 1.00 0.00 C ATOM 1024 CG ASP A 131 8.922 2.762 -9.807 1.00 0.00 C ATOM 1025 OD1 ASP A 131 8.924 3.352 -10.908 1.00 0.00 O ATOM 1026 OD2 ASP A 131 9.867 2.050 -9.409 1.00 0.00 O ATOM 0 H ASP A 131 7.345 5.050 -10.167 1.00 0.00 H new ATOM 0 HA ASP A 131 6.408 2.593 -10.584 1.00 0.00 H new ATOM 0 HB2 ASP A 131 7.894 3.722 -8.193 1.00 0.00 H new ATOM 0 HB3 ASP A 131 7.570 2.005 -8.329 1.00 0.00 H new ATOM 1031 N ALA A 132 4.830 3.854 -7.989 1.00 0.00 N ATOM 1032 CA ALA A 132 3.674 3.677 -7.117 1.00 0.00 C ATOM 1033 C ALA A 132 2.375 3.950 -7.867 1.00 0.00 C ATOM 1034 O ALA A 132 1.505 3.084 -7.954 1.00 0.00 O ATOM 1035 CB ALA A 132 3.786 4.587 -5.903 1.00 0.00 C ATOM 0 H ALA A 132 5.305 4.751 -7.884 1.00 0.00 H new ATOM 0 HA ALA A 132 3.658 2.640 -6.780 1.00 0.00 H new ATOM 0 HB1 ALA A 132 2.917 4.445 -5.260 1.00 0.00 H new ATOM 0 HB2 ALA A 132 4.692 4.343 -5.348 1.00 0.00 H new ATOM 0 HB3 ALA A 132 3.830 5.626 -6.230 1.00 0.00 H new ATOM 1041 N GLU A 133 2.250 5.159 -8.406 1.00 0.00 N ATOM 1042 CA GLU A 133 1.055 5.544 -9.147 1.00 0.00 C ATOM 1043 C GLU A 133 0.623 4.434 -10.100 1.00 0.00 C ATOM 1044 O GLU A 133 -0.513 3.965 -10.050 1.00 0.00 O ATOM 1045 CB GLU A 133 1.307 6.834 -9.930 1.00 0.00 C ATOM 1046 CG GLU A 133 1.007 8.096 -9.138 1.00 0.00 C ATOM 1047 CD GLU A 133 0.673 9.278 -10.027 1.00 0.00 C ATOM 1048 OE1 GLU A 133 1.052 9.252 -11.217 1.00 0.00 O ATOM 1049 OE2 GLU A 133 0.032 10.229 -9.533 1.00 0.00 O ATOM 0 H GLU A 133 2.961 5.888 -8.343 1.00 0.00 H new ATOM 0 HA GLU A 133 0.253 5.714 -8.429 1.00 0.00 H new ATOM 0 HB2 GLU A 133 2.348 6.856 -10.252 1.00 0.00 H new ATOM 0 HB3 GLU A 133 0.695 6.827 -10.832 1.00 0.00 H new ATOM 0 HG2 GLU A 133 0.172 7.907 -8.463 1.00 0.00 H new ATOM 0 HG3 GLU A 133 1.868 8.345 -8.518 1.00 0.00 H new ATOM 1056 N ASN A 134 1.540 4.019 -10.969 1.00 0.00 N ATOM 1057 CA ASN A 134 1.255 2.964 -11.935 1.00 0.00 C ATOM 1058 C ASN A 134 0.479 1.824 -11.283 1.00 0.00 C ATOM 1059 O ASN A 134 -0.464 1.289 -11.865 1.00 0.00 O ATOM 1060 CB ASN A 134 2.556 2.431 -12.538 1.00 0.00 C ATOM 1061 CG ASN A 134 2.332 1.713 -13.855 1.00 0.00 C ATOM 1062 OD1 ASN A 134 1.509 2.131 -14.670 1.00 0.00 O ATOM 1063 ND2 ASN A 134 3.065 0.627 -14.069 1.00 0.00 N ATOM 0 H ASN A 134 2.486 4.397 -11.024 1.00 0.00 H new ATOM 0 HA ASN A 134 0.642 3.389 -12.729 1.00 0.00 H new ATOM 0 HB2 ASN A 134 3.248 3.259 -12.692 1.00 0.00 H new ATOM 0 HB3 ASN A 134 3.028 1.749 -11.831 1.00 0.00 H new ATOM 0 HD21 ASN A 134 2.958 0.102 -14.937 1.00 0.00 H new ATOM 0 HD22 ASN A 134 3.735 0.317 -13.365 1.00 0.00 H new ATOM 1070 N ALA A 135 0.882 1.459 -10.070 1.00 0.00 N ATOM 1071 CA ALA A 135 0.223 0.384 -9.338 1.00 0.00 C ATOM 1072 C ALA A 135 -1.155 0.818 -8.850 1.00 0.00 C ATOM 1073 O ALA A 135 -2.160 0.171 -9.145 1.00 0.00 O ATOM 1074 CB ALA A 135 1.085 -0.060 -8.165 1.00 0.00 C ATOM 0 H ALA A 135 1.661 1.892 -9.574 1.00 0.00 H new ATOM 0 HA ALA A 135 0.091 -0.458 -10.017 1.00 0.00 H new ATOM 0 HB1 ALA A 135 0.581 -0.863 -7.627 1.00 0.00 H new ATOM 0 HB2 ALA A 135 2.046 -0.418 -8.535 1.00 0.00 H new ATOM 0 HB3 ALA A 135 1.246 0.782 -7.492 1.00 0.00 H new ATOM 1080 N ILE A 136 -1.194 1.914 -8.101 1.00 0.00 N ATOM 1081 CA ILE A 136 -2.450 2.433 -7.572 1.00 0.00 C ATOM 1082 C ILE A 136 -3.575 2.293 -8.592 1.00 0.00 C ATOM 1083 O ILE A 136 -4.720 2.022 -8.233 1.00 0.00 O ATOM 1084 CB ILE A 136 -2.321 3.913 -7.167 1.00 0.00 C ATOM 1085 CG1 ILE A 136 -1.335 4.063 -6.006 1.00 0.00 C ATOM 1086 CG2 ILE A 136 -3.682 4.480 -6.789 1.00 0.00 C ATOM 1087 CD1 ILE A 136 -1.103 5.499 -5.592 1.00 0.00 C ATOM 0 H ILE A 136 -0.371 2.460 -7.846 1.00 0.00 H new ATOM 0 HA ILE A 136 -2.689 1.842 -6.688 1.00 0.00 H new ATOM 0 HB ILE A 136 -1.939 4.475 -8.019 1.00 0.00 H new ATOM 0 HG12 ILE A 136 -1.707 3.502 -5.149 1.00 0.00 H new ATOM 0 HG13 ILE A 136 -0.382 3.617 -6.289 1.00 0.00 H new ATOM 0 HG21 ILE A 136 -3.574 5.527 -6.505 1.00 0.00 H new ATOM 0 HG22 ILE A 136 -4.358 4.403 -7.641 1.00 0.00 H new ATOM 0 HG23 ILE A 136 -4.090 3.917 -5.950 1.00 0.00 H new ATOM 0 HD11 ILE A 136 -0.394 5.529 -4.765 1.00 0.00 H new ATOM 0 HD12 ILE A 136 -0.701 6.060 -6.435 1.00 0.00 H new ATOM 0 HD13 ILE A 136 -2.047 5.944 -5.277 1.00 0.00 H new ATOM 1099 N GLN A 137 -3.239 2.479 -9.865 1.00 0.00 N ATOM 1100 CA GLN A 137 -4.222 2.372 -10.937 1.00 0.00 C ATOM 1101 C GLN A 137 -4.414 0.918 -11.356 1.00 0.00 C ATOM 1102 O GLN A 137 -5.527 0.394 -11.317 1.00 0.00 O ATOM 1103 CB GLN A 137 -3.787 3.209 -12.141 1.00 0.00 C ATOM 1104 CG GLN A 137 -3.280 4.593 -11.768 1.00 0.00 C ATOM 1105 CD GLN A 137 -2.413 5.207 -12.850 1.00 0.00 C ATOM 1106 OE1 GLN A 137 -1.419 4.456 -13.310 1.00 0.00 O flip ATOM 1107 NE2 GLN A 137 -2.634 6.344 -13.267 1.00 0.00 N flip ATOM 0 H GLN A 137 -2.295 2.704 -10.179 1.00 0.00 H new ATOM 0 HA GLN A 137 -5.173 2.752 -10.564 1.00 0.00 H new ATOM 0 HB2 GLN A 137 -3.003 2.677 -12.679 1.00 0.00 H new ATOM 0 HB3 GLN A 137 -4.629 3.312 -12.825 1.00 0.00 H new ATOM 0 HG2 GLN A 137 -4.130 5.247 -11.574 1.00 0.00 H new ATOM 0 HG3 GLN A 137 -2.709 4.529 -10.842 1.00 0.00 H new ATOM 0 HE21 GLN A 137 -3.409 6.886 -12.885 1.00 0.00 H new ATOM 0 HE22 GLN A 137 -2.042 6.744 -13.995 1.00 0.00 H new ATOM 1116 N GLN A 138 -3.323 0.273 -11.756 1.00 0.00 N ATOM 1117 CA GLN A 138 -3.373 -1.120 -12.184 1.00 0.00 C ATOM 1118 C GLN A 138 -3.679 -2.040 -11.007 1.00 0.00 C ATOM 1119 O GLN A 138 -4.691 -2.739 -11.000 1.00 0.00 O ATOM 1120 CB GLN A 138 -2.048 -1.524 -12.832 1.00 0.00 C ATOM 1121 CG GLN A 138 -1.581 -0.564 -13.913 1.00 0.00 C ATOM 1122 CD GLN A 138 -2.208 -0.855 -15.263 1.00 0.00 C ATOM 1123 OE1 GLN A 138 -3.313 -1.393 -15.344 1.00 0.00 O ATOM 1124 NE2 GLN A 138 -1.504 -0.500 -16.332 1.00 0.00 N ATOM 0 H GLN A 138 -2.394 0.693 -11.793 1.00 0.00 H new ATOM 0 HA GLN A 138 -4.173 -1.220 -12.917 1.00 0.00 H new ATOM 0 HB2 GLN A 138 -1.281 -1.590 -12.060 1.00 0.00 H new ATOM 0 HB3 GLN A 138 -2.153 -2.520 -13.263 1.00 0.00 H new ATOM 0 HG2 GLN A 138 -1.823 0.457 -13.617 1.00 0.00 H new ATOM 0 HG3 GLN A 138 -0.496 -0.621 -14.001 1.00 0.00 H new ATOM 0 HE21 GLN A 138 -0.592 -0.057 -16.218 1.00 0.00 H new ATOM 0 HE22 GLN A 138 -1.875 -0.671 -17.267 1.00 0.00 H new ATOM 1133 N MET A 139 -2.797 -2.034 -10.012 1.00 0.00 N ATOM 1134 CA MET A 139 -2.974 -2.867 -8.829 1.00 0.00 C ATOM 1135 C MET A 139 -4.349 -2.644 -8.207 1.00 0.00 C ATOM 1136 O MET A 139 -4.931 -3.555 -7.620 1.00 0.00 O ATOM 1137 CB MET A 139 -1.881 -2.570 -7.801 1.00 0.00 C ATOM 1138 CG MET A 139 -0.492 -2.994 -8.250 1.00 0.00 C ATOM 1139 SD MET A 139 -0.390 -4.755 -8.622 1.00 0.00 S ATOM 1140 CE MET A 139 -1.417 -5.436 -7.322 1.00 0.00 C ATOM 0 H MET A 139 -1.953 -1.461 -10.002 1.00 0.00 H new ATOM 0 HA MET A 139 -2.899 -3.910 -9.136 1.00 0.00 H new ATOM 0 HB2 MET A 139 -1.874 -1.501 -7.589 1.00 0.00 H new ATOM 0 HB3 MET A 139 -2.123 -3.079 -6.868 1.00 0.00 H new ATOM 0 HG2 MET A 139 -0.210 -2.423 -9.135 1.00 0.00 H new ATOM 0 HG3 MET A 139 0.228 -2.749 -7.470 1.00 0.00 H new ATOM 0 HE1 MET A 139 -1.299 -6.519 -7.295 1.00 0.00 H new ATOM 0 HE2 MET A 139 -1.117 -5.014 -6.363 1.00 0.00 H new ATOM 0 HE3 MET A 139 -2.461 -5.190 -7.516 1.00 0.00 H new ATOM 1150 N GLY A 140 -4.862 -1.424 -8.340 1.00 0.00 N ATOM 1151 CA GLY A 140 -6.164 -1.103 -7.785 1.00 0.00 C ATOM 1152 C GLY A 140 -7.279 -1.913 -8.416 1.00 0.00 C ATOM 1153 O GLY A 140 -7.647 -1.684 -9.568 1.00 0.00 O ATOM 0 H GLY A 140 -4.399 -0.653 -8.822 1.00 0.00 H new ATOM 0 HA2 GLY A 140 -6.152 -1.283 -6.710 1.00 0.00 H new ATOM 0 HA3 GLY A 140 -6.365 -0.041 -7.928 1.00 0.00 H new ATOM 1157 N GLY A 141 -7.818 -2.865 -7.660 1.00 0.00 N ATOM 1158 CA GLY A 141 -8.891 -3.699 -8.171 1.00 0.00 C ATOM 1159 C GLY A 141 -8.399 -5.054 -8.640 1.00 0.00 C ATOM 1160 O GLY A 141 -9.120 -5.778 -9.326 1.00 0.00 O ATOM 0 H GLY A 141 -7.531 -3.074 -6.704 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -9.641 -3.838 -7.393 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -9.382 -3.188 -8.999 1.00 0.00 H new ATOM 1164 N GLN A 142 -7.169 -5.395 -8.271 1.00 0.00 N ATOM 1165 CA GLN A 142 -6.582 -6.671 -8.662 1.00 0.00 C ATOM 1166 C GLN A 142 -6.819 -7.730 -7.590 1.00 0.00 C ATOM 1167 O GLN A 142 -7.217 -7.414 -6.469 1.00 0.00 O ATOM 1168 CB GLN A 142 -5.081 -6.511 -8.914 1.00 0.00 C ATOM 1169 CG GLN A 142 -4.757 -5.747 -10.187 1.00 0.00 C ATOM 1170 CD GLN A 142 -4.951 -6.585 -11.436 1.00 0.00 C ATOM 1171 OE1 GLN A 142 -4.795 -7.806 -11.408 1.00 0.00 O ATOM 1172 NE2 GLN A 142 -5.294 -5.932 -12.540 1.00 0.00 N ATOM 0 H GLN A 142 -6.560 -4.806 -7.703 1.00 0.00 H new ATOM 0 HA GLN A 142 -7.065 -6.997 -9.583 1.00 0.00 H new ATOM 0 HB2 GLN A 142 -4.631 -5.995 -8.066 1.00 0.00 H new ATOM 0 HB3 GLN A 142 -4.622 -7.498 -8.966 1.00 0.00 H new ATOM 0 HG2 GLN A 142 -5.390 -4.862 -10.246 1.00 0.00 H new ATOM 0 HG3 GLN A 142 -3.725 -5.399 -10.144 1.00 0.00 H new ATOM 0 HE21 GLN A 142 -5.413 -4.919 -12.517 1.00 0.00 H new ATOM 0 HE22 GLN A 142 -5.439 -6.443 -13.411 1.00 0.00 H new ATOM 1181 N TRP A 143 -6.573 -8.987 -7.943 1.00 0.00 N ATOM 1182 CA TRP A 143 -6.761 -10.093 -7.011 1.00 0.00 C ATOM 1183 C TRP A 143 -5.423 -10.573 -6.460 1.00 0.00 C ATOM 1184 O TRP A 143 -4.644 -11.215 -7.166 1.00 0.00 O ATOM 1185 CB TRP A 143 -7.487 -11.249 -7.699 1.00 0.00 C ATOM 1186 CG TRP A 143 -8.976 -11.077 -7.737 1.00 0.00 C ATOM 1187 CD1 TRP A 143 -9.673 -10.114 -8.409 1.00 0.00 C ATOM 1188 CD2 TRP A 143 -9.949 -11.891 -7.073 1.00 0.00 C ATOM 1189 NE1 TRP A 143 -11.021 -10.279 -8.202 1.00 0.00 N ATOM 1190 CE2 TRP A 143 -11.217 -11.363 -7.387 1.00 0.00 C ATOM 1191 CE3 TRP A 143 -9.874 -13.014 -6.245 1.00 0.00 C ATOM 1192 CZ2 TRP A 143 -12.396 -11.921 -6.901 1.00 0.00 C ATOM 1193 CZ3 TRP A 143 -11.045 -13.566 -5.763 1.00 0.00 C ATOM 1194 CH2 TRP A 143 -12.293 -13.020 -6.093 1.00 0.00 C ATOM 0 H TRP A 143 -6.243 -9.265 -8.867 1.00 0.00 H new ATOM 0 HA TRP A 143 -7.368 -9.736 -6.180 1.00 0.00 H new ATOM 0 HB2 TRP A 143 -7.114 -11.348 -8.718 1.00 0.00 H new ATOM 0 HB3 TRP A 143 -7.249 -12.178 -7.181 1.00 0.00 H new ATOM 0 HD1 TRP A 143 -9.230 -9.337 -9.014 1.00 0.00 H new ATOM 0 HE1 TRP A 143 -11.757 -9.690 -8.592 1.00 0.00 H new ATOM 0 HE3 TRP A 143 -8.917 -13.443 -5.986 1.00 0.00 H new ATOM 0 HZ2 TRP A 143 -13.359 -11.501 -7.153 1.00 0.00 H new ATOM 0 HZ3 TRP A 143 -10.998 -14.433 -5.121 1.00 0.00 H new ATOM 0 HH2 TRP A 143 -13.191 -13.476 -5.702 1.00 0.00 H new ATOM 1205 N LEU A 144 -5.162 -10.259 -5.196 1.00 0.00 N ATOM 1206 CA LEU A 144 -3.916 -10.659 -4.549 1.00 0.00 C ATOM 1207 C LEU A 144 -4.128 -11.893 -3.677 1.00 0.00 C ATOM 1208 O LEU A 144 -5.004 -11.912 -2.813 1.00 0.00 O ATOM 1209 CB LEU A 144 -3.366 -9.510 -3.703 1.00 0.00 C ATOM 1210 CG LEU A 144 -2.060 -9.791 -2.959 1.00 0.00 C ATOM 1211 CD1 LEU A 144 -0.941 -10.099 -3.941 1.00 0.00 C ATOM 1212 CD2 LEU A 144 -1.686 -8.610 -2.074 1.00 0.00 C ATOM 0 H LEU A 144 -5.796 -9.729 -4.598 1.00 0.00 H new ATOM 0 HA LEU A 144 -3.194 -10.906 -5.327 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -3.213 -8.648 -4.352 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -4.124 -9.228 -2.972 1.00 0.00 H new ATOM 0 HG LEU A 144 -2.207 -10.664 -2.323 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -0.020 -10.296 -3.393 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -1.206 -10.976 -4.532 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -0.793 -9.246 -4.604 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -0.754 -8.827 -1.552 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -1.558 -7.720 -2.690 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -2.478 -8.436 -1.345 1.00 0.00 H new ATOM 1224 N GLY A 145 -3.317 -12.921 -3.908 1.00 0.00 N ATOM 1225 CA GLY A 145 -3.430 -14.143 -3.134 1.00 0.00 C ATOM 1226 C GLY A 145 -4.690 -14.921 -3.459 1.00 0.00 C ATOM 1227 O GLY A 145 -4.643 -15.924 -4.169 1.00 0.00 O ATOM 0 H GLY A 145 -2.584 -12.929 -4.617 1.00 0.00 H new ATOM 0 HA2 GLY A 145 -2.560 -14.771 -3.324 1.00 0.00 H new ATOM 0 HA3 GLY A 145 -3.421 -13.899 -2.072 1.00 0.00 H new ATOM 1231 N GLY A 146 -5.821 -14.457 -2.935 1.00 0.00 N ATOM 1232 CA GLY A 146 -7.083 -15.129 -3.182 1.00 0.00 C ATOM 1233 C GLY A 146 -8.273 -14.203 -3.028 1.00 0.00 C ATOM 1234 O GLY A 146 -9.414 -14.657 -2.938 1.00 0.00 O ATOM 0 H GLY A 146 -5.885 -13.628 -2.344 1.00 0.00 H new ATOM 0 HA2 GLY A 146 -7.078 -15.545 -4.189 1.00 0.00 H new ATOM 0 HA3 GLY A 146 -7.186 -15.966 -2.492 1.00 0.00 H new ATOM 1238 N ARG A 147 -8.007 -12.901 -2.996 1.00 0.00 N ATOM 1239 CA ARG A 147 -9.065 -11.909 -2.848 1.00 0.00 C ATOM 1240 C ARG A 147 -8.657 -10.581 -3.479 1.00 0.00 C ATOM 1241 O ARG A 147 -7.470 -10.298 -3.639 1.00 0.00 O ATOM 1242 CB ARG A 147 -9.397 -11.702 -1.369 1.00 0.00 C ATOM 1243 CG ARG A 147 -10.466 -12.649 -0.847 1.00 0.00 C ATOM 1244 CD ARG A 147 -10.687 -12.470 0.647 1.00 0.00 C ATOM 1245 NE ARG A 147 -11.269 -11.168 0.962 1.00 0.00 N ATOM 1246 CZ ARG A 147 -11.801 -10.867 2.142 1.00 0.00 C ATOM 1247 NH1 ARG A 147 -11.823 -11.770 3.112 1.00 0.00 N ATOM 1248 NH2 ARG A 147 -12.311 -9.660 2.352 1.00 0.00 N ATOM 0 H ARG A 147 -7.068 -12.509 -3.071 1.00 0.00 H new ATOM 0 HA ARG A 147 -9.951 -12.280 -3.364 1.00 0.00 H new ATOM 0 HB2 ARG A 147 -8.489 -11.832 -0.780 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -9.729 -10.675 -1.220 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -11.401 -12.472 -1.378 1.00 0.00 H new ATOM 0 HG3 ARG A 147 -10.173 -13.679 -1.052 1.00 0.00 H new ATOM 0 HD2 ARG A 147 -11.344 -13.259 1.013 1.00 0.00 H new ATOM 0 HD3 ARG A 147 -9.737 -12.578 1.170 1.00 0.00 H new ATOM 0 HE ARG A 147 -11.267 -10.451 0.237 1.00 0.00 H new ATOM 0 HH11 ARG A 147 -11.431 -12.698 2.954 1.00 0.00 H new ATOM 0 HH12 ARG A 147 -12.232 -11.537 4.017 1.00 0.00 H new ATOM 0 HH21 ARG A 147 -12.295 -8.963 1.608 1.00 0.00 H new ATOM 0 HH22 ARG A 147 -12.719 -9.429 3.258 1.00 0.00 H new ATOM 1262 N GLN A 148 -9.649 -9.771 -3.835 1.00 0.00 N ATOM 1263 CA GLN A 148 -9.392 -8.474 -4.449 1.00 0.00 C ATOM 1264 C GLN A 148 -8.614 -7.567 -3.501 1.00 0.00 C ATOM 1265 O GLN A 148 -8.488 -7.859 -2.312 1.00 0.00 O ATOM 1266 CB GLN A 148 -10.709 -7.805 -4.848 1.00 0.00 C ATOM 1267 CG GLN A 148 -11.176 -8.168 -6.248 1.00 0.00 C ATOM 1268 CD GLN A 148 -12.258 -7.239 -6.761 1.00 0.00 C ATOM 1269 OE1 GLN A 148 -13.370 -7.211 -6.233 1.00 0.00 O ATOM 1270 NE2 GLN A 148 -11.939 -6.473 -7.798 1.00 0.00 N ATOM 0 H GLN A 148 -10.637 -9.990 -3.709 1.00 0.00 H new ATOM 0 HA GLN A 148 -8.790 -8.637 -5.343 1.00 0.00 H new ATOM 0 HB2 GLN A 148 -11.481 -8.086 -4.132 1.00 0.00 H new ATOM 0 HB3 GLN A 148 -10.592 -6.723 -4.782 1.00 0.00 H new ATOM 0 HG2 GLN A 148 -10.326 -8.140 -6.929 1.00 0.00 H new ATOM 0 HG3 GLN A 148 -11.551 -9.191 -6.248 1.00 0.00 H new ATOM 0 HE21 GLN A 148 -11.005 -6.528 -8.205 1.00 0.00 H new ATOM 0 HE22 GLN A 148 -12.628 -5.829 -8.188 1.00 0.00 H new ATOM 1279 N ILE A 149 -8.095 -6.467 -4.036 1.00 0.00 N ATOM 1280 CA ILE A 149 -7.330 -5.518 -3.237 1.00 0.00 C ATOM 1281 C ILE A 149 -7.680 -4.080 -3.606 1.00 0.00 C ATOM 1282 O ILE A 149 -8.094 -3.801 -4.732 1.00 0.00 O ATOM 1283 CB ILE A 149 -5.814 -5.726 -3.413 1.00 0.00 C ATOM 1284 CG1 ILE A 149 -5.386 -5.344 -4.831 1.00 0.00 C ATOM 1285 CG2 ILE A 149 -5.440 -7.170 -3.112 1.00 0.00 C ATOM 1286 CD1 ILE A 149 -3.891 -5.167 -4.983 1.00 0.00 C ATOM 0 H ILE A 149 -8.190 -6.211 -5.019 1.00 0.00 H new ATOM 0 HA ILE A 149 -7.595 -5.698 -2.195 1.00 0.00 H new ATOM 0 HB ILE A 149 -5.289 -5.080 -2.709 1.00 0.00 H new ATOM 0 HG12 ILE A 149 -5.725 -6.114 -5.524 1.00 0.00 H new ATOM 0 HG13 ILE A 149 -5.884 -4.417 -5.115 1.00 0.00 H new ATOM 0 HG21 ILE A 149 -4.366 -7.302 -3.241 1.00 0.00 H new ATOM 0 HG22 ILE A 149 -5.715 -7.411 -2.085 1.00 0.00 H new ATOM 0 HG23 ILE A 149 -5.971 -7.833 -3.795 1.00 0.00 H new ATOM 0 HD11 ILE A 149 -3.659 -4.897 -6.013 1.00 0.00 H new ATOM 0 HD12 ILE A 149 -3.548 -4.377 -4.315 1.00 0.00 H new ATOM 0 HD13 ILE A 149 -3.387 -6.100 -4.730 1.00 0.00 H new ATOM 1298 N ARG A 150 -7.510 -3.171 -2.652 1.00 0.00 N ATOM 1299 CA ARG A 150 -7.807 -1.762 -2.877 1.00 0.00 C ATOM 1300 C ARG A 150 -6.555 -0.907 -2.702 1.00 0.00 C ATOM 1301 O ARG A 150 -5.985 -0.836 -1.612 1.00 0.00 O ATOM 1302 CB ARG A 150 -8.899 -1.289 -1.916 1.00 0.00 C ATOM 1303 CG ARG A 150 -8.367 -0.832 -0.567 1.00 0.00 C ATOM 1304 CD ARG A 150 -9.493 -0.610 0.430 1.00 0.00 C ATOM 1305 NE ARG A 150 -10.052 0.736 0.333 1.00 0.00 N ATOM 1306 CZ ARG A 150 -11.023 1.187 1.119 1.00 0.00 C ATOM 1307 NH1 ARG A 150 -11.541 0.403 2.054 1.00 0.00 N ATOM 1308 NH2 ARG A 150 -11.478 2.425 0.970 1.00 0.00 N ATOM 0 H ARG A 150 -7.168 -3.385 -1.715 1.00 0.00 H new ATOM 0 HA ARG A 150 -8.161 -1.651 -3.902 1.00 0.00 H new ATOM 0 HB2 ARG A 150 -9.447 -0.468 -2.378 1.00 0.00 H new ATOM 0 HB3 ARG A 150 -9.611 -2.100 -1.761 1.00 0.00 H new ATOM 0 HG2 ARG A 150 -7.675 -1.578 -0.176 1.00 0.00 H new ATOM 0 HG3 ARG A 150 -7.802 0.092 -0.691 1.00 0.00 H new ATOM 0 HD2 ARG A 150 -10.281 -1.343 0.256 1.00 0.00 H new ATOM 0 HD3 ARG A 150 -9.120 -0.776 1.441 1.00 0.00 H new ATOM 0 HE ARG A 150 -9.676 1.364 -0.377 1.00 0.00 H new ATOM 0 HH11 ARG A 150 -11.194 -0.549 2.171 1.00 0.00 H new ATOM 0 HH12 ARG A 150 -12.287 0.752 2.656 1.00 0.00 H new ATOM 0 HH21 ARG A 150 -11.082 3.031 0.251 1.00 0.00 H new ATOM 0 HH22 ARG A 150 -12.224 2.770 1.574 1.00 0.00 H new ATOM 1322 N THR A 151 -6.131 -0.260 -3.783 1.00 0.00 N ATOM 1323 CA THR A 151 -4.946 0.588 -3.750 1.00 0.00 C ATOM 1324 C THR A 151 -5.324 2.064 -3.818 1.00 0.00 C ATOM 1325 O THR A 151 -6.171 2.460 -4.617 1.00 0.00 O ATOM 1326 CB THR A 151 -3.988 0.261 -4.911 1.00 0.00 C ATOM 1327 OG1 THR A 151 -4.677 0.375 -6.161 1.00 0.00 O ATOM 1328 CG2 THR A 151 -3.420 -1.143 -4.765 1.00 0.00 C ATOM 0 H THR A 151 -6.591 -0.307 -4.692 1.00 0.00 H new ATOM 0 HA THR A 151 -4.441 0.388 -2.805 1.00 0.00 H new ATOM 0 HB THR A 151 -3.164 0.974 -4.885 1.00 0.00 H new ATOM 0 HG1 THR A 151 -4.678 1.311 -6.450 1.00 0.00 H new ATOM 0 HG21 THR A 151 -2.746 -1.351 -5.596 1.00 0.00 H new ATOM 0 HG22 THR A 151 -2.872 -1.218 -3.826 1.00 0.00 H new ATOM 0 HG23 THR A 151 -4.235 -1.867 -4.768 1.00 0.00 H new ATOM 1336 N ASN A 152 -4.689 2.872 -2.975 1.00 0.00 N ATOM 1337 CA ASN A 152 -4.959 4.305 -2.941 1.00 0.00 C ATOM 1338 C ASN A 152 -3.809 5.059 -2.280 1.00 0.00 C ATOM 1339 O ASN A 152 -2.900 4.453 -1.714 1.00 0.00 O ATOM 1340 CB ASN A 152 -6.263 4.581 -2.190 1.00 0.00 C ATOM 1341 CG ASN A 152 -6.883 5.910 -2.577 1.00 0.00 C ATOM 1342 OD1 ASN A 152 -7.113 6.181 -3.756 1.00 0.00 O ATOM 1343 ND2 ASN A 152 -7.155 6.747 -1.583 1.00 0.00 N ATOM 0 H ASN A 152 -3.985 2.559 -2.307 1.00 0.00 H new ATOM 0 HA ASN A 152 -5.058 4.656 -3.968 1.00 0.00 H new ATOM 0 HB2 ASN A 152 -6.973 3.779 -2.393 1.00 0.00 H new ATOM 0 HB3 ASN A 152 -6.070 4.572 -1.117 1.00 0.00 H new ATOM 0 HD21 ASN A 152 -7.572 7.657 -1.782 1.00 0.00 H new ATOM 0 HD22 ASN A 152 -6.947 6.480 -0.621 1.00 0.00 H new ATOM 1350 N TRP A 153 -3.858 6.384 -2.356 1.00 0.00 N ATOM 1351 CA TRP A 153 -2.821 7.222 -1.764 1.00 0.00 C ATOM 1352 C TRP A 153 -2.838 7.117 -0.243 1.00 0.00 C ATOM 1353 O TRP A 153 -3.852 7.394 0.396 1.00 0.00 O ATOM 1354 CB TRP A 153 -3.009 8.679 -2.189 1.00 0.00 C ATOM 1355 CG TRP A 153 -2.464 8.974 -3.554 1.00 0.00 C ATOM 1356 CD1 TRP A 153 -3.133 9.547 -4.597 1.00 0.00 C ATOM 1357 CD2 TRP A 153 -1.137 8.710 -4.022 1.00 0.00 C ATOM 1358 NE1 TRP A 153 -2.302 9.655 -5.687 1.00 0.00 N ATOM 1359 CE2 TRP A 153 -1.072 9.149 -5.359 1.00 0.00 C ATOM 1360 CE3 TRP A 153 0.003 8.148 -3.442 1.00 0.00 C ATOM 1361 CZ2 TRP A 153 0.088 9.041 -6.122 1.00 0.00 C ATOM 1362 CZ3 TRP A 153 1.153 8.041 -4.201 1.00 0.00 C ATOM 1363 CH2 TRP A 153 1.189 8.486 -5.529 1.00 0.00 C ATOM 0 H TRP A 153 -4.604 6.901 -2.821 1.00 0.00 H new ATOM 0 HA TRP A 153 -1.855 6.868 -2.123 1.00 0.00 H new ATOM 0 HB2 TRP A 153 -4.071 8.922 -2.169 1.00 0.00 H new ATOM 0 HB3 TRP A 153 -2.520 9.328 -1.462 1.00 0.00 H new ATOM 0 HD1 TRP A 153 -4.164 9.868 -4.570 1.00 0.00 H new ATOM 0 HE1 TRP A 153 -2.559 10.048 -6.592 1.00 0.00 H new ATOM 0 HE3 TRP A 153 -0.014 7.803 -2.419 1.00 0.00 H new ATOM 0 HZ2 TRP A 153 0.117 9.383 -7.146 1.00 0.00 H new ATOM 0 HZ3 TRP A 153 2.039 7.607 -3.763 1.00 0.00 H new ATOM 0 HH2 TRP A 153 2.103 8.389 -6.095 1.00 0.00 H new ATOM 1374 N ALA A 154 -1.709 6.715 0.331 1.00 0.00 N ATOM 1375 CA ALA A 154 -1.594 6.576 1.778 1.00 0.00 C ATOM 1376 C ALA A 154 -1.410 7.934 2.447 1.00 0.00 C ATOM 1377 O ALA A 154 -2.185 8.317 3.323 1.00 0.00 O ATOM 1378 CB ALA A 154 -0.439 5.651 2.129 1.00 0.00 C ATOM 0 H ALA A 154 -0.861 6.480 -0.184 1.00 0.00 H new ATOM 0 HA ALA A 154 -2.520 6.139 2.151 1.00 0.00 H new ATOM 0 HB1 ALA A 154 -0.365 5.556 3.212 1.00 0.00 H new ATOM 0 HB2 ALA A 154 -0.613 4.669 1.690 1.00 0.00 H new ATOM 0 HB3 ALA A 154 0.490 6.064 1.736 1.00 0.00 H new ATOM 1384 N THR A 155 -0.377 8.659 2.028 1.00 0.00 N ATOM 1385 CA THR A 155 -0.090 9.974 2.588 1.00 0.00 C ATOM 1386 C THR A 155 -1.086 11.014 2.089 1.00 0.00 C ATOM 1387 O THR A 155 -1.620 10.897 0.985 1.00 0.00 O ATOM 1388 CB THR A 155 1.337 10.435 2.235 1.00 0.00 C ATOM 1389 OG1 THR A 155 1.594 11.719 2.814 1.00 0.00 O ATOM 1390 CG2 THR A 155 1.525 10.507 0.727 1.00 0.00 C ATOM 0 H THR A 155 0.274 8.358 1.303 1.00 0.00 H new ATOM 0 HA THR A 155 -0.177 9.882 3.671 1.00 0.00 H new ATOM 0 HB THR A 155 2.041 9.707 2.639 1.00 0.00 H new ATOM 0 HG1 THR A 155 2.504 12.004 2.587 1.00 0.00 H new ATOM 0 HG21 THR A 155 2.540 10.835 0.502 1.00 0.00 H new ATOM 0 HG22 THR A 155 1.357 9.522 0.292 1.00 0.00 H new ATOM 0 HG23 THR A 155 0.813 11.216 0.305 1.00 0.00 H new ATOM 1398 N ARG A 156 -1.332 12.032 2.907 1.00 0.00 N ATOM 1399 CA ARG A 156 -2.265 13.093 2.548 1.00 0.00 C ATOM 1400 C ARG A 156 -2.157 14.264 3.520 1.00 0.00 C ATOM 1401 O ARG A 156 -1.779 14.090 4.679 1.00 0.00 O ATOM 1402 CB ARG A 156 -3.698 12.558 2.534 1.00 0.00 C ATOM 1403 CG ARG A 156 -4.176 12.063 3.889 1.00 0.00 C ATOM 1404 CD ARG A 156 -5.672 11.788 3.886 1.00 0.00 C ATOM 1405 NE ARG A 156 -6.011 10.618 3.080 1.00 0.00 N ATOM 1406 CZ ARG A 156 -7.243 10.346 2.662 1.00 0.00 C ATOM 1407 NH1 ARG A 156 -8.246 11.156 2.971 1.00 0.00 N ATOM 1408 NH2 ARG A 156 -7.472 9.262 1.931 1.00 0.00 N ATOM 0 H ARG A 156 -0.898 12.144 3.823 1.00 0.00 H new ATOM 0 HA ARG A 156 -2.007 13.447 1.550 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -4.367 13.345 2.187 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -3.765 11.742 1.814 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -3.638 11.153 4.156 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -3.943 12.806 4.652 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -6.015 11.635 4.909 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -6.200 12.660 3.500 1.00 0.00 H new ATOM 0 HE ARG A 156 -5.262 9.975 2.824 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -8.073 11.991 3.531 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -9.190 10.944 2.649 1.00 0.00 H new ATOM 0 HH21 ARG A 156 -6.702 8.637 1.690 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -8.418 9.053 1.610 1.00 0.00 H new ATOM 1422 N LYS A 157 -2.491 15.457 3.041 1.00 0.00 N ATOM 1423 CA LYS A 157 -2.433 16.658 3.866 1.00 0.00 C ATOM 1424 C LYS A 157 -3.664 17.531 3.644 1.00 0.00 C ATOM 1425 O LYS A 157 -4.306 17.485 2.594 1.00 0.00 O ATOM 1426 CB LYS A 157 -1.165 17.456 3.553 1.00 0.00 C ATOM 1427 CG LYS A 157 0.090 16.875 4.182 1.00 0.00 C ATOM 1428 CD LYS A 157 0.105 17.079 5.687 1.00 0.00 C ATOM 1429 CE LYS A 157 0.508 18.500 6.053 1.00 0.00 C ATOM 1430 NZ LYS A 157 0.403 18.746 7.518 1.00 0.00 N ATOM 0 H LYS A 157 -2.805 15.618 2.084 1.00 0.00 H new ATOM 0 HA LYS A 157 -2.412 16.350 4.911 1.00 0.00 H new ATOM 0 HB2 LYS A 157 -1.032 17.502 2.472 1.00 0.00 H new ATOM 0 HB3 LYS A 157 -1.295 18.481 3.902 1.00 0.00 H new ATOM 0 HG2 LYS A 157 0.151 15.810 3.958 1.00 0.00 H new ATOM 0 HG3 LYS A 157 0.970 17.344 3.742 1.00 0.00 H new ATOM 0 HD2 LYS A 157 -0.883 16.863 6.094 1.00 0.00 H new ATOM 0 HD3 LYS A 157 0.799 16.374 6.144 1.00 0.00 H new ATOM 0 HE2 LYS A 157 1.532 18.683 5.726 1.00 0.00 H new ATOM 0 HE3 LYS A 157 -0.128 19.207 5.520 1.00 0.00 H new ATOM 0 HZ1 LYS A 157 0.686 19.725 7.727 1.00 0.00 H new ATOM 0 HZ2 LYS A 157 -0.579 18.596 7.826 1.00 0.00 H new ATOM 0 HZ3 LYS A 157 1.029 18.089 8.026 1.00 0.00 H new ATOM 1444 N PRO A 158 -4.001 18.348 4.653 1.00 0.00 N ATOM 1445 CA PRO A 158 -5.156 19.248 4.590 1.00 0.00 C ATOM 1446 C PRO A 158 -4.946 20.393 3.604 1.00 0.00 C ATOM 1447 O PRO A 158 -3.828 20.862 3.391 1.00 0.00 O ATOM 1448 CB PRO A 158 -5.265 19.786 6.019 1.00 0.00 C ATOM 1449 CG PRO A 158 -3.886 19.674 6.571 1.00 0.00 C ATOM 1450 CD PRO A 158 -3.281 18.455 5.933 1.00 0.00 C ATOM 0 HA PRO A 158 -6.053 18.736 4.243 1.00 0.00 H new ATOM 0 HB2 PRO A 158 -5.612 20.819 6.028 1.00 0.00 H new ATOM 0 HB3 PRO A 158 -5.976 19.206 6.608 1.00 0.00 H new ATOM 0 HG2 PRO A 158 -3.301 20.565 6.342 1.00 0.00 H new ATOM 0 HG3 PRO A 158 -3.907 19.576 7.656 1.00 0.00 H new ATOM 0 HD2 PRO A 158 -2.208 18.571 5.782 1.00 0.00 H new ATOM 0 HD3 PRO A 158 -3.422 17.567 6.549 1.00 0.00 H new ATOM 1458 N PRO A 159 -6.044 20.854 2.988 1.00 0.00 N ATOM 1459 CA PRO A 159 -6.005 21.950 2.016 1.00 0.00 C ATOM 1460 C PRO A 159 -5.688 23.292 2.667 1.00 0.00 C ATOM 1461 O PRO A 159 -5.891 23.474 3.867 1.00 0.00 O ATOM 1462 CB PRO A 159 -7.421 21.960 1.435 1.00 0.00 C ATOM 1463 CG PRO A 159 -8.272 21.359 2.500 1.00 0.00 C ATOM 1464 CD PRO A 159 -7.409 20.341 3.194 1.00 0.00 C ATOM 0 HA PRO A 159 -5.224 21.804 1.270 1.00 0.00 H new ATOM 0 HB2 PRO A 159 -7.743 22.973 1.195 1.00 0.00 H new ATOM 0 HB3 PRO A 159 -7.474 21.382 0.512 1.00 0.00 H new ATOM 0 HG2 PRO A 159 -8.617 22.120 3.200 1.00 0.00 H new ATOM 0 HG3 PRO A 159 -9.160 20.892 2.073 1.00 0.00 H new ATOM 0 HD2 PRO A 159 -7.653 20.262 4.253 1.00 0.00 H new ATOM 0 HD3 PRO A 159 -7.534 19.347 2.763 1.00 0.00 H new ATOM 1472 N ALA A 160 -5.188 24.229 1.868 1.00 0.00 N ATOM 1473 CA ALA A 160 -4.845 25.555 2.367 1.00 0.00 C ATOM 1474 C ALA A 160 -6.084 26.439 2.474 1.00 0.00 C ATOM 1475 O ALA A 160 -7.081 26.238 1.779 1.00 0.00 O ATOM 1476 CB ALA A 160 -3.807 26.206 1.465 1.00 0.00 C ATOM 0 H ALA A 160 -5.011 24.094 0.872 1.00 0.00 H new ATOM 0 HA ALA A 160 -4.423 25.442 3.366 1.00 0.00 H new ATOM 0 HB1 ALA A 160 -3.560 27.196 1.850 1.00 0.00 H new ATOM 0 HB2 ALA A 160 -2.907 25.591 1.442 1.00 0.00 H new ATOM 0 HB3 ALA A 160 -4.209 26.299 0.456 1.00 0.00 H new ATOM 1482 N PRO A 161 -6.022 27.440 3.364 1.00 0.00 N ATOM 1483 CA PRO A 161 -7.131 28.374 3.583 1.00 0.00 C ATOM 1484 C PRO A 161 -7.342 29.310 2.398 1.00 0.00 C ATOM 1485 O PRO A 161 -6.418 29.998 1.964 1.00 0.00 O ATOM 1486 CB PRO A 161 -6.690 29.165 4.817 1.00 0.00 C ATOM 1487 CG PRO A 161 -5.202 29.082 4.809 1.00 0.00 C ATOM 1488 CD PRO A 161 -4.866 27.737 4.226 1.00 0.00 C ATOM 0 HA PRO A 161 -8.082 27.856 3.709 1.00 0.00 H new ATOM 0 HB2 PRO A 161 -7.029 30.200 4.766 1.00 0.00 H new ATOM 0 HB3 PRO A 161 -7.105 28.738 5.730 1.00 0.00 H new ATOM 0 HG2 PRO A 161 -4.769 29.885 4.212 1.00 0.00 H new ATOM 0 HG3 PRO A 161 -4.800 29.182 5.817 1.00 0.00 H new ATOM 0 HD2 PRO A 161 -3.937 27.767 3.656 1.00 0.00 H new ATOM 0 HD3 PRO A 161 -4.740 26.983 5.003 1.00 0.00 H new ATOM 1496 N LYS A 162 -8.565 29.332 1.879 1.00 0.00 N ATOM 1497 CA LYS A 162 -8.899 30.185 0.744 1.00 0.00 C ATOM 1498 C LYS A 162 -8.889 31.656 1.148 1.00 0.00 C ATOM 1499 O LYS A 162 -9.733 32.103 1.925 1.00 0.00 O ATOM 1500 CB LYS A 162 -10.273 29.809 0.185 1.00 0.00 C ATOM 1501 CG LYS A 162 -10.222 28.715 -0.868 1.00 0.00 C ATOM 1502 CD LYS A 162 -10.339 27.335 -0.243 1.00 0.00 C ATOM 1503 CE LYS A 162 -11.793 26.933 -0.046 1.00 0.00 C ATOM 1504 NZ LYS A 162 -12.438 27.706 1.051 1.00 0.00 N ATOM 0 H LYS A 162 -9.341 28.769 2.226 1.00 0.00 H new ATOM 0 HA LYS A 162 -8.145 30.033 -0.028 1.00 0.00 H new ATOM 0 HB2 LYS A 162 -10.913 29.483 1.005 1.00 0.00 H new ATOM 0 HB3 LYS A 162 -10.736 30.696 -0.247 1.00 0.00 H new ATOM 0 HG2 LYS A 162 -11.030 28.861 -1.585 1.00 0.00 H new ATOM 0 HG3 LYS A 162 -9.287 28.786 -1.423 1.00 0.00 H new ATOM 0 HD2 LYS A 162 -9.841 26.603 -0.879 1.00 0.00 H new ATOM 0 HD3 LYS A 162 -9.824 27.325 0.718 1.00 0.00 H new ATOM 0 HE2 LYS A 162 -12.343 27.092 -0.974 1.00 0.00 H new ATOM 0 HE3 LYS A 162 -11.848 25.868 0.179 1.00 0.00 H new ATOM 0 HZ1 LYS A 162 -13.253 27.174 1.418 1.00 0.00 H new ATOM 0 HZ2 LYS A 162 -11.752 27.860 1.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 162 -12.761 28.624 0.685 1.00 0.00 H new ATOM 1518 N SER A 163 -7.928 32.405 0.615 1.00 0.00 N ATOM 1519 CA SER A 163 -7.806 33.825 0.922 1.00 0.00 C ATOM 1520 C SER A 163 -7.300 34.601 -0.290 1.00 0.00 C ATOM 1521 O SER A 163 -6.335 34.199 -0.941 1.00 0.00 O ATOM 1522 CB SER A 163 -6.861 34.033 2.107 1.00 0.00 C ATOM 1523 OG SER A 163 -5.601 33.432 1.866 1.00 0.00 O ATOM 0 H SER A 163 -7.223 32.051 -0.032 1.00 0.00 H new ATOM 0 HA SER A 163 -8.795 34.201 1.185 1.00 0.00 H new ATOM 0 HB2 SER A 163 -6.730 35.100 2.289 1.00 0.00 H new ATOM 0 HB3 SER A 163 -7.304 33.608 3.008 1.00 0.00 H new ATOM 0 HG SER A 163 -5.401 33.465 0.907 1.00 0.00 H new ATOM 1529 N THR A 164 -7.958 35.718 -0.587 1.00 0.00 N ATOM 1530 CA THR A 164 -7.577 36.551 -1.720 1.00 0.00 C ATOM 1531 C THR A 164 -7.588 38.028 -1.345 1.00 0.00 C ATOM 1532 O THR A 164 -8.068 38.403 -0.275 1.00 0.00 O ATOM 1533 CB THR A 164 -8.516 36.331 -2.921 1.00 0.00 C ATOM 1534 OG1 THR A 164 -8.032 37.049 -4.060 1.00 0.00 O ATOM 1535 CG2 THR A 164 -9.930 36.785 -2.591 1.00 0.00 C ATOM 0 H THR A 164 -8.758 36.066 -0.058 1.00 0.00 H new ATOM 0 HA THR A 164 -6.565 36.258 -2.001 1.00 0.00 H new ATOM 0 HB THR A 164 -8.537 35.265 -3.148 1.00 0.00 H new ATOM 0 HG1 THR A 164 -8.634 36.902 -4.819 1.00 0.00 H new ATOM 0 HG21 THR A 164 -10.576 36.620 -3.454 1.00 0.00 H new ATOM 0 HG22 THR A 164 -10.306 36.215 -1.742 1.00 0.00 H new ATOM 0 HG23 THR A 164 -9.922 37.846 -2.341 1.00 0.00 H new ATOM 1543 N TYR A 165 -7.057 38.863 -2.231 1.00 0.00 N ATOM 1544 CA TYR A 165 -7.004 40.300 -1.992 1.00 0.00 C ATOM 1545 C TYR A 165 -7.989 41.039 -2.893 1.00 0.00 C ATOM 1546 O TYR A 165 -7.707 41.287 -4.065 1.00 0.00 O ATOM 1547 CB TYR A 165 -5.587 40.826 -2.226 1.00 0.00 C ATOM 1548 CG TYR A 165 -5.229 42.010 -1.357 1.00 0.00 C ATOM 1549 CD1 TYR A 165 -5.105 41.873 0.020 1.00 0.00 C ATOM 1550 CD2 TYR A 165 -5.016 43.266 -1.912 1.00 0.00 C ATOM 1551 CE1 TYR A 165 -4.778 42.952 0.819 1.00 0.00 C ATOM 1552 CE2 TYR A 165 -4.688 44.350 -1.121 1.00 0.00 C ATOM 1553 CZ TYR A 165 -4.570 44.188 0.244 1.00 0.00 C ATOM 1554 OH TYR A 165 -4.245 45.266 1.035 1.00 0.00 O ATOM 0 H TYR A 165 -6.657 38.569 -3.122 1.00 0.00 H new ATOM 0 HA TYR A 165 -7.284 40.480 -0.954 1.00 0.00 H new ATOM 0 HB2 TYR A 165 -4.875 40.022 -2.041 1.00 0.00 H new ATOM 0 HB3 TYR A 165 -5.482 41.110 -3.273 1.00 0.00 H new ATOM 0 HD1 TYR A 165 -5.267 40.906 0.474 1.00 0.00 H new ATOM 0 HD2 TYR A 165 -5.108 43.397 -2.980 1.00 0.00 H new ATOM 0 HE1 TYR A 165 -4.686 42.828 1.888 1.00 0.00 H new ATOM 0 HE2 TYR A 165 -4.525 45.319 -1.569 1.00 0.00 H new ATOM 0 HH TYR A 165 -4.131 46.061 0.474 1.00 0.00 H new ATOM 1564 N GLU A 166 -9.145 41.387 -2.336 1.00 0.00 N ATOM 1565 CA GLU A 166 -10.171 42.098 -3.089 1.00 0.00 C ATOM 1566 C GLU A 166 -11.305 42.549 -2.172 1.00 0.00 C ATOM 1567 O GLU A 166 -11.649 41.862 -1.210 1.00 0.00 O ATOM 1568 CB GLU A 166 -10.726 41.207 -4.203 1.00 0.00 C ATOM 1569 CG GLU A 166 -11.455 39.976 -3.692 1.00 0.00 C ATOM 1570 CD GLU A 166 -12.323 39.329 -4.754 1.00 0.00 C ATOM 1571 OE1 GLU A 166 -12.029 39.515 -5.954 1.00 0.00 O ATOM 1572 OE2 GLU A 166 -13.296 38.639 -4.386 1.00 0.00 O ATOM 0 H GLU A 166 -9.394 41.188 -1.367 1.00 0.00 H new ATOM 0 HA GLU A 166 -9.713 42.982 -3.533 1.00 0.00 H new ATOM 0 HB2 GLU A 166 -11.408 41.793 -4.819 1.00 0.00 H new ATOM 0 HB3 GLU A 166 -9.905 40.891 -4.847 1.00 0.00 H new ATOM 0 HG2 GLU A 166 -10.726 39.250 -3.332 1.00 0.00 H new ATOM 0 HG3 GLU A 166 -12.076 40.254 -2.840 1.00 0.00 H new ATOM 1579 N SER A 167 -11.880 43.707 -2.477 1.00 0.00 N ATOM 1580 CA SER A 167 -12.971 44.253 -1.679 1.00 0.00 C ATOM 1581 C SER A 167 -13.869 45.149 -2.526 1.00 0.00 C ATOM 1582 O SER A 167 -13.435 46.186 -3.027 1.00 0.00 O ATOM 1583 CB SER A 167 -12.417 45.043 -0.492 1.00 0.00 C ATOM 1584 OG SER A 167 -11.476 46.013 -0.919 1.00 0.00 O ATOM 0 H SER A 167 -11.608 44.286 -3.272 1.00 0.00 H new ATOM 0 HA SER A 167 -13.567 43.420 -1.306 1.00 0.00 H new ATOM 0 HB2 SER A 167 -13.235 45.533 0.036 1.00 0.00 H new ATOM 0 HB3 SER A 167 -11.945 44.360 0.215 1.00 0.00 H new ATOM 0 HG SER A 167 -11.787 46.426 -1.752 1.00 0.00 H new ATOM 1590 N ASN A 168 -15.124 44.741 -2.682 1.00 0.00 N ATOM 1591 CA ASN A 168 -16.084 45.506 -3.470 1.00 0.00 C ATOM 1592 C ASN A 168 -17.514 45.186 -3.044 1.00 0.00 C ATOM 1593 O ASN A 168 -17.897 44.020 -2.939 1.00 0.00 O ATOM 1594 CB ASN A 168 -15.905 45.208 -4.960 1.00 0.00 C ATOM 1595 CG ASN A 168 -16.475 46.304 -5.840 1.00 0.00 C ATOM 1596 OD1 ASN A 168 -15.768 47.234 -6.228 1.00 0.00 O ATOM 1597 ND2 ASN A 168 -17.760 46.198 -6.159 1.00 0.00 N ATOM 0 H ASN A 168 -15.500 43.885 -2.273 1.00 0.00 H new ATOM 0 HA ASN A 168 -15.899 46.566 -3.294 1.00 0.00 H new ATOM 0 HB2 ASN A 168 -14.844 45.085 -5.178 1.00 0.00 H new ATOM 0 HB3 ASN A 168 -16.392 44.263 -5.200 1.00 0.00 H new ATOM 0 HD21 ASN A 168 -18.199 46.905 -6.749 1.00 0.00 H new ATOM 0 HD22 ASN A 168 -18.308 45.409 -5.814 1.00 0.00 H new ATOM 1604 N THR A 169 -18.301 46.230 -2.800 1.00 0.00 N ATOM 1605 CA THR A 169 -19.688 46.061 -2.385 1.00 0.00 C ATOM 1606 C THR A 169 -20.433 47.391 -2.405 1.00 0.00 C ATOM 1607 O THR A 169 -19.833 48.453 -2.242 1.00 0.00 O ATOM 1608 CB THR A 169 -19.782 45.454 -0.972 1.00 0.00 C ATOM 1609 OG1 THR A 169 -21.148 45.171 -0.651 1.00 0.00 O ATOM 1610 CG2 THR A 169 -19.198 46.402 0.064 1.00 0.00 C ATOM 0 H THR A 169 -18.001 47.201 -2.883 1.00 0.00 H new ATOM 0 HA THR A 169 -20.150 45.377 -3.097 1.00 0.00 H new ATOM 0 HB THR A 169 -19.207 44.528 -0.959 1.00 0.00 H new ATOM 0 HG1 THR A 169 -21.199 44.784 0.248 1.00 0.00 H new ATOM 0 HG21 THR A 169 -19.276 45.952 1.054 1.00 0.00 H new ATOM 0 HG22 THR A 169 -18.150 46.592 -0.167 1.00 0.00 H new ATOM 0 HG23 THR A 169 -19.749 47.342 0.049 1.00 0.00 H new ATOM 1618 N LYS A 170 -21.745 47.325 -2.606 1.00 0.00 N ATOM 1619 CA LYS A 170 -22.574 48.523 -2.646 1.00 0.00 C ATOM 1620 C LYS A 170 -23.535 48.560 -1.462 1.00 0.00 C ATOM 1621 O LYS A 170 -24.381 47.678 -1.312 1.00 0.00 O ATOM 1622 CB LYS A 170 -23.361 48.581 -3.957 1.00 0.00 C ATOM 1623 CG LYS A 170 -22.487 48.487 -5.196 1.00 0.00 C ATOM 1624 CD LYS A 170 -22.041 49.860 -5.669 1.00 0.00 C ATOM 1625 CE LYS A 170 -20.717 50.265 -5.039 1.00 0.00 C ATOM 1626 NZ LYS A 170 -20.609 51.741 -4.874 1.00 0.00 N ATOM 0 H LYS A 170 -22.257 46.454 -2.744 1.00 0.00 H new ATOM 0 HA LYS A 170 -21.917 49.391 -2.585 1.00 0.00 H new ATOM 0 HB2 LYS A 170 -24.086 47.768 -3.972 1.00 0.00 H new ATOM 0 HB3 LYS A 170 -23.926 49.513 -3.991 1.00 0.00 H new ATOM 0 HG2 LYS A 170 -21.612 47.874 -4.980 1.00 0.00 H new ATOM 0 HG3 LYS A 170 -23.037 47.987 -5.993 1.00 0.00 H new ATOM 0 HD2 LYS A 170 -21.943 49.858 -6.755 1.00 0.00 H new ATOM 0 HD3 LYS A 170 -22.804 50.597 -5.420 1.00 0.00 H new ATOM 0 HE2 LYS A 170 -20.615 49.783 -4.067 1.00 0.00 H new ATOM 0 HE3 LYS A 170 -19.895 49.908 -5.660 1.00 0.00 H new ATOM 0 HZ1 LYS A 170 -19.693 51.976 -4.442 1.00 0.00 H new ATOM 0 HZ2 LYS A 170 -20.681 52.200 -5.804 1.00 0.00 H new ATOM 0 HZ3 LYS A 170 -21.378 52.079 -4.261 1.00 0.00 H new ATOM 1640 N GLN A 171 -23.400 49.584 -0.627 1.00 0.00 N ATOM 1641 CA GLN A 171 -24.258 49.734 0.543 1.00 0.00 C ATOM 1642 C GLN A 171 -24.444 51.206 0.896 1.00 0.00 C ATOM 1643 O GLN A 171 -23.545 52.022 0.695 1.00 0.00 O ATOM 1644 CB GLN A 171 -23.665 48.983 1.736 1.00 0.00 C ATOM 1645 CG GLN A 171 -22.423 49.642 2.314 1.00 0.00 C ATOM 1646 CD GLN A 171 -21.745 48.787 3.367 1.00 0.00 C ATOM 1647 OE1 GLN A 171 -20.786 48.071 3.079 1.00 0.00 O ATOM 1648 NE2 GLN A 171 -22.242 48.858 4.596 1.00 0.00 N ATOM 0 H GLN A 171 -22.705 50.322 -0.738 1.00 0.00 H new ATOM 0 HA GLN A 171 -25.233 49.310 0.304 1.00 0.00 H new ATOM 0 HB2 GLN A 171 -24.421 48.904 2.517 1.00 0.00 H new ATOM 0 HB3 GLN A 171 -23.417 47.967 1.428 1.00 0.00 H new ATOM 0 HG2 GLN A 171 -21.717 49.848 1.509 1.00 0.00 H new ATOM 0 HG3 GLN A 171 -22.696 50.602 2.752 1.00 0.00 H new ATOM 0 HE21 GLN A 171 -23.038 49.465 4.790 1.00 0.00 H new ATOM 0 HE22 GLN A 171 -21.827 48.305 5.346 1.00 0.00 H new ATOM 1657 N SER A 172 -25.619 51.539 1.422 1.00 0.00 N ATOM 1658 CA SER A 172 -25.925 52.914 1.799 1.00 0.00 C ATOM 1659 C SER A 172 -25.717 53.860 0.620 1.00 0.00 C ATOM 1660 O SER A 172 -25.236 54.980 0.786 1.00 0.00 O ATOM 1661 CB SER A 172 -25.051 53.349 2.977 1.00 0.00 C ATOM 1662 OG SER A 172 -25.311 52.559 4.124 1.00 0.00 O ATOM 0 H SER A 172 -26.374 50.876 1.597 1.00 0.00 H new ATOM 0 HA SER A 172 -26.972 52.958 2.097 1.00 0.00 H new ATOM 0 HB2 SER A 172 -23.999 53.264 2.704 1.00 0.00 H new ATOM 0 HB3 SER A 172 -25.238 54.398 3.204 1.00 0.00 H new ATOM 0 HG SER A 172 -24.739 52.856 4.862 1.00 0.00 H new ATOM 1668 N GLY A 173 -26.084 53.399 -0.572 1.00 0.00 N ATOM 1669 CA GLY A 173 -25.930 54.215 -1.762 1.00 0.00 C ATOM 1670 C GLY A 173 -26.926 55.357 -1.815 1.00 0.00 C ATOM 1671 O GLY A 173 -27.477 55.776 -0.796 1.00 0.00 O ATOM 0 H GLY A 173 -26.485 52.475 -0.735 1.00 0.00 H new ATOM 0 HA2 GLY A 173 -24.918 54.618 -1.794 1.00 0.00 H new ATOM 0 HA3 GLY A 173 -26.052 53.589 -2.646 1.00 0.00 H new ATOM 1675 N PRO A 174 -27.168 55.881 -3.025 1.00 0.00 N ATOM 1676 CA PRO A 174 -28.104 56.990 -3.235 1.00 0.00 C ATOM 1677 C PRO A 174 -29.554 56.573 -3.018 1.00 0.00 C ATOM 1678 O PRO A 174 -30.042 55.636 -3.649 1.00 0.00 O ATOM 1679 CB PRO A 174 -27.872 57.377 -4.698 1.00 0.00 C ATOM 1680 CG PRO A 174 -27.349 56.139 -5.340 1.00 0.00 C ATOM 1681 CD PRO A 174 -26.547 55.432 -4.283 1.00 0.00 C ATOM 0 HA PRO A 174 -27.935 57.806 -2.532 1.00 0.00 H new ATOM 0 HB2 PRO A 174 -28.797 57.708 -5.171 1.00 0.00 H new ATOM 0 HB3 PRO A 174 -27.160 58.198 -4.782 1.00 0.00 H new ATOM 0 HG2 PRO A 174 -28.165 55.510 -5.697 1.00 0.00 H new ATOM 0 HG3 PRO A 174 -26.730 56.379 -6.204 1.00 0.00 H new ATOM 0 HD2 PRO A 174 -26.602 54.349 -4.394 1.00 0.00 H new ATOM 0 HD3 PRO A 174 -25.492 55.704 -4.330 1.00 0.00 H new ATOM 1689 N SER A 175 -30.239 57.276 -2.121 1.00 0.00 N ATOM 1690 CA SER A 175 -31.633 56.976 -1.818 1.00 0.00 C ATOM 1691 C SER A 175 -32.529 58.166 -2.150 1.00 0.00 C ATOM 1692 O SER A 175 -32.125 59.320 -2.009 1.00 0.00 O ATOM 1693 CB SER A 175 -31.788 56.603 -0.342 1.00 0.00 C ATOM 1694 OG SER A 175 -30.993 55.477 -0.015 1.00 0.00 O ATOM 0 H SER A 175 -29.851 58.057 -1.592 1.00 0.00 H new ATOM 0 HA SER A 175 -31.939 56.130 -2.433 1.00 0.00 H new ATOM 0 HB2 SER A 175 -31.500 57.449 0.282 1.00 0.00 H new ATOM 0 HB3 SER A 175 -32.835 56.388 -0.126 1.00 0.00 H new ATOM 0 HG SER A 175 -31.108 55.260 0.934 1.00 0.00 H new ATOM 1700 N SER A 176 -33.749 57.875 -2.590 1.00 0.00 N ATOM 1701 CA SER A 176 -34.702 58.920 -2.946 1.00 0.00 C ATOM 1702 C SER A 176 -36.082 58.327 -3.215 1.00 0.00 C ATOM 1703 O SER A 176 -36.228 57.118 -3.387 1.00 0.00 O ATOM 1704 CB SER A 176 -34.215 59.686 -4.178 1.00 0.00 C ATOM 1705 OG SER A 176 -34.912 60.911 -4.324 1.00 0.00 O ATOM 0 H SER A 176 -34.101 56.925 -2.708 1.00 0.00 H new ATOM 0 HA SER A 176 -34.779 59.609 -2.105 1.00 0.00 H new ATOM 0 HB2 SER A 176 -33.146 59.880 -4.091 1.00 0.00 H new ATOM 0 HB3 SER A 176 -34.356 59.075 -5.070 1.00 0.00 H new ATOM 0 HG SER A 176 -34.582 61.383 -5.117 1.00 0.00 H new ATOM 1711 N GLY A 177 -37.093 59.190 -3.250 1.00 0.00 N ATOM 1712 CA GLY A 177 -38.449 58.735 -3.498 1.00 0.00 C ATOM 1713 C GLY A 177 -38.961 57.817 -2.406 1.00 0.00 C ATOM 1714 O GLY A 177 -40.004 58.079 -1.805 1.00 0.00 O ATOM 0 H GLY A 177 -36.997 60.196 -3.111 1.00 0.00 H new ATOM 0 HA2 GLY A 177 -39.109 59.598 -3.582 1.00 0.00 H new ATOM 0 HA3 GLY A 177 -38.485 58.213 -4.454 1.00 0.00 H new TER 1718 GLY A 177