USER MOD reduce.3.24.130724 H: found=0, std=0, add=803, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 804 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 31 MET CE :methyl -126:sc= -2.66! (180deg=-4.69!) USER MOD Set 1.2: A 105 THR OG1 : rot -109:sc= 0.48 USER MOD Set 2.1: A 8 SER OG : rot -55:sc= -2.83! USER MOD Set 2.2: A 27 MET CE :methyl 172:sc= 0 (180deg=0) USER MOD Set 3.1: A 1 MET N :NH3+ 152:sc=-0.00732 (180deg=0) USER MOD Set 3.2: A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET CE :methyl -156:sc= -0.297 (180deg=-1.67) USER MOD Single : A 7 SER OG : rot 180:sc= -0.247 USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 58:sc= 0.584 USER MOD Single : A 17 SER OG : rot 83:sc= -0.424! USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 38 SER OG : rot -70:sc= 0.863 USER MOD Single : A 39 SER OG : rot 180:sc= -0.133 USER MOD Single : A 44 ASN : amide:sc= -0.538 K(o=-0.54,f=0.15) USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 ASN : amide:sc= -0.0482 X(o=-0.048,f=0) USER MOD Single : A 64 ASN : amide:sc= 0.299 X(o=0.3,f=0) USER MOD Single : A 67 LYS NZ :NH3+ 146:sc= -0.195 (180deg=-1.1) USER MOD Single : A 72 SER OG : rot -49:sc= 0.718 USER MOD Single : A 73 SER OG : rot 180:sc= -1.64! USER MOD Single : A 77 ASN : amide:sc= -0.0852 X(o=-0.085,f=-0.51) USER MOD Single : A 83 ASN : amide:sc= 0.0885 X(o=0.088,f=-0.011) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 TYR OH : rot -137:sc= -0.178 USER MOD Single : A 93 THR OG1 : rot 180:sc= -0.0298 USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 180:sc= -0.017 USER MOD Single : A 100 ASN : amide:sc= -2.19 K(o=-2.2,f=-1.5) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 ASN : amide:sc= -2.99! C(o=-3!,f=-5.9!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 8.786 0.611 -3.680 1.00 0.00 N ATOM 2 CA MET A 1 7.669 -0.121 -4.342 1.00 0.00 C ATOM 3 C MET A 1 6.350 0.232 -3.654 1.00 0.00 C ATOM 4 O MET A 1 6.245 0.219 -2.444 1.00 0.00 O ATOM 5 CB MET A 1 7.912 -1.628 -4.237 1.00 0.00 C ATOM 6 CG MET A 1 7.190 -2.342 -5.381 1.00 0.00 C ATOM 7 SD MET A 1 7.060 -4.108 -5.003 1.00 0.00 S ATOM 8 CE MET A 1 8.807 -4.384 -4.619 1.00 0.00 C ATOM 0 H1 MET A 1 9.667 0.068 -3.784 1.00 0.00 H new ATOM 0 H2 MET A 1 8.901 1.544 -4.124 1.00 0.00 H new ATOM 0 H3 MET A 1 8.571 0.732 -2.670 1.00 0.00 H new ATOM 0 HA MET A 1 7.619 0.166 -5.392 1.00 0.00 H new ATOM 0 HB2 MET A 1 8.981 -1.839 -4.280 1.00 0.00 H new ATOM 0 HB3 MET A 1 7.552 -1.999 -3.278 1.00 0.00 H new ATOM 0 HG2 MET A 1 6.197 -1.915 -5.521 1.00 0.00 H new ATOM 0 HG3 MET A 1 7.734 -2.198 -6.315 1.00 0.00 H new ATOM 0 HE1 MET A 1 9.051 -5.435 -4.770 1.00 0.00 H new ATOM 0 HE2 MET A 1 9.425 -3.770 -5.274 1.00 0.00 H new ATOM 0 HE3 MET A 1 8.999 -4.113 -3.581 1.00 0.00 H new ATOM 20 N LYS A 2 5.339 0.546 -4.417 1.00 0.00 N ATOM 21 CA LYS A 2 4.026 0.900 -3.807 1.00 0.00 C ATOM 22 C LYS A 2 2.896 0.358 -4.683 1.00 0.00 C ATOM 23 O LYS A 2 2.623 0.871 -5.752 1.00 0.00 O ATOM 24 CB LYS A 2 3.906 2.420 -3.699 1.00 0.00 C ATOM 25 CG LYS A 2 4.460 2.880 -2.350 1.00 0.00 C ATOM 26 CD LYS A 2 5.573 3.903 -2.578 1.00 0.00 C ATOM 27 CE LYS A 2 6.910 3.311 -2.126 1.00 0.00 C ATOM 28 NZ LYS A 2 7.989 3.754 -3.055 1.00 0.00 N ATOM 0 H LYS A 2 5.365 0.573 -5.436 1.00 0.00 H new ATOM 0 HA LYS A 2 3.957 0.461 -2.812 1.00 0.00 H new ATOM 0 HB2 LYS A 2 4.454 2.897 -4.511 1.00 0.00 H new ATOM 0 HB3 LYS A 2 2.863 2.721 -3.798 1.00 0.00 H new ATOM 0 HG2 LYS A 2 3.664 3.320 -1.749 1.00 0.00 H new ATOM 0 HG3 LYS A 2 4.845 2.026 -1.793 1.00 0.00 H new ATOM 0 HD2 LYS A 2 5.621 4.175 -3.632 1.00 0.00 H new ATOM 0 HD3 LYS A 2 5.361 4.817 -2.023 1.00 0.00 H new ATOM 0 HE2 LYS A 2 7.137 3.631 -1.109 1.00 0.00 H new ATOM 0 HE3 LYS A 2 6.852 2.223 -2.112 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 8.898 3.352 -2.748 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 7.773 3.427 -4.018 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 8.049 4.792 -3.047 1.00 0.00 H new ATOM 42 N ILE A 3 2.237 -0.676 -4.239 1.00 0.00 N ATOM 43 CA ILE A 3 1.125 -1.254 -5.043 1.00 0.00 C ATOM 44 C ILE A 3 -0.211 -0.917 -4.379 1.00 0.00 C ATOM 45 O ILE A 3 -0.502 -1.362 -3.286 1.00 0.00 O ATOM 46 CB ILE A 3 1.288 -2.772 -5.120 1.00 0.00 C ATOM 47 CG1 ILE A 3 2.487 -3.113 -6.008 1.00 0.00 C ATOM 48 CG2 ILE A 3 0.023 -3.393 -5.715 1.00 0.00 C ATOM 49 CD1 ILE A 3 3.537 -3.859 -5.182 1.00 0.00 C ATOM 0 H ILE A 3 2.421 -1.146 -3.353 1.00 0.00 H new ATOM 0 HA ILE A 3 1.147 -0.835 -6.049 1.00 0.00 H new ATOM 0 HB ILE A 3 1.452 -3.169 -4.118 1.00 0.00 H new ATOM 0 HG12 ILE A 3 2.167 -3.727 -6.850 1.00 0.00 H new ATOM 0 HG13 ILE A 3 2.916 -2.201 -6.424 1.00 0.00 H new ATOM 0 HG21 ILE A 3 0.140 -4.475 -5.770 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -0.832 -3.152 -5.084 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -0.141 -2.995 -6.716 1.00 0.00 H new ATOM 0 HD11 ILE A 3 4.391 -4.102 -5.814 1.00 0.00 H new ATOM 0 HD12 ILE A 3 3.865 -3.229 -4.355 1.00 0.00 H new ATOM 0 HD13 ILE A 3 3.104 -4.778 -4.788 1.00 0.00 H new ATOM 61 N ALA A 4 -1.027 -0.135 -5.030 1.00 0.00 N ATOM 62 CA ALA A 4 -2.345 0.229 -4.438 1.00 0.00 C ATOM 63 C ALA A 4 -3.465 -0.391 -5.275 1.00 0.00 C ATOM 64 O ALA A 4 -3.575 -0.144 -6.460 1.00 0.00 O ATOM 65 CB ALA A 4 -2.499 1.751 -4.424 1.00 0.00 C ATOM 0 H ALA A 4 -0.838 0.268 -5.948 1.00 0.00 H new ATOM 0 HA ALA A 4 -2.401 -0.148 -3.417 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -3.464 2.015 -3.991 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -1.700 2.192 -3.828 1.00 0.00 H new ATOM 0 HB3 ALA A 4 -2.443 2.132 -5.444 1.00 0.00 H new ATOM 71 N ILE A 5 -4.297 -1.194 -4.673 1.00 0.00 N ATOM 72 CA ILE A 5 -5.405 -1.829 -5.440 1.00 0.00 C ATOM 73 C ILE A 5 -6.689 -1.018 -5.252 1.00 0.00 C ATOM 74 O ILE A 5 -7.085 -0.714 -4.144 1.00 0.00 O ATOM 75 CB ILE A 5 -5.625 -3.254 -4.930 1.00 0.00 C ATOM 76 CG1 ILE A 5 -4.303 -4.024 -4.987 1.00 0.00 C ATOM 77 CG2 ILE A 5 -6.661 -3.957 -5.808 1.00 0.00 C ATOM 78 CD1 ILE A 5 -3.794 -4.272 -3.565 1.00 0.00 C ATOM 0 H ILE A 5 -4.258 -1.438 -3.683 1.00 0.00 H new ATOM 0 HA ILE A 5 -5.144 -1.856 -6.498 1.00 0.00 H new ATOM 0 HB ILE A 5 -5.984 -3.220 -3.901 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -4.445 -4.973 -5.504 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -3.565 -3.458 -5.555 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -6.817 -4.972 -5.444 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -7.602 -3.409 -5.770 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -6.303 -3.991 -6.837 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -2.853 -4.820 -3.606 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -3.636 -3.317 -3.063 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -4.530 -4.855 -3.012 1.00 0.00 H new ATOM 90 N ALA A 6 -7.345 -0.669 -6.325 1.00 0.00 N ATOM 91 CA ALA A 6 -8.604 0.119 -6.203 1.00 0.00 C ATOM 92 C ALA A 6 -9.693 -0.761 -5.582 1.00 0.00 C ATOM 93 O ALA A 6 -9.734 -1.956 -5.795 1.00 0.00 O ATOM 94 CB ALA A 6 -9.053 0.582 -7.590 1.00 0.00 C ATOM 0 H ALA A 6 -7.064 -0.895 -7.279 1.00 0.00 H new ATOM 0 HA ALA A 6 -8.430 0.989 -5.569 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -9.974 1.158 -7.501 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -8.277 1.205 -8.035 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -9.229 -0.287 -8.224 1.00 0.00 H new ATOM 100 N SER A 7 -10.574 -0.181 -4.813 1.00 0.00 N ATOM 101 CA SER A 7 -11.656 -0.986 -4.179 1.00 0.00 C ATOM 102 C SER A 7 -11.033 -2.060 -3.282 1.00 0.00 C ATOM 103 O SER A 7 -10.720 -1.816 -2.133 1.00 0.00 O ATOM 104 CB SER A 7 -12.503 -1.650 -5.267 1.00 0.00 C ATOM 105 OG SER A 7 -13.330 -2.643 -4.676 1.00 0.00 O ATOM 0 H SER A 7 -10.591 0.816 -4.597 1.00 0.00 H new ATOM 0 HA SER A 7 -12.290 -0.335 -3.576 1.00 0.00 H new ATOM 0 HB2 SER A 7 -13.116 -0.904 -5.773 1.00 0.00 H new ATOM 0 HB3 SER A 7 -11.858 -2.099 -6.023 1.00 0.00 H new ATOM 0 HG SER A 7 -13.875 -3.070 -5.369 1.00 0.00 H new ATOM 111 N SER A 8 -10.847 -3.247 -3.796 1.00 0.00 N ATOM 112 CA SER A 8 -10.242 -4.330 -2.970 1.00 0.00 C ATOM 113 C SER A 8 -11.161 -4.656 -1.790 1.00 0.00 C ATOM 114 O SER A 8 -10.710 -5.036 -0.728 1.00 0.00 O ATOM 115 CB SER A 8 -8.883 -3.868 -2.443 1.00 0.00 C ATOM 116 OG SER A 8 -8.174 -4.988 -1.928 1.00 0.00 O ATOM 0 H SER A 8 -11.088 -3.512 -4.751 1.00 0.00 H new ATOM 0 HA SER A 8 -10.114 -5.222 -3.584 1.00 0.00 H new ATOM 0 HB2 SER A 8 -8.311 -3.397 -3.242 1.00 0.00 H new ATOM 0 HB3 SER A 8 -9.018 -3.118 -1.663 1.00 0.00 H new ATOM 0 HG SER A 8 -8.721 -5.438 -1.251 1.00 0.00 H new ATOM 122 N GLY A 9 -12.447 -4.511 -1.969 1.00 0.00 N ATOM 123 CA GLY A 9 -13.395 -4.814 -0.858 1.00 0.00 C ATOM 124 C GLY A 9 -12.844 -4.257 0.455 1.00 0.00 C ATOM 125 O GLY A 9 -12.868 -3.067 0.696 1.00 0.00 O ATOM 0 H GLY A 9 -12.882 -4.196 -2.836 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -14.370 -4.376 -1.069 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -13.541 -5.891 -0.775 1.00 0.00 H new ATOM 129 N THR A 10 -12.349 -5.111 1.309 1.00 0.00 N ATOM 130 CA THR A 10 -11.796 -4.631 2.607 1.00 0.00 C ATOM 131 C THR A 10 -10.834 -5.680 3.169 1.00 0.00 C ATOM 132 O THR A 10 -9.744 -5.366 3.606 1.00 0.00 O ATOM 133 CB THR A 10 -12.941 -4.407 3.597 1.00 0.00 C ATOM 134 OG1 THR A 10 -14.118 -5.033 3.107 1.00 0.00 O ATOM 135 CG2 THR A 10 -13.188 -2.907 3.763 1.00 0.00 C ATOM 0 H THR A 10 -12.304 -6.120 1.164 1.00 0.00 H new ATOM 0 HA THR A 10 -11.262 -3.694 2.451 1.00 0.00 H new ATOM 0 HB THR A 10 -12.677 -4.837 4.563 1.00 0.00 H new ATOM 0 HG1 THR A 10 -14.852 -4.892 3.741 1.00 0.00 H new ATOM 0 HG21 THR A 10 -14.004 -2.748 4.468 1.00 0.00 H new ATOM 0 HG22 THR A 10 -12.284 -2.429 4.140 1.00 0.00 H new ATOM 0 HG23 THR A 10 -13.453 -2.473 2.799 1.00 0.00 H new ATOM 143 N ASP A 11 -11.227 -6.924 3.164 1.00 0.00 N ATOM 144 CA ASP A 11 -10.334 -7.991 3.700 1.00 0.00 C ATOM 145 C ASP A 11 -10.439 -9.239 2.821 1.00 0.00 C ATOM 146 O ASP A 11 -9.538 -9.561 2.074 1.00 0.00 O ATOM 147 CB ASP A 11 -10.754 -8.337 5.131 1.00 0.00 C ATOM 148 CG ASP A 11 -9.513 -8.662 5.963 1.00 0.00 C ATOM 149 OD1 ASP A 11 -8.771 -7.743 6.269 1.00 0.00 O ATOM 150 OD2 ASP A 11 -9.325 -9.824 6.282 1.00 0.00 O ATOM 0 H ASP A 11 -12.128 -7.248 2.812 1.00 0.00 H new ATOM 0 HA ASP A 11 -9.304 -7.634 3.699 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -11.294 -7.501 5.575 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -11.434 -9.189 5.126 1.00 0.00 H new ATOM 155 N LEU A 12 -11.533 -9.947 2.906 1.00 0.00 N ATOM 156 CA LEU A 12 -11.693 -11.175 2.077 1.00 0.00 C ATOM 157 C LEU A 12 -12.697 -10.908 0.954 1.00 0.00 C ATOM 158 O LEU A 12 -12.794 -11.660 0.004 1.00 0.00 O ATOM 159 CB LEU A 12 -12.202 -12.319 2.954 1.00 0.00 C ATOM 160 CG LEU A 12 -11.358 -12.402 4.227 1.00 0.00 C ATOM 161 CD1 LEU A 12 -11.861 -13.554 5.099 1.00 0.00 C ATOM 162 CD2 LEU A 12 -9.894 -12.649 3.852 1.00 0.00 C ATOM 0 H LEU A 12 -12.322 -9.728 3.514 1.00 0.00 H new ATOM 0 HA LEU A 12 -10.730 -11.448 1.645 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -13.249 -12.157 3.209 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -12.149 -13.261 2.408 1.00 0.00 H new ATOM 0 HG LEU A 12 -11.440 -11.466 4.779 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -11.260 -13.613 6.006 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -12.904 -13.380 5.366 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -11.779 -14.491 4.547 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -9.291 -12.708 4.758 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -9.813 -13.585 3.300 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -9.534 -11.829 3.230 1.00 0.00 H new ATOM 174 N GLY A 13 -13.446 -9.844 1.053 1.00 0.00 N ATOM 175 CA GLY A 13 -14.443 -9.535 -0.012 1.00 0.00 C ATOM 176 C GLY A 13 -13.743 -8.853 -1.188 1.00 0.00 C ATOM 177 O GLY A 13 -14.376 -8.411 -2.126 1.00 0.00 O ATOM 0 H GLY A 13 -13.411 -9.176 1.823 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -14.928 -10.452 -0.347 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -15.225 -8.887 0.384 1.00 0.00 H new ATOM 181 N SER A 14 -12.441 -8.764 -1.147 1.00 0.00 N ATOM 182 CA SER A 14 -11.700 -8.110 -2.262 1.00 0.00 C ATOM 183 C SER A 14 -11.604 -9.071 -3.451 1.00 0.00 C ATOM 184 O SER A 14 -10.575 -9.669 -3.692 1.00 0.00 O ATOM 185 CB SER A 14 -10.293 -7.742 -1.791 1.00 0.00 C ATOM 186 OG SER A 14 -9.582 -8.929 -1.464 1.00 0.00 O ATOM 0 H SER A 14 -11.858 -9.117 -0.388 1.00 0.00 H new ATOM 0 HA SER A 14 -12.231 -7.208 -2.568 1.00 0.00 H new ATOM 0 HB2 SER A 14 -9.767 -7.193 -2.572 1.00 0.00 H new ATOM 0 HB3 SER A 14 -10.348 -7.086 -0.922 1.00 0.00 H new ATOM 0 HG SER A 14 -9.551 -9.518 -2.247 1.00 0.00 H new ATOM 192 N GLU A 15 -12.665 -9.223 -4.195 1.00 0.00 N ATOM 193 CA GLU A 15 -12.627 -10.144 -5.367 1.00 0.00 C ATOM 194 C GLU A 15 -11.899 -9.462 -6.528 1.00 0.00 C ATOM 195 O GLU A 15 -12.514 -8.969 -7.452 1.00 0.00 O ATOM 196 CB GLU A 15 -14.056 -10.488 -5.795 1.00 0.00 C ATOM 197 CG GLU A 15 -14.247 -12.006 -5.759 1.00 0.00 C ATOM 198 CD GLU A 15 -15.309 -12.411 -6.783 1.00 0.00 C ATOM 199 OE1 GLU A 15 -15.296 -11.859 -7.871 1.00 0.00 O ATOM 200 OE2 GLU A 15 -16.116 -13.268 -6.462 1.00 0.00 O ATOM 0 H GLU A 15 -13.556 -8.750 -4.043 1.00 0.00 H new ATOM 0 HA GLU A 15 -12.100 -11.058 -5.092 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -14.772 -10.005 -5.131 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -14.247 -10.110 -6.799 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -13.304 -12.507 -5.979 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -14.550 -12.322 -4.761 1.00 0.00 H new ATOM 207 N VAL A 16 -10.592 -9.433 -6.486 1.00 0.00 N ATOM 208 CA VAL A 16 -9.817 -8.786 -7.585 1.00 0.00 C ATOM 209 C VAL A 16 -10.507 -7.488 -8.013 1.00 0.00 C ATOM 210 O VAL A 16 -10.615 -7.189 -9.186 1.00 0.00 O ATOM 211 CB VAL A 16 -9.732 -9.741 -8.779 1.00 0.00 C ATOM 212 CG1 VAL A 16 -11.124 -9.944 -9.378 1.00 0.00 C ATOM 213 CG2 VAL A 16 -8.803 -9.147 -9.840 1.00 0.00 C ATOM 0 H VAL A 16 -10.027 -9.831 -5.736 1.00 0.00 H new ATOM 0 HA VAL A 16 -8.812 -8.556 -7.230 1.00 0.00 H new ATOM 0 HB VAL A 16 -9.340 -10.702 -8.445 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -11.059 -10.624 -10.227 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -11.787 -10.368 -8.623 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -11.520 -8.985 -9.711 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -8.741 -9.826 -10.691 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -9.196 -8.186 -10.171 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -7.809 -9.006 -9.416 1.00 0.00 H new ATOM 223 N SER A 17 -10.974 -6.714 -7.071 1.00 0.00 N ATOM 224 CA SER A 17 -11.657 -5.437 -7.425 1.00 0.00 C ATOM 225 C SER A 17 -12.878 -5.736 -8.297 1.00 0.00 C ATOM 226 O SER A 17 -13.344 -6.856 -8.364 1.00 0.00 O ATOM 227 CB SER A 17 -10.692 -4.533 -8.194 1.00 0.00 C ATOM 228 OG SER A 17 -9.430 -5.179 -8.309 1.00 0.00 O ATOM 0 H SER A 17 -10.912 -6.911 -6.072 1.00 0.00 H new ATOM 0 HA SER A 17 -11.975 -4.933 -6.512 1.00 0.00 H new ATOM 0 HB2 SER A 17 -11.092 -4.314 -9.184 1.00 0.00 H new ATOM 0 HB3 SER A 17 -10.579 -3.580 -7.677 1.00 0.00 H new ATOM 0 HG SER A 17 -9.448 -5.799 -9.068 1.00 0.00 H new ATOM 234 N ARG A 18 -13.400 -4.744 -8.966 1.00 0.00 N ATOM 235 CA ARG A 18 -14.589 -4.976 -9.832 1.00 0.00 C ATOM 236 C ARG A 18 -14.850 -3.729 -10.681 1.00 0.00 C ATOM 237 O ARG A 18 -15.252 -3.818 -11.824 1.00 0.00 O ATOM 238 CB ARG A 18 -15.809 -5.263 -8.956 1.00 0.00 C ATOM 239 CG ARG A 18 -16.826 -6.087 -9.749 1.00 0.00 C ATOM 240 CD ARG A 18 -16.605 -7.576 -9.471 1.00 0.00 C ATOM 241 NE ARG A 18 -16.539 -8.317 -10.761 1.00 0.00 N ATOM 242 CZ ARG A 18 -15.382 -8.648 -11.266 1.00 0.00 C ATOM 243 NH1 ARG A 18 -14.422 -9.059 -10.483 1.00 0.00 N ATOM 244 NH2 ARG A 18 -15.184 -8.567 -12.554 1.00 0.00 N ATOM 0 H ARG A 18 -13.054 -3.784 -8.950 1.00 0.00 H new ATOM 0 HA ARG A 18 -14.404 -5.829 -10.485 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -15.507 -5.804 -8.059 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -16.261 -4.328 -8.626 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -17.840 -5.800 -9.469 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -16.721 -5.886 -10.815 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -15.682 -7.719 -8.909 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -17.416 -7.966 -8.856 1.00 0.00 H new ATOM 0 HE ARG A 18 -17.399 -8.566 -11.250 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -14.576 -9.121 -9.477 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -13.518 -9.318 -10.877 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -15.934 -8.245 -13.166 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -14.280 -8.826 -12.948 1.00 0.00 H new ATOM 258 N PHE A 19 -14.626 -2.568 -10.129 1.00 0.00 N ATOM 259 CA PHE A 19 -14.861 -1.317 -10.904 1.00 0.00 C ATOM 260 C PHE A 19 -13.869 -0.244 -10.453 1.00 0.00 C ATOM 261 O PHE A 19 -13.576 -0.109 -9.281 1.00 0.00 O ATOM 262 CB PHE A 19 -16.290 -0.829 -10.661 1.00 0.00 C ATOM 263 CG PHE A 19 -17.256 -1.709 -11.416 1.00 0.00 C ATOM 264 CD1 PHE A 19 -17.318 -1.642 -12.815 1.00 0.00 C ATOM 265 CD2 PHE A 19 -18.091 -2.594 -10.720 1.00 0.00 C ATOM 266 CE1 PHE A 19 -18.216 -2.459 -13.517 1.00 0.00 C ATOM 267 CE2 PHE A 19 -18.988 -3.410 -11.421 1.00 0.00 C ATOM 268 CZ PHE A 19 -19.050 -3.343 -12.820 1.00 0.00 C ATOM 0 H PHE A 19 -14.291 -2.432 -9.175 1.00 0.00 H new ATOM 0 HA PHE A 19 -14.721 -1.515 -11.967 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -16.517 -0.852 -9.595 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -16.393 0.206 -10.987 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -16.674 -0.961 -13.352 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -18.043 -2.647 -9.642 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -18.265 -2.407 -14.595 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -19.632 -4.091 -10.884 1.00 0.00 H new ATOM 0 HZ PHE A 19 -19.741 -3.973 -13.361 1.00 0.00 H new ATOM 278 N PHE A 20 -13.347 0.520 -11.374 1.00 0.00 N ATOM 279 CA PHE A 20 -12.373 1.582 -10.993 1.00 0.00 C ATOM 280 C PHE A 20 -12.954 2.959 -11.324 1.00 0.00 C ATOM 281 O PHE A 20 -12.253 3.849 -11.762 1.00 0.00 O ATOM 282 CB PHE A 20 -11.071 1.379 -11.771 1.00 0.00 C ATOM 283 CG PHE A 20 -10.035 2.361 -11.280 1.00 0.00 C ATOM 284 CD1 PHE A 20 -9.899 2.607 -9.908 1.00 0.00 C ATOM 285 CD2 PHE A 20 -9.211 3.027 -12.197 1.00 0.00 C ATOM 286 CE1 PHE A 20 -8.938 3.519 -9.451 1.00 0.00 C ATOM 287 CE2 PHE A 20 -8.250 3.940 -11.740 1.00 0.00 C ATOM 288 CZ PHE A 20 -8.113 4.185 -10.368 1.00 0.00 C ATOM 0 H PHE A 20 -13.552 0.455 -12.371 1.00 0.00 H new ATOM 0 HA PHE A 20 -12.174 1.523 -9.923 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -10.712 0.358 -11.640 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -11.246 1.521 -12.837 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -10.535 2.094 -9.202 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -9.316 2.837 -13.255 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -8.833 3.709 -8.393 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -7.615 4.454 -12.446 1.00 0.00 H new ATOM 0 HZ PHE A 20 -7.372 4.887 -10.016 1.00 0.00 H new ATOM 298 N GLY A 21 -14.229 3.143 -11.115 1.00 0.00 N ATOM 299 CA GLY A 21 -14.849 4.465 -11.415 1.00 0.00 C ATOM 300 C GLY A 21 -14.864 5.316 -10.144 1.00 0.00 C ATOM 301 O GLY A 21 -14.334 6.409 -10.110 1.00 0.00 O ATOM 0 H GLY A 21 -14.867 2.436 -10.750 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -14.288 4.973 -12.200 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -15.864 4.328 -11.786 1.00 0.00 H new ATOM 305 N ARG A 22 -15.463 4.821 -9.097 1.00 0.00 N ATOM 306 CA ARG A 22 -15.509 5.596 -7.825 1.00 0.00 C ATOM 307 C ARG A 22 -15.300 4.641 -6.649 1.00 0.00 C ATOM 308 O ARG A 22 -15.960 4.735 -5.632 1.00 0.00 O ATOM 309 CB ARG A 22 -16.869 6.285 -7.697 1.00 0.00 C ATOM 310 CG ARG A 22 -17.227 6.956 -9.024 1.00 0.00 C ATOM 311 CD ARG A 22 -18.039 8.224 -8.756 1.00 0.00 C ATOM 312 NE ARG A 22 -18.795 8.598 -9.984 1.00 0.00 N ATOM 313 CZ ARG A 22 -19.601 9.623 -9.968 1.00 0.00 C ATOM 314 NH1 ARG A 22 -19.150 10.813 -10.260 1.00 0.00 N ATOM 315 NH2 ARG A 22 -20.859 9.460 -9.662 1.00 0.00 N ATOM 0 H ARG A 22 -15.924 3.911 -9.067 1.00 0.00 H new ATOM 0 HA ARG A 22 -14.724 6.352 -7.824 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -17.634 5.557 -7.427 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -16.839 7.026 -6.899 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -16.319 7.203 -9.575 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -17.801 6.270 -9.647 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -18.728 8.059 -7.928 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -17.376 9.038 -8.462 1.00 0.00 H new ATOM 0 HE ARG A 22 -18.682 8.052 -10.838 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -18.167 10.941 -10.501 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -19.781 11.615 -10.247 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -21.212 8.530 -9.435 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -21.489 10.262 -9.650 1.00 0.00 H new ATOM 329 N ALA A 23 -14.386 3.719 -6.784 1.00 0.00 N ATOM 330 CA ALA A 23 -14.128 2.750 -5.683 1.00 0.00 C ATOM 331 C ALA A 23 -13.885 3.508 -4.372 1.00 0.00 C ATOM 332 O ALA A 23 -12.855 4.132 -4.206 1.00 0.00 O ATOM 333 CB ALA A 23 -12.888 1.920 -6.024 1.00 0.00 C ATOM 0 H ALA A 23 -13.805 3.595 -7.613 1.00 0.00 H new ATOM 0 HA ALA A 23 -14.992 2.095 -5.566 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -12.694 1.209 -5.221 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -13.057 1.379 -6.955 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -12.028 2.580 -6.139 1.00 0.00 H new ATOM 339 N PRO A 24 -14.837 3.427 -3.473 1.00 0.00 N ATOM 340 CA PRO A 24 -14.747 4.092 -2.159 1.00 0.00 C ATOM 341 C PRO A 24 -13.895 3.257 -1.193 1.00 0.00 C ATOM 342 O PRO A 24 -14.216 3.122 -0.029 1.00 0.00 O ATOM 343 CB PRO A 24 -16.203 4.142 -1.687 1.00 0.00 C ATOM 344 CG PRO A 24 -16.949 3.022 -2.451 1.00 0.00 C ATOM 345 CD PRO A 24 -16.092 2.679 -3.683 1.00 0.00 C ATOM 0 HA PRO A 24 -14.280 5.076 -2.207 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -16.268 3.987 -0.610 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -16.646 5.116 -1.896 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -17.084 2.145 -1.817 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -17.943 3.354 -2.751 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -15.909 1.607 -3.754 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -16.585 2.980 -4.607 1.00 0.00 H new ATOM 353 N TYR A 25 -12.815 2.698 -1.664 1.00 0.00 N ATOM 354 CA TYR A 25 -11.948 1.877 -0.777 1.00 0.00 C ATOM 355 C TYR A 25 -10.567 1.747 -1.417 1.00 0.00 C ATOM 356 O TYR A 25 -10.213 0.717 -1.956 1.00 0.00 O ATOM 357 CB TYR A 25 -12.567 0.490 -0.593 1.00 0.00 C ATOM 358 CG TYR A 25 -13.565 0.536 0.540 1.00 0.00 C ATOM 359 CD1 TYR A 25 -13.209 1.124 1.761 1.00 0.00 C ATOM 360 CD2 TYR A 25 -14.846 -0.004 0.369 1.00 0.00 C ATOM 361 CE1 TYR A 25 -14.134 1.169 2.813 1.00 0.00 C ATOM 362 CE2 TYR A 25 -15.772 0.042 1.420 1.00 0.00 C ATOM 363 CZ TYR A 25 -15.416 0.629 2.642 1.00 0.00 C ATOM 364 OH TYR A 25 -16.328 0.676 3.677 1.00 0.00 O ATOM 0 H TYR A 25 -12.495 2.776 -2.629 1.00 0.00 H new ATOM 0 HA TYR A 25 -11.857 2.356 0.198 1.00 0.00 H new ATOM 0 HB2 TYR A 25 -13.058 0.173 -1.513 1.00 0.00 H new ATOM 0 HB3 TYR A 25 -11.789 -0.243 -0.378 1.00 0.00 H new ATOM 0 HD1 TYR A 25 -12.222 1.542 1.891 1.00 0.00 H new ATOM 0 HD2 TYR A 25 -15.120 -0.456 -0.573 1.00 0.00 H new ATOM 0 HE1 TYR A 25 -13.859 1.620 3.755 1.00 0.00 H new ATOM 0 HE2 TYR A 25 -16.760 -0.375 1.288 1.00 0.00 H new ATOM 0 HH TYR A 25 -17.168 0.259 3.392 1.00 0.00 H new ATOM 374 N PHE A 26 -9.791 2.790 -1.371 1.00 0.00 N ATOM 375 CA PHE A 26 -8.434 2.743 -1.985 1.00 0.00 C ATOM 376 C PHE A 26 -7.478 1.995 -1.054 1.00 0.00 C ATOM 377 O PHE A 26 -7.153 2.454 0.024 1.00 0.00 O ATOM 378 CB PHE A 26 -7.927 4.172 -2.193 1.00 0.00 C ATOM 379 CG PHE A 26 -6.664 4.152 -3.020 1.00 0.00 C ATOM 380 CD1 PHE A 26 -6.618 3.416 -4.211 1.00 0.00 C ATOM 381 CD2 PHE A 26 -5.540 4.873 -2.597 1.00 0.00 C ATOM 382 CE1 PHE A 26 -5.446 3.401 -4.979 1.00 0.00 C ATOM 383 CE2 PHE A 26 -4.368 4.858 -3.366 1.00 0.00 C ATOM 384 CZ PHE A 26 -4.321 4.123 -4.557 1.00 0.00 C ATOM 0 H PHE A 26 -10.037 3.678 -0.933 1.00 0.00 H new ATOM 0 HA PHE A 26 -8.483 2.227 -2.944 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -8.690 4.769 -2.692 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -7.734 4.643 -1.229 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -7.485 2.861 -4.537 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -5.576 5.440 -1.679 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -5.409 2.833 -5.897 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -3.501 5.413 -3.040 1.00 0.00 H new ATOM 0 HZ PHE A 26 -3.418 4.112 -5.150 1.00 0.00 H new ATOM 394 N MET A 27 -7.026 0.841 -1.468 1.00 0.00 N ATOM 395 CA MET A 27 -6.091 0.053 -0.618 1.00 0.00 C ATOM 396 C MET A 27 -4.650 0.372 -1.021 1.00 0.00 C ATOM 397 O MET A 27 -4.221 0.075 -2.117 1.00 0.00 O ATOM 398 CB MET A 27 -6.359 -1.440 -0.820 1.00 0.00 C ATOM 399 CG MET A 27 -5.651 -2.240 0.275 1.00 0.00 C ATOM 400 SD MET A 27 -5.148 -3.850 -0.385 1.00 0.00 S ATOM 401 CE MET A 27 -6.306 -4.860 0.571 1.00 0.00 C ATOM 0 H MET A 27 -7.266 0.410 -2.361 1.00 0.00 H new ATOM 0 HA MET A 27 -6.242 0.311 0.430 1.00 0.00 H new ATOM 0 HB2 MET A 27 -7.431 -1.635 -0.791 1.00 0.00 H new ATOM 0 HB3 MET A 27 -6.004 -1.754 -1.802 1.00 0.00 H new ATOM 0 HG2 MET A 27 -4.779 -1.693 0.634 1.00 0.00 H new ATOM 0 HG3 MET A 27 -6.315 -2.376 1.128 1.00 0.00 H new ATOM 0 HE1 MET A 27 -6.268 -5.890 0.217 1.00 0.00 H new ATOM 0 HE2 MET A 27 -6.032 -4.828 1.625 1.00 0.00 H new ATOM 0 HE3 MET A 27 -7.316 -4.471 0.447 1.00 0.00 H new ATOM 411 N ILE A 28 -3.901 0.978 -0.142 1.00 0.00 N ATOM 412 CA ILE A 28 -2.490 1.319 -0.474 1.00 0.00 C ATOM 413 C ILE A 28 -1.546 0.378 0.280 1.00 0.00 C ATOM 414 O ILE A 28 -1.593 0.274 1.490 1.00 0.00 O ATOM 415 CB ILE A 28 -2.213 2.768 -0.064 1.00 0.00 C ATOM 416 CG1 ILE A 28 -0.716 3.061 -0.187 1.00 0.00 C ATOM 417 CG2 ILE A 28 -2.656 2.981 1.384 1.00 0.00 C ATOM 418 CD1 ILE A 28 -0.484 4.071 -1.312 1.00 0.00 C ATOM 0 H ILE A 28 -4.205 1.252 0.792 1.00 0.00 H new ATOM 0 HA ILE A 28 -2.326 1.207 -1.546 1.00 0.00 H new ATOM 0 HB ILE A 28 -2.768 3.441 -0.718 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -0.333 3.455 0.754 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -0.170 2.140 -0.392 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -2.459 4.012 1.677 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -3.723 2.776 1.472 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -2.102 2.306 2.037 1.00 0.00 H new ATOM 0 HD11 ILE A 28 0.582 4.280 -1.399 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -0.852 3.659 -2.252 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -1.017 4.995 -1.087 1.00 0.00 H new ATOM 430 N VAL A 29 -0.690 -0.312 -0.427 1.00 0.00 N ATOM 431 CA VAL A 29 0.254 -1.246 0.248 1.00 0.00 C ATOM 432 C VAL A 29 1.695 -0.850 -0.084 1.00 0.00 C ATOM 433 O VAL A 29 2.091 -0.823 -1.233 1.00 0.00 O ATOM 434 CB VAL A 29 -0.005 -2.674 -0.238 1.00 0.00 C ATOM 435 CG1 VAL A 29 0.496 -3.669 0.810 1.00 0.00 C ATOM 436 CG2 VAL A 29 -1.506 -2.874 -0.455 1.00 0.00 C ATOM 0 H VAL A 29 -0.605 -0.268 -1.443 1.00 0.00 H new ATOM 0 HA VAL A 29 0.103 -1.194 1.326 1.00 0.00 H new ATOM 0 HB VAL A 29 0.523 -2.839 -1.177 1.00 0.00 H new ATOM 0 HG11 VAL A 29 0.311 -4.686 0.464 1.00 0.00 H new ATOM 0 HG12 VAL A 29 1.566 -3.527 0.965 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -0.032 -3.504 1.750 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -1.691 -3.891 -0.801 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -2.035 -2.708 0.484 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -1.863 -2.166 -1.202 1.00 0.00 H new ATOM 446 N GLU A 30 2.481 -0.545 0.912 1.00 0.00 N ATOM 447 CA GLU A 30 3.895 -0.152 0.653 1.00 0.00 C ATOM 448 C GLU A 30 4.835 -1.172 1.300 1.00 0.00 C ATOM 449 O GLU A 30 5.131 -1.100 2.476 1.00 0.00 O ATOM 450 CB GLU A 30 4.159 1.230 1.251 1.00 0.00 C ATOM 451 CG GLU A 30 5.614 1.627 0.991 1.00 0.00 C ATOM 452 CD GLU A 30 6.313 1.910 2.323 1.00 0.00 C ATOM 453 OE1 GLU A 30 5.848 2.779 3.042 1.00 0.00 O ATOM 454 OE2 GLU A 30 7.302 1.251 2.601 1.00 0.00 O ATOM 0 H GLU A 30 2.205 -0.551 1.894 1.00 0.00 H new ATOM 0 HA GLU A 30 4.071 -0.124 -0.422 1.00 0.00 H new ATOM 0 HB2 GLU A 30 3.486 1.964 0.809 1.00 0.00 H new ATOM 0 HB3 GLU A 30 3.959 1.219 2.323 1.00 0.00 H new ATOM 0 HG2 GLU A 30 6.131 0.828 0.460 1.00 0.00 H new ATOM 0 HG3 GLU A 30 5.653 2.510 0.353 1.00 0.00 H new ATOM 461 N MET A 31 5.308 -2.122 0.540 1.00 0.00 N ATOM 462 CA MET A 31 6.230 -3.144 1.113 1.00 0.00 C ATOM 463 C MET A 31 7.669 -2.630 1.034 1.00 0.00 C ATOM 464 O MET A 31 7.954 -1.658 0.364 1.00 0.00 O ATOM 465 CB MET A 31 6.107 -4.446 0.319 1.00 0.00 C ATOM 466 CG MET A 31 6.408 -4.176 -1.157 1.00 0.00 C ATOM 467 SD MET A 31 6.376 -5.736 -2.074 1.00 0.00 S ATOM 468 CE MET A 31 4.643 -6.150 -1.759 1.00 0.00 C ATOM 0 H MET A 31 5.096 -2.235 -0.451 1.00 0.00 H new ATOM 0 HA MET A 31 5.966 -3.330 2.154 1.00 0.00 H new ATOM 0 HB2 MET A 31 6.800 -5.190 0.712 1.00 0.00 H new ATOM 0 HB3 MET A 31 5.103 -4.856 0.427 1.00 0.00 H new ATOM 0 HG2 MET A 31 5.673 -3.485 -1.569 1.00 0.00 H new ATOM 0 HG3 MET A 31 7.384 -3.702 -1.259 1.00 0.00 H new ATOM 0 HE1 MET A 31 4.580 -7.150 -1.329 1.00 0.00 H new ATOM 0 HE2 MET A 31 4.217 -5.428 -1.062 1.00 0.00 H new ATOM 0 HE3 MET A 31 4.086 -6.122 -2.696 1.00 0.00 H new ATOM 478 N LYS A 32 8.578 -3.274 1.714 1.00 0.00 N ATOM 479 CA LYS A 32 9.997 -2.816 1.677 1.00 0.00 C ATOM 480 C LYS A 32 10.747 -3.560 0.568 1.00 0.00 C ATOM 481 O LYS A 32 10.740 -3.153 -0.576 1.00 0.00 O ATOM 482 CB LYS A 32 10.661 -3.096 3.027 1.00 0.00 C ATOM 483 CG LYS A 32 10.530 -1.865 3.926 1.00 0.00 C ATOM 484 CD LYS A 32 11.877 -1.568 4.587 1.00 0.00 C ATOM 485 CE LYS A 32 11.652 -1.167 6.046 1.00 0.00 C ATOM 486 NZ LYS A 32 11.778 -2.369 6.917 1.00 0.00 N ATOM 0 H LYS A 32 8.401 -4.095 2.292 1.00 0.00 H new ATOM 0 HA LYS A 32 10.027 -1.745 1.476 1.00 0.00 H new ATOM 0 HB2 LYS A 32 10.193 -3.958 3.502 1.00 0.00 H new ATOM 0 HB3 LYS A 32 11.713 -3.344 2.883 1.00 0.00 H new ATOM 0 HG2 LYS A 32 10.204 -1.006 3.339 1.00 0.00 H new ATOM 0 HG3 LYS A 32 9.770 -2.037 4.688 1.00 0.00 H new ATOM 0 HD2 LYS A 32 12.521 -2.446 4.535 1.00 0.00 H new ATOM 0 HD3 LYS A 32 12.387 -0.766 4.053 1.00 0.00 H new ATOM 0 HE2 LYS A 32 12.380 -0.412 6.343 1.00 0.00 H new ATOM 0 HE3 LYS A 32 10.664 -0.722 6.164 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 11.625 -2.097 7.909 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 11.067 -3.076 6.639 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 12.730 -2.775 6.812 1.00 0.00 H new ATOM 500 N LYS A 33 11.392 -4.647 0.896 1.00 0.00 N ATOM 501 CA LYS A 33 12.139 -5.409 -0.144 1.00 0.00 C ATOM 502 C LYS A 33 11.462 -6.762 -0.370 1.00 0.00 C ATOM 503 O LYS A 33 12.112 -7.759 -0.615 1.00 0.00 O ATOM 504 CB LYS A 33 13.583 -5.626 0.319 1.00 0.00 C ATOM 505 CG LYS A 33 13.612 -6.616 1.486 1.00 0.00 C ATOM 506 CD LYS A 33 14.628 -7.722 1.193 1.00 0.00 C ATOM 507 CE LYS A 33 15.597 -7.852 2.370 1.00 0.00 C ATOM 508 NZ LYS A 33 16.673 -8.824 2.022 1.00 0.00 N ATOM 0 H LYS A 33 11.434 -5.039 1.837 1.00 0.00 H new ATOM 0 HA LYS A 33 12.140 -4.846 -1.077 1.00 0.00 H new ATOM 0 HB2 LYS A 33 14.186 -6.005 -0.506 1.00 0.00 H new ATOM 0 HB3 LYS A 33 14.023 -4.677 0.625 1.00 0.00 H new ATOM 0 HG2 LYS A 33 13.877 -6.099 2.408 1.00 0.00 H new ATOM 0 HG3 LYS A 33 12.622 -7.047 1.635 1.00 0.00 H new ATOM 0 HD2 LYS A 33 14.113 -8.668 1.026 1.00 0.00 H new ATOM 0 HD3 LYS A 33 15.177 -7.493 0.280 1.00 0.00 H new ATOM 0 HE2 LYS A 33 16.032 -6.881 2.606 1.00 0.00 H new ATOM 0 HE3 LYS A 33 15.063 -8.187 3.259 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 17.332 -8.913 2.821 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 16.250 -9.752 1.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 17.188 -8.486 1.184 1.00 0.00 H new ATOM 522 N GLY A 34 10.161 -6.805 -0.290 1.00 0.00 N ATOM 523 CA GLY A 34 9.443 -8.094 -0.500 1.00 0.00 C ATOM 524 C GLY A 34 8.636 -8.440 0.753 1.00 0.00 C ATOM 525 O GLY A 34 8.290 -9.582 0.986 1.00 0.00 O ATOM 0 H GLY A 34 9.564 -6.003 -0.088 1.00 0.00 H new ATOM 0 HA2 GLY A 34 8.781 -8.017 -1.362 1.00 0.00 H new ATOM 0 HA3 GLY A 34 10.157 -8.889 -0.717 1.00 0.00 H new ATOM 529 N ASN A 35 8.331 -7.463 1.563 1.00 0.00 N ATOM 530 CA ASN A 35 7.545 -7.736 2.799 1.00 0.00 C ATOM 531 C ASN A 35 6.547 -6.600 3.027 1.00 0.00 C ATOM 532 O ASN A 35 6.919 -5.494 3.366 1.00 0.00 O ATOM 533 CB ASN A 35 8.495 -7.829 3.995 1.00 0.00 C ATOM 534 CG ASN A 35 7.775 -8.498 5.166 1.00 0.00 C ATOM 535 OD1 ASN A 35 7.600 -9.701 5.180 1.00 0.00 O ATOM 536 ND2 ASN A 35 7.346 -7.766 6.157 1.00 0.00 N ATOM 0 H ASN A 35 8.592 -6.487 1.422 1.00 0.00 H new ATOM 0 HA ASN A 35 7.006 -8.677 2.689 1.00 0.00 H new ATOM 0 HB2 ASN A 35 9.382 -8.401 3.725 1.00 0.00 H new ATOM 0 HB3 ASN A 35 8.833 -6.834 4.283 1.00 0.00 H new ATOM 0 HD21 ASN A 35 6.864 -8.203 6.943 1.00 0.00 H new ATOM 0 HD22 ASN A 35 7.492 -6.757 6.146 1.00 0.00 H new ATOM 543 N ILE A 36 5.281 -6.862 2.844 1.00 0.00 N ATOM 544 CA ILE A 36 4.261 -5.795 3.050 1.00 0.00 C ATOM 545 C ILE A 36 4.271 -5.350 4.514 1.00 0.00 C ATOM 546 O ILE A 36 3.931 -6.103 5.404 1.00 0.00 O ATOM 547 CB ILE A 36 2.874 -6.335 2.697 1.00 0.00 C ATOM 548 CG1 ILE A 36 2.845 -6.743 1.222 1.00 0.00 C ATOM 549 CG2 ILE A 36 1.826 -5.249 2.944 1.00 0.00 C ATOM 550 CD1 ILE A 36 2.240 -8.142 1.094 1.00 0.00 C ATOM 0 H ILE A 36 4.909 -7.769 2.561 1.00 0.00 H new ATOM 0 HA ILE A 36 4.497 -4.946 2.409 1.00 0.00 H new ATOM 0 HB ILE A 36 2.654 -7.202 3.319 1.00 0.00 H new ATOM 0 HG12 ILE A 36 2.258 -6.027 0.647 1.00 0.00 H new ATOM 0 HG13 ILE A 36 3.854 -6.732 0.810 1.00 0.00 H new ATOM 0 HG21 ILE A 36 0.837 -5.633 2.693 1.00 0.00 H new ATOM 0 HG22 ILE A 36 1.845 -4.957 3.994 1.00 0.00 H new ATOM 0 HG23 ILE A 36 2.047 -4.382 2.322 1.00 0.00 H new ATOM 0 HD11 ILE A 36 2.218 -8.434 0.044 1.00 0.00 H new ATOM 0 HD12 ILE A 36 2.845 -8.853 1.656 1.00 0.00 H new ATOM 0 HD13 ILE A 36 1.225 -8.137 1.490 1.00 0.00 H new ATOM 562 N GLU A 37 4.653 -4.130 4.769 1.00 0.00 N ATOM 563 CA GLU A 37 4.679 -3.636 6.173 1.00 0.00 C ATOM 564 C GLU A 37 3.803 -2.387 6.285 1.00 0.00 C ATOM 565 O GLU A 37 4.033 -1.525 7.111 1.00 0.00 O ATOM 566 CB GLU A 37 6.116 -3.291 6.569 1.00 0.00 C ATOM 567 CG GLU A 37 6.445 -3.942 7.912 1.00 0.00 C ATOM 568 CD GLU A 37 5.525 -3.373 8.994 1.00 0.00 C ATOM 569 OE1 GLU A 37 5.807 -2.287 9.472 1.00 0.00 O ATOM 570 OE2 GLU A 37 4.554 -4.033 9.325 1.00 0.00 O ATOM 0 H GLU A 37 4.948 -3.453 4.065 1.00 0.00 H new ATOM 0 HA GLU A 37 4.298 -4.410 6.839 1.00 0.00 H new ATOM 0 HB2 GLU A 37 6.809 -3.641 5.804 1.00 0.00 H new ATOM 0 HB3 GLU A 37 6.236 -2.210 6.638 1.00 0.00 H new ATOM 0 HG2 GLU A 37 6.320 -5.023 7.845 1.00 0.00 H new ATOM 0 HG3 GLU A 37 7.487 -3.757 8.172 1.00 0.00 H new ATOM 577 N SER A 38 2.799 -2.283 5.457 1.00 0.00 N ATOM 578 CA SER A 38 1.908 -1.090 5.511 1.00 0.00 C ATOM 579 C SER A 38 0.722 -1.297 4.566 1.00 0.00 C ATOM 580 O SER A 38 0.808 -1.048 3.381 1.00 0.00 O ATOM 581 CB SER A 38 2.695 0.151 5.085 1.00 0.00 C ATOM 582 OG SER A 38 1.863 0.986 4.291 1.00 0.00 O ATOM 0 H SER A 38 2.558 -2.973 4.746 1.00 0.00 H new ATOM 0 HA SER A 38 1.540 -0.954 6.528 1.00 0.00 H new ATOM 0 HB2 SER A 38 3.043 0.695 5.964 1.00 0.00 H new ATOM 0 HB3 SER A 38 3.580 -0.142 4.521 1.00 0.00 H new ATOM 0 HG SER A 38 1.695 0.554 3.427 1.00 0.00 H new ATOM 588 N SER A 39 -0.386 -1.753 5.084 1.00 0.00 N ATOM 589 CA SER A 39 -1.578 -1.977 4.220 1.00 0.00 C ATOM 590 C SER A 39 -2.772 -1.227 4.809 1.00 0.00 C ATOM 591 O SER A 39 -3.361 -1.647 5.784 1.00 0.00 O ATOM 592 CB SER A 39 -1.892 -3.472 4.164 1.00 0.00 C ATOM 593 OG SER A 39 -0.678 -4.210 4.214 1.00 0.00 O ATOM 0 H SER A 39 -0.516 -1.980 6.070 1.00 0.00 H new ATOM 0 HA SER A 39 -1.376 -1.612 3.213 1.00 0.00 H new ATOM 0 HB2 SER A 39 -2.535 -3.752 4.998 1.00 0.00 H new ATOM 0 HB3 SER A 39 -2.436 -3.707 3.249 1.00 0.00 H new ATOM 0 HG SER A 39 -0.877 -5.169 4.180 1.00 0.00 H new ATOM 599 N GLU A 40 -3.128 -0.113 4.231 1.00 0.00 N ATOM 600 CA GLU A 40 -4.280 0.664 4.770 1.00 0.00 C ATOM 601 C GLU A 40 -5.423 0.682 3.752 1.00 0.00 C ATOM 602 O GLU A 40 -5.208 0.767 2.560 1.00 0.00 O ATOM 603 CB GLU A 40 -3.836 2.100 5.057 1.00 0.00 C ATOM 604 CG GLU A 40 -3.052 2.139 6.370 1.00 0.00 C ATOM 605 CD GLU A 40 -4.028 2.212 7.545 1.00 0.00 C ATOM 606 OE1 GLU A 40 -4.699 1.226 7.796 1.00 0.00 O ATOM 607 OE2 GLU A 40 -4.088 3.256 8.176 1.00 0.00 O ATOM 0 H GLU A 40 -2.674 0.292 3.412 1.00 0.00 H new ATOM 0 HA GLU A 40 -4.627 0.194 5.690 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -3.217 2.471 4.240 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -4.705 2.755 5.120 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -2.426 1.251 6.458 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -2.386 3.002 6.383 1.00 0.00 H new ATOM 614 N VAL A 41 -6.638 0.608 4.220 1.00 0.00 N ATOM 615 CA VAL A 41 -7.804 0.627 3.292 1.00 0.00 C ATOM 616 C VAL A 41 -8.643 1.874 3.574 1.00 0.00 C ATOM 617 O VAL A 41 -9.468 1.888 4.466 1.00 0.00 O ATOM 618 CB VAL A 41 -8.652 -0.625 3.518 1.00 0.00 C ATOM 619 CG1 VAL A 41 -9.503 -0.901 2.276 1.00 0.00 C ATOM 620 CG2 VAL A 41 -7.734 -1.821 3.780 1.00 0.00 C ATOM 0 H VAL A 41 -6.875 0.535 5.209 1.00 0.00 H new ATOM 0 HA VAL A 41 -7.457 0.644 2.259 1.00 0.00 H new ATOM 0 HB VAL A 41 -9.305 -0.469 4.377 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -10.106 -1.794 2.440 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -10.158 -0.050 2.087 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -8.852 -1.056 1.416 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -8.337 -2.714 3.941 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -7.082 -1.974 2.920 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -7.128 -1.628 4.665 1.00 0.00 H new ATOM 630 N ILE A 42 -8.436 2.926 2.829 1.00 0.00 N ATOM 631 CA ILE A 42 -9.220 4.170 3.070 1.00 0.00 C ATOM 632 C ILE A 42 -9.992 4.549 1.806 1.00 0.00 C ATOM 633 O ILE A 42 -9.430 4.670 0.735 1.00 0.00 O ATOM 634 CB ILE A 42 -8.268 5.306 3.446 1.00 0.00 C ATOM 635 CG1 ILE A 42 -7.336 4.837 4.567 1.00 0.00 C ATOM 636 CG2 ILE A 42 -9.077 6.510 3.930 1.00 0.00 C ATOM 637 CD1 ILE A 42 -6.036 5.640 4.519 1.00 0.00 C ATOM 0 H ILE A 42 -7.760 2.978 2.067 1.00 0.00 H new ATOM 0 HA ILE A 42 -9.925 3.999 3.883 1.00 0.00 H new ATOM 0 HB ILE A 42 -7.678 5.590 2.574 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -7.820 4.966 5.535 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -7.123 3.774 4.457 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -8.399 7.320 4.198 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -9.744 6.843 3.135 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -9.666 6.226 4.802 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -5.373 5.306 5.317 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -5.550 5.488 3.555 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -6.257 6.699 4.651 1.00 0.00 H new ATOM 649 N GLU A 43 -11.277 4.742 1.924 1.00 0.00 N ATOM 650 CA GLU A 43 -12.092 5.117 0.735 1.00 0.00 C ATOM 651 C GLU A 43 -11.482 6.348 0.063 1.00 0.00 C ATOM 652 O GLU A 43 -10.899 7.195 0.710 1.00 0.00 O ATOM 653 CB GLU A 43 -13.519 5.440 1.180 1.00 0.00 C ATOM 654 CG GLU A 43 -13.478 6.436 2.340 1.00 0.00 C ATOM 655 CD GLU A 43 -14.332 7.657 1.997 1.00 0.00 C ATOM 656 OE1 GLU A 43 -15.544 7.555 2.097 1.00 0.00 O ATOM 657 OE2 GLU A 43 -13.761 8.675 1.642 1.00 0.00 O ATOM 0 H GLU A 43 -11.799 4.656 2.796 1.00 0.00 H new ATOM 0 HA GLU A 43 -12.106 4.287 0.029 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -14.085 5.858 0.348 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -14.031 4.528 1.488 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -13.848 5.965 3.251 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -12.450 6.741 2.534 1.00 0.00 H new ATOM 664 N ASN A 44 -11.614 6.458 -1.231 1.00 0.00 N ATOM 665 CA ASN A 44 -11.045 7.639 -1.939 1.00 0.00 C ATOM 666 C ASN A 44 -11.760 8.907 -1.460 1.00 0.00 C ATOM 667 O ASN A 44 -12.925 8.869 -1.121 1.00 0.00 O ATOM 668 CB ASN A 44 -11.244 7.477 -3.448 1.00 0.00 C ATOM 669 CG ASN A 44 -10.133 6.593 -4.018 1.00 0.00 C ATOM 670 OD1 ASN A 44 -10.353 5.434 -4.311 1.00 0.00 O ATOM 671 ND2 ASN A 44 -8.939 7.094 -4.187 1.00 0.00 N ATOM 0 H ASN A 44 -12.091 5.782 -1.828 1.00 0.00 H new ATOM 0 HA ASN A 44 -9.979 7.716 -1.723 1.00 0.00 H new ATOM 0 HB2 ASN A 44 -12.218 7.032 -3.651 1.00 0.00 H new ATOM 0 HB3 ASN A 44 -11.232 8.453 -3.934 1.00 0.00 H new ATOM 0 HD21 ASN A 44 -8.191 6.513 -4.565 1.00 0.00 H new ATOM 0 HD22 ASN A 44 -8.755 8.067 -3.941 1.00 0.00 H new ATOM 769 N GLY A 54 -14.393 10.458 -11.624 1.00 0.00 N ATOM 770 CA GLY A 54 -13.859 9.128 -11.214 1.00 0.00 C ATOM 771 C GLY A 54 -12.483 8.911 -11.844 1.00 0.00 C ATOM 772 O GLY A 54 -11.541 8.522 -11.182 1.00 0.00 O ATOM 0 HA2 GLY A 54 -13.785 9.074 -10.128 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -14.542 8.338 -11.527 1.00 0.00 H new ATOM 776 N ILE A 55 -12.358 9.159 -13.118 1.00 0.00 N ATOM 777 CA ILE A 55 -11.043 8.967 -13.790 1.00 0.00 C ATOM 778 C ILE A 55 -10.105 10.117 -13.420 1.00 0.00 C ATOM 779 O ILE A 55 -8.900 10.010 -13.540 1.00 0.00 O ATOM 780 CB ILE A 55 -11.245 8.943 -15.306 1.00 0.00 C ATOM 781 CG1 ILE A 55 -12.077 7.718 -15.690 1.00 0.00 C ATOM 782 CG2 ILE A 55 -9.885 8.874 -16.001 1.00 0.00 C ATOM 783 CD1 ILE A 55 -11.235 6.452 -15.520 1.00 0.00 C ATOM 0 H ILE A 55 -13.111 9.487 -13.723 1.00 0.00 H new ATOM 0 HA ILE A 55 -10.605 8.023 -13.465 1.00 0.00 H new ATOM 0 HB ILE A 55 -11.766 9.848 -15.617 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -12.968 7.661 -15.065 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -12.416 7.805 -16.722 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -10.029 8.857 -17.081 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -9.292 9.747 -15.728 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -9.363 7.969 -15.690 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -11.829 5.580 -15.794 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -10.357 6.510 -16.164 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -10.918 6.363 -14.481 1.00 0.00 H new ATOM 795 N ARG A 56 -10.647 11.216 -12.973 1.00 0.00 N ATOM 796 CA ARG A 56 -9.785 12.372 -12.598 1.00 0.00 C ATOM 797 C ARG A 56 -9.001 12.034 -11.327 1.00 0.00 C ATOM 798 O ARG A 56 -7.941 12.572 -11.080 1.00 0.00 O ATOM 799 CB ARG A 56 -10.662 13.600 -12.346 1.00 0.00 C ATOM 800 CG ARG A 56 -9.843 14.871 -12.583 1.00 0.00 C ATOM 801 CD ARG A 56 -9.637 15.076 -14.086 1.00 0.00 C ATOM 802 NE ARG A 56 -10.952 15.341 -14.736 1.00 0.00 N ATOM 803 CZ ARG A 56 -11.070 15.245 -16.033 1.00 0.00 C ATOM 804 NH1 ARG A 56 -10.985 14.078 -16.611 1.00 0.00 N ATOM 805 NH2 ARG A 56 -11.274 16.316 -16.752 1.00 0.00 N ATOM 0 H ARG A 56 -11.649 11.364 -12.851 1.00 0.00 H new ATOM 0 HA ARG A 56 -9.087 12.583 -13.408 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -11.527 13.584 -13.008 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -11.042 13.585 -11.325 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -10.357 15.732 -12.155 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -8.879 14.793 -12.081 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -8.958 15.911 -14.260 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -9.174 14.192 -14.524 1.00 0.00 H new ATOM 0 HE ARG A 56 -11.759 15.597 -14.168 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -10.826 13.241 -16.050 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -11.077 14.003 -17.624 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -11.341 17.228 -16.301 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -11.366 16.240 -17.765 1.00 0.00 H new ATOM 819 N THR A 57 -9.514 11.146 -10.519 1.00 0.00 N ATOM 820 CA THR A 57 -8.795 10.778 -9.267 1.00 0.00 C ATOM 821 C THR A 57 -7.385 10.291 -9.610 1.00 0.00 C ATOM 822 O THR A 57 -6.476 10.374 -8.808 1.00 0.00 O ATOM 823 CB THR A 57 -9.559 9.664 -8.547 1.00 0.00 C ATOM 824 OG1 THR A 57 -8.933 9.390 -7.302 1.00 0.00 O ATOM 825 CG2 THR A 57 -9.555 8.403 -9.411 1.00 0.00 C ATOM 0 H THR A 57 -10.398 10.661 -10.672 1.00 0.00 H new ATOM 0 HA THR A 57 -8.729 11.651 -8.618 1.00 0.00 H new ATOM 0 HB THR A 57 -10.587 9.981 -8.374 1.00 0.00 H new ATOM 0 HG1 THR A 57 -9.422 8.678 -6.840 1.00 0.00 H new ATOM 0 HG21 THR A 57 -10.099 7.609 -8.899 1.00 0.00 H new ATOM 0 HG22 THR A 57 -10.036 8.615 -10.366 1.00 0.00 H new ATOM 0 HG23 THR A 57 -8.527 8.085 -9.585 1.00 0.00 H new ATOM 833 N ALA A 58 -7.195 9.782 -10.796 1.00 0.00 N ATOM 834 CA ALA A 58 -5.844 9.292 -11.187 1.00 0.00 C ATOM 835 C ALA A 58 -4.791 10.321 -10.770 1.00 0.00 C ATOM 836 O ALA A 58 -3.737 9.980 -10.273 1.00 0.00 O ATOM 837 CB ALA A 58 -5.789 9.091 -12.703 1.00 0.00 C ATOM 0 H ALA A 58 -7.916 9.684 -11.510 1.00 0.00 H new ATOM 0 HA ALA A 58 -5.644 8.343 -10.690 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -4.800 8.732 -12.987 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -6.539 8.359 -13.000 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -5.989 10.039 -13.203 1.00 0.00 H new ATOM 843 N GLN A 59 -5.071 11.580 -10.969 1.00 0.00 N ATOM 844 CA GLN A 59 -4.089 12.633 -10.585 1.00 0.00 C ATOM 845 C GLN A 59 -3.657 12.425 -9.131 1.00 0.00 C ATOM 846 O GLN A 59 -2.486 12.296 -8.835 1.00 0.00 O ATOM 847 CB GLN A 59 -4.737 14.012 -10.733 1.00 0.00 C ATOM 848 CG GLN A 59 -3.658 15.094 -10.666 1.00 0.00 C ATOM 849 CD GLN A 59 -4.001 16.091 -9.557 1.00 0.00 C ATOM 850 OE1 GLN A 59 -3.428 16.049 -8.487 1.00 0.00 O ATOM 851 NE2 GLN A 59 -4.920 16.994 -9.769 1.00 0.00 N ATOM 0 H GLN A 59 -5.938 11.925 -11.381 1.00 0.00 H new ATOM 0 HA GLN A 59 -3.216 12.569 -11.235 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -5.271 14.075 -11.681 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -5.472 14.167 -9.943 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -2.685 14.641 -10.474 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -3.586 15.610 -11.623 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -5.402 17.030 -10.667 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -5.156 17.663 -9.036 1.00 0.00 H new ATOM 860 N ILE A 60 -4.593 12.392 -8.221 1.00 0.00 N ATOM 861 CA ILE A 60 -4.231 12.192 -6.790 1.00 0.00 C ATOM 862 C ILE A 60 -3.401 10.914 -6.650 1.00 0.00 C ATOM 863 O ILE A 60 -2.519 10.822 -5.821 1.00 0.00 O ATOM 864 CB ILE A 60 -5.505 12.066 -5.952 1.00 0.00 C ATOM 865 CG1 ILE A 60 -6.191 13.431 -5.860 1.00 0.00 C ATOM 866 CG2 ILE A 60 -5.145 11.581 -4.547 1.00 0.00 C ATOM 867 CD1 ILE A 60 -7.671 13.237 -5.530 1.00 0.00 C ATOM 0 H ILE A 60 -5.591 12.495 -8.407 1.00 0.00 H new ATOM 0 HA ILE A 60 -3.650 13.045 -6.440 1.00 0.00 H new ATOM 0 HB ILE A 60 -6.180 11.350 -6.422 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -5.713 14.039 -5.092 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -6.085 13.967 -6.803 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -6.052 11.491 -3.950 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -4.655 10.609 -4.612 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -4.470 12.297 -4.077 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -8.160 14.209 -5.464 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -8.144 12.645 -6.314 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -7.766 12.718 -4.576 1.00 0.00 H new ATOM 879 N ILE A 61 -3.678 9.926 -7.456 1.00 0.00 N ATOM 880 CA ILE A 61 -2.906 8.654 -7.368 1.00 0.00 C ATOM 881 C ILE A 61 -1.422 8.936 -7.619 1.00 0.00 C ATOM 882 O ILE A 61 -0.570 8.561 -6.839 1.00 0.00 O ATOM 883 CB ILE A 61 -3.423 7.672 -8.420 1.00 0.00 C ATOM 884 CG1 ILE A 61 -4.904 7.382 -8.163 1.00 0.00 C ATOM 885 CG2 ILE A 61 -2.627 6.368 -8.337 1.00 0.00 C ATOM 886 CD1 ILE A 61 -5.047 6.513 -6.914 1.00 0.00 C ATOM 0 H ILE A 61 -4.405 9.944 -8.171 1.00 0.00 H new ATOM 0 HA ILE A 61 -3.029 8.223 -6.375 1.00 0.00 H new ATOM 0 HB ILE A 61 -3.304 8.108 -9.412 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -5.451 8.316 -8.033 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -5.340 6.874 -9.023 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -2.996 5.668 -9.087 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -1.572 6.573 -8.520 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -2.745 5.932 -7.345 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -6.102 6.308 -6.733 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -4.514 5.573 -7.062 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -4.627 7.037 -6.056 1.00 0.00 H new ATOM 898 N ALA A 62 -1.107 9.589 -8.704 1.00 0.00 N ATOM 899 CA ALA A 62 0.322 9.891 -9.005 1.00 0.00 C ATOM 900 C ALA A 62 0.889 10.827 -7.935 1.00 0.00 C ATOM 901 O ALA A 62 2.086 10.906 -7.738 1.00 0.00 O ATOM 902 CB ALA A 62 0.420 10.564 -10.375 1.00 0.00 C ATOM 0 H ALA A 62 -1.777 9.927 -9.395 1.00 0.00 H new ATOM 0 HA ALA A 62 0.894 8.963 -9.011 1.00 0.00 H new ATOM 0 HB1 ALA A 62 1.464 10.786 -10.598 1.00 0.00 H new ATOM 0 HB2 ALA A 62 0.020 9.896 -11.138 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -0.154 11.490 -10.367 1.00 0.00 H new ATOM 908 N ASN A 63 0.041 11.537 -7.242 1.00 0.00 N ATOM 909 CA ASN A 63 0.533 12.468 -6.187 1.00 0.00 C ATOM 910 C ASN A 63 0.946 11.670 -4.948 1.00 0.00 C ATOM 911 O ASN A 63 1.736 12.119 -4.143 1.00 0.00 O ATOM 912 CB ASN A 63 -0.581 13.448 -5.813 1.00 0.00 C ATOM 913 CG ASN A 63 -0.347 14.783 -6.522 1.00 0.00 C ATOM 914 OD1 ASN A 63 -0.431 15.831 -5.913 1.00 0.00 O ATOM 915 ND2 ASN A 63 -0.055 14.790 -7.794 1.00 0.00 N ATOM 0 H ASN A 63 -0.972 11.513 -7.361 1.00 0.00 H new ATOM 0 HA ASN A 63 1.394 13.020 -6.565 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -1.550 13.038 -6.097 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -0.602 13.596 -4.733 1.00 0.00 H new ATOM 0 HD21 ASN A 63 0.103 15.675 -8.276 1.00 0.00 H new ATOM 0 HD22 ASN A 63 0.016 13.911 -8.306 1.00 0.00 H new ATOM 922 N ASN A 64 0.414 10.488 -4.785 1.00 0.00 N ATOM 923 CA ASN A 64 0.776 9.666 -3.597 1.00 0.00 C ATOM 924 C ASN A 64 2.076 8.906 -3.872 1.00 0.00 C ATOM 925 O ASN A 64 2.724 8.418 -2.968 1.00 0.00 O ATOM 926 CB ASN A 64 -0.346 8.666 -3.307 1.00 0.00 C ATOM 927 CG ASN A 64 -0.529 8.524 -1.795 1.00 0.00 C ATOM 928 OD1 ASN A 64 -1.581 8.828 -1.267 1.00 0.00 O ATOM 929 ND2 ASN A 64 0.456 8.069 -1.070 1.00 0.00 N ATOM 0 H ASN A 64 -0.255 10.058 -5.423 1.00 0.00 H new ATOM 0 HA ASN A 64 0.915 10.320 -2.736 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -1.275 9.004 -3.766 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -0.107 7.698 -3.747 1.00 0.00 H new ATOM 0 HD21 ASN A 64 0.343 7.969 -0.061 1.00 0.00 H new ATOM 0 HD22 ASN A 64 1.339 7.814 -1.512 1.00 0.00 H new ATOM 936 N GLY A 65 2.462 8.801 -5.114 1.00 0.00 N ATOM 937 CA GLY A 65 3.718 8.069 -5.444 1.00 0.00 C ATOM 938 C GLY A 65 3.380 6.644 -5.889 1.00 0.00 C ATOM 939 O GLY A 65 4.249 5.873 -6.245 1.00 0.00 O ATOM 0 H GLY A 65 1.963 9.190 -5.914 1.00 0.00 H new ATOM 0 HA2 GLY A 65 4.257 8.590 -6.235 1.00 0.00 H new ATOM 0 HA3 GLY A 65 4.375 8.043 -4.575 1.00 0.00 H new ATOM 943 N VAL A 66 2.122 6.289 -5.872 1.00 0.00 N ATOM 944 CA VAL A 66 1.724 4.915 -6.295 1.00 0.00 C ATOM 945 C VAL A 66 2.502 4.514 -7.542 1.00 0.00 C ATOM 946 O VAL A 66 2.142 4.853 -8.651 1.00 0.00 O ATOM 947 CB VAL A 66 0.227 4.889 -6.599 1.00 0.00 C ATOM 948 CG1 VAL A 66 -0.262 3.440 -6.634 1.00 0.00 C ATOM 949 CG2 VAL A 66 -0.529 5.655 -5.512 1.00 0.00 C ATOM 0 H VAL A 66 1.352 6.893 -5.583 1.00 0.00 H new ATOM 0 HA VAL A 66 1.946 4.213 -5.491 1.00 0.00 H new ATOM 0 HB VAL A 66 0.046 5.358 -7.566 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -1.330 3.422 -6.851 1.00 0.00 H new ATOM 0 HG12 VAL A 66 0.275 2.893 -7.409 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -0.080 2.971 -5.667 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -1.597 5.636 -5.729 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -0.347 5.188 -4.544 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -0.182 6.688 -5.487 1.00 0.00 H new ATOM 959 N LYS A 67 3.560 3.774 -7.369 1.00 0.00 N ATOM 960 CA LYS A 67 4.353 3.330 -8.542 1.00 0.00 C ATOM 961 C LYS A 67 3.638 2.144 -9.190 1.00 0.00 C ATOM 962 O LYS A 67 3.983 1.714 -10.274 1.00 0.00 O ATOM 963 CB LYS A 67 5.747 2.902 -8.081 1.00 0.00 C ATOM 964 CG LYS A 67 6.633 2.648 -9.301 1.00 0.00 C ATOM 965 CD LYS A 67 8.009 3.271 -9.067 1.00 0.00 C ATOM 966 CE LYS A 67 8.219 4.429 -10.045 1.00 0.00 C ATOM 967 NZ LYS A 67 7.050 5.353 -9.979 1.00 0.00 N ATOM 0 H LYS A 67 3.908 3.458 -6.464 1.00 0.00 H new ATOM 0 HA LYS A 67 4.450 4.144 -9.261 1.00 0.00 H new ATOM 0 HB2 LYS A 67 6.188 3.677 -7.453 1.00 0.00 H new ATOM 0 HB3 LYS A 67 5.679 2.000 -7.473 1.00 0.00 H new ATOM 0 HG2 LYS A 67 6.732 1.577 -9.476 1.00 0.00 H new ATOM 0 HG3 LYS A 67 6.175 3.076 -10.193 1.00 0.00 H new ATOM 0 HD2 LYS A 67 8.088 3.629 -8.041 1.00 0.00 H new ATOM 0 HD3 LYS A 67 8.788 2.520 -9.203 1.00 0.00 H new ATOM 0 HE2 LYS A 67 9.135 4.966 -9.798 1.00 0.00 H new ATOM 0 HE3 LYS A 67 8.337 4.046 -11.059 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 7.371 6.330 -10.133 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 6.361 5.095 -10.714 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 6.602 5.279 -9.044 1.00 0.00 H new ATOM 981 N ALA A 68 2.636 1.617 -8.533 1.00 0.00 N ATOM 982 CA ALA A 68 1.892 0.462 -9.111 1.00 0.00 C ATOM 983 C ALA A 68 0.388 0.689 -8.937 1.00 0.00 C ATOM 984 O ALA A 68 -0.107 0.796 -7.832 1.00 0.00 O ATOM 985 CB ALA A 68 2.302 -0.824 -8.391 1.00 0.00 C ATOM 0 H ALA A 68 2.303 1.937 -7.624 1.00 0.00 H new ATOM 0 HA ALA A 68 2.127 0.372 -10.172 1.00 0.00 H new ATOM 0 HB1 ALA A 68 1.757 -1.668 -8.815 1.00 0.00 H new ATOM 0 HB2 ALA A 68 3.373 -0.985 -8.515 1.00 0.00 H new ATOM 0 HB3 ALA A 68 2.068 -0.737 -7.330 1.00 0.00 H new ATOM 991 N VAL A 69 -0.341 0.768 -10.015 1.00 0.00 N ATOM 992 CA VAL A 69 -1.811 0.994 -9.905 1.00 0.00 C ATOM 993 C VAL A 69 -2.559 -0.261 -10.357 1.00 0.00 C ATOM 994 O VAL A 69 -2.431 -0.700 -11.483 1.00 0.00 O ATOM 995 CB VAL A 69 -2.214 2.175 -10.790 1.00 0.00 C ATOM 996 CG1 VAL A 69 -3.739 2.268 -10.856 1.00 0.00 C ATOM 997 CG2 VAL A 69 -1.648 3.469 -10.200 1.00 0.00 C ATOM 0 H VAL A 69 0.016 0.686 -10.967 1.00 0.00 H new ATOM 0 HA VAL A 69 -2.066 1.213 -8.868 1.00 0.00 H new ATOM 0 HB VAL A 69 -1.817 2.029 -11.794 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -4.025 3.110 -11.487 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -4.142 1.346 -11.276 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -4.138 2.414 -9.852 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -1.934 4.312 -10.829 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -2.045 3.615 -9.195 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -0.561 3.403 -10.154 1.00 0.00 H new ATOM 1007 N ILE A 70 -3.341 -0.844 -9.490 1.00 0.00 N ATOM 1008 CA ILE A 70 -4.095 -2.070 -9.875 1.00 0.00 C ATOM 1009 C ILE A 70 -5.557 -1.707 -10.151 1.00 0.00 C ATOM 1010 O ILE A 70 -6.269 -1.253 -9.277 1.00 0.00 O ATOM 1011 CB ILE A 70 -4.027 -3.086 -8.735 1.00 0.00 C ATOM 1012 CG1 ILE A 70 -2.660 -2.990 -8.051 1.00 0.00 C ATOM 1013 CG2 ILE A 70 -4.217 -4.497 -9.294 1.00 0.00 C ATOM 1014 CD1 ILE A 70 -1.570 -3.437 -9.026 1.00 0.00 C ATOM 0 H ILE A 70 -3.490 -0.525 -8.533 1.00 0.00 H new ATOM 0 HA ILE A 70 -3.654 -2.501 -10.774 1.00 0.00 H new ATOM 0 HB ILE A 70 -4.814 -2.874 -8.012 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -2.475 -1.966 -7.726 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -2.643 -3.615 -7.158 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -4.168 -5.220 -8.480 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -5.188 -4.567 -9.784 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -3.430 -4.711 -10.017 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -0.597 -3.369 -8.540 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -1.753 -4.468 -9.329 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -1.582 -2.793 -9.905 1.00 0.00 H new ATOM 1026 N ALA A 71 -6.008 -1.900 -11.363 1.00 0.00 N ATOM 1027 CA ALA A 71 -7.422 -1.562 -11.692 1.00 0.00 C ATOM 1028 C ALA A 71 -7.851 -2.308 -12.959 1.00 0.00 C ATOM 1029 O ALA A 71 -7.049 -2.927 -13.630 1.00 0.00 O ATOM 1030 CB ALA A 71 -7.542 -0.055 -11.926 1.00 0.00 C ATOM 0 H ALA A 71 -5.459 -2.276 -12.136 1.00 0.00 H new ATOM 0 HA ALA A 71 -8.066 -1.858 -10.864 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -8.575 0.195 -12.167 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -7.240 0.478 -11.024 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -6.896 0.237 -12.754 1.00 0.00 H new ATOM 1036 N SER A 72 -9.112 -2.250 -13.290 1.00 0.00 N ATOM 1037 CA SER A 72 -9.600 -2.950 -14.512 1.00 0.00 C ATOM 1038 C SER A 72 -10.504 -2.005 -15.309 1.00 0.00 C ATOM 1039 O SER A 72 -11.548 -2.391 -15.796 1.00 0.00 O ATOM 1040 CB SER A 72 -10.392 -4.194 -14.104 1.00 0.00 C ATOM 1041 OG SER A 72 -10.815 -4.887 -15.271 1.00 0.00 O ATOM 0 H SER A 72 -9.827 -1.747 -12.765 1.00 0.00 H new ATOM 0 HA SER A 72 -8.751 -3.248 -15.128 1.00 0.00 H new ATOM 0 HB2 SER A 72 -9.775 -4.845 -13.485 1.00 0.00 H new ATOM 0 HB3 SER A 72 -11.256 -3.908 -13.504 1.00 0.00 H new ATOM 0 HG SER A 72 -11.235 -4.256 -15.892 1.00 0.00 H new ATOM 1047 N SER A 73 -10.109 -0.768 -15.439 1.00 0.00 N ATOM 1048 CA SER A 73 -10.941 0.211 -16.197 1.00 0.00 C ATOM 1049 C SER A 73 -11.287 -0.359 -17.576 1.00 0.00 C ATOM 1050 O SER A 73 -10.580 -1.201 -18.094 1.00 0.00 O ATOM 1051 CB SER A 73 -10.162 1.516 -16.368 1.00 0.00 C ATOM 1052 OG SER A 73 -11.026 2.615 -16.114 1.00 0.00 O ATOM 0 H SER A 73 -9.244 -0.392 -15.052 1.00 0.00 H new ATOM 0 HA SER A 73 -11.861 0.403 -15.646 1.00 0.00 H new ATOM 0 HB2 SER A 73 -9.314 1.539 -15.683 1.00 0.00 H new ATOM 0 HB3 SER A 73 -9.758 1.582 -17.378 1.00 0.00 H new ATOM 0 HG SER A 73 -10.529 3.453 -16.221 1.00 0.00 H new ATOM 1058 N PRO A 74 -12.370 0.126 -18.129 1.00 0.00 N ATOM 1059 CA PRO A 74 -12.851 -0.307 -19.454 1.00 0.00 C ATOM 1060 C PRO A 74 -12.037 0.360 -20.569 1.00 0.00 C ATOM 1061 O PRO A 74 -12.122 -0.018 -21.721 1.00 0.00 O ATOM 1062 CB PRO A 74 -14.304 0.171 -19.482 1.00 0.00 C ATOM 1063 CG PRO A 74 -14.407 1.318 -18.447 1.00 0.00 C ATOM 1064 CD PRO A 74 -13.218 1.149 -17.483 1.00 0.00 C ATOM 0 HA PRO A 74 -12.755 -1.381 -19.612 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -14.579 0.520 -20.477 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -14.985 -0.642 -19.230 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -14.371 2.289 -18.940 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -15.353 1.269 -17.908 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -12.678 2.086 -17.348 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -13.549 0.827 -16.496 1.00 0.00 H new ATOM 1072 N GLY A 75 -11.251 1.349 -20.239 1.00 0.00 N ATOM 1073 CA GLY A 75 -10.439 2.034 -21.286 1.00 0.00 C ATOM 1074 C GLY A 75 -9.131 2.542 -20.673 1.00 0.00 C ATOM 1075 O GLY A 75 -9.059 2.794 -19.487 1.00 0.00 O ATOM 0 H GLY A 75 -11.136 1.712 -19.293 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -10.226 1.345 -22.103 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -11.001 2.866 -21.709 1.00 0.00 H new ATOM 1079 N PRO A 76 -8.131 2.676 -21.509 1.00 0.00 N ATOM 1080 CA PRO A 76 -6.798 3.153 -21.093 1.00 0.00 C ATOM 1081 C PRO A 76 -6.777 4.681 -20.961 1.00 0.00 C ATOM 1082 O PRO A 76 -5.812 5.328 -21.316 1.00 0.00 O ATOM 1083 CB PRO A 76 -5.886 2.700 -22.237 1.00 0.00 C ATOM 1084 CG PRO A 76 -6.796 2.513 -23.476 1.00 0.00 C ATOM 1085 CD PRO A 76 -8.235 2.358 -22.949 1.00 0.00 C ATOM 0 HA PRO A 76 -6.495 2.764 -20.121 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -5.112 3.442 -22.433 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -5.379 1.769 -21.984 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -6.719 3.370 -24.145 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -6.496 1.634 -24.047 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -8.920 3.036 -23.458 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -8.610 1.347 -23.107 1.00 0.00 H new ATOM 1093 N ASN A 77 -7.831 5.267 -20.456 1.00 0.00 N ATOM 1094 CA ASN A 77 -7.858 6.749 -20.307 1.00 0.00 C ATOM 1095 C ASN A 77 -7.024 7.160 -19.091 1.00 0.00 C ATOM 1096 O ASN A 77 -6.128 7.974 -19.187 1.00 0.00 O ATOM 1097 CB ASN A 77 -9.303 7.216 -20.114 1.00 0.00 C ATOM 1098 CG ASN A 77 -9.609 8.351 -21.094 1.00 0.00 C ATOM 1099 OD1 ASN A 77 -8.761 9.175 -21.371 1.00 0.00 O ATOM 1100 ND2 ASN A 77 -10.794 8.429 -21.633 1.00 0.00 N ATOM 0 H ASN A 77 -8.672 4.783 -20.141 1.00 0.00 H new ATOM 0 HA ASN A 77 -7.442 7.209 -21.203 1.00 0.00 H new ATOM 0 HB2 ASN A 77 -9.990 6.385 -20.278 1.00 0.00 H new ATOM 0 HB3 ASN A 77 -9.452 7.556 -19.089 1.00 0.00 H new ATOM 0 HD21 ASN A 77 -11.008 9.182 -22.287 1.00 0.00 H new ATOM 0 HD22 ASN A 77 -11.507 7.737 -21.401 1.00 0.00 H new ATOM 1107 N ALA A 78 -7.317 6.607 -17.946 1.00 0.00 N ATOM 1108 CA ALA A 78 -6.546 6.970 -16.724 1.00 0.00 C ATOM 1109 C ALA A 78 -5.100 6.491 -16.867 1.00 0.00 C ATOM 1110 O ALA A 78 -4.171 7.160 -16.457 1.00 0.00 O ATOM 1111 CB ALA A 78 -7.188 6.308 -15.502 1.00 0.00 C ATOM 0 H ALA A 78 -8.057 5.920 -17.804 1.00 0.00 H new ATOM 0 HA ALA A 78 -6.555 8.053 -16.598 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -6.625 6.573 -14.607 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -8.217 6.654 -15.399 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -7.180 5.225 -15.629 1.00 0.00 H new ATOM 1117 N PHE A 79 -4.900 5.338 -17.444 1.00 0.00 N ATOM 1118 CA PHE A 79 -3.512 4.820 -17.610 1.00 0.00 C ATOM 1119 C PHE A 79 -2.667 5.855 -18.356 1.00 0.00 C ATOM 1120 O PHE A 79 -1.485 5.995 -18.113 1.00 0.00 O ATOM 1121 CB PHE A 79 -3.543 3.516 -18.412 1.00 0.00 C ATOM 1122 CG PHE A 79 -4.614 2.599 -17.864 1.00 0.00 C ATOM 1123 CD1 PHE A 79 -5.136 2.810 -16.578 1.00 0.00 C ATOM 1124 CD2 PHE A 79 -5.084 1.534 -18.644 1.00 0.00 C ATOM 1125 CE1 PHE A 79 -6.128 1.956 -16.077 1.00 0.00 C ATOM 1126 CE2 PHE A 79 -6.076 0.680 -18.142 1.00 0.00 C ATOM 1127 CZ PHE A 79 -6.597 0.891 -16.858 1.00 0.00 C ATOM 0 H PHE A 79 -5.636 4.733 -17.807 1.00 0.00 H new ATOM 0 HA PHE A 79 -3.077 4.632 -16.629 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -3.738 3.730 -19.463 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -2.571 3.025 -18.362 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -4.774 3.630 -15.975 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -4.682 1.371 -19.633 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -6.531 2.119 -15.088 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -6.439 -0.140 -18.744 1.00 0.00 H new ATOM 0 HZ PHE A 79 -7.360 0.233 -16.470 1.00 0.00 H new ATOM 1137 N GLU A 80 -3.261 6.580 -19.263 1.00 0.00 N ATOM 1138 CA GLU A 80 -2.489 7.602 -20.023 1.00 0.00 C ATOM 1139 C GLU A 80 -1.769 8.531 -19.044 1.00 0.00 C ATOM 1140 O GLU A 80 -0.565 8.691 -19.096 1.00 0.00 O ATOM 1141 CB GLU A 80 -3.443 8.421 -20.895 1.00 0.00 C ATOM 1142 CG GLU A 80 -3.491 7.821 -22.301 1.00 0.00 C ATOM 1143 CD GLU A 80 -4.404 8.671 -23.188 1.00 0.00 C ATOM 1144 OE1 GLU A 80 -4.530 9.852 -22.913 1.00 0.00 O ATOM 1145 OE2 GLU A 80 -4.960 8.125 -24.126 1.00 0.00 O ATOM 0 H GLU A 80 -4.248 6.509 -19.511 1.00 0.00 H new ATOM 0 HA GLU A 80 -1.756 7.103 -20.657 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -4.441 8.426 -20.456 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -3.110 9.458 -20.942 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -2.488 7.782 -22.726 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -3.859 6.796 -22.258 1.00 0.00 H new ATOM 1152 N VAL A 81 -2.495 9.145 -18.149 1.00 0.00 N ATOM 1153 CA VAL A 81 -1.850 10.062 -17.167 1.00 0.00 C ATOM 1154 C VAL A 81 -0.841 9.279 -16.326 1.00 0.00 C ATOM 1155 O VAL A 81 0.226 9.765 -16.007 1.00 0.00 O ATOM 1156 CB VAL A 81 -2.920 10.658 -16.250 1.00 0.00 C ATOM 1157 CG1 VAL A 81 -2.391 11.946 -15.618 1.00 0.00 C ATOM 1158 CG2 VAL A 81 -4.176 10.970 -17.064 1.00 0.00 C ATOM 0 H VAL A 81 -3.506 9.051 -18.056 1.00 0.00 H new ATOM 0 HA VAL A 81 -1.337 10.863 -17.699 1.00 0.00 H new ATOM 0 HB VAL A 81 -3.164 9.941 -15.466 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -3.153 12.371 -14.965 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -1.496 11.725 -15.036 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -2.146 12.662 -16.402 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -4.937 11.394 -16.410 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -3.932 11.686 -17.849 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -4.555 10.053 -17.514 1.00 0.00 H new ATOM 1168 N LEU A 82 -1.173 8.072 -15.963 1.00 0.00 N ATOM 1169 CA LEU A 82 -0.240 7.254 -15.139 1.00 0.00 C ATOM 1170 C LEU A 82 1.141 7.215 -15.798 1.00 0.00 C ATOM 1171 O LEU A 82 2.157 7.295 -15.138 1.00 0.00 O ATOM 1172 CB LEU A 82 -0.787 5.832 -15.021 1.00 0.00 C ATOM 1173 CG LEU A 82 -0.848 5.429 -13.548 1.00 0.00 C ATOM 1174 CD1 LEU A 82 -1.873 6.301 -12.820 1.00 0.00 C ATOM 1175 CD2 LEU A 82 -1.262 3.960 -13.441 1.00 0.00 C ATOM 0 H LEU A 82 -2.053 7.615 -16.202 1.00 0.00 H new ATOM 0 HA LEU A 82 -0.150 7.699 -14.148 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -1.780 5.775 -15.466 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -0.151 5.140 -15.572 1.00 0.00 H new ATOM 0 HG LEU A 82 0.133 5.567 -13.093 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -1.916 6.013 -11.770 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -1.580 7.348 -12.897 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -2.855 6.164 -13.274 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -1.306 3.670 -12.391 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -2.243 3.824 -13.897 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -0.532 3.338 -13.959 1.00 0.00 H new ATOM 1187 N ASN A 83 1.188 7.085 -17.096 1.00 0.00 N ATOM 1188 CA ASN A 83 2.506 7.032 -17.791 1.00 0.00 C ATOM 1189 C ASN A 83 3.133 8.429 -17.822 1.00 0.00 C ATOM 1190 O ASN A 83 4.332 8.582 -17.697 1.00 0.00 O ATOM 1191 CB ASN A 83 2.305 6.531 -19.223 1.00 0.00 C ATOM 1192 CG ASN A 83 3.429 5.561 -19.588 1.00 0.00 C ATOM 1193 OD1 ASN A 83 4.139 5.770 -20.552 1.00 0.00 O ATOM 1194 ND2 ASN A 83 3.623 4.501 -18.853 1.00 0.00 N ATOM 0 H ASN A 83 0.372 7.013 -17.704 1.00 0.00 H new ATOM 0 HA ASN A 83 3.169 6.353 -17.255 1.00 0.00 H new ATOM 0 HB2 ASN A 83 1.339 6.035 -19.313 1.00 0.00 H new ATOM 0 HB3 ASN A 83 2.297 7.372 -19.916 1.00 0.00 H new ATOM 0 HD21 ASN A 83 4.370 3.848 -19.087 1.00 0.00 H new ATOM 0 HD22 ASN A 83 3.027 4.325 -18.044 1.00 0.00 H new ATOM 1201 N GLU A 84 2.335 9.446 -17.990 1.00 0.00 N ATOM 1202 CA GLU A 84 2.891 10.830 -18.034 1.00 0.00 C ATOM 1203 C GLU A 84 3.457 11.206 -16.662 1.00 0.00 C ATOM 1204 O GLU A 84 4.262 12.108 -16.540 1.00 0.00 O ATOM 1205 CB GLU A 84 1.782 11.812 -18.412 1.00 0.00 C ATOM 1206 CG GLU A 84 1.913 12.187 -19.889 1.00 0.00 C ATOM 1207 CD GLU A 84 1.301 13.570 -20.120 1.00 0.00 C ATOM 1208 OE1 GLU A 84 1.914 14.543 -19.713 1.00 0.00 O ATOM 1209 OE2 GLU A 84 0.230 13.632 -20.698 1.00 0.00 O ATOM 0 H GLU A 84 1.323 9.381 -18.099 1.00 0.00 H new ATOM 0 HA GLU A 84 3.688 10.873 -18.776 1.00 0.00 H new ATOM 0 HB2 GLU A 84 0.806 11.364 -18.225 1.00 0.00 H new ATOM 0 HB3 GLU A 84 1.847 12.706 -17.792 1.00 0.00 H new ATOM 0 HG2 GLU A 84 2.963 12.188 -20.183 1.00 0.00 H new ATOM 0 HG3 GLU A 84 1.409 11.446 -20.509 1.00 0.00 H new ATOM 1216 N LEU A 85 3.043 10.526 -15.628 1.00 0.00 N ATOM 1217 CA LEU A 85 3.560 10.855 -14.269 1.00 0.00 C ATOM 1218 C LEU A 85 4.608 9.821 -13.851 1.00 0.00 C ATOM 1219 O LEU A 85 4.848 9.604 -12.681 1.00 0.00 O ATOM 1220 CB LEU A 85 2.404 10.845 -13.267 1.00 0.00 C ATOM 1221 CG LEU A 85 2.323 12.205 -12.574 1.00 0.00 C ATOM 1222 CD1 LEU A 85 3.540 12.387 -11.667 1.00 0.00 C ATOM 1223 CD2 LEU A 85 2.303 13.314 -13.629 1.00 0.00 C ATOM 0 H LEU A 85 2.371 9.759 -15.665 1.00 0.00 H new ATOM 0 HA LEU A 85 4.018 11.844 -14.287 1.00 0.00 H new ATOM 0 HB2 LEU A 85 1.466 10.629 -13.779 1.00 0.00 H new ATOM 0 HB3 LEU A 85 2.554 10.057 -12.529 1.00 0.00 H new ATOM 0 HG LEU A 85 1.413 12.255 -11.976 1.00 0.00 H new ATOM 0 HD11 LEU A 85 3.483 13.357 -11.172 1.00 0.00 H new ATOM 0 HD12 LEU A 85 3.556 11.597 -10.916 1.00 0.00 H new ATOM 0 HD13 LEU A 85 4.450 12.337 -12.265 1.00 0.00 H new ATOM 0 HD21 LEU A 85 2.245 14.284 -13.136 1.00 0.00 H new ATOM 0 HD22 LEU A 85 3.213 13.264 -14.226 1.00 0.00 H new ATOM 0 HD23 LEU A 85 1.436 13.184 -14.277 1.00 0.00 H new ATOM 1235 N GLY A 86 5.239 9.184 -14.801 1.00 0.00 N ATOM 1236 CA GLY A 86 6.274 8.167 -14.458 1.00 0.00 C ATOM 1237 C GLY A 86 5.699 7.156 -13.463 1.00 0.00 C ATOM 1238 O GLY A 86 6.136 7.064 -12.333 1.00 0.00 O ATOM 0 H GLY A 86 5.082 9.324 -15.799 1.00 0.00 H new ATOM 0 HA2 GLY A 86 6.606 7.654 -15.361 1.00 0.00 H new ATOM 0 HA3 GLY A 86 7.149 8.656 -14.029 1.00 0.00 H new ATOM 1242 N ILE A 87 4.723 6.394 -13.875 1.00 0.00 N ATOM 1243 CA ILE A 87 4.123 5.387 -12.955 1.00 0.00 C ATOM 1244 C ILE A 87 3.813 4.109 -13.737 1.00 0.00 C ATOM 1245 O ILE A 87 3.636 4.136 -14.939 1.00 0.00 O ATOM 1246 CB ILE A 87 2.834 5.950 -12.353 1.00 0.00 C ATOM 1247 CG1 ILE A 87 3.177 7.101 -11.405 1.00 0.00 C ATOM 1248 CG2 ILE A 87 2.110 4.850 -11.575 1.00 0.00 C ATOM 1249 CD1 ILE A 87 1.921 7.929 -11.127 1.00 0.00 C ATOM 0 H ILE A 87 4.315 6.425 -14.809 1.00 0.00 H new ATOM 0 HA ILE A 87 4.824 5.159 -12.152 1.00 0.00 H new ATOM 0 HB ILE A 87 2.189 6.314 -13.152 1.00 0.00 H new ATOM 0 HG12 ILE A 87 3.580 6.709 -10.471 1.00 0.00 H new ATOM 0 HG13 ILE A 87 3.950 7.731 -11.846 1.00 0.00 H new ATOM 0 HG21 ILE A 87 1.192 5.252 -11.146 1.00 0.00 H new ATOM 0 HG22 ILE A 87 1.867 4.028 -12.248 1.00 0.00 H new ATOM 0 HG23 ILE A 87 2.755 4.485 -10.775 1.00 0.00 H new ATOM 0 HD11 ILE A 87 2.167 8.748 -10.452 1.00 0.00 H new ATOM 0 HD12 ILE A 87 1.537 8.334 -12.064 1.00 0.00 H new ATOM 0 HD13 ILE A 87 1.162 7.296 -10.667 1.00 0.00 H new ATOM 1261 N LYS A 88 3.752 2.988 -13.071 1.00 0.00 N ATOM 1262 CA LYS A 88 3.460 1.714 -13.787 1.00 0.00 C ATOM 1263 C LYS A 88 1.993 1.330 -13.586 1.00 0.00 C ATOM 1264 O LYS A 88 1.488 1.319 -12.480 1.00 0.00 O ATOM 1265 CB LYS A 88 4.358 0.604 -13.240 1.00 0.00 C ATOM 1266 CG LYS A 88 5.805 0.865 -13.666 1.00 0.00 C ATOM 1267 CD LYS A 88 6.759 0.255 -12.638 1.00 0.00 C ATOM 1268 CE LYS A 88 8.143 0.080 -13.266 1.00 0.00 C ATOM 1269 NZ LYS A 88 8.981 1.274 -12.962 1.00 0.00 N ATOM 0 H LYS A 88 3.891 2.899 -12.064 1.00 0.00 H new ATOM 0 HA LYS A 88 3.653 1.848 -14.851 1.00 0.00 H new ATOM 0 HB2 LYS A 88 4.288 0.567 -12.153 1.00 0.00 H new ATOM 0 HB3 LYS A 88 4.026 -0.365 -13.614 1.00 0.00 H new ATOM 0 HG2 LYS A 88 5.989 0.433 -14.650 1.00 0.00 H new ATOM 0 HG3 LYS A 88 5.982 1.937 -13.751 1.00 0.00 H new ATOM 0 HD2 LYS A 88 6.825 0.899 -11.761 1.00 0.00 H new ATOM 0 HD3 LYS A 88 6.378 -0.708 -12.299 1.00 0.00 H new ATOM 0 HE2 LYS A 88 8.619 -0.820 -12.877 1.00 0.00 H new ATOM 0 HE3 LYS A 88 8.051 -0.048 -14.345 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 9.922 1.155 -13.389 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 8.528 2.125 -13.353 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 9.079 1.376 -11.932 1.00 0.00 H new ATOM 1283 N ILE A 89 1.306 1.012 -14.649 1.00 0.00 N ATOM 1284 CA ILE A 89 -0.128 0.624 -14.523 1.00 0.00 C ATOM 1285 C ILE A 89 -0.237 -0.898 -14.436 1.00 0.00 C ATOM 1286 O ILE A 89 0.666 -1.617 -14.815 1.00 0.00 O ATOM 1287 CB ILE A 89 -0.901 1.118 -15.747 1.00 0.00 C ATOM 1288 CG1 ILE A 89 -0.489 2.558 -16.064 1.00 0.00 C ATOM 1289 CG2 ILE A 89 -2.401 1.069 -15.457 1.00 0.00 C ATOM 1290 CD1 ILE A 89 0.451 2.566 -17.270 1.00 0.00 C ATOM 0 H ILE A 89 1.676 1.004 -15.600 1.00 0.00 H new ATOM 0 HA ILE A 89 -0.547 1.073 -13.622 1.00 0.00 H new ATOM 0 HB ILE A 89 -0.675 0.479 -16.601 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -1.372 3.162 -16.274 1.00 0.00 H new ATOM 0 HG13 ILE A 89 0.005 3.004 -15.201 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -2.952 1.421 -16.329 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -2.695 0.044 -15.232 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -2.627 1.707 -14.603 1.00 0.00 H new ATOM 0 HD11 ILE A 89 0.744 3.591 -17.496 1.00 0.00 H new ATOM 0 HD12 ILE A 89 1.339 1.976 -17.043 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -0.059 2.136 -18.132 1.00 0.00 H new ATOM 1302 N TYR A 90 -1.336 -1.394 -13.940 1.00 0.00 N ATOM 1303 CA TYR A 90 -1.504 -2.869 -13.829 1.00 0.00 C ATOM 1304 C TYR A 90 -2.966 -3.235 -14.092 1.00 0.00 C ATOM 1305 O TYR A 90 -3.874 -2.597 -13.597 1.00 0.00 O ATOM 1306 CB TYR A 90 -1.111 -3.324 -12.422 1.00 0.00 C ATOM 1307 CG TYR A 90 0.108 -4.210 -12.504 1.00 0.00 C ATOM 1308 CD1 TYR A 90 1.342 -3.670 -12.889 1.00 0.00 C ATOM 1309 CD2 TYR A 90 0.007 -5.572 -12.192 1.00 0.00 C ATOM 1310 CE1 TYR A 90 2.475 -4.491 -12.964 1.00 0.00 C ATOM 1311 CE2 TYR A 90 1.139 -6.394 -12.266 1.00 0.00 C ATOM 1312 CZ TYR A 90 2.374 -5.853 -12.653 1.00 0.00 C ATOM 1313 OH TYR A 90 3.488 -6.663 -12.725 1.00 0.00 O ATOM 0 H TYR A 90 -2.125 -0.841 -13.607 1.00 0.00 H new ATOM 0 HA TYR A 90 -0.866 -3.363 -14.562 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -0.903 -2.459 -11.793 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -1.936 -3.864 -11.959 1.00 0.00 H new ATOM 0 HD1 TYR A 90 1.420 -2.620 -13.128 1.00 0.00 H new ATOM 0 HD2 TYR A 90 -0.944 -5.988 -11.894 1.00 0.00 H new ATOM 0 HE1 TYR A 90 3.426 -4.074 -13.261 1.00 0.00 H new ATOM 0 HE2 TYR A 90 1.061 -7.444 -12.025 1.00 0.00 H new ATOM 0 HH TYR A 90 3.249 -7.511 -13.153 1.00 0.00 H new ATOM 1323 N ARG A 91 -3.200 -4.255 -14.869 1.00 0.00 N ATOM 1324 CA ARG A 91 -4.604 -4.658 -15.163 1.00 0.00 C ATOM 1325 C ARG A 91 -4.998 -5.830 -14.261 1.00 0.00 C ATOM 1326 O ARG A 91 -4.220 -6.731 -14.021 1.00 0.00 O ATOM 1327 CB ARG A 91 -4.717 -5.081 -16.628 1.00 0.00 C ATOM 1328 CG ARG A 91 -6.173 -5.417 -16.950 1.00 0.00 C ATOM 1329 CD ARG A 91 -6.458 -5.100 -18.419 1.00 0.00 C ATOM 1330 NE ARG A 91 -7.228 -6.221 -19.029 1.00 0.00 N ATOM 1331 CZ ARG A 91 -8.176 -5.969 -19.890 1.00 0.00 C ATOM 1332 NH1 ARG A 91 -7.877 -5.721 -21.136 1.00 0.00 N ATOM 1333 NH2 ARG A 91 -9.422 -5.964 -19.504 1.00 0.00 N ATOM 0 H ARG A 91 -2.481 -4.827 -15.313 1.00 0.00 H new ATOM 0 HA ARG A 91 -5.270 -3.816 -14.976 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -4.365 -4.279 -17.277 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -4.082 -5.947 -16.818 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -6.367 -6.471 -16.750 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -6.840 -4.843 -16.307 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -7.023 -4.171 -18.499 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -5.522 -4.952 -18.958 1.00 0.00 H new ATOM 0 HE ARG A 91 -7.014 -7.185 -18.774 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -6.902 -5.724 -21.437 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -8.618 -5.524 -21.809 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -9.655 -6.157 -18.530 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -10.163 -5.767 -20.176 1.00 0.00 H new ATOM 1347 N ALA A 92 -6.203 -5.825 -13.761 1.00 0.00 N ATOM 1348 CA ALA A 92 -6.646 -6.938 -12.875 1.00 0.00 C ATOM 1349 C ALA A 92 -7.080 -8.129 -13.732 1.00 0.00 C ATOM 1350 O ALA A 92 -8.073 -8.076 -14.429 1.00 0.00 O ATOM 1351 CB ALA A 92 -7.824 -6.473 -12.016 1.00 0.00 C ATOM 0 H ALA A 92 -6.900 -5.099 -13.928 1.00 0.00 H new ATOM 0 HA ALA A 92 -5.821 -7.235 -12.228 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -8.147 -7.289 -11.369 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -7.516 -5.625 -11.405 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -8.650 -6.174 -12.662 1.00 0.00 H new ATOM 1357 N THR A 93 -6.343 -9.205 -13.684 1.00 0.00 N ATOM 1358 CA THR A 93 -6.712 -10.399 -14.496 1.00 0.00 C ATOM 1359 C THR A 93 -6.371 -11.671 -13.716 1.00 0.00 C ATOM 1360 O THR A 93 -6.310 -12.752 -14.267 1.00 0.00 O ATOM 1361 CB THR A 93 -5.932 -10.381 -15.814 1.00 0.00 C ATOM 1362 OG1 THR A 93 -5.527 -9.050 -16.103 1.00 0.00 O ATOM 1363 CG2 THR A 93 -6.821 -10.903 -16.943 1.00 0.00 C ATOM 0 H THR A 93 -5.501 -9.309 -13.117 1.00 0.00 H new ATOM 0 HA THR A 93 -7.781 -10.379 -14.708 1.00 0.00 H new ATOM 0 HB THR A 93 -5.052 -11.018 -15.725 1.00 0.00 H new ATOM 0 HG1 THR A 93 -5.026 -9.036 -16.945 1.00 0.00 H new ATOM 0 HG21 THR A 93 -6.265 -10.890 -17.880 1.00 0.00 H new ATOM 0 HG22 THR A 93 -7.131 -11.924 -16.720 1.00 0.00 H new ATOM 0 HG23 THR A 93 -7.702 -10.268 -17.035 1.00 0.00 H new ATOM 1371 N GLY A 94 -6.153 -11.551 -12.435 1.00 0.00 N ATOM 1372 CA GLY A 94 -5.819 -12.753 -11.619 1.00 0.00 C ATOM 1373 C GLY A 94 -7.104 -13.345 -11.039 1.00 0.00 C ATOM 1374 O GLY A 94 -8.070 -13.562 -11.743 1.00 0.00 O ATOM 0 H GLY A 94 -6.192 -10.673 -11.918 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -5.309 -13.494 -12.235 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -5.135 -12.482 -10.815 1.00 0.00 H new ATOM 1378 N THR A 95 -7.125 -13.610 -9.761 1.00 0.00 N ATOM 1379 CA THR A 95 -8.351 -14.188 -9.140 1.00 0.00 C ATOM 1380 C THR A 95 -8.826 -13.278 -8.005 1.00 0.00 C ATOM 1381 O THR A 95 -9.958 -12.841 -7.980 1.00 0.00 O ATOM 1382 CB THR A 95 -8.035 -15.578 -8.583 1.00 0.00 C ATOM 1383 OG1 THR A 95 -7.699 -16.449 -9.654 1.00 0.00 O ATOM 1384 CG2 THR A 95 -9.257 -16.123 -7.843 1.00 0.00 C ATOM 0 H THR A 95 -6.347 -13.451 -9.121 1.00 0.00 H new ATOM 0 HA THR A 95 -9.135 -14.269 -9.892 1.00 0.00 H new ATOM 0 HB THR A 95 -7.195 -15.511 -7.891 1.00 0.00 H new ATOM 0 HG1 THR A 95 -7.494 -17.339 -9.300 1.00 0.00 H new ATOM 0 HG21 THR A 95 -9.031 -17.113 -7.447 1.00 0.00 H new ATOM 0 HG22 THR A 95 -9.514 -15.454 -7.022 1.00 0.00 H new ATOM 0 HG23 THR A 95 -10.099 -16.192 -8.532 1.00 0.00 H new ATOM 1392 N SER A 96 -7.967 -12.988 -7.065 1.00 0.00 N ATOM 1393 CA SER A 96 -8.369 -12.106 -5.933 1.00 0.00 C ATOM 1394 C SER A 96 -7.361 -10.962 -5.795 1.00 0.00 C ATOM 1395 O SER A 96 -6.335 -10.946 -6.447 1.00 0.00 O ATOM 1396 CB SER A 96 -8.398 -12.918 -4.638 1.00 0.00 C ATOM 1397 OG SER A 96 -8.967 -14.195 -4.897 1.00 0.00 O ATOM 0 H SER A 96 -7.004 -13.324 -7.033 1.00 0.00 H new ATOM 0 HA SER A 96 -9.360 -11.696 -6.127 1.00 0.00 H new ATOM 0 HB2 SER A 96 -7.388 -13.030 -4.243 1.00 0.00 H new ATOM 0 HB3 SER A 96 -8.981 -12.394 -3.880 1.00 0.00 H new ATOM 0 HG SER A 96 -8.986 -14.719 -4.069 1.00 0.00 H new ATOM 1403 N VAL A 97 -7.645 -10.006 -4.954 1.00 0.00 N ATOM 1404 CA VAL A 97 -6.703 -8.865 -4.779 1.00 0.00 C ATOM 1405 C VAL A 97 -5.521 -9.303 -3.909 1.00 0.00 C ATOM 1406 O VAL A 97 -4.380 -9.002 -4.199 1.00 0.00 O ATOM 1407 CB VAL A 97 -7.432 -7.701 -4.104 1.00 0.00 C ATOM 1408 CG1 VAL A 97 -6.418 -6.645 -3.664 1.00 0.00 C ATOM 1409 CG2 VAL A 97 -8.417 -7.078 -5.095 1.00 0.00 C ATOM 0 H VAL A 97 -8.488 -9.966 -4.381 1.00 0.00 H new ATOM 0 HA VAL A 97 -6.335 -8.547 -5.754 1.00 0.00 H new ATOM 0 HB VAL A 97 -7.972 -8.069 -3.231 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -6.940 -5.817 -3.184 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -5.714 -7.088 -2.959 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -5.876 -6.276 -4.535 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -8.938 -6.248 -4.617 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -7.874 -6.712 -5.966 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -9.142 -7.829 -5.409 1.00 0.00 H new ATOM 1419 N GLU A 98 -5.785 -10.011 -2.845 1.00 0.00 N ATOM 1420 CA GLU A 98 -4.676 -10.466 -1.959 1.00 0.00 C ATOM 1421 C GLU A 98 -3.665 -11.272 -2.777 1.00 0.00 C ATOM 1422 O GLU A 98 -2.475 -11.224 -2.531 1.00 0.00 O ATOM 1423 CB GLU A 98 -5.242 -11.345 -0.842 1.00 0.00 C ATOM 1424 CG GLU A 98 -6.260 -12.325 -1.428 1.00 0.00 C ATOM 1425 CD GLU A 98 -7.636 -12.060 -0.814 1.00 0.00 C ATOM 1426 OE1 GLU A 98 -8.281 -11.116 -1.240 1.00 0.00 O ATOM 1427 OE2 GLU A 98 -8.022 -12.804 0.073 1.00 0.00 O ATOM 0 H GLU A 98 -6.720 -10.294 -2.551 1.00 0.00 H new ATOM 0 HA GLU A 98 -4.182 -9.598 -1.524 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -4.436 -11.891 -0.352 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -5.715 -10.724 -0.081 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -6.306 -12.214 -2.511 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -5.951 -13.351 -1.226 1.00 0.00 H new ATOM 1434 N GLU A 99 -4.126 -12.013 -3.745 1.00 0.00 N ATOM 1435 CA GLU A 99 -3.189 -12.820 -4.575 1.00 0.00 C ATOM 1436 C GLU A 99 -2.458 -11.904 -5.557 1.00 0.00 C ATOM 1437 O GLU A 99 -1.247 -11.812 -5.550 1.00 0.00 O ATOM 1438 CB GLU A 99 -3.975 -13.877 -5.352 1.00 0.00 C ATOM 1439 CG GLU A 99 -3.001 -14.859 -6.006 1.00 0.00 C ATOM 1440 CD GLU A 99 -2.293 -15.672 -4.920 1.00 0.00 C ATOM 1441 OE1 GLU A 99 -2.739 -15.624 -3.787 1.00 0.00 O ATOM 1442 OE2 GLU A 99 -1.315 -16.327 -5.242 1.00 0.00 O ATOM 0 H GLU A 99 -5.111 -12.095 -3.997 1.00 0.00 H new ATOM 0 HA GLU A 99 -2.463 -13.311 -3.927 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -4.650 -14.410 -4.682 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -4.593 -13.400 -6.113 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -3.538 -15.524 -6.682 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -2.269 -14.318 -6.606 1.00 0.00 H new ATOM 1449 N ASN A 100 -3.183 -11.226 -6.404 1.00 0.00 N ATOM 1450 CA ASN A 100 -2.524 -10.319 -7.386 1.00 0.00 C ATOM 1451 C ASN A 100 -1.555 -9.391 -6.652 1.00 0.00 C ATOM 1452 O ASN A 100 -0.632 -8.856 -7.233 1.00 0.00 O ATOM 1453 CB ASN A 100 -3.585 -9.483 -8.102 1.00 0.00 C ATOM 1454 CG ASN A 100 -2.910 -8.589 -9.145 1.00 0.00 C ATOM 1455 OD1 ASN A 100 -2.044 -9.033 -9.872 1.00 0.00 O ATOM 1456 ND2 ASN A 100 -3.272 -7.340 -9.248 1.00 0.00 N ATOM 0 H ASN A 100 -4.201 -11.261 -6.459 1.00 0.00 H new ATOM 0 HA ASN A 100 -1.976 -10.913 -8.117 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -4.314 -10.135 -8.583 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -4.130 -8.873 -7.382 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -2.828 -6.736 -9.939 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -3.999 -6.968 -8.637 1.00 0.00 H new ATOM 1463 N LEU A 101 -1.756 -9.195 -5.378 1.00 0.00 N ATOM 1464 CA LEU A 101 -0.844 -8.304 -4.609 1.00 0.00 C ATOM 1465 C LEU A 101 0.560 -8.910 -4.593 1.00 0.00 C ATOM 1466 O LEU A 101 1.475 -8.400 -5.208 1.00 0.00 O ATOM 1467 CB LEU A 101 -1.356 -8.168 -3.174 1.00 0.00 C ATOM 1468 CG LEU A 101 -0.336 -7.394 -2.339 1.00 0.00 C ATOM 1469 CD1 LEU A 101 -0.388 -5.912 -2.716 1.00 0.00 C ATOM 1470 CD2 LEU A 101 -0.668 -7.555 -0.854 1.00 0.00 C ATOM 0 H LEU A 101 -2.512 -9.614 -4.837 1.00 0.00 H new ATOM 0 HA LEU A 101 -0.812 -7.321 -5.078 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -2.315 -7.651 -3.167 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -1.522 -9.154 -2.741 1.00 0.00 H new ATOM 0 HG LEU A 101 0.664 -7.783 -2.533 1.00 0.00 H new ATOM 0 HD11 LEU A 101 0.339 -5.359 -2.121 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -0.153 -5.797 -3.774 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -1.387 -5.522 -2.522 1.00 0.00 H new ATOM 0 HD21 LEU A 101 0.058 -7.004 -0.257 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -1.667 -7.165 -0.660 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -0.632 -8.611 -0.585 1.00 0.00 H new ATOM 1482 N LYS A 102 0.735 -9.998 -3.895 1.00 0.00 N ATOM 1483 CA LYS A 102 2.078 -10.641 -3.837 1.00 0.00 C ATOM 1484 C LYS A 102 2.486 -11.097 -5.240 1.00 0.00 C ATOM 1485 O LYS A 102 3.632 -11.406 -5.494 1.00 0.00 O ATOM 1486 CB LYS A 102 2.019 -11.852 -2.905 1.00 0.00 C ATOM 1487 CG LYS A 102 2.627 -11.483 -1.550 1.00 0.00 C ATOM 1488 CD LYS A 102 3.617 -12.568 -1.125 1.00 0.00 C ATOM 1489 CE LYS A 102 3.173 -13.171 0.211 1.00 0.00 C ATOM 1490 NZ LYS A 102 4.210 -14.123 0.695 1.00 0.00 N ATOM 0 H LYS A 102 0.005 -10.470 -3.362 1.00 0.00 H new ATOM 0 HA LYS A 102 2.810 -9.926 -3.461 1.00 0.00 H new ATOM 0 HB2 LYS A 102 0.986 -12.175 -2.776 1.00 0.00 H new ATOM 0 HB3 LYS A 102 2.562 -12.689 -3.344 1.00 0.00 H new ATOM 0 HG2 LYS A 102 3.133 -10.520 -1.616 1.00 0.00 H new ATOM 0 HG3 LYS A 102 1.841 -11.380 -0.802 1.00 0.00 H new ATOM 0 HD2 LYS A 102 3.670 -13.345 -1.887 1.00 0.00 H new ATOM 0 HD3 LYS A 102 4.617 -12.145 -1.031 1.00 0.00 H new ATOM 0 HE2 LYS A 102 3.019 -12.381 0.945 1.00 0.00 H new ATOM 0 HE3 LYS A 102 2.220 -13.685 0.091 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 3.909 -14.533 1.602 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 4.336 -14.883 -0.003 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 5.110 -13.619 0.825 1.00 0.00 H new ATOM 1504 N LEU A 103 1.553 -11.144 -6.151 1.00 0.00 N ATOM 1505 CA LEU A 103 1.883 -11.582 -7.538 1.00 0.00 C ATOM 1506 C LEU A 103 2.585 -10.444 -8.283 1.00 0.00 C ATOM 1507 O LEU A 103 3.427 -10.669 -9.129 1.00 0.00 O ATOM 1508 CB LEU A 103 0.593 -11.949 -8.273 1.00 0.00 C ATOM 1509 CG LEU A 103 0.847 -13.148 -9.188 1.00 0.00 C ATOM 1510 CD1 LEU A 103 0.433 -14.434 -8.472 1.00 0.00 C ATOM 1511 CD2 LEU A 103 0.024 -12.991 -10.469 1.00 0.00 C ATOM 0 H LEU A 103 0.575 -10.898 -5.995 1.00 0.00 H new ATOM 0 HA LEU A 103 2.542 -12.449 -7.497 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -0.192 -12.187 -7.555 1.00 0.00 H new ATOM 0 HB3 LEU A 103 0.242 -11.099 -8.859 1.00 0.00 H new ATOM 0 HG LEU A 103 1.907 -13.197 -9.438 1.00 0.00 H new ATOM 0 HD11 LEU A 103 0.614 -15.288 -9.124 1.00 0.00 H new ATOM 0 HD12 LEU A 103 1.016 -14.545 -7.558 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -0.627 -14.386 -8.222 1.00 0.00 H new ATOM 0 HD21 LEU A 103 0.203 -13.844 -11.123 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -1.035 -12.943 -10.217 1.00 0.00 H new ATOM 0 HD23 LEU A 103 0.318 -12.074 -10.980 1.00 0.00 H new ATOM 1523 N PHE A 104 2.240 -9.224 -7.979 1.00 0.00 N ATOM 1524 CA PHE A 104 2.879 -8.069 -8.671 1.00 0.00 C ATOM 1525 C PHE A 104 4.332 -7.927 -8.200 1.00 0.00 C ATOM 1526 O PHE A 104 5.190 -7.482 -8.936 1.00 0.00 O ATOM 1527 CB PHE A 104 2.095 -6.791 -8.340 1.00 0.00 C ATOM 1528 CG PHE A 104 2.930 -5.567 -8.650 1.00 0.00 C ATOM 1529 CD1 PHE A 104 3.966 -5.187 -7.786 1.00 0.00 C ATOM 1530 CD2 PHE A 104 2.665 -4.811 -9.800 1.00 0.00 C ATOM 1531 CE1 PHE A 104 4.737 -4.052 -8.072 1.00 0.00 C ATOM 1532 CE2 PHE A 104 3.436 -3.678 -10.086 1.00 0.00 C ATOM 1533 CZ PHE A 104 4.472 -3.297 -9.223 1.00 0.00 C ATOM 0 H PHE A 104 1.541 -8.976 -7.279 1.00 0.00 H new ATOM 0 HA PHE A 104 2.870 -8.233 -9.749 1.00 0.00 H new ATOM 0 HB2 PHE A 104 1.170 -6.764 -8.916 1.00 0.00 H new ATOM 0 HB3 PHE A 104 1.814 -6.791 -7.287 1.00 0.00 H new ATOM 0 HD1 PHE A 104 4.170 -5.769 -6.899 1.00 0.00 H new ATOM 0 HD2 PHE A 104 1.866 -5.102 -10.466 1.00 0.00 H new ATOM 0 HE1 PHE A 104 5.535 -3.759 -7.406 1.00 0.00 H new ATOM 0 HE2 PHE A 104 3.232 -3.097 -10.973 1.00 0.00 H new ATOM 0 HZ PHE A 104 5.066 -2.422 -9.444 1.00 0.00 H new ATOM 1543 N THR A 105 4.615 -8.290 -6.978 1.00 0.00 N ATOM 1544 CA THR A 105 6.010 -8.160 -6.467 1.00 0.00 C ATOM 1545 C THR A 105 6.895 -9.250 -7.078 1.00 0.00 C ATOM 1546 O THR A 105 8.103 -9.131 -7.118 1.00 0.00 O ATOM 1547 CB THR A 105 6.012 -8.299 -4.944 1.00 0.00 C ATOM 1548 OG1 THR A 105 5.289 -7.218 -4.372 1.00 0.00 O ATOM 1549 CG2 THR A 105 7.453 -8.280 -4.431 1.00 0.00 C ATOM 0 H THR A 105 3.942 -8.670 -6.313 1.00 0.00 H new ATOM 0 HA THR A 105 6.401 -7.182 -6.746 1.00 0.00 H new ATOM 0 HB THR A 105 5.541 -9.241 -4.663 1.00 0.00 H new ATOM 0 HG1 THR A 105 5.912 -6.609 -3.923 1.00 0.00 H new ATOM 0 HG21 THR A 105 7.454 -8.379 -3.346 1.00 0.00 H new ATOM 0 HG22 THR A 105 8.007 -9.109 -4.872 1.00 0.00 H new ATOM 0 HG23 THR A 105 7.926 -7.338 -4.710 1.00 0.00 H new ATOM 1557 N GLU A 106 6.307 -10.314 -7.553 1.00 0.00 N ATOM 1558 CA GLU A 106 7.123 -11.405 -8.157 1.00 0.00 C ATOM 1559 C GLU A 106 7.253 -11.172 -9.662 1.00 0.00 C ATOM 1560 O GLU A 106 7.688 -12.035 -10.398 1.00 0.00 O ATOM 1561 CB GLU A 106 6.440 -12.750 -7.910 1.00 0.00 C ATOM 1562 CG GLU A 106 6.099 -12.886 -6.424 1.00 0.00 C ATOM 1563 CD GLU A 106 7.375 -13.172 -5.630 1.00 0.00 C ATOM 1564 OE1 GLU A 106 8.064 -14.118 -5.975 1.00 0.00 O ATOM 1565 OE2 GLU A 106 7.642 -12.441 -4.691 1.00 0.00 O ATOM 0 H GLU A 106 5.300 -10.475 -7.549 1.00 0.00 H new ATOM 0 HA GLU A 106 8.113 -11.410 -7.702 1.00 0.00 H new ATOM 0 HB2 GLU A 106 5.533 -12.825 -8.510 1.00 0.00 H new ATOM 0 HB3 GLU A 106 7.095 -13.564 -8.219 1.00 0.00 H new ATOM 0 HG2 GLU A 106 5.631 -11.970 -6.062 1.00 0.00 H new ATOM 0 HG3 GLU A 106 5.379 -13.691 -6.278 1.00 0.00 H new ATOM 1572 N GLY A 107 6.878 -10.013 -10.125 1.00 0.00 N ATOM 1573 CA GLY A 107 6.979 -9.726 -11.583 1.00 0.00 C ATOM 1574 C GLY A 107 6.267 -10.830 -12.366 1.00 0.00 C ATOM 1575 O GLY A 107 6.833 -11.440 -13.251 1.00 0.00 O ATOM 0 H GLY A 107 6.506 -9.252 -9.557 1.00 0.00 H new ATOM 0 HA2 GLY A 107 6.530 -8.758 -11.807 1.00 0.00 H new ATOM 0 HA3 GLY A 107 8.026 -9.669 -11.882 1.00 0.00 H new ATOM 1579 N ASN A 108 5.031 -11.092 -12.045 1.00 0.00 N ATOM 1580 CA ASN A 108 4.283 -12.157 -12.769 1.00 0.00 C ATOM 1581 C ASN A 108 3.782 -11.609 -14.106 1.00 0.00 C ATOM 1582 O ASN A 108 4.177 -12.066 -15.160 1.00 0.00 O ATOM 1583 CB ASN A 108 3.090 -12.609 -11.924 1.00 0.00 C ATOM 1584 CG ASN A 108 2.885 -14.115 -12.096 1.00 0.00 C ATOM 1585 OD1 ASN A 108 2.697 -14.592 -13.199 1.00 0.00 O ATOM 1586 ND2 ASN A 108 2.914 -14.888 -11.047 1.00 0.00 N ATOM 0 H ASN A 108 4.506 -10.614 -11.312 1.00 0.00 H new ATOM 0 HA ASN A 108 4.943 -13.006 -12.948 1.00 0.00 H new ATOM 0 HB2 ASN A 108 3.264 -12.372 -10.874 1.00 0.00 H new ATOM 0 HB3 ASN A 108 2.191 -12.072 -12.227 1.00 0.00 H new ATOM 0 HD21 ASN A 108 2.779 -15.894 -11.151 1.00 0.00 H new ATOM 0 HD22 ASN A 108 3.072 -14.487 -10.122 1.00 0.00 H new ATOM 1593 N LEU A 109 2.916 -10.632 -14.072 1.00 0.00 N ATOM 1594 CA LEU A 109 2.393 -10.058 -15.344 1.00 0.00 C ATOM 1595 C LEU A 109 1.361 -8.971 -15.029 1.00 0.00 C ATOM 1596 O LEU A 109 1.402 -8.351 -13.984 1.00 0.00 O ATOM 1597 CB LEU A 109 1.738 -11.166 -16.174 1.00 0.00 C ATOM 1598 CG LEU A 109 0.535 -11.731 -15.418 1.00 0.00 C ATOM 1599 CD1 LEU A 109 -0.680 -11.770 -16.347 1.00 0.00 C ATOM 1600 CD2 LEU A 109 0.855 -13.149 -14.940 1.00 0.00 C ATOM 0 H LEU A 109 2.549 -10.208 -13.220 1.00 0.00 H new ATOM 0 HA LEU A 109 3.215 -9.621 -15.911 1.00 0.00 H new ATOM 0 HB2 LEU A 109 1.421 -10.772 -17.139 1.00 0.00 H new ATOM 0 HB3 LEU A 109 2.459 -11.958 -16.375 1.00 0.00 H new ATOM 0 HG LEU A 109 0.315 -11.097 -14.559 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -1.537 -12.173 -15.808 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -0.908 -10.761 -16.690 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -0.461 -12.404 -17.206 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -0.002 -13.553 -14.401 1.00 0.00 H new ATOM 0 HD22 LEU A 109 1.074 -13.782 -15.800 1.00 0.00 H new ATOM 0 HD23 LEU A 109 1.721 -13.123 -14.278 1.00 0.00 H new ATOM 1612 N GLU A 110 0.440 -8.731 -15.922 1.00 0.00 N ATOM 1613 CA GLU A 110 -0.589 -7.682 -15.671 1.00 0.00 C ATOM 1614 C GLU A 110 0.099 -6.322 -15.532 1.00 0.00 C ATOM 1615 O GLU A 110 -0.389 -5.433 -14.861 1.00 0.00 O ATOM 1616 CB GLU A 110 -1.347 -8.006 -14.381 1.00 0.00 C ATOM 1617 CG GLU A 110 -2.145 -9.299 -14.568 1.00 0.00 C ATOM 1618 CD GLU A 110 -2.797 -9.692 -13.242 1.00 0.00 C ATOM 1619 OE1 GLU A 110 -2.938 -8.827 -12.394 1.00 0.00 O ATOM 1620 OE2 GLU A 110 -3.145 -10.853 -13.097 1.00 0.00 O ATOM 0 H GLU A 110 0.356 -9.216 -16.815 1.00 0.00 H new ATOM 0 HA GLU A 110 -1.291 -7.653 -16.504 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -0.647 -8.115 -13.553 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -2.018 -7.186 -14.125 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -2.908 -9.160 -15.334 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -1.488 -10.097 -14.913 1.00 0.00 H new ATOM 1627 N GLU A 111 1.231 -6.153 -16.162 1.00 0.00 N ATOM 1628 CA GLU A 111 1.954 -4.854 -16.066 1.00 0.00 C ATOM 1629 C GLU A 111 1.861 -4.110 -17.401 1.00 0.00 C ATOM 1630 O GLU A 111 1.820 -4.710 -18.457 1.00 0.00 O ATOM 1631 CB GLU A 111 3.426 -5.115 -15.733 1.00 0.00 C ATOM 1632 CG GLU A 111 4.079 -5.888 -16.880 1.00 0.00 C ATOM 1633 CD GLU A 111 5.601 -5.819 -16.741 1.00 0.00 C ATOM 1634 OE1 GLU A 111 6.120 -6.434 -15.824 1.00 0.00 O ATOM 1635 OE2 GLU A 111 6.221 -5.154 -17.553 1.00 0.00 O ATOM 0 H GLU A 111 1.686 -6.860 -16.739 1.00 0.00 H new ATOM 0 HA GLU A 111 1.501 -4.247 -15.282 1.00 0.00 H new ATOM 0 HB2 GLU A 111 3.947 -4.171 -15.574 1.00 0.00 H new ATOM 0 HB3 GLU A 111 3.505 -5.683 -14.806 1.00 0.00 H new ATOM 0 HG2 GLU A 111 3.749 -6.927 -16.867 1.00 0.00 H new ATOM 0 HG3 GLU A 111 3.771 -5.468 -17.837 1.00 0.00 H new ATOM 1642 N ILE A 112 1.831 -2.805 -17.360 1.00 0.00 N ATOM 1643 CA ILE A 112 1.745 -2.017 -18.622 1.00 0.00 C ATOM 1644 C ILE A 112 2.408 -0.653 -18.410 1.00 0.00 C ATOM 1645 O ILE A 112 2.107 0.052 -17.469 1.00 0.00 O ATOM 1646 CB ILE A 112 0.276 -1.819 -19.001 1.00 0.00 C ATOM 1647 CG1 ILE A 112 -0.375 -3.182 -19.242 1.00 0.00 C ATOM 1648 CG2 ILE A 112 0.184 -0.979 -20.276 1.00 0.00 C ATOM 1649 CD1 ILE A 112 -1.746 -2.987 -19.892 1.00 0.00 C ATOM 0 H ILE A 112 1.862 -2.250 -16.505 1.00 0.00 H new ATOM 0 HA ILE A 112 2.255 -2.551 -19.424 1.00 0.00 H new ATOM 0 HB ILE A 112 -0.241 -1.305 -18.191 1.00 0.00 H new ATOM 0 HG12 ILE A 112 0.260 -3.791 -19.885 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -0.481 -3.718 -18.299 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -0.863 -0.839 -20.545 1.00 0.00 H new ATOM 0 HG22 ILE A 112 0.648 -0.008 -20.106 1.00 0.00 H new ATOM 0 HG23 ILE A 112 0.701 -1.491 -21.087 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -2.209 -3.959 -20.063 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -2.380 -2.394 -19.233 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -1.627 -2.469 -20.844 1.00 0.00 H new ATOM 1661 N ARG A 113 3.312 -0.279 -19.274 1.00 0.00 N ATOM 1662 CA ARG A 113 3.994 1.037 -19.113 1.00 0.00 C ATOM 1663 C ARG A 113 4.129 1.721 -20.475 1.00 0.00 C ATOM 1664 O ARG A 113 4.943 2.605 -20.657 1.00 0.00 O ATOM 1665 CB ARG A 113 5.385 0.816 -18.517 1.00 0.00 C ATOM 1666 CG ARG A 113 5.981 -0.478 -19.078 1.00 0.00 C ATOM 1667 CD ARG A 113 7.508 -0.386 -19.064 1.00 0.00 C ATOM 1668 NE ARG A 113 8.055 -1.016 -20.299 1.00 0.00 N ATOM 1669 CZ ARG A 113 9.191 -0.606 -20.792 1.00 0.00 C ATOM 1670 NH1 ARG A 113 10.179 -0.306 -19.994 1.00 0.00 N ATOM 1671 NH2 ARG A 113 9.339 -0.496 -22.084 1.00 0.00 N ATOM 0 H ARG A 113 3.607 -0.826 -20.083 1.00 0.00 H new ATOM 0 HA ARG A 113 3.405 1.670 -18.449 1.00 0.00 H new ATOM 0 HB2 ARG A 113 6.032 1.660 -18.755 1.00 0.00 H new ATOM 0 HB3 ARG A 113 5.322 0.759 -17.430 1.00 0.00 H new ATOM 0 HG2 ARG A 113 5.652 -1.330 -18.483 1.00 0.00 H new ATOM 0 HG3 ARG A 113 5.626 -0.643 -20.095 1.00 0.00 H new ATOM 0 HD2 ARG A 113 7.820 0.657 -19.006 1.00 0.00 H new ATOM 0 HD3 ARG A 113 7.905 -0.887 -18.181 1.00 0.00 H new ATOM 0 HE ARG A 113 7.541 -1.768 -20.759 1.00 0.00 H new ATOM 0 HH11 ARG A 113 10.063 -0.392 -18.984 1.00 0.00 H new ATOM 0 HH12 ARG A 113 11.067 0.015 -20.380 1.00 0.00 H new ATOM 0 HH21 ARG A 113 8.567 -0.731 -22.708 1.00 0.00 H new ATOM 0 HH22 ARG A 113 10.227 -0.175 -22.470 1.00 0.00 H new