USER MOD reduce.3.24.130724 H: found=0, std=0, add=1029, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1027 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 70 THR OG1 : rot 171:sc= 0.495 USER MOD Set 1.2: A 72 SER OG : rot -71:sc= 0.926 USER MOD Single : A 1 ALA N :NH3+ -112:sc= 0.143 (180deg=0) USER MOD Single : A 2 GLN : amide:sc= 0 K(o=0,f=-0.69) USER MOD Single : A 4 THR OG1 : rot 180:sc= -0.0158 USER MOD Single : A 7 ASN : amide:sc= 0.619 K(o=0.62,f=-3.6!) USER MOD Single : A 13 SER OG : rot -60:sc= 0.723 USER MOD Single : A 18 GLN : amide:sc=-0.00525 X(o=-0.0053,f=0) USER MOD Single : A 20 SER OG : rot -77:sc= 1.24 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 63 SER OG : rot 52:sc= 0.449 USER MOD Single : A 64 HIS : no HE2:sc= -0.0209 X(o=-0.021,f=-0.19) USER MOD Single : A 66 SER OG : rot 180:sc= -0.262 USER MOD Single : A 81 SER OG : rot -28:sc= 0.388 USER MOD Single : A 82 GLN : amide:sc= 0.628 K(o=0.63,f=0) USER MOD Single : A 84 LYS NZ :NH3+ 174:sc= 1.16 (180deg=1.12) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 97 ASN : amide:sc= -0.0244 X(o=-0.024,f=-0.024) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot -49:sc= 1.5 USER MOD Single : A 106 SER OG : rot 180:sc= -0.104 USER MOD Single : A 108 SER OG : rot 180:sc= 0.0456 USER MOD Single : A 114 THR OG1 : rot -107:sc= -0.115 USER MOD Single : A 115 TYR OH : rot 180:sc= 0 USER MOD Single : A 117 LYS NZ :NH3+ 173:sc= 1.16 (180deg=1.13) USER MOD Single : A 118 SER OG : rot 54:sc= 1.28 USER MOD Single : A 119 TYR OH : rot 180:sc= 0 USER MOD Single : A 124 GLN : amide:sc= -0.0465 X(o=-0.046,f=-0.062) USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 135 ASN : amide:sc= 0.527 K(o=0.53,f=-0.1) USER MOD Single : A 136 HIS : no HE2:sc= 0.326 K(o=0.33,f=-1.1) USER MOD Single : A 139 THR OG1 : rot -13:sc= 0.201 USER MOD Single : A 141 SER OG : rot 180:sc= 0.348 USER MOD Single : A 144 ASN : amide:sc= -0.0389 K(o=-0.039,f=-0.71) USER MOD Single : A 151 THR OG1 : rot 180:sc= -0.0514 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -14.744 16.267 4.855 1.00 25.00 N ATOM 2 CA ALA A 1 -14.219 14.947 4.404 1.00 25.00 C ATOM 3 C ALA A 1 -12.933 15.149 3.638 1.00 25.00 C ATOM 4 O ALA A 1 -12.732 16.234 3.120 1.00 25.00 O ATOM 5 CB ALA A 1 -15.265 14.222 3.519 1.00 25.00 C ATOM 0 H1 ALA A 1 -14.680 16.331 5.891 1.00 25.00 H new ATOM 0 H2 ALA A 1 -14.182 17.029 4.426 1.00 25.00 H new ATOM 0 H3 ALA A 1 -15.738 16.364 4.563 1.00 25.00 H new ATOM 0 HA ALA A 1 -14.021 14.326 5.277 1.00 25.00 H new ATOM 0 HB1 ALA A 1 -14.866 13.260 3.198 1.00 25.00 H new ATOM 0 HB2 ALA A 1 -16.179 14.063 4.092 1.00 25.00 H new ATOM 0 HB3 ALA A 1 -15.487 14.833 2.644 1.00 25.00 H new ATOM 13 N GLN A 2 -12.090 14.115 3.596 1.00 25.00 N ATOM 14 CA GLN A 2 -10.754 14.151 2.966 1.00 25.00 C ATOM 15 C GLN A 2 -9.800 15.131 3.680 1.00 25.00 C ATOM 16 O GLN A 2 -10.227 15.948 4.494 1.00 25.00 O ATOM 17 CB GLN A 2 -10.860 14.399 1.440 1.00 25.00 C ATOM 18 CG GLN A 2 -10.407 15.781 0.933 1.00 25.00 C ATOM 19 CD GLN A 2 -10.617 15.951 -0.553 1.00 25.00 C ATOM 20 OE1 GLN A 2 -11.536 15.397 -1.132 1.00 25.00 O ATOM 21 NE2 GLN A 2 -9.756 16.710 -1.178 1.00 25.00 N ATOM 0 H GLN A 2 -12.315 13.208 4.005 1.00 25.00 H new ATOM 0 HA GLN A 2 -10.302 13.167 3.088 1.00 25.00 H new ATOM 0 HB2 GLN A 2 -10.269 13.638 0.929 1.00 25.00 H new ATOM 0 HB3 GLN A 2 -11.898 14.250 1.142 1.00 25.00 H new ATOM 0 HG2 GLN A 2 -10.957 16.557 1.465 1.00 25.00 H new ATOM 0 HG3 GLN A 2 -9.351 15.921 1.166 1.00 25.00 H new ATOM 0 HE21 GLN A 2 -9.000 17.157 -0.660 1.00 25.00 H new ATOM 0 HE22 GLN A 2 -9.840 16.855 -2.184 1.00 25.00 H new ATOM 30 N GLY A 3 -8.505 14.970 3.440 1.00 25.00 N ATOM 31 CA GLY A 3 -7.495 15.779 4.101 1.00 25.00 C ATOM 32 C GLY A 3 -6.924 16.873 3.223 1.00 25.00 C ATOM 33 O GLY A 3 -7.307 17.028 2.063 1.00 25.00 O ATOM 0 H GLY A 3 -8.130 14.281 2.788 1.00 25.00 H new ATOM 0 HA2 GLY A 3 -7.930 16.230 4.993 1.00 25.00 H new ATOM 0 HA3 GLY A 3 -6.684 15.132 4.434 1.00 25.00 H new ATOM 37 N THR A 4 -5.973 17.609 3.773 1.00 25.00 N ATOM 38 CA THR A 4 -5.268 18.672 3.054 1.00 25.00 C ATOM 39 C THR A 4 -3.853 18.144 2.773 1.00 25.00 C ATOM 40 O THR A 4 -3.568 16.981 3.044 1.00 25.00 O ATOM 41 CB THR A 4 -5.277 19.993 3.892 1.00 25.00 C ATOM 42 OG1 THR A 4 -4.547 21.022 3.215 1.00 25.00 O ATOM 43 CG2 THR A 4 -4.677 19.791 5.286 1.00 25.00 C ATOM 0 H THR A 4 -5.662 17.490 4.737 1.00 25.00 H new ATOM 0 HA THR A 4 -5.753 18.924 2.111 1.00 25.00 H new ATOM 0 HB THR A 4 -6.320 20.289 4.005 1.00 25.00 H new ATOM 0 HG1 THR A 4 -4.564 21.842 3.751 1.00 25.00 H new ATOM 0 HG21 THR A 4 -4.703 20.733 5.833 1.00 25.00 H new ATOM 0 HG22 THR A 4 -5.255 19.041 5.826 1.00 25.00 H new ATOM 0 HG23 THR A 4 -3.645 19.454 5.192 1.00 25.00 H new ATOM 51 N ASP A 5 -2.956 18.958 2.241 1.00 25.00 N ATOM 52 CA ASP A 5 -1.594 18.498 1.933 1.00 25.00 C ATOM 53 C ASP A 5 -0.665 18.576 3.142 1.00 25.00 C ATOM 54 O ASP A 5 0.506 18.210 3.087 1.00 25.00 O ATOM 55 CB ASP A 5 -1.025 19.271 0.741 1.00 25.00 C ATOM 56 CG ASP A 5 -1.477 18.690 -0.594 1.00 25.00 C ATOM 57 OD1 ASP A 5 -1.955 17.524 -0.619 1.00 25.00 O ATOM 58 OD2 ASP A 5 -1.320 19.370 -1.620 1.00 25.00 O ATOM 0 H ASP A 5 -3.135 19.935 2.011 1.00 25.00 H new ATOM 0 HA ASP A 5 -1.659 17.444 1.663 1.00 25.00 H new ATOM 0 HB2 ASP A 5 -1.336 20.314 0.805 1.00 25.00 H new ATOM 0 HB3 ASP A 5 0.064 19.260 0.790 1.00 25.00 H new ATOM 63 N GLY A 6 -1.256 18.951 4.261 1.00 25.00 N ATOM 64 CA GLY A 6 -0.582 18.898 5.551 1.00 25.00 C ATOM 65 C GLY A 6 -0.770 17.512 6.144 1.00 25.00 C ATOM 66 O GLY A 6 -1.173 16.595 5.433 1.00 25.00 O ATOM 0 H GLY A 6 -2.213 19.300 4.305 1.00 25.00 H new ATOM 0 HA2 GLY A 6 0.479 19.117 5.432 1.00 25.00 H new ATOM 0 HA3 GLY A 6 -0.990 19.654 6.222 1.00 25.00 H new ATOM 70 N ASN A 7 -0.522 17.339 7.432 1.00 25.00 N ATOM 71 CA ASN A 7 -0.739 16.035 8.072 1.00 25.00 C ATOM 72 C ASN A 7 -2.193 15.961 8.538 1.00 25.00 C ATOM 73 O ASN A 7 -2.710 16.934 9.076 1.00 25.00 O ATOM 74 CB ASN A 7 0.192 15.852 9.277 1.00 25.00 C ATOM 75 CG ASN A 7 1.641 15.658 8.880 1.00 25.00 C ATOM 76 OD1 ASN A 7 2.002 15.696 7.711 1.00 25.00 O ATOM 77 ND2 ASN A 7 2.480 15.458 9.858 1.00 25.00 N ATOM 0 H ASN A 7 -0.175 18.069 8.055 1.00 25.00 H new ATOM 0 HA ASN A 7 -0.523 15.244 7.353 1.00 25.00 H new ATOM 0 HB2 ASN A 7 0.112 16.724 9.927 1.00 25.00 H new ATOM 0 HB3 ASN A 7 -0.139 14.991 9.857 1.00 25.00 H new ATOM 0 HD21 ASN A 7 3.472 15.327 9.660 1.00 25.00 H new ATOM 0 HD22 ASN A 7 2.144 15.432 10.821 1.00 25.00 H new ATOM 84 N ASP A 8 -2.852 14.829 8.318 1.00 25.00 N ATOM 85 CA ASP A 8 -4.270 14.670 8.679 1.00 25.00 C ATOM 86 C ASP A 8 -4.534 13.347 9.391 1.00 25.00 C ATOM 87 O ASP A 8 -3.853 12.347 9.155 1.00 25.00 O ATOM 88 CB ASP A 8 -5.157 14.683 7.424 1.00 25.00 C ATOM 89 CG ASP A 8 -5.084 15.986 6.662 1.00 25.00 C ATOM 90 OD1 ASP A 8 -4.263 16.062 5.724 1.00 50.00 O ATOM 91 OD2 ASP A 8 -5.924 16.871 6.877 1.00 50.00 O ATOM 0 H ASP A 8 -2.433 14.003 7.891 1.00 25.00 H new ATOM 0 HA ASP A 8 -4.507 15.504 9.340 1.00 25.00 H new ATOM 0 HB2 ASP A 8 -4.858 13.867 6.766 1.00 25.00 H new ATOM 0 HB3 ASP A 8 -6.191 14.496 7.715 1.00 25.00 H new ATOM 96 N VAL A 9 -5.588 13.322 10.192 1.00 25.00 N ATOM 97 CA VAL A 9 -6.082 12.083 10.791 1.00 25.00 C ATOM 98 C VAL A 9 -7.541 12.001 10.377 1.00 25.00 C ATOM 99 O VAL A 9 -8.340 12.869 10.719 1.00 25.00 O ATOM 100 CB VAL A 9 -5.947 12.074 12.342 1.00 25.00 C ATOM 101 CG1 VAL A 9 -6.514 10.765 12.928 1.00 25.00 C ATOM 102 CG2 VAL A 9 -4.470 12.228 12.748 1.00 25.00 C ATOM 0 H VAL A 9 -6.125 14.151 10.446 1.00 25.00 H new ATOM 0 HA VAL A 9 -5.500 11.227 10.450 1.00 25.00 H new ATOM 0 HB VAL A 9 -6.517 12.913 12.740 1.00 25.00 H new ATOM 0 HG11 VAL A 9 -6.411 10.777 14.013 1.00 25.00 H new ATOM 0 HG12 VAL A 9 -7.568 10.675 12.665 1.00 25.00 H new ATOM 0 HG13 VAL A 9 -5.965 9.916 12.521 1.00 25.00 H new ATOM 0 HG21 VAL A 9 -4.389 12.220 13.835 1.00 25.00 H new ATOM 0 HG22 VAL A 9 -3.891 11.402 12.335 1.00 25.00 H new ATOM 0 HG23 VAL A 9 -4.083 13.171 12.362 1.00 25.00 H new ATOM 112 N LEU A 10 -7.859 11.005 9.567 1.00 25.00 N ATOM 113 CA LEU A 10 -9.190 10.854 8.996 1.00 25.00 C ATOM 114 C LEU A 10 -9.735 9.503 9.419 1.00 25.00 C ATOM 115 O LEU A 10 -9.038 8.501 9.309 1.00 25.00 O ATOM 116 CB LEU A 10 -9.100 10.924 7.467 1.00 25.00 C ATOM 117 CG LEU A 10 -8.476 12.211 6.890 1.00 25.00 C ATOM 118 CD1 LEU A 10 -8.178 12.024 5.410 1.00 25.00 C ATOM 119 CD2 LEU A 10 -9.393 13.421 7.088 1.00 25.00 C ATOM 0 H LEU A 10 -7.202 10.277 9.286 1.00 25.00 H new ATOM 0 HA LEU A 10 -9.848 11.649 9.346 1.00 25.00 H new ATOM 0 HB2 LEU A 10 -8.518 10.072 7.117 1.00 25.00 H new ATOM 0 HB3 LEU A 10 -10.104 10.814 7.057 1.00 25.00 H new ATOM 0 HG LEU A 10 -7.548 12.403 7.429 1.00 25.00 H new ATOM 0 HD11 LEU A 10 -7.738 12.937 5.009 1.00 25.00 H new ATOM 0 HD12 LEU A 10 -7.479 11.197 5.281 1.00 25.00 H new ATOM 0 HD13 LEU A 10 -9.103 11.804 4.878 1.00 25.00 H new ATOM 0 HD21 LEU A 10 -8.920 14.309 6.669 1.00 25.00 H new ATOM 0 HD22 LEU A 10 -10.343 13.244 6.584 1.00 25.00 H new ATOM 0 HD23 LEU A 10 -9.570 13.573 8.153 1.00 25.00 H new ATOM 131 N ILE A 11 -10.958 9.480 9.924 1.00 25.00 N ATOM 132 CA ILE A 11 -11.586 8.239 10.386 1.00 25.00 C ATOM 133 C ILE A 11 -12.993 8.191 9.801 1.00 25.00 C ATOM 134 O ILE A 11 -13.744 9.160 9.917 1.00 25.00 O ATOM 135 CB ILE A 11 -11.647 8.168 11.955 1.00 25.00 C ATOM 136 CG1 ILE A 11 -10.219 8.258 12.550 1.00 25.00 C ATOM 137 CG2 ILE A 11 -12.337 6.851 12.419 1.00 25.00 C ATOM 138 CD1 ILE A 11 -10.167 8.396 14.082 1.00 25.00 C ATOM 0 H ILE A 11 -11.544 10.309 10.027 1.00 25.00 H new ATOM 0 HA ILE A 11 -10.995 7.385 10.054 1.00 25.00 H new ATOM 0 HB ILE A 11 -12.235 9.012 12.315 1.00 25.00 H new ATOM 0 HG12 ILE A 11 -9.663 7.367 12.260 1.00 25.00 H new ATOM 0 HG13 ILE A 11 -9.708 9.111 12.105 1.00 25.00 H new ATOM 0 HG21 ILE A 11 -12.369 6.821 13.508 1.00 25.00 H new ATOM 0 HG22 ILE A 11 -13.353 6.814 12.025 1.00 25.00 H new ATOM 0 HG23 ILE A 11 -11.773 5.995 12.049 1.00 25.00 H new ATOM 0 HD11 ILE A 11 -9.128 8.452 14.407 1.00 25.00 H new ATOM 0 HD12 ILE A 11 -10.691 9.303 14.384 1.00 25.00 H new ATOM 0 HD13 ILE A 11 -10.645 7.531 14.542 1.00 25.00 H new ATOM 150 N GLY A 12 -13.319 7.092 9.135 1.00 25.00 N ATOM 151 CA GLY A 12 -14.621 6.934 8.512 1.00 25.00 C ATOM 152 C GLY A 12 -15.640 6.280 9.421 1.00 25.00 C ATOM 153 O GLY A 12 -15.388 6.031 10.598 1.00 25.00 O ATOM 0 H GLY A 12 -12.695 6.294 9.013 1.00 25.00 H new ATOM 0 HA2 GLY A 12 -14.991 7.912 8.206 1.00 25.00 H new ATOM 0 HA3 GLY A 12 -14.514 6.336 7.607 1.00 25.00 H new ATOM 157 N SER A 13 -16.799 5.994 8.854 1.00 25.00 N ATOM 158 CA SER A 13 -17.915 5.386 9.569 1.00 25.00 C ATOM 159 C SER A 13 -18.325 4.091 8.868 1.00 25.00 C ATOM 160 O SER A 13 -17.597 3.582 8.015 1.00 25.00 O ATOM 161 CB SER A 13 -19.078 6.376 9.609 1.00 25.00 C ATOM 162 OG SER A 13 -19.504 6.692 8.297 1.00 25.00 O ATOM 0 H SER A 13 -16.997 6.179 7.871 1.00 25.00 H new ATOM 0 HA SER A 13 -17.622 5.145 10.591 1.00 25.00 H new ATOM 0 HB2 SER A 13 -19.907 5.950 10.174 1.00 25.00 H new ATOM 0 HB3 SER A 13 -18.772 7.285 10.127 1.00 25.00 H new ATOM 0 HG SER A 13 -18.764 7.101 7.802 1.00 25.00 H new ATOM 168 N ASP A 14 -19.466 3.534 9.239 1.00 25.00 N ATOM 169 CA ASP A 14 -19.887 2.231 8.718 1.00 25.00 C ATOM 170 C ASP A 14 -20.426 2.254 7.288 1.00 25.00 C ATOM 171 O ASP A 14 -20.515 1.215 6.639 1.00 25.00 O ATOM 172 CB ASP A 14 -20.951 1.647 9.643 1.00 25.00 C ATOM 173 CG ASP A 14 -20.430 1.432 11.044 1.00 25.00 C ATOM 174 OD1 ASP A 14 -19.364 0.793 11.194 1.00 25.00 O ATOM 175 OD2 ASP A 14 -21.039 1.968 11.988 1.00 25.00 O ATOM 0 H ASP A 14 -20.120 3.957 9.897 1.00 25.00 H new ATOM 0 HA ASP A 14 -18.988 1.616 8.687 1.00 25.00 H new ATOM 0 HB2 ASP A 14 -21.810 2.317 9.675 1.00 25.00 H new ATOM 0 HB3 ASP A 14 -21.302 0.698 9.238 1.00 25.00 H new ATOM 180 N VAL A 15 -20.775 3.429 6.785 1.00 25.00 N ATOM 181 CA VAL A 15 -21.276 3.542 5.410 1.00 25.00 C ATOM 182 C VAL A 15 -20.091 3.553 4.446 1.00 25.00 C ATOM 183 O VAL A 15 -18.940 3.707 4.871 1.00 25.00 O ATOM 184 CB VAL A 15 -22.154 4.820 5.209 1.00 25.00 C ATOM 185 CG1 VAL A 15 -23.382 4.769 6.133 1.00 25.00 C ATOM 186 CG2 VAL A 15 -21.359 6.102 5.474 1.00 25.00 C ATOM 0 H VAL A 15 -20.724 4.311 7.295 1.00 25.00 H new ATOM 0 HA VAL A 15 -21.915 2.682 5.206 1.00 25.00 H new ATOM 0 HB VAL A 15 -22.479 4.836 4.169 1.00 25.00 H new ATOM 0 HG11 VAL A 15 -23.986 5.664 5.985 1.00 25.00 H new ATOM 0 HG12 VAL A 15 -23.977 3.886 5.899 1.00 25.00 H new ATOM 0 HG13 VAL A 15 -23.054 4.721 7.171 1.00 25.00 H new ATOM 0 HG21 VAL A 15 -22.004 6.968 5.324 1.00 25.00 H new ATOM 0 HG22 VAL A 15 -20.992 6.097 6.500 1.00 25.00 H new ATOM 0 HG23 VAL A 15 -20.515 6.155 4.787 1.00 25.00 H new ATOM 196 N GLY A 16 -20.354 3.376 3.158 1.00 25.00 N ATOM 197 CA GLY A 16 -19.283 3.410 2.175 1.00 25.00 C ATOM 198 C GLY A 16 -18.812 4.833 1.954 1.00 25.00 C ATOM 199 O GLY A 16 -19.637 5.743 1.865 1.00 25.00 O ATOM 0 H GLY A 16 -21.285 3.210 2.775 1.00 25.00 H new ATOM 0 HA2 GLY A 16 -18.450 2.793 2.514 1.00 25.00 H new ATOM 0 HA3 GLY A 16 -19.632 2.985 1.234 1.00 25.00 H new ATOM 203 N GLU A 17 -17.502 5.044 1.930 1.00 25.00 N ATOM 204 CA GLU A 17 -16.930 6.394 1.859 1.00 25.00 C ATOM 205 C GLU A 17 -15.713 6.458 0.939 1.00 25.00 C ATOM 206 O GLU A 17 -15.062 5.449 0.672 1.00 25.00 O ATOM 207 CB GLU A 17 -16.481 6.836 3.261 1.00 25.00 C ATOM 208 CG GLU A 17 -17.624 7.037 4.257 1.00 25.00 C ATOM 209 CD GLU A 17 -17.208 6.760 5.685 1.00 25.00 C ATOM 210 OE1 GLU A 17 -16.673 5.657 5.952 1.00 50.00 O ATOM 211 OE2 GLU A 17 -17.479 7.593 6.569 1.00 50.00 O ATOM 0 H GLU A 17 -16.808 4.297 1.959 1.00 25.00 H new ATOM 0 HA GLU A 17 -17.706 7.049 1.462 1.00 25.00 H new ATOM 0 HB2 GLU A 17 -15.794 6.090 3.661 1.00 25.00 H new ATOM 0 HB3 GLU A 17 -15.924 7.769 3.173 1.00 25.00 H new ATOM 0 HG2 GLU A 17 -17.991 8.061 4.182 1.00 25.00 H new ATOM 0 HG3 GLU A 17 -18.453 6.381 3.990 1.00 25.00 H new ATOM 218 N GLN A 18 -15.370 7.668 0.523 1.00 25.00 N ATOM 219 CA GLN A 18 -14.147 7.927 -0.224 1.00 25.00 C ATOM 220 C GLN A 18 -13.320 8.849 0.658 1.00 25.00 C ATOM 221 O GLN A 18 -13.791 9.915 1.067 1.00 25.00 O ATOM 222 CB GLN A 18 -14.461 8.605 -1.558 1.00 25.00 C ATOM 223 CG GLN A 18 -13.228 8.884 -2.406 1.00 25.00 C ATOM 224 CD GLN A 18 -13.536 9.805 -3.557 1.00 25.00 C ATOM 225 OE1 GLN A 18 -14.350 9.503 -4.413 1.00 25.00 O ATOM 226 NE2 GLN A 18 -12.908 10.948 -3.563 1.00 25.00 N ATOM 0 H GLN A 18 -15.933 8.501 0.694 1.00 25.00 H new ATOM 0 HA GLN A 18 -13.616 7.004 -0.457 1.00 25.00 H new ATOM 0 HB2 GLN A 18 -15.146 7.974 -2.124 1.00 25.00 H new ATOM 0 HB3 GLN A 18 -14.979 9.544 -1.365 1.00 25.00 H new ATOM 0 HG2 GLN A 18 -12.452 9.328 -1.783 1.00 25.00 H new ATOM 0 HG3 GLN A 18 -12.830 7.944 -2.789 1.00 25.00 H new ATOM 0 HE21 GLN A 18 -12.234 11.163 -2.828 1.00 25.00 H new ATOM 0 HE22 GLN A 18 -13.091 11.627 -4.302 1.00 25.00 H new ATOM 235 N ILE A 19 -12.121 8.414 1.006 1.00 25.00 N ATOM 236 CA ILE A 19 -11.264 9.153 1.922 1.00 25.00 C ATOM 237 C ILE A 19 -9.915 9.351 1.250 1.00 25.00 C ATOM 238 O ILE A 19 -9.226 8.399 0.918 1.00 25.00 O ATOM 239 CB ILE A 19 -11.076 8.377 3.255 1.00 25.00 C ATOM 240 CG1 ILE A 19 -12.453 8.013 3.862 1.00 25.00 C ATOM 241 CG2 ILE A 19 -10.244 9.212 4.261 1.00 25.00 C ATOM 242 CD1 ILE A 19 -12.395 7.099 5.080 1.00 25.00 C ATOM 0 H ILE A 19 -11.714 7.543 0.664 1.00 25.00 H new ATOM 0 HA ILE A 19 -11.724 10.113 2.156 1.00 25.00 H new ATOM 0 HB ILE A 19 -10.533 7.456 3.045 1.00 25.00 H new ATOM 0 HG12 ILE A 19 -12.966 8.934 4.141 1.00 25.00 H new ATOM 0 HG13 ILE A 19 -13.057 7.532 3.093 1.00 25.00 H new ATOM 0 HG21 ILE A 19 -10.124 8.651 5.188 1.00 25.00 H new ATOM 0 HG22 ILE A 19 -9.263 9.423 3.835 1.00 25.00 H new ATOM 0 HG23 ILE A 19 -10.759 10.150 4.469 1.00 25.00 H new ATOM 0 HD11 ILE A 19 -13.406 6.900 5.434 1.00 25.00 H new ATOM 0 HD12 ILE A 19 -11.915 6.159 4.807 1.00 25.00 H new ATOM 0 HD13 ILE A 19 -11.822 7.583 5.871 1.00 25.00 H new ATOM 254 N SER A 20 -9.549 10.600 1.044 1.00 25.00 N ATOM 255 CA SER A 20 -8.289 10.927 0.384 1.00 25.00 C ATOM 256 C SER A 20 -7.393 11.698 1.336 1.00 25.00 C ATOM 257 O SER A 20 -7.819 12.682 1.931 1.00 25.00 O ATOM 258 CB SER A 20 -8.559 11.749 -0.873 1.00 25.00 C ATOM 259 OG SER A 20 -9.588 11.151 -1.651 1.00 25.00 O ATOM 0 H SER A 20 -10.103 11.410 1.322 1.00 25.00 H new ATOM 0 HA SER A 20 -7.784 10.004 0.097 1.00 25.00 H new ATOM 0 HB2 SER A 20 -8.848 12.763 -0.596 1.00 25.00 H new ATOM 0 HB3 SER A 20 -7.647 11.828 -1.465 1.00 25.00 H new ATOM 0 HG SER A 20 -9.227 10.378 -2.132 1.00 25.00 H new ATOM 265 N GLY A 21 -6.166 11.231 1.514 1.00 25.00 N ATOM 266 CA GLY A 21 -5.258 11.852 2.466 1.00 25.00 C ATOM 267 C GLY A 21 -4.452 13.007 1.903 1.00 25.00 C ATOM 268 O GLY A 21 -4.098 13.928 2.639 1.00 25.00 O ATOM 0 H GLY A 21 -5.778 10.430 1.016 1.00 25.00 H new ATOM 0 HA2 GLY A 21 -5.835 12.209 3.319 1.00 25.00 H new ATOM 0 HA3 GLY A 21 -4.570 11.094 2.841 1.00 25.00 H new ATOM 272 N GLY A 22 -4.139 12.965 0.615 1.00 25.00 N ATOM 273 CA GLY A 22 -3.329 14.015 0.005 1.00 25.00 C ATOM 274 C GLY A 22 -1.866 13.900 0.402 1.00 25.00 C ATOM 275 O GLY A 22 -1.423 12.840 0.876 1.00 25.00 O ATOM 0 H GLY A 22 -4.429 12.224 -0.023 1.00 25.00 H new ATOM 0 HA2 GLY A 22 -3.417 13.958 -1.080 1.00 25.00 H new ATOM 0 HA3 GLY A 22 -3.712 14.990 0.305 1.00 25.00 H new ATOM 279 N ALA A 23 -1.098 14.967 0.238 1.00 25.00 N ATOM 280 CA ALA A 23 0.307 14.964 0.641 1.00 25.00 C ATOM 281 C ALA A 23 0.389 14.982 2.174 1.00 25.00 C ATOM 282 O ALA A 23 -0.638 14.994 2.859 1.00 25.00 O ATOM 283 CB ALA A 23 1.045 16.166 0.038 1.00 25.00 C ATOM 0 H ALA A 23 -1.419 15.845 -0.170 1.00 25.00 H new ATOM 0 HA ALA A 23 0.790 14.061 0.268 1.00 25.00 H new ATOM 0 HB1 ALA A 23 2.089 16.146 0.350 1.00 25.00 H new ATOM 0 HB2 ALA A 23 0.990 16.118 -1.050 1.00 25.00 H new ATOM 0 HB3 ALA A 23 0.581 17.089 0.385 1.00 25.00 H new ATOM 289 N GLY A 24 1.600 14.945 2.705 1.00 25.00 N ATOM 290 CA GLY A 24 1.786 14.919 4.147 1.00 25.00 C ATOM 291 C GLY A 24 1.572 13.533 4.723 1.00 25.00 C ATOM 292 O GLY A 24 1.141 12.607 4.015 1.00 25.00 O ATOM 0 H GLY A 24 2.464 14.932 2.163 1.00 25.00 H new ATOM 0 HA2 GLY A 24 2.792 15.261 4.389 1.00 25.00 H new ATOM 0 HA3 GLY A 24 1.092 15.617 4.615 1.00 25.00 H new ATOM 296 N ASP A 25 1.886 13.378 5.995 1.00 25.00 N ATOM 297 CA ASP A 25 1.762 12.090 6.677 1.00 25.00 C ATOM 298 C ASP A 25 0.346 11.970 7.201 1.00 25.00 C ATOM 299 O ASP A 25 -0.126 12.853 7.911 1.00 25.00 O ATOM 300 CB ASP A 25 2.725 12.002 7.863 1.00 25.00 C ATOM 301 CG ASP A 25 4.171 11.830 7.439 1.00 25.00 C ATOM 302 OD1 ASP A 25 4.500 11.911 6.225 1.00 25.00 O ATOM 303 OD2 ASP A 25 4.999 11.566 8.342 1.00 25.00 O ATOM 0 H ASP A 25 2.233 14.132 6.588 1.00 25.00 H new ATOM 0 HA ASP A 25 1.999 11.291 5.974 1.00 25.00 H new ATOM 0 HB2 ASP A 25 2.634 12.905 8.466 1.00 25.00 H new ATOM 0 HB3 ASP A 25 2.436 11.164 8.498 1.00 25.00 H new ATOM 308 N ASP A 26 -0.353 10.911 6.822 1.00 25.00 N ATOM 309 CA ASP A 26 -1.764 10.781 7.170 1.00 25.00 C ATOM 310 C ASP A 26 -2.129 9.437 7.773 1.00 25.00 C ATOM 311 O ASP A 26 -1.607 8.393 7.368 1.00 25.00 O ATOM 312 CB ASP A 26 -2.614 10.963 5.911 1.00 25.00 C ATOM 313 CG ASP A 26 -2.329 12.260 5.205 1.00 25.00 C ATOM 314 OD1 ASP A 26 -2.421 13.325 5.833 1.00 50.00 O ATOM 315 OD2 ASP A 26 -2.037 12.241 3.986 1.00 50.00 O ATOM 0 H ASP A 26 0.026 10.135 6.279 1.00 25.00 H new ATOM 0 HA ASP A 26 -1.957 11.547 7.921 1.00 25.00 H new ATOM 0 HB2 ASP A 26 -2.429 10.133 5.229 1.00 25.00 H new ATOM 0 HB3 ASP A 26 -3.669 10.924 6.181 1.00 25.00 H new ATOM 320 N ARG A 27 -3.135 9.447 8.636 1.00 25.00 N ATOM 321 CA ARG A 27 -3.817 8.211 9.015 1.00 25.00 C ATOM 322 C ARG A 27 -5.165 8.293 8.348 1.00 25.00 C ATOM 323 O ARG A 27 -5.883 9.269 8.525 1.00 25.00 O ATOM 324 CB ARG A 27 -4.011 8.052 10.530 1.00 25.00 C ATOM 325 CG ARG A 27 -4.892 6.820 10.868 1.00 25.00 C ATOM 326 CD ARG A 27 -5.056 6.580 12.359 1.00 25.00 C ATOM 327 NE ARG A 27 -6.024 5.491 12.611 1.00 25.00 N ATOM 328 CZ ARG A 27 -6.296 4.961 13.800 1.00 25.00 C ATOM 329 NH1 ARG A 27 -5.691 5.356 14.895 1.00 25.00 N ATOM 330 NH2 ARG A 27 -7.189 4.020 13.894 1.00 25.00 N ATOM 0 H ARG A 27 -3.497 10.288 9.085 1.00 25.00 H new ATOM 0 HA ARG A 27 -3.219 7.353 8.708 1.00 25.00 H new ATOM 0 HB2 ARG A 27 -3.039 7.948 11.013 1.00 25.00 H new ATOM 0 HB3 ARG A 27 -4.473 8.952 10.934 1.00 25.00 H new ATOM 0 HG2 ARG A 27 -5.876 6.954 10.420 1.00 25.00 H new ATOM 0 HG3 ARG A 27 -4.452 5.933 10.412 1.00 25.00 H new ATOM 0 HD2 ARG A 27 -4.092 6.325 12.799 1.00 25.00 H new ATOM 0 HD3 ARG A 27 -5.396 7.495 12.844 1.00 25.00 H new ATOM 0 HE ARG A 27 -6.525 5.115 11.806 1.00 25.00 H new ATOM 0 HH11 ARG A 27 -4.987 6.092 14.851 1.00 25.00 H new ATOM 0 HH12 ARG A 27 -5.925 4.927 15.790 1.00 25.00 H new ATOM 0 HH21 ARG A 27 -7.675 3.693 13.059 1.00 25.00 H new ATOM 0 HH22 ARG A 27 -7.403 3.609 14.803 1.00 25.00 H new ATOM 344 N LEU A 28 -5.509 7.256 7.613 1.00 25.00 N ATOM 345 CA LEU A 28 -6.826 7.116 7.034 1.00 25.00 C ATOM 346 C LEU A 28 -7.380 5.889 7.724 1.00 25.00 C ATOM 347 O LEU A 28 -6.644 4.932 7.977 1.00 25.00 O ATOM 348 CB LEU A 28 -6.773 6.871 5.518 1.00 25.00 C ATOM 349 CG LEU A 28 -6.316 8.003 4.582 1.00 25.00 C ATOM 350 CD1 LEU A 28 -4.798 8.230 4.599 1.00 25.00 C ATOM 351 CD2 LEU A 28 -6.745 7.650 3.162 1.00 25.00 C ATOM 0 H LEU A 28 -4.878 6.483 7.400 1.00 25.00 H new ATOM 0 HA LEU A 28 -7.424 8.017 7.168 1.00 25.00 H new ATOM 0 HB2 LEU A 28 -6.113 6.020 5.348 1.00 25.00 H new ATOM 0 HB3 LEU A 28 -7.771 6.569 5.201 1.00 25.00 H new ATOM 0 HG LEU A 28 -6.778 8.926 4.933 1.00 25.00 H new ATOM 0 HD11 LEU A 28 -4.544 9.042 3.917 1.00 25.00 H new ATOM 0 HD12 LEU A 28 -4.480 8.491 5.608 1.00 25.00 H new ATOM 0 HD13 LEU A 28 -4.290 7.319 4.283 1.00 25.00 H new ATOM 0 HD21 LEU A 28 -6.431 8.440 2.480 1.00 25.00 H new ATOM 0 HD22 LEU A 28 -6.282 6.709 2.865 1.00 25.00 H new ATOM 0 HD23 LEU A 28 -7.830 7.548 3.124 1.00 25.00 H new ATOM 363 N ASP A 29 -8.661 5.903 8.019 1.00 25.00 N ATOM 364 CA ASP A 29 -9.325 4.758 8.609 1.00 25.00 C ATOM 365 C ASP A 29 -10.693 4.730 7.968 1.00 25.00 C ATOM 366 O ASP A 29 -11.309 5.768 7.810 1.00 25.00 O ATOM 367 CB ASP A 29 -9.415 4.904 10.125 1.00 25.00 C ATOM 368 CG ASP A 29 -9.670 3.591 10.817 1.00 25.00 C ATOM 369 OD1 ASP A 29 -10.518 2.800 10.343 1.00 25.00 O ATOM 370 OD2 ASP A 29 -8.980 3.331 11.827 1.00 25.00 O ATOM 0 H ASP A 29 -9.271 6.704 7.858 1.00 25.00 H new ATOM 0 HA ASP A 29 -8.783 3.829 8.435 1.00 25.00 H new ATOM 0 HB2 ASP A 29 -8.487 5.335 10.501 1.00 25.00 H new ATOM 0 HB3 ASP A 29 -10.214 5.603 10.373 1.00 25.00 H new ATOM 375 N GLY A 30 -11.109 3.568 7.506 1.00 25.00 N ATOM 376 CA GLY A 30 -12.331 3.443 6.734 1.00 25.00 C ATOM 377 C GLY A 30 -13.505 2.907 7.517 1.00 25.00 C ATOM 378 O GLY A 30 -14.653 3.103 7.122 1.00 25.00 O ATOM 0 H GLY A 30 -10.614 2.688 7.653 1.00 25.00 H new ATOM 0 HA2 GLY A 30 -12.594 4.421 6.330 1.00 25.00 H new ATOM 0 HA3 GLY A 30 -12.145 2.786 5.884 1.00 25.00 H new ATOM 382 N GLY A 31 -13.237 2.196 8.601 1.00 25.00 N ATOM 383 CA GLY A 31 -14.309 1.555 9.348 1.00 25.00 C ATOM 384 C GLY A 31 -14.998 0.477 8.517 1.00 25.00 C ATOM 385 O GLY A 31 -14.422 -0.054 7.549 1.00 25.00 O ATOM 0 H GLY A 31 -12.301 2.049 8.979 1.00 25.00 H new ATOM 0 HA2 GLY A 31 -13.906 1.112 10.259 1.00 25.00 H new ATOM 0 HA3 GLY A 31 -15.040 2.304 9.654 1.00 25.00 H new ATOM 389 N ALA A 32 -16.233 0.144 8.869 1.00 25.00 N ATOM 390 CA ALA A 32 -16.986 -0.864 8.126 1.00 25.00 C ATOM 391 C ALA A 32 -17.460 -0.298 6.777 1.00 25.00 C ATOM 392 O ALA A 32 -17.243 0.884 6.460 1.00 25.00 O ATOM 393 CB ALA A 32 -18.177 -1.360 8.958 1.00 25.00 C ATOM 0 H ALA A 32 -16.734 0.552 9.658 1.00 25.00 H new ATOM 0 HA ALA A 32 -16.330 -1.711 7.926 1.00 25.00 H new ATOM 0 HB1 ALA A 32 -18.729 -2.110 8.392 1.00 25.00 H new ATOM 0 HB2 ALA A 32 -17.814 -1.800 9.887 1.00 25.00 H new ATOM 0 HB3 ALA A 32 -18.835 -0.522 9.187 1.00 25.00 H new ATOM 399 N GLY A 33 -18.070 -1.159 5.977 1.00 25.00 N ATOM 400 CA GLY A 33 -18.521 -0.775 4.651 1.00 25.00 C ATOM 401 C GLY A 33 -17.369 -0.794 3.670 1.00 25.00 C ATOM 402 O GLY A 33 -16.202 -0.879 4.073 1.00 25.00 O ATOM 0 H GLY A 33 -18.264 -2.129 6.225 1.00 25.00 H new ATOM 0 HA2 GLY A 33 -19.303 -1.457 4.315 1.00 25.00 H new ATOM 0 HA3 GLY A 33 -18.960 0.222 4.685 1.00 25.00 H new ATOM 406 N ASP A 34 -17.680 -0.736 2.390 1.00 0.00 N ATOM 407 CA ASP A 34 -16.654 -0.759 1.353 1.00 25.00 C ATOM 408 C ASP A 34 -16.127 0.664 1.211 1.00 25.00 C ATOM 409 O ASP A 34 -16.907 1.606 1.284 1.00 25.00 O ATOM 410 CB ASP A 34 -17.248 -1.252 0.030 1.00 25.00 C ATOM 411 CG ASP A 34 -17.723 -2.703 0.103 1.00 25.00 C ATOM 412 OD1 ASP A 34 -17.374 -3.421 1.076 1.00 25.00 O ATOM 413 OD2 ASP A 34 -18.489 -3.112 -0.789 1.00 25.00 O ATOM 0 H ASP A 34 -18.635 -0.672 2.038 1.00 0.00 H new ATOM 0 HA ASP A 34 -15.846 -1.440 1.620 1.00 25.00 H new ATOM 0 HB2 ASP A 34 -18.086 -0.613 -0.248 1.00 25.00 H new ATOM 0 HB3 ASP A 34 -16.500 -1.158 -0.757 1.00 25.00 H new ATOM 418 N ASP A 35 -14.818 0.842 1.098 1.00 25.00 N ATOM 419 CA ASP A 35 -14.237 2.193 1.115 1.00 25.00 C ATOM 420 C ASP A 35 -13.132 2.397 0.083 1.00 25.00 C ATOM 421 O ASP A 35 -12.435 1.456 -0.304 1.00 25.00 O ATOM 422 CB ASP A 35 -13.660 2.498 2.503 1.00 25.00 C ATOM 423 CG ASP A 35 -14.715 2.488 3.592 1.00 25.00 C ATOM 424 OD1 ASP A 35 -15.641 3.322 3.567 1.00 50.00 O ATOM 425 OD2 ASP A 35 -14.595 1.675 4.544 1.00 50.00 O ATOM 0 H ASP A 35 -14.141 0.086 0.995 1.00 25.00 H new ATOM 0 HA ASP A 35 -15.053 2.871 0.864 1.00 25.00 H new ATOM 0 HB2 ASP A 35 -12.891 1.763 2.741 1.00 25.00 H new ATOM 0 HB3 ASP A 35 -13.174 3.473 2.483 1.00 25.00 H new ATOM 430 N LEU A 36 -12.954 3.647 -0.324 1.00 25.00 N ATOM 431 CA LEU A 36 -11.893 4.037 -1.255 1.00 25.00 C ATOM 432 C LEU A 36 -10.905 4.880 -0.458 1.00 25.00 C ATOM 433 O LEU A 36 -11.316 5.827 0.212 1.00 25.00 O ATOM 434 CB LEU A 36 -12.452 4.881 -2.417 1.00 25.00 C ATOM 435 CG LEU A 36 -13.328 4.223 -3.503 1.00 25.00 C ATOM 436 CD1 LEU A 36 -14.692 3.739 -2.998 1.00 25.00 C ATOM 437 CD2 LEU A 36 -13.541 5.237 -4.630 1.00 25.00 C ATOM 0 H LEU A 36 -13.541 4.424 -0.019 1.00 25.00 H new ATOM 0 HA LEU A 36 -11.427 3.150 -1.685 1.00 25.00 H new ATOM 0 HB2 LEU A 36 -13.036 5.690 -1.977 1.00 25.00 H new ATOM 0 HB3 LEU A 36 -11.602 5.339 -2.922 1.00 25.00 H new ATOM 0 HG LEU A 36 -12.798 3.334 -3.845 1.00 25.00 H new ATOM 0 HD11 LEU A 36 -15.246 3.289 -3.822 1.00 25.00 H new ATOM 0 HD12 LEU A 36 -14.547 2.999 -2.211 1.00 25.00 H new ATOM 0 HD13 LEU A 36 -15.254 4.585 -2.602 1.00 25.00 H new ATOM 0 HD21 LEU A 36 -14.159 4.791 -5.409 1.00 25.00 H new ATOM 0 HD22 LEU A 36 -14.039 6.122 -4.234 1.00 25.00 H new ATOM 0 HD23 LEU A 36 -12.576 5.522 -5.050 1.00 25.00 H new ATOM 449 N LEU A 37 -9.626 4.525 -0.489 1.00 25.00 N ATOM 450 CA LEU A 37 -8.615 5.217 0.315 1.00 25.00 C ATOM 451 C LEU A 37 -7.395 5.655 -0.511 1.00 25.00 C ATOM 452 O LEU A 37 -6.588 4.823 -0.923 1.00 25.00 O ATOM 453 CB LEU A 37 -8.140 4.314 1.465 1.00 25.00 C ATOM 454 CG LEU A 37 -9.180 3.856 2.509 1.00 25.00 C ATOM 455 CD1 LEU A 37 -9.826 2.516 2.136 1.00 25.00 C ATOM 456 CD2 LEU A 37 -8.502 3.712 3.874 1.00 25.00 C ATOM 0 H LEU A 37 -9.260 3.763 -1.060 1.00 25.00 H new ATOM 0 HA LEU A 37 -9.093 6.115 0.707 1.00 25.00 H new ATOM 0 HB2 LEU A 37 -7.694 3.422 1.025 1.00 25.00 H new ATOM 0 HB3 LEU A 37 -7.345 4.840 1.995 1.00 25.00 H new ATOM 0 HG LEU A 37 -9.964 4.612 2.541 1.00 25.00 H new ATOM 0 HD11 LEU A 37 -10.550 2.236 2.901 1.00 25.00 H new ATOM 0 HD12 LEU A 37 -10.331 2.611 1.175 1.00 25.00 H new ATOM 0 HD13 LEU A 37 -9.056 1.748 2.067 1.00 25.00 H new ATOM 0 HD21 LEU A 37 -9.236 3.389 4.612 1.00 25.00 H new ATOM 0 HD22 LEU A 37 -7.704 2.973 3.808 1.00 25.00 H new ATOM 0 HD23 LEU A 37 -8.083 4.672 4.175 1.00 25.00 H new ATOM 468 N ASP A 38 -7.239 6.955 -0.721 1.00 25.00 N ATOM 469 CA ASP A 38 -6.083 7.496 -1.465 1.00 25.00 C ATOM 470 C ASP A 38 -4.987 7.920 -0.485 1.00 25.00 C ATOM 471 O ASP A 38 -5.187 8.841 0.313 1.00 25.00 O ATOM 472 CB ASP A 38 -6.464 8.734 -2.288 1.00 25.00 C ATOM 473 CG ASP A 38 -7.578 8.472 -3.277 1.00 25.00 C ATOM 474 OD1 ASP A 38 -7.317 7.904 -4.358 1.00 25.00 O ATOM 475 OD2 ASP A 38 -8.706 8.942 -3.009 1.00 25.00 O ATOM 0 H ASP A 38 -7.893 7.665 -0.391 1.00 25.00 H new ATOM 0 HA ASP A 38 -5.737 6.707 -2.133 1.00 25.00 H new ATOM 0 HB2 ASP A 38 -6.768 9.533 -1.611 1.00 25.00 H new ATOM 0 HB3 ASP A 38 -5.585 9.089 -2.826 1.00 25.00 H new ATOM 480 N GLY A 39 -3.826 7.282 -0.539 1.00 25.00 N ATOM 481 CA GLY A 39 -2.754 7.617 0.396 1.00 25.00 C ATOM 482 C GLY A 39 -2.120 8.980 0.148 1.00 25.00 C ATOM 483 O GLY A 39 -1.992 9.817 1.063 1.00 25.00 O ATOM 0 H GLY A 39 -3.602 6.543 -1.205 1.00 25.00 H new ATOM 0 HA2 GLY A 39 -3.150 7.591 1.411 1.00 25.00 H new ATOM 0 HA3 GLY A 39 -1.981 6.851 0.336 1.00 25.00 H new ATOM 487 N GLY A 40 -1.704 9.212 -1.087 1.00 25.00 N ATOM 488 CA GLY A 40 -1.052 10.461 -1.448 1.00 25.00 C ATOM 489 C GLY A 40 0.405 10.493 -1.025 1.00 25.00 C ATOM 490 O GLY A 40 0.891 9.588 -0.336 1.00 25.00 O ATOM 0 H GLY A 40 -1.806 8.551 -1.857 1.00 25.00 H new ATOM 0 HA2 GLY A 40 -1.118 10.604 -2.526 1.00 25.00 H new ATOM 0 HA3 GLY A 40 -1.581 11.292 -0.983 1.00 25.00 H new ATOM 494 N ALA A 41 1.115 11.546 -1.405 1.00 25.00 N ATOM 495 CA ALA A 41 2.524 11.687 -1.038 1.00 25.00 C ATOM 496 C ALA A 41 2.684 11.646 0.492 1.00 25.00 C ATOM 497 O ALA A 41 1.733 11.922 1.236 1.00 25.00 O ATOM 498 CB ALA A 41 3.085 12.998 -1.609 1.00 25.00 C ATOM 0 H ALA A 41 0.744 12.314 -1.965 1.00 25.00 H new ATOM 0 HA ALA A 41 3.087 10.855 -1.461 1.00 25.00 H new ATOM 0 HB1 ALA A 41 4.135 13.096 -1.332 1.00 25.00 H new ATOM 0 HB2 ALA A 41 2.996 12.989 -2.695 1.00 25.00 H new ATOM 0 HB3 ALA A 41 2.523 13.840 -1.206 1.00 25.00 H new ATOM 504 N GLY A 42 3.872 11.277 0.947 1.00 25.00 N ATOM 505 CA GLY A 42 4.133 11.132 2.374 1.00 25.00 C ATOM 506 C GLY A 42 3.887 9.707 2.830 1.00 25.00 C ATOM 507 O GLY A 42 3.342 8.893 2.066 1.00 25.00 O ATOM 0 H GLY A 42 4.672 11.072 0.349 1.00 25.00 H new ATOM 0 HA2 GLY A 42 5.164 11.413 2.589 1.00 25.00 H new ATOM 0 HA3 GLY A 42 3.493 11.813 2.935 1.00 25.00 H new ATOM 511 N ARG A 43 4.306 9.392 4.050 1.00 25.00 N ATOM 512 CA ARG A 43 4.145 8.040 4.609 1.00 25.00 C ATOM 513 C ARG A 43 2.783 7.990 5.289 1.00 25.00 C ATOM 514 O ARG A 43 2.424 8.894 6.031 1.00 25.00 O ATOM 515 CB ARG A 43 5.290 7.718 5.595 1.00 25.00 C ATOM 516 CG ARG A 43 5.374 8.664 6.798 1.00 25.00 C ATOM 517 CD ARG A 43 6.748 8.706 7.453 1.00 25.00 C ATOM 518 NE ARG A 43 7.764 9.302 6.567 1.00 25.00 N ATOM 519 CZ ARG A 43 8.086 10.591 6.488 1.00 25.00 C ATOM 520 NH1 ARG A 43 7.512 11.523 7.193 1.00 25.00 N ATOM 521 NH2 ARG A 43 9.027 10.942 5.660 1.00 25.00 N ATOM 0 H ARG A 43 4.763 10.052 4.679 1.00 25.00 H new ATOM 0 HA ARG A 43 4.194 7.286 3.824 1.00 25.00 H new ATOM 0 HB2 ARG A 43 5.164 6.698 5.958 1.00 25.00 H new ATOM 0 HB3 ARG A 43 6.237 7.750 5.056 1.00 25.00 H new ATOM 0 HG2 ARG A 43 5.104 9.670 6.477 1.00 25.00 H new ATOM 0 HG3 ARG A 43 4.637 8.358 7.541 1.00 25.00 H new ATOM 0 HD2 ARG A 43 6.691 9.280 8.378 1.00 25.00 H new ATOM 0 HD3 ARG A 43 7.052 7.695 7.724 1.00 25.00 H new ATOM 0 HE ARG A 43 8.270 8.663 5.954 1.00 25.00 H new ATOM 0 HH11 ARG A 43 6.771 11.281 7.851 1.00 25.00 H new ATOM 0 HH12 ARG A 43 7.803 12.495 7.087 1.00 25.00 H new ATOM 0 HH21 ARG A 43 9.497 10.236 5.093 1.00 25.00 H new ATOM 0 HH22 ARG A 43 9.295 11.923 5.578 1.00 25.00 H new ATOM 535 N ASP A 44 1.996 6.980 4.972 1.00 25.00 N ATOM 536 CA ASP A 44 0.607 6.934 5.423 1.00 25.00 C ATOM 537 C ASP A 44 0.238 5.613 6.070 1.00 25.00 C ATOM 538 O ASP A 44 0.900 4.594 5.859 1.00 25.00 O ATOM 539 CB ASP A 44 -0.314 7.181 4.229 1.00 25.00 C ATOM 540 CG ASP A 44 -0.036 8.501 3.557 1.00 25.00 C ATOM 541 OD1 ASP A 44 -0.116 9.549 4.216 1.00 50.00 O ATOM 542 OD2 ASP A 44 0.282 8.519 2.349 1.00 50.00 O ATOM 0 H ASP A 44 2.287 6.182 4.408 1.00 25.00 H new ATOM 0 HA ASP A 44 0.488 7.708 6.181 1.00 25.00 H new ATOM 0 HB2 ASP A 44 -0.192 6.375 3.506 1.00 25.00 H new ATOM 0 HB3 ASP A 44 -1.352 7.156 4.562 1.00 25.00 H new ATOM 547 N ARG A 45 -0.833 5.641 6.850 1.00 25.00 N ATOM 548 CA ARG A 45 -1.385 4.446 7.495 1.00 25.00 C ATOM 549 C ARG A 45 -2.819 4.338 7.029 1.00 25.00 C ATOM 550 O ARG A 45 -3.620 5.208 7.329 1.00 25.00 O ATOM 551 CB ARG A 45 -1.340 4.567 9.022 1.00 25.00 C ATOM 552 CG ARG A 45 -0.105 3.932 9.659 1.00 25.00 C ATOM 553 CD ARG A 45 1.155 4.734 9.387 1.00 25.00 C ATOM 554 NE ARG A 45 2.337 4.124 10.016 1.00 25.00 N ATOM 555 CZ ARG A 45 3.576 4.586 9.913 1.00 25.00 C ATOM 556 NH1 ARG A 45 3.867 5.661 9.220 1.00 25.00 N ATOM 557 NH2 ARG A 45 4.543 3.954 10.519 1.00 25.00 N ATOM 0 H ARG A 45 -1.350 6.495 7.058 1.00 25.00 H new ATOM 0 HA ARG A 45 -0.803 3.564 7.229 1.00 25.00 H new ATOM 0 HB2 ARG A 45 -1.375 5.622 9.294 1.00 25.00 H new ATOM 0 HB3 ARG A 45 -2.232 4.101 9.440 1.00 25.00 H new ATOM 0 HG2 ARG A 45 -0.255 3.848 10.735 1.00 25.00 H new ATOM 0 HG3 ARG A 45 0.020 2.920 9.275 1.00 25.00 H new ATOM 0 HD2 ARG A 45 1.313 4.808 8.311 1.00 25.00 H new ATOM 0 HD3 ARG A 45 1.027 5.750 9.761 1.00 25.00 H new ATOM 0 HE ARG A 45 2.193 3.282 10.573 1.00 25.00 H new ATOM 0 HH11 ARG A 45 3.128 6.172 8.737 1.00 25.00 H new ATOM 0 HH12 ARG A 45 4.832 5.986 9.164 1.00 25.00 H new ATOM 0 HH21 ARG A 45 4.342 3.115 11.064 1.00 25.00 H new ATOM 0 HH22 ARG A 45 5.500 4.298 10.448 1.00 25.00 H new ATOM 571 N LEU A 46 -3.119 3.319 6.244 1.00 25.00 N ATOM 572 CA LEU A 46 -4.439 3.168 5.633 1.00 25.00 C ATOM 573 C LEU A 46 -5.174 1.986 6.253 1.00 25.00 C ATOM 574 O LEU A 46 -4.911 0.843 5.912 1.00 25.00 O ATOM 575 CB LEU A 46 -4.305 2.956 4.114 1.00 25.00 C ATOM 576 CG LEU A 46 -3.619 4.077 3.306 1.00 25.00 C ATOM 577 CD1 LEU A 46 -2.103 3.863 3.189 1.00 25.00 C ATOM 578 CD2 LEU A 46 -4.211 4.134 1.905 1.00 25.00 C ATOM 0 H LEU A 46 -2.463 2.574 6.009 1.00 25.00 H new ATOM 0 HA LEU A 46 -5.009 4.079 5.815 1.00 25.00 H new ATOM 0 HB2 LEU A 46 -3.751 2.032 3.949 1.00 25.00 H new ATOM 0 HB3 LEU A 46 -5.304 2.806 3.704 1.00 25.00 H new ATOM 0 HG LEU A 46 -3.792 5.012 3.839 1.00 25.00 H new ATOM 0 HD11 LEU A 46 -1.664 4.677 2.612 1.00 25.00 H new ATOM 0 HD12 LEU A 46 -1.660 3.844 4.185 1.00 25.00 H new ATOM 0 HD13 LEU A 46 -1.907 2.916 2.687 1.00 25.00 H new ATOM 0 HD21 LEU A 46 -3.725 4.927 1.336 1.00 25.00 H new ATOM 0 HD22 LEU A 46 -4.053 3.179 1.404 1.00 25.00 H new ATOM 0 HD23 LEU A 46 -5.280 4.337 1.970 1.00 25.00 H new ATOM 590 N THR A 47 -6.081 2.253 7.175 1.00 25.00 N ATOM 591 CA THR A 47 -6.838 1.185 7.825 1.00 25.00 C ATOM 592 C THR A 47 -8.116 0.939 7.047 1.00 25.00 C ATOM 593 O THR A 47 -8.961 1.819 6.945 1.00 25.00 O ATOM 594 CB THR A 47 -7.180 1.563 9.283 1.00 25.00 C ATOM 595 OG1 THR A 47 -5.991 2.011 9.940 1.00 25.00 O ATOM 596 CG2 THR A 47 -7.758 0.388 10.051 1.00 25.00 C ATOM 0 H THR A 47 -6.315 3.194 7.493 1.00 25.00 H new ATOM 0 HA THR A 47 -6.230 0.280 7.840 1.00 25.00 H new ATOM 0 HB THR A 47 -7.932 2.352 9.259 1.00 25.00 H new ATOM 0 HG1 THR A 47 -6.201 2.254 10.866 1.00 25.00 H new ATOM 0 HG21 THR A 47 -7.985 0.696 11.072 1.00 25.00 H new ATOM 0 HG22 THR A 47 -8.672 0.049 9.563 1.00 25.00 H new ATOM 0 HG23 THR A 47 -7.033 -0.426 10.070 1.00 25.00 H new ATOM 604 N GLY A 48 -8.250 -0.236 6.453 1.00 25.00 N ATOM 605 CA GLY A 48 -9.431 -0.509 5.649 1.00 25.00 C ATOM 606 C GLY A 48 -10.613 -0.957 6.479 1.00 25.00 C ATOM 607 O GLY A 48 -11.755 -0.553 6.227 1.00 25.00 O ATOM 0 H GLY A 48 -7.575 -0.999 6.509 1.00 25.00 H new ATOM 0 HA2 GLY A 48 -9.702 0.389 5.093 1.00 25.00 H new ATOM 0 HA3 GLY A 48 -9.195 -1.279 4.915 1.00 25.00 H new ATOM 611 N GLY A 49 -10.352 -1.800 7.465 1.00 25.00 N ATOM 612 CA GLY A 49 -11.416 -2.340 8.292 1.00 25.00 C ATOM 613 C GLY A 49 -12.236 -3.364 7.529 1.00 25.00 C ATOM 614 O GLY A 49 -11.826 -3.857 6.465 1.00 25.00 O ATOM 0 H GLY A 49 -9.416 -2.123 7.711 1.00 25.00 H new ATOM 0 HA2 GLY A 49 -10.990 -2.802 9.183 1.00 25.00 H new ATOM 0 HA3 GLY A 49 -12.063 -1.531 8.631 1.00 25.00 H new ATOM 618 N LEU A 50 -13.415 -3.669 8.053 1.00 25.00 N ATOM 619 CA LEU A 50 -14.332 -4.607 7.404 1.00 25.00 C ATOM 620 C LEU A 50 -14.794 -4.059 6.061 1.00 25.00 C ATOM 621 O LEU A 50 -14.789 -2.842 5.834 1.00 25.00 O ATOM 622 CB LEU A 50 -15.562 -4.853 8.288 1.00 25.00 C ATOM 623 CG LEU A 50 -15.299 -5.602 9.600 1.00 25.00 C ATOM 624 CD1 LEU A 50 -16.543 -5.532 10.482 1.00 25.00 C ATOM 625 CD2 LEU A 50 -14.923 -7.065 9.350 1.00 25.00 C ATOM 0 H LEU A 50 -13.764 -3.281 8.929 1.00 25.00 H new ATOM 0 HA LEU A 50 -13.798 -5.545 7.251 1.00 25.00 H new ATOM 0 HB2 LEU A 50 -16.015 -3.890 8.525 1.00 25.00 H new ATOM 0 HB3 LEU A 50 -16.295 -5.416 7.710 1.00 25.00 H new ATOM 0 HG LEU A 50 -14.457 -5.124 10.101 1.00 25.00 H new ATOM 0 HD11 LEU A 50 -16.358 -6.064 11.415 1.00 25.00 H new ATOM 0 HD12 LEU A 50 -16.777 -4.490 10.699 1.00 25.00 H new ATOM 0 HD13 LEU A 50 -17.384 -5.992 9.963 1.00 25.00 H new ATOM 0 HD21 LEU A 50 -14.744 -7.563 10.303 1.00 25.00 H new ATOM 0 HD22 LEU A 50 -15.737 -7.566 8.826 1.00 25.00 H new ATOM 0 HD23 LEU A 50 -14.019 -7.110 8.742 1.00 25.00 H new ATOM 637 N GLY A 51 -15.208 -4.965 5.192 1.00 25.00 N ATOM 638 CA GLY A 51 -15.662 -4.599 3.858 1.00 25.00 C ATOM 639 C GLY A 51 -14.525 -4.657 2.858 1.00 25.00 C ATOM 640 O GLY A 51 -13.349 -4.780 3.253 1.00 25.00 O ATOM 0 H GLY A 51 -15.240 -5.966 5.386 1.00 25.00 H new ATOM 0 HA2 GLY A 51 -16.460 -5.272 3.545 1.00 25.00 H new ATOM 0 HA3 GLY A 51 -16.082 -3.594 3.877 1.00 25.00 H new ATOM 644 N ALA A 52 -14.863 -4.580 1.582 1.00 25.00 N ATOM 645 CA ALA A 52 -13.878 -4.596 0.509 1.00 25.00 C ATOM 646 C ALA A 52 -13.356 -3.171 0.367 1.00 25.00 C ATOM 647 O ALA A 52 -14.122 -2.233 0.203 1.00 25.00 O ATOM 648 CB ALA A 52 -14.525 -5.073 -0.796 1.00 25.00 C ATOM 0 H ALA A 52 -15.827 -4.505 1.259 1.00 25.00 H new ATOM 0 HA ALA A 52 -13.061 -5.282 0.734 1.00 25.00 H new ATOM 0 HB1 ALA A 52 -13.779 -5.081 -1.590 1.00 25.00 H new ATOM 0 HB2 ALA A 52 -14.920 -6.080 -0.660 1.00 25.00 H new ATOM 0 HB3 ALA A 52 -15.337 -4.398 -1.067 1.00 25.00 H new ATOM 654 N ASP A 53 -12.056 -3.004 0.489 1.00 25.00 N ATOM 655 CA ASP A 53 -11.458 -1.679 0.470 1.00 25.00 C ATOM 656 C ASP A 53 -10.471 -1.587 -0.666 1.00 25.00 C ATOM 657 O ASP A 53 -9.739 -2.538 -0.931 1.00 25.00 O ATOM 658 CB ASP A 53 -10.750 -1.421 1.794 1.00 25.00 C ATOM 659 CG ASP A 53 -11.685 -1.527 2.973 1.00 25.00 C ATOM 660 OD1 ASP A 53 -12.656 -0.753 3.068 1.00 50.00 O ATOM 661 OD2 ASP A 53 -11.448 -2.395 3.844 1.00 50.00 O ATOM 0 H ASP A 53 -11.390 -3.768 0.603 1.00 25.00 H new ATOM 0 HA ASP A 53 -12.237 -0.930 0.328 1.00 25.00 H new ATOM 0 HB2 ASP A 53 -9.936 -2.136 1.913 1.00 25.00 H new ATOM 0 HB3 ASP A 53 -10.302 -0.427 1.776 1.00 25.00 H new ATOM 666 N THR A 54 -10.427 -0.445 -1.328 1.00 25.00 N ATOM 667 CA THR A 54 -9.463 -0.238 -2.399 1.00 25.00 C ATOM 668 C THR A 54 -8.509 0.861 -1.961 1.00 25.00 C ATOM 669 O THR A 54 -8.911 1.964 -1.578 1.00 25.00 O ATOM 670 CB THR A 54 -10.145 0.036 -3.776 1.00 25.00 C ATOM 671 OG1 THR A 54 -9.142 0.169 -4.786 1.00 25.00 O ATOM 672 CG2 THR A 54 -10.992 1.286 -3.779 1.00 25.00 C ATOM 0 H THR A 54 -11.041 0.349 -1.147 1.00 25.00 H new ATOM 0 HA THR A 54 -8.894 -1.152 -2.570 1.00 25.00 H new ATOM 0 HB THR A 54 -10.802 -0.811 -3.973 1.00 25.00 H new ATOM 0 HG1 THR A 54 -9.570 0.339 -5.651 1.00 25.00 H new ATOM 0 HG21 THR A 54 -11.438 1.421 -4.764 1.00 25.00 H new ATOM 0 HG22 THR A 54 -11.781 1.193 -3.033 1.00 25.00 H new ATOM 0 HG23 THR A 54 -10.369 2.148 -3.542 1.00 25.00 H new ATOM 680 N PHE A 55 -7.234 0.518 -1.948 1.00 25.00 N ATOM 681 CA PHE A 55 -6.190 1.423 -1.504 1.00 25.00 C ATOM 682 C PHE A 55 -5.493 1.900 -2.756 1.00 25.00 C ATOM 683 O PHE A 55 -5.181 1.097 -3.637 1.00 25.00 O ATOM 684 CB PHE A 55 -5.232 0.689 -0.571 1.00 25.00 C ATOM 685 CG PHE A 55 -5.923 0.033 0.593 1.00 25.00 C ATOM 686 CD1 PHE A 55 -6.261 0.776 1.738 1.00 25.00 C ATOM 687 CD2 PHE A 55 -6.265 -1.333 0.543 1.00 25.00 C ATOM 688 CE1 PHE A 55 -6.924 0.162 2.831 1.00 25.00 C ATOM 689 CE2 PHE A 55 -6.934 -1.951 1.623 1.00 25.00 C ATOM 690 CZ PHE A 55 -7.257 -1.207 2.766 1.00 25.00 C ATOM 0 H PHE A 55 -6.893 -0.396 -2.245 1.00 25.00 H new ATOM 0 HA PHE A 55 -6.587 2.269 -0.943 1.00 25.00 H new ATOM 0 HB2 PHE A 55 -4.692 -0.069 -1.139 1.00 25.00 H new ATOM 0 HB3 PHE A 55 -4.491 1.394 -0.195 1.00 25.00 H new ATOM 0 HD1 PHE A 55 -6.013 1.826 1.786 1.00 25.00 H new ATOM 0 HD2 PHE A 55 -6.013 -1.915 -0.331 1.00 25.00 H new ATOM 0 HE1 PHE A 55 -7.173 0.740 3.709 1.00 25.00 H new ATOM 0 HE2 PHE A 55 -7.197 -2.997 1.568 1.00 25.00 H new ATOM 0 HZ PHE A 55 -7.760 -1.681 3.596 1.00 25.00 H new ATOM 700 N ARG A 56 -5.335 3.205 -2.892 1.00 25.00 N ATOM 701 CA ARG A 56 -4.895 3.783 -4.153 1.00 25.00 C ATOM 702 C ARG A 56 -3.764 4.787 -4.022 1.00 25.00 C ATOM 703 O ARG A 56 -3.674 5.534 -3.041 1.00 25.00 O ATOM 704 CB ARG A 56 -6.101 4.467 -4.798 1.00 25.00 C ATOM 705 CG ARG A 56 -6.027 4.554 -6.302 1.00 25.00 C ATOM 706 CD ARG A 56 -6.673 5.806 -6.786 1.00 25.00 C ATOM 707 NE ARG A 56 -6.497 5.954 -8.234 1.00 25.00 N ATOM 708 CZ ARG A 56 -6.709 7.077 -8.905 1.00 25.00 C ATOM 709 NH1 ARG A 56 -7.116 8.176 -8.311 1.00 25.00 N ATOM 710 NH2 ARG A 56 -6.509 7.094 -10.193 1.00 25.00 N ATOM 0 H ARG A 56 -5.504 3.883 -2.149 1.00 25.00 H new ATOM 0 HA ARG A 56 -4.499 2.969 -4.760 1.00 25.00 H new ATOM 0 HB2 ARG A 56 -7.005 3.925 -4.520 1.00 25.00 H new ATOM 0 HB3 ARG A 56 -6.195 5.474 -4.391 1.00 25.00 H new ATOM 0 HG2 ARG A 56 -4.986 4.528 -6.623 1.00 25.00 H new ATOM 0 HG3 ARG A 56 -6.519 3.689 -6.747 1.00 25.00 H new ATOM 0 HD2 ARG A 56 -7.736 5.790 -6.544 1.00 25.00 H new ATOM 0 HD3 ARG A 56 -6.242 6.665 -6.273 1.00 25.00 H new ATOM 0 HE ARG A 56 -6.190 5.136 -8.761 1.00 25.00 H new ATOM 0 HH11 ARG A 56 -7.278 8.181 -7.304 1.00 25.00 H new ATOM 0 HH12 ARG A 56 -7.270 9.024 -8.857 1.00 25.00 H new ATOM 0 HH21 ARG A 56 -6.193 6.250 -10.671 1.00 25.00 H new ATOM 0 HH22 ARG A 56 -6.668 7.951 -10.723 1.00 25.00 H new ATOM 724 N PHE A 57 -2.930 4.828 -5.048 1.00 25.00 N ATOM 725 CA PHE A 57 -1.893 5.841 -5.163 1.00 25.00 C ATOM 726 C PHE A 57 -2.533 7.146 -5.641 1.00 25.00 C ATOM 727 O PHE A 57 -3.575 7.131 -6.293 1.00 25.00 O ATOM 728 CB PHE A 57 -0.852 5.407 -6.210 1.00 25.00 C ATOM 729 CG PHE A 57 -1.385 5.419 -7.629 1.00 25.00 C ATOM 730 CD1 PHE A 57 -1.339 6.599 -8.403 1.00 25.00 C ATOM 731 CD2 PHE A 57 -1.967 4.270 -8.188 1.00 25.00 C ATOM 732 CE1 PHE A 57 -1.891 6.638 -9.703 1.00 25.00 C ATOM 733 CE2 PHE A 57 -2.506 4.299 -9.496 1.00 25.00 C ATOM 734 CZ PHE A 57 -2.474 5.485 -10.247 1.00 25.00 C ATOM 0 H PHE A 57 -2.952 4.163 -5.822 1.00 25.00 H new ATOM 0 HA PHE A 57 -1.411 5.974 -4.195 1.00 25.00 H new ATOM 0 HB2 PHE A 57 0.012 6.069 -6.149 1.00 25.00 H new ATOM 0 HB3 PHE A 57 -0.502 4.403 -5.969 1.00 25.00 H new ATOM 0 HD1 PHE A 57 -0.875 7.485 -7.995 1.00 25.00 H new ATOM 0 HD2 PHE A 57 -2.004 3.356 -7.614 1.00 25.00 H new ATOM 0 HE1 PHE A 57 -1.864 7.553 -10.276 1.00 25.00 H new ATOM 0 HE2 PHE A 57 -2.943 3.406 -9.918 1.00 25.00 H new ATOM 0 HZ PHE A 57 -2.897 5.509 -11.240 1.00 25.00 H new ATOM 744 N ALA A 58 -1.839 8.254 -5.429 1.00 25.00 N ATOM 745 CA ALA A 58 -2.182 9.524 -6.069 1.00 25.00 C ATOM 746 C ALA A 58 -0.934 10.114 -6.750 1.00 25.00 C ATOM 747 O ALA A 58 -0.995 11.167 -7.373 1.00 25.00 O ATOM 748 CB ALA A 58 -2.758 10.498 -5.043 1.00 25.00 C ATOM 0 H ALA A 58 -1.027 8.303 -4.814 1.00 25.00 H new ATOM 0 HA ALA A 58 -2.944 9.350 -6.829 1.00 25.00 H new ATOM 0 HB1 ALA A 58 -3.008 11.438 -5.534 1.00 25.00 H new ATOM 0 HB2 ALA A 58 -3.657 10.070 -4.600 1.00 25.00 H new ATOM 0 HB3 ALA A 58 -2.020 10.682 -4.262 1.00 25.00 H new ATOM 754 N LEU A 59 0.198 9.429 -6.611 1.00 25.00 N ATOM 755 CA LEU A 59 1.471 9.872 -7.185 1.00 25.00 C ATOM 756 C LEU A 59 2.341 8.628 -7.383 1.00 25.00 C ATOM 757 O LEU A 59 2.074 7.606 -6.777 1.00 25.00 O ATOM 758 CB LEU A 59 2.150 10.854 -6.211 1.00 25.00 C ATOM 759 CG LEU A 59 3.390 11.631 -6.691 1.00 25.00 C ATOM 760 CD1 LEU A 59 3.094 12.488 -7.922 1.00 25.00 C ATOM 761 CD2 LEU A 59 3.897 12.511 -5.561 1.00 25.00 C ATOM 0 H LEU A 59 0.261 8.550 -6.097 1.00 25.00 H new ATOM 0 HA LEU A 59 1.322 10.381 -8.137 1.00 25.00 H new ATOM 0 HB2 LEU A 59 1.402 11.584 -5.902 1.00 25.00 H new ATOM 0 HB3 LEU A 59 2.435 10.293 -5.321 1.00 25.00 H new ATOM 0 HG LEU A 59 4.151 10.905 -6.977 1.00 25.00 H new ATOM 0 HD11 LEU A 59 3.998 13.017 -8.223 1.00 25.00 H new ATOM 0 HD12 LEU A 59 2.759 11.848 -8.738 1.00 25.00 H new ATOM 0 HD13 LEU A 59 2.314 13.211 -7.683 1.00 25.00 H new ATOM 0 HD21 LEU A 59 4.775 13.063 -5.896 1.00 25.00 H new ATOM 0 HD22 LEU A 59 3.116 13.213 -5.268 1.00 25.00 H new ATOM 0 HD23 LEU A 59 4.164 11.889 -4.707 1.00 25.00 H new ATOM 773 N ARG A 60 3.395 8.707 -8.184 1.00 25.00 N ATOM 774 CA ARG A 60 4.322 7.572 -8.340 1.00 25.00 C ATOM 775 C ARG A 60 5.244 7.424 -7.116 1.00 25.00 C ATOM 776 O ARG A 60 5.850 6.391 -6.902 1.00 25.00 O ATOM 777 CB ARG A 60 5.170 7.744 -9.608 1.00 25.00 C ATOM 778 CG ARG A 60 6.119 8.925 -9.535 1.00 25.00 C ATOM 779 CD ARG A 60 6.972 9.082 -10.769 1.00 25.00 C ATOM 780 NE ARG A 60 7.882 10.216 -10.556 1.00 25.00 N ATOM 781 CZ ARG A 60 8.806 10.646 -11.399 1.00 25.00 C ATOM 782 NH1 ARG A 60 9.018 10.081 -12.563 1.00 25.00 N ATOM 783 NH2 ARG A 60 9.529 11.671 -11.049 1.00 25.00 N ATOM 0 H ARG A 60 3.636 9.531 -8.734 1.00 25.00 H new ATOM 0 HA ARG A 60 3.721 6.667 -8.426 1.00 25.00 H new ATOM 0 HB2 ARG A 60 5.745 6.834 -9.779 1.00 25.00 H new ATOM 0 HB3 ARG A 60 4.509 7.870 -10.465 1.00 25.00 H new ATOM 0 HG2 ARG A 60 5.542 9.837 -9.382 1.00 25.00 H new ATOM 0 HG3 ARG A 60 6.767 8.808 -8.666 1.00 25.00 H new ATOM 0 HD2 ARG A 60 7.538 8.170 -10.958 1.00 25.00 H new ATOM 0 HD3 ARG A 60 6.346 9.256 -11.644 1.00 25.00 H new ATOM 0 HE ARG A 60 7.792 10.720 -9.674 1.00 25.00 H new ATOM 0 HH11 ARG A 60 8.459 9.277 -12.849 1.00 25.00 H new ATOM 0 HH12 ARG A 60 9.742 10.446 -13.183 1.00 25.00 H new ATOM 0 HH21 ARG A 60 9.375 12.119 -10.146 1.00 25.00 H new ATOM 0 HH22 ARG A 60 10.249 12.026 -11.678 1.00 25.00 H new ATOM 797 N GLU A 61 5.341 8.477 -6.319 1.00 25.00 N ATOM 798 CA GLU A 61 6.216 8.502 -5.138 1.00 25.00 C ATOM 799 C GLU A 61 5.406 8.244 -3.872 1.00 25.00 C ATOM 800 O GLU A 61 5.857 8.481 -2.754 1.00 25.00 O ATOM 801 CB GLU A 61 6.880 9.869 -5.027 1.00 25.00 C ATOM 802 CG GLU A 61 7.923 10.145 -6.107 1.00 25.00 C ATOM 803 CD GLU A 61 7.683 11.464 -6.825 1.00 25.00 C ATOM 804 OE1 GLU A 61 7.478 12.488 -6.149 1.00 25.00 O ATOM 805 OE2 GLU A 61 7.686 11.471 -8.079 1.00 25.00 O ATOM 0 H GLU A 61 4.820 9.341 -6.465 1.00 25.00 H new ATOM 0 HA GLU A 61 6.972 7.724 -5.247 1.00 25.00 H new ATOM 0 HB2 GLU A 61 6.111 10.640 -5.075 1.00 25.00 H new ATOM 0 HB3 GLU A 61 7.354 9.952 -4.049 1.00 25.00 H new ATOM 0 HG2 GLU A 61 8.915 10.156 -5.655 1.00 25.00 H new ATOM 0 HG3 GLU A 61 7.913 9.332 -6.833 1.00 25.00 H new ATOM 812 N ASP A 62 4.185 7.775 -4.068 1.00 25.00 N ATOM 813 CA ASP A 62 3.258 7.510 -2.965 1.00 25.00 C ATOM 814 C ASP A 62 3.827 6.515 -1.954 1.00 25.00 C ATOM 815 O ASP A 62 3.537 6.600 -0.759 1.00 25.00 O ATOM 816 CB ASP A 62 1.954 6.955 -3.530 1.00 25.00 C ATOM 817 CG ASP A 62 0.763 7.318 -2.697 1.00 25.00 C ATOM 818 OD1 ASP A 62 0.736 7.024 -1.488 1.00 25.00 O ATOM 819 OD2 ASP A 62 -0.139 7.975 -3.248 1.00 25.00 O ATOM 0 H ASP A 62 3.803 7.566 -4.990 1.00 25.00 H new ATOM 0 HA ASP A 62 3.088 8.452 -2.443 1.00 25.00 H new ATOM 0 HB2 ASP A 62 1.812 7.331 -4.543 1.00 25.00 H new ATOM 0 HB3 ASP A 62 2.026 5.870 -3.600 1.00 25.00 H new ATOM 824 N SER A 63 4.643 5.593 -2.441 1.00 25.00 N ATOM 825 CA SER A 63 5.262 4.563 -1.612 1.00 25.00 C ATOM 826 C SER A 63 6.718 4.381 -2.048 1.00 25.00 C ATOM 827 O SER A 63 7.024 3.553 -2.896 1.00 25.00 O ATOM 828 CB SER A 63 4.482 3.260 -1.774 1.00 25.00 C ATOM 829 OG SER A 63 4.335 2.932 -3.148 1.00 25.00 O ATOM 0 H SER A 63 4.898 5.535 -3.427 1.00 25.00 H new ATOM 0 HA SER A 63 5.244 4.855 -0.562 1.00 25.00 H new ATOM 0 HB2 SER A 63 5.000 2.453 -1.256 1.00 25.00 H new ATOM 0 HB3 SER A 63 3.500 3.358 -1.311 1.00 25.00 H new ATOM 0 HG SER A 63 5.211 2.957 -3.586 1.00 25.00 H new ATOM 835 N HIS A 64 7.601 5.210 -1.510 1.00 25.00 N ATOM 836 CA HIS A 64 9.000 5.270 -1.952 1.00 25.00 C ATOM 837 C HIS A 64 9.938 5.292 -0.739 1.00 25.00 C ATOM 838 O HIS A 64 9.553 5.774 0.321 1.00 25.00 O ATOM 839 CB HIS A 64 9.156 6.536 -2.816 1.00 25.00 C ATOM 840 CG HIS A 64 10.550 7.075 -2.883 1.00 25.00 C ATOM 841 ND1 HIS A 64 10.950 8.245 -2.290 1.00 25.00 N ATOM 842 CD2 HIS A 64 11.664 6.601 -3.511 1.00 25.00 C ATOM 843 CE1 HIS A 64 12.234 8.434 -2.559 1.00 25.00 C ATOM 844 NE2 HIS A 64 12.726 7.460 -3.294 1.00 25.00 N ATOM 0 H HIS A 64 7.376 5.860 -0.757 1.00 25.00 H new ATOM 0 HA HIS A 64 9.265 4.391 -2.539 1.00 25.00 H new ATOM 0 HB2 HIS A 64 8.817 6.314 -3.828 1.00 25.00 H new ATOM 0 HB3 HIS A 64 8.499 7.312 -2.423 1.00 25.00 H new ATOM 0 HD1 HIS A 64 10.359 8.865 -1.736 1.00 25.00 H new ATOM 0 HD2 HIS A 64 11.710 5.691 -4.091 1.00 25.00 H new ATOM 0 HE1 HIS A 64 12.806 9.284 -2.217 1.00 25.00 H new ATOM 852 N ARG A 65 11.150 4.764 -0.868 1.00 25.00 N ATOM 853 CA ARG A 65 12.140 4.819 0.218 1.00 25.00 C ATOM 854 C ARG A 65 13.494 5.265 -0.309 1.00 25.00 C ATOM 855 O ARG A 65 13.897 4.923 -1.416 1.00 25.00 O ATOM 856 CB ARG A 65 12.285 3.461 0.921 1.00 25.00 C ATOM 857 CG ARG A 65 11.060 3.056 1.729 1.00 25.00 C ATOM 858 CD ARG A 65 11.393 1.949 2.728 1.00 25.00 C ATOM 859 NE ARG A 65 10.203 1.520 3.484 1.00 25.00 N ATOM 860 CZ ARG A 65 10.061 0.353 4.104 1.00 25.00 C ATOM 861 NH1 ARG A 65 10.983 -0.572 4.096 1.00 25.00 N ATOM 862 NH2 ARG A 65 8.951 0.114 4.745 1.00 25.00 N ATOM 0 H ARG A 65 11.477 4.292 -1.711 1.00 25.00 H new ATOM 0 HA ARG A 65 11.779 5.546 0.945 1.00 25.00 H new ATOM 0 HB2 ARG A 65 12.485 2.694 0.173 1.00 25.00 H new ATOM 0 HB3 ARG A 65 13.151 3.495 1.583 1.00 25.00 H new ATOM 0 HG2 ARG A 65 10.670 3.924 2.261 1.00 25.00 H new ATOM 0 HG3 ARG A 65 10.274 2.716 1.055 1.00 25.00 H new ATOM 0 HD2 ARG A 65 11.814 1.095 2.198 1.00 25.00 H new ATOM 0 HD3 ARG A 65 12.157 2.302 3.421 1.00 25.00 H new ATOM 0 HE ARG A 65 9.422 2.174 3.536 1.00 25.00 H new ATOM 0 HH11 ARG A 65 11.859 -0.414 3.598 1.00 25.00 H new ATOM 0 HH12 ARG A 65 10.827 -1.452 4.587 1.00 25.00 H new ATOM 0 HH21 ARG A 65 8.212 0.816 4.764 1.00 25.00 H new ATOM 0 HH22 ARG A 65 8.822 -0.775 5.227 1.00 25.00 H new ATOM 876 N SER A 66 14.185 6.037 0.513 1.00 25.00 N ATOM 877 CA SER A 66 15.480 6.617 0.180 1.00 25.00 C ATOM 878 C SER A 66 16.256 6.650 1.494 1.00 25.00 C ATOM 879 O SER A 66 15.639 6.679 2.558 1.00 25.00 O ATOM 880 CB SER A 66 15.251 8.041 -0.356 1.00 25.00 C ATOM 881 OG SER A 66 16.453 8.778 -0.488 1.00 25.00 O ATOM 0 H SER A 66 13.858 6.284 1.447 1.00 25.00 H new ATOM 0 HA SER A 66 16.022 6.054 -0.580 1.00 25.00 H new ATOM 0 HB2 SER A 66 14.757 7.984 -1.326 1.00 25.00 H new ATOM 0 HB3 SER A 66 14.576 8.573 0.315 1.00 25.00 H new ATOM 0 HG SER A 66 16.252 9.673 -0.833 1.00 25.00 H new ATOM 887 N PRO A 67 17.605 6.677 1.455 1.00 25.00 N ATOM 888 CA PRO A 67 18.279 6.806 2.756 1.00 25.00 C ATOM 889 C PRO A 67 18.035 8.167 3.419 1.00 25.00 C ATOM 890 O PRO A 67 18.252 8.329 4.609 1.00 25.00 O ATOM 891 CB PRO A 67 19.757 6.623 2.395 1.00 25.00 C ATOM 892 CG PRO A 67 19.852 7.116 0.998 1.00 25.00 C ATOM 893 CD PRO A 67 18.586 6.615 0.352 1.00 25.00 C ATOM 0 HA PRO A 67 17.911 6.084 3.485 1.00 25.00 H new ATOM 0 HB2 PRO A 67 20.404 7.191 3.063 1.00 25.00 H new ATOM 0 HB3 PRO A 67 20.060 5.579 2.471 1.00 25.00 H new ATOM 0 HG2 PRO A 67 19.916 8.203 0.961 1.00 25.00 H new ATOM 0 HG3 PRO A 67 20.738 6.727 0.496 1.00 25.00 H new ATOM 0 HD2 PRO A 67 18.287 7.240 -0.490 1.00 25.00 H new ATOM 0 HD3 PRO A 67 18.701 5.600 -0.029 1.00 25.00 H new ATOM 901 N LEU A 68 17.537 9.127 2.647 1.00 25.00 N ATOM 902 CA LEU A 68 17.200 10.452 3.168 1.00 25.00 C ATOM 903 C LEU A 68 15.826 10.453 3.846 1.00 25.00 C ATOM 904 O LEU A 68 15.400 11.461 4.398 1.00 25.00 O ATOM 905 CB LEU A 68 17.202 11.478 2.028 1.00 25.00 C ATOM 906 CG LEU A 68 18.524 11.638 1.259 1.00 25.00 C ATOM 907 CD1 LEU A 68 18.317 12.602 0.093 1.00 25.00 C ATOM 908 CD2 LEU A 68 19.651 12.153 2.160 1.00 25.00 C ATOM 0 H LEU A 68 17.356 9.013 1.650 1.00 25.00 H new ATOM 0 HA LEU A 68 17.952 10.719 3.911 1.00 25.00 H new ATOM 0 HB2 LEU A 68 16.424 11.201 1.317 1.00 25.00 H new ATOM 0 HB3 LEU A 68 16.926 12.449 2.440 1.00 25.00 H new ATOM 0 HG LEU A 68 18.819 10.656 0.890 1.00 25.00 H new ATOM 0 HD11 LEU A 68 19.253 12.717 -0.454 1.00 25.00 H new ATOM 0 HD12 LEU A 68 17.552 12.206 -0.575 1.00 25.00 H new ATOM 0 HD13 LEU A 68 17.998 13.572 0.475 1.00 25.00 H new ATOM 0 HD21 LEU A 68 20.567 12.252 1.577 1.00 25.00 H new ATOM 0 HD22 LEU A 68 19.375 13.125 2.569 1.00 25.00 H new ATOM 0 HD23 LEU A 68 19.815 11.449 2.976 1.00 25.00 H new ATOM 920 N GLY A 69 15.130 9.325 3.795 1.00 25.00 N ATOM 921 CA GLY A 69 13.827 9.216 4.424 1.00 25.00 C ATOM 922 C GLY A 69 12.926 8.199 3.752 1.00 25.00 C ATOM 923 O GLY A 69 13.023 7.945 2.553 1.00 25.00 O ATOM 0 H GLY A 69 15.447 8.477 3.325 1.00 25.00 H new ATOM 0 HA2 GLY A 69 13.957 8.942 5.471 1.00 25.00 H new ATOM 0 HA3 GLY A 69 13.340 10.191 4.408 1.00 25.00 H new ATOM 927 N THR A 70 12.033 7.616 4.535 1.00 25.00 N ATOM 928 CA THR A 70 11.073 6.646 4.021 1.00 25.00 C ATOM 929 C THR A 70 9.739 7.343 3.816 1.00 25.00 C ATOM 930 O THR A 70 9.375 8.226 4.584 1.00 25.00 O ATOM 931 CB THR A 70 10.906 5.442 4.993 1.00 25.00 C ATOM 932 OG1 THR A 70 9.837 4.609 4.543 1.00 25.00 O ATOM 933 CG2 THR A 70 10.587 5.886 6.427 1.00 25.00 C ATOM 0 H THR A 70 11.951 7.798 5.535 1.00 25.00 H new ATOM 0 HA THR A 70 11.441 6.252 3.074 1.00 25.00 H new ATOM 0 HB THR A 70 11.855 4.906 4.999 1.00 25.00 H new ATOM 0 HG1 THR A 70 9.825 3.781 5.067 1.00 25.00 H new ATOM 0 HG21 THR A 70 10.480 5.008 7.064 1.00 25.00 H new ATOM 0 HG22 THR A 70 11.397 6.511 6.803 1.00 25.00 H new ATOM 0 HG23 THR A 70 9.657 6.454 6.434 1.00 25.00 H new ATOM 941 N PHE A 71 9.024 6.962 2.772 1.00 25.00 N ATOM 942 CA PHE A 71 7.716 7.529 2.449 1.00 25.00 C ATOM 943 C PHE A 71 6.778 6.368 2.135 1.00 25.00 C ATOM 944 O PHE A 71 5.769 6.529 1.467 1.00 25.00 O ATOM 945 CB PHE A 71 7.833 8.474 1.248 1.00 25.00 C ATOM 946 CG PHE A 71 8.903 9.521 1.415 1.00 25.00 C ATOM 947 CD1 PHE A 71 8.610 10.747 2.039 1.00 25.00 C ATOM 948 CD2 PHE A 71 10.218 9.278 0.965 1.00 25.00 C ATOM 949 CE1 PHE A 71 9.620 11.731 2.210 1.00 25.00 C ATOM 950 CE2 PHE A 71 11.234 10.248 1.138 1.00 25.00 C ATOM 951 CZ PHE A 71 10.934 11.475 1.764 1.00 25.00 C ATOM 0 H PHE A 71 9.333 6.245 2.116 1.00 25.00 H new ATOM 0 HA PHE A 71 7.328 8.109 3.286 1.00 25.00 H new ATOM 0 HB2 PHE A 71 8.044 7.888 0.353 1.00 25.00 H new ATOM 0 HB3 PHE A 71 6.874 8.967 1.088 1.00 25.00 H new ATOM 0 HD1 PHE A 71 7.608 10.942 2.391 1.00 25.00 H new ATOM 0 HD2 PHE A 71 10.452 8.340 0.483 1.00 25.00 H new ATOM 0 HE1 PHE A 71 9.383 12.674 2.681 1.00 25.00 H new ATOM 0 HE2 PHE A 71 12.237 10.049 0.791 1.00 25.00 H new ATOM 0 HZ PHE A 71 11.707 12.216 1.902 1.00 25.00 H new ATOM 961 N SER A 72 7.164 5.179 2.584 1.00 25.00 N ATOM 962 CA SER A 72 6.385 3.967 2.344 1.00 25.00 C ATOM 963 C SER A 72 5.109 3.988 3.164 1.00 25.00 C ATOM 964 O SER A 72 5.070 4.589 4.240 1.00 25.00 O ATOM 965 CB SER A 72 7.192 2.745 2.753 1.00 25.00 C ATOM 966 OG SER A 72 7.575 2.839 4.118 1.00 25.00 O ATOM 0 H SER A 72 8.018 5.027 3.120 1.00 25.00 H new ATOM 0 HA SER A 72 6.142 3.923 1.282 1.00 25.00 H new ATOM 0 HB2 SER A 72 6.602 1.842 2.596 1.00 25.00 H new ATOM 0 HB3 SER A 72 8.079 2.660 2.125 1.00 25.00 H new ATOM 0 HG SER A 72 8.265 3.528 4.217 1.00 25.00 H new ATOM 972 N ASP A 73 4.098 3.282 2.688 1.00 25.00 N ATOM 973 CA ASP A 73 2.814 3.218 3.380 1.00 25.00 C ATOM 974 C ASP A 73 2.615 1.881 4.064 1.00 25.00 C ATOM 975 O ASP A 73 3.179 0.862 3.653 1.00 25.00 O ATOM 976 CB ASP A 73 1.667 3.440 2.394 1.00 25.00 C ATOM 977 CG ASP A 73 1.550 4.880 1.959 1.00 25.00 C ATOM 978 OD1 ASP A 73 2.322 5.738 2.438 1.00 50.00 O ATOM 979 OD2 ASP A 73 0.694 5.192 1.118 1.00 50.00 O ATOM 0 H ASP A 73 4.138 2.742 1.823 1.00 25.00 H new ATOM 0 HA ASP A 73 2.816 4.003 4.136 1.00 25.00 H new ATOM 0 HB2 ASP A 73 1.819 2.810 1.517 1.00 25.00 H new ATOM 0 HB3 ASP A 73 0.730 3.126 2.854 1.00 25.00 H new ATOM 984 N LEU A 74 1.780 1.901 5.090 1.00 25.00 N ATOM 985 CA LEU A 74 1.391 0.706 5.824 1.00 25.00 C ATOM 986 C LEU A 74 -0.121 0.604 5.712 1.00 25.00 C ATOM 987 O LEU A 74 -0.823 1.588 5.941 1.00 25.00 O ATOM 988 CB LEU A 74 1.800 0.840 7.297 1.00 25.00 C ATOM 989 CG LEU A 74 1.386 -0.316 8.227 1.00 25.00 C ATOM 990 CD1 LEU A 74 2.055 -1.622 7.832 1.00 25.00 C ATOM 991 CD2 LEU A 74 1.754 0.033 9.669 1.00 25.00 C ATOM 0 H LEU A 74 1.348 2.756 5.441 1.00 25.00 H new ATOM 0 HA LEU A 74 1.878 -0.182 5.421 1.00 25.00 H new ATOM 0 HB2 LEU A 74 2.884 0.945 7.343 1.00 25.00 H new ATOM 0 HB3 LEU A 74 1.373 1.764 7.688 1.00 25.00 H new ATOM 0 HG LEU A 74 0.308 -0.451 8.137 1.00 25.00 H new ATOM 0 HD11 LEU A 74 1.738 -2.413 8.511 1.00 25.00 H new ATOM 0 HD12 LEU A 74 1.770 -1.883 6.813 1.00 25.00 H new ATOM 0 HD13 LEU A 74 3.138 -1.508 7.888 1.00 25.00 H new ATOM 0 HD21 LEU A 74 1.461 -0.785 10.327 1.00 25.00 H new ATOM 0 HD22 LEU A 74 2.830 0.190 9.742 1.00 25.00 H new ATOM 0 HD23 LEU A 74 1.233 0.943 9.967 1.00 25.00 H new ATOM 1003 N ILE A 75 -0.626 -0.563 5.358 1.00 25.00 N ATOM 1004 CA ILE A 75 -2.064 -0.773 5.268 1.00 25.00 C ATOM 1005 C ILE A 75 -2.382 -1.649 6.458 1.00 25.00 C ATOM 1006 O ILE A 75 -1.551 -2.440 6.884 1.00 25.00 O ATOM 1007 CB ILE A 75 -2.477 -1.445 3.937 1.00 25.00 C ATOM 1008 CG1 ILE A 75 -1.925 -0.611 2.750 1.00 25.00 C ATOM 1009 CG2 ILE A 75 -4.007 -1.589 3.834 1.00 25.00 C ATOM 1010 CD1 ILE A 75 -2.272 -1.132 1.339 1.00 25.00 C ATOM 0 H ILE A 75 -0.064 -1.382 5.127 1.00 25.00 H new ATOM 0 HA ILE A 75 -2.616 0.167 5.280 1.00 25.00 H new ATOM 0 HB ILE A 75 -2.053 -2.449 3.904 1.00 25.00 H new ATOM 0 HG12 ILE A 75 -2.300 0.408 2.842 1.00 25.00 H new ATOM 0 HG13 ILE A 75 -0.840 -0.560 2.841 1.00 25.00 H new ATOM 0 HG21 ILE A 75 -4.265 -2.065 2.888 1.00 25.00 H new ATOM 0 HG22 ILE A 75 -4.371 -2.201 4.659 1.00 25.00 H new ATOM 0 HG23 ILE A 75 -4.469 -0.603 3.882 1.00 25.00 H new ATOM 0 HD11 ILE A 75 -1.835 -0.472 0.590 1.00 25.00 H new ATOM 0 HD12 ILE A 75 -1.872 -2.138 1.214 1.00 25.00 H new ATOM 0 HD13 ILE A 75 -3.355 -1.154 1.215 1.00 25.00 H new ATOM 1022 N LEU A 76 -3.558 -1.457 7.017 1.00 25.00 N ATOM 1023 CA LEU A 76 -3.996 -2.167 8.215 1.00 25.00 C ATOM 1024 C LEU A 76 -5.318 -2.835 7.870 1.00 25.00 C ATOM 1025 O LEU A 76 -6.091 -2.295 7.065 1.00 25.00 O ATOM 1026 CB LEU A 76 -4.221 -1.209 9.404 1.00 25.00 C ATOM 1027 CG LEU A 76 -3.109 -0.327 10.013 1.00 25.00 C ATOM 1028 CD1 LEU A 76 -1.882 -1.137 10.358 1.00 25.00 C ATOM 1029 CD2 LEU A 76 -2.711 0.856 9.117 1.00 25.00 C ATOM 0 H LEU A 76 -4.248 -0.799 6.655 1.00 25.00 H new ATOM 0 HA LEU A 76 -3.230 -2.883 8.512 1.00 25.00 H new ATOM 0 HB2 LEU A 76 -5.020 -0.531 9.104 1.00 25.00 H new ATOM 0 HB3 LEU A 76 -4.610 -1.819 10.220 1.00 25.00 H new ATOM 0 HG LEU A 76 -3.538 0.085 10.927 1.00 25.00 H new ATOM 0 HD11 LEU A 76 -1.122 -0.482 10.784 1.00 25.00 H new ATOM 0 HD12 LEU A 76 -2.146 -1.906 11.084 1.00 25.00 H new ATOM 0 HD13 LEU A 76 -1.491 -1.608 9.456 1.00 25.00 H new ATOM 0 HD21 LEU A 76 -1.926 1.434 9.605 1.00 25.00 H new ATOM 0 HD22 LEU A 76 -2.345 0.481 8.161 1.00 25.00 H new ATOM 0 HD23 LEU A 76 -3.579 1.493 8.949 1.00 25.00 H new ATOM 1041 N ASP A 77 -5.570 -3.980 8.492 1.00 25.00 N ATOM 1042 CA ASP A 77 -6.812 -4.754 8.315 1.00 25.00 C ATOM 1043 C ASP A 77 -7.009 -5.112 6.844 1.00 25.00 C ATOM 1044 O ASP A 77 -8.105 -4.958 6.274 1.00 25.00 O ATOM 1045 CB ASP A 77 -8.036 -3.996 8.849 1.00 25.00 C ATOM 1046 CG ASP A 77 -7.931 -3.666 10.326 1.00 25.00 C ATOM 1047 OD1 ASP A 77 -7.070 -4.235 11.035 1.00 25.00 O ATOM 1048 OD2 ASP A 77 -8.724 -2.814 10.776 1.00 25.00 O ATOM 0 H ASP A 77 -4.915 -4.411 9.144 1.00 25.00 H new ATOM 0 HA ASP A 77 -6.714 -5.672 8.895 1.00 25.00 H new ATOM 0 HB2 ASP A 77 -8.159 -3.072 8.284 1.00 25.00 H new ATOM 0 HB3 ASP A 77 -8.930 -4.595 8.679 1.00 25.00 H new ATOM 1053 N PHE A 78 -5.928 -5.548 6.214 1.00 25.00 N ATOM 1054 CA PHE A 78 -5.980 -5.917 4.811 1.00 25.00 C ATOM 1055 C PHE A 78 -6.568 -7.312 4.647 1.00 25.00 C ATOM 1056 O PHE A 78 -6.074 -8.298 5.204 1.00 25.00 O ATOM 1057 CB PHE A 78 -4.598 -5.863 4.168 1.00 25.00 C ATOM 1058 CG PHE A 78 -4.640 -6.013 2.671 1.00 25.00 C ATOM 1059 CD1 PHE A 78 -5.002 -4.922 1.863 1.00 25.00 C ATOM 1060 CD2 PHE A 78 -4.346 -7.246 2.063 1.00 25.00 C ATOM 1061 CE1 PHE A 78 -5.083 -5.056 0.458 1.00 25.00 C ATOM 1062 CE2 PHE A 78 -4.421 -7.392 0.654 1.00 25.00 C ATOM 1063 CZ PHE A 78 -4.797 -6.296 -0.147 1.00 25.00 C ATOM 0 H PHE A 78 -5.012 -5.654 6.650 1.00 25.00 H new ATOM 0 HA PHE A 78 -6.621 -5.194 4.307 1.00 25.00 H new ATOM 0 HB2 PHE A 78 -4.123 -4.915 4.419 1.00 25.00 H new ATOM 0 HB3 PHE A 78 -3.976 -6.653 4.590 1.00 25.00 H new ATOM 0 HD1 PHE A 78 -5.221 -3.969 2.321 1.00 25.00 H new ATOM 0 HD2 PHE A 78 -4.061 -8.090 2.674 1.00 25.00 H new ATOM 0 HE1 PHE A 78 -5.364 -4.209 -0.151 1.00 25.00 H new ATOM 0 HE2 PHE A 78 -4.190 -8.342 0.196 1.00 25.00 H new ATOM 0 HZ PHE A 78 -4.866 -6.406 -1.219 1.00 25.00 H new ATOM 1073 N ASP A 79 -7.616 -7.379 3.850 1.00 25.00 N ATOM 1074 CA ASP A 79 -8.304 -8.630 3.550 1.00 25.00 C ATOM 1075 C ASP A 79 -7.931 -9.066 2.138 1.00 25.00 C ATOM 1076 O ASP A 79 -8.574 -8.649 1.194 1.00 25.00 O ATOM 1077 CB ASP A 79 -9.825 -8.429 3.591 1.00 25.00 C ATOM 1078 CG ASP A 79 -10.323 -8.016 4.952 1.00 25.00 C ATOM 1079 OD1 ASP A 79 -10.005 -8.678 5.947 1.00 25.00 O ATOM 1080 OD2 ASP A 79 -11.049 -6.988 5.014 1.00 25.00 O ATOM 0 H ASP A 79 -8.021 -6.565 3.387 1.00 25.00 H new ATOM 0 HA ASP A 79 -8.012 -9.377 4.288 1.00 25.00 H new ATOM 0 HB2 ASP A 79 -10.106 -7.670 2.861 1.00 25.00 H new ATOM 0 HB3 ASP A 79 -10.317 -9.355 3.295 1.00 25.00 H new ATOM 1085 N PRO A 80 -6.914 -9.924 1.962 1.00 25.00 N ATOM 1086 CA PRO A 80 -6.573 -10.311 0.583 1.00 25.00 C ATOM 1087 C PRO A 80 -7.689 -11.031 -0.187 1.00 25.00 C ATOM 1088 O PRO A 80 -7.676 -11.086 -1.411 1.00 25.00 O ATOM 1089 CB PRO A 80 -5.349 -11.216 0.778 1.00 25.00 C ATOM 1090 CG PRO A 80 -5.469 -11.713 2.166 1.00 25.00 C ATOM 1091 CD PRO A 80 -6.014 -10.565 2.932 1.00 25.00 C ATOM 0 HA PRO A 80 -6.395 -9.433 -0.037 1.00 25.00 H new ATOM 0 HB2 PRO A 80 -5.346 -12.038 0.062 1.00 25.00 H new ATOM 0 HB3 PRO A 80 -4.421 -10.663 0.634 1.00 25.00 H new ATOM 0 HG2 PRO A 80 -6.132 -12.576 2.221 1.00 25.00 H new ATOM 0 HG3 PRO A 80 -4.502 -12.028 2.559 1.00 25.00 H new ATOM 0 HD2 PRO A 80 -6.548 -10.891 3.825 1.00 25.00 H new ATOM 0 HD3 PRO A 80 -5.226 -9.888 3.261 1.00 25.00 H new ATOM 1099 N SER A 81 -8.691 -11.530 0.522 1.00 25.00 N ATOM 1100 CA SER A 81 -9.845 -12.155 -0.119 1.00 25.00 C ATOM 1101 C SER A 81 -10.841 -11.134 -0.701 1.00 25.00 C ATOM 1102 O SER A 81 -11.792 -11.531 -1.378 1.00 25.00 O ATOM 1103 CB SER A 81 -10.578 -13.024 0.904 1.00 25.00 C ATOM 1104 OG SER A 81 -11.616 -13.772 0.293 1.00 25.00 O ATOM 0 H SER A 81 -8.731 -11.516 1.541 1.00 25.00 H new ATOM 0 HA SER A 81 -9.463 -12.749 -0.949 1.00 25.00 H new ATOM 0 HB2 SER A 81 -9.871 -13.702 1.382 1.00 25.00 H new ATOM 0 HB3 SER A 81 -10.995 -12.393 1.689 1.00 25.00 H new ATOM 0 HG SER A 81 -11.942 -13.294 -0.498 1.00 25.00 H new ATOM 1110 N GLN A 82 -10.681 -9.852 -0.378 1.00 25.00 N ATOM 1111 CA GLN A 82 -11.658 -8.813 -0.767 1.00 25.00 C ATOM 1112 C GLN A 82 -11.044 -7.475 -1.206 1.00 25.00 C ATOM 1113 O GLN A 82 -11.578 -6.798 -2.079 1.00 25.00 O ATOM 1114 CB GLN A 82 -12.572 -8.504 0.434 1.00 25.00 C ATOM 1115 CG GLN A 82 -13.512 -9.637 0.852 1.00 25.00 C ATOM 1116 CD GLN A 82 -14.698 -9.785 -0.082 1.00 25.00 C ATOM 1117 OE1 GLN A 82 -15.711 -9.134 0.090 1.00 25.00 O ATOM 1118 NE2 GLN A 82 -14.580 -10.645 -1.057 1.00 25.00 N ATOM 0 H GLN A 82 -9.885 -9.498 0.153 1.00 25.00 H new ATOM 0 HA GLN A 82 -12.187 -9.230 -1.624 1.00 25.00 H new ATOM 0 HB2 GLN A 82 -11.946 -8.241 1.287 1.00 25.00 H new ATOM 0 HB3 GLN A 82 -13.172 -7.626 0.196 1.00 25.00 H new ATOM 0 HG2 GLN A 82 -12.956 -10.574 0.879 1.00 25.00 H new ATOM 0 HG3 GLN A 82 -13.872 -9.451 1.864 1.00 25.00 H new ATOM 0 HE21 GLN A 82 -13.714 -11.173 -1.169 1.00 25.00 H new ATOM 0 HE22 GLN A 82 -15.353 -10.789 -1.706 1.00 25.00 H new ATOM 1127 N ASP A 83 -9.980 -7.066 -0.538 1.00 25.00 N ATOM 1128 CA ASP A 83 -9.385 -5.744 -0.728 1.00 25.00 C ATOM 1129 C ASP A 83 -8.507 -5.685 -1.980 1.00 25.00 C ATOM 1130 O ASP A 83 -8.037 -6.710 -2.482 1.00 25.00 O ATOM 1131 CB ASP A 83 -8.540 -5.365 0.497 1.00 25.00 C ATOM 1132 CG ASP A 83 -9.377 -5.129 1.759 1.00 25.00 C ATOM 1133 OD1 ASP A 83 -10.620 -5.107 1.700 1.00 50.00 O ATOM 1134 OD2 ASP A 83 -8.791 -4.973 2.848 1.00 50.00 O ATOM 0 H ASP A 83 -9.499 -7.639 0.155 1.00 25.00 H new ATOM 0 HA ASP A 83 -10.205 -5.037 -0.853 1.00 25.00 H new ATOM 0 HB2 ASP A 83 -7.818 -6.158 0.691 1.00 25.00 H new ATOM 0 HB3 ASP A 83 -7.971 -4.463 0.273 1.00 25.00 H new ATOM 1139 N LYS A 84 -8.281 -4.475 -2.476 1.00 25.00 N ATOM 1140 CA LYS A 84 -7.508 -4.260 -3.703 1.00 25.00 C ATOM 1141 C LYS A 84 -6.484 -3.148 -3.517 1.00 25.00 C ATOM 1142 O LYS A 84 -6.724 -2.207 -2.769 1.00 25.00 O ATOM 1143 CB LYS A 84 -8.480 -3.875 -4.825 1.00 25.00 C ATOM 1144 CG LYS A 84 -7.987 -4.187 -6.231 1.00 25.00 C ATOM 1145 CD LYS A 84 -8.182 -5.660 -6.565 1.00 25.00 C ATOM 1146 CE LYS A 84 -7.690 -5.943 -7.968 1.00 25.00 C ATOM 1147 NZ LYS A 84 -7.941 -7.352 -8.373 1.00 25.00 N ATOM 0 H LYS A 84 -8.624 -3.616 -2.045 1.00 25.00 H new ATOM 0 HA LYS A 84 -6.972 -5.176 -3.953 1.00 25.00 H new ATOM 0 HB2 LYS A 84 -9.424 -4.394 -4.663 1.00 25.00 H new ATOM 0 HB3 LYS A 84 -8.688 -2.807 -4.756 1.00 25.00 H new ATOM 0 HG2 LYS A 84 -8.525 -3.573 -6.953 1.00 25.00 H new ATOM 0 HG3 LYS A 84 -6.932 -3.928 -6.316 1.00 25.00 H new ATOM 0 HD2 LYS A 84 -7.640 -6.278 -5.849 1.00 25.00 H new ATOM 0 HD3 LYS A 84 -9.236 -5.924 -6.480 1.00 25.00 H new ATOM 0 HE2 LYS A 84 -8.186 -5.271 -8.668 1.00 25.00 H new ATOM 0 HE3 LYS A 84 -6.622 -5.734 -8.027 1.00 25.00 H new ATOM 0 HZ1 LYS A 84 -7.683 -7.477 -9.373 1.00 25.00 H new ATOM 0 HZ2 LYS A 84 -7.368 -7.990 -7.785 1.00 25.00 H new ATOM 0 HZ3 LYS A 84 -8.949 -7.576 -8.245 1.00 25.00 H new ATOM 1161 N ILE A 85 -5.360 -3.238 -4.214 1.00 25.00 N ATOM 1162 CA ILE A 85 -4.335 -2.193 -4.173 1.00 25.00 C ATOM 1163 C ILE A 85 -4.036 -1.720 -5.597 1.00 25.00 C ATOM 1164 O ILE A 85 -3.576 -2.502 -6.443 1.00 25.00 O ATOM 1165 CB ILE A 85 -3.006 -2.691 -3.515 1.00 25.00 C ATOM 1166 CG1 ILE A 85 -3.286 -3.340 -2.141 1.00 25.00 C ATOM 1167 CG2 ILE A 85 -2.014 -1.501 -3.345 1.00 25.00 C ATOM 1168 CD1 ILE A 85 -2.065 -4.029 -1.504 1.00 25.00 C ATOM 0 H ILE A 85 -5.130 -4.026 -4.819 1.00 25.00 H new ATOM 0 HA ILE A 85 -4.725 -1.376 -3.565 1.00 25.00 H new ATOM 0 HB ILE A 85 -2.560 -3.440 -4.169 1.00 25.00 H new ATOM 0 HG12 ILE A 85 -3.653 -2.573 -1.458 1.00 25.00 H new ATOM 0 HG13 ILE A 85 -4.084 -4.074 -2.255 1.00 25.00 H new ATOM 0 HG21 ILE A 85 -1.092 -1.858 -2.886 1.00 25.00 H new ATOM 0 HG22 ILE A 85 -1.790 -1.071 -4.321 1.00 25.00 H new ATOM 0 HG23 ILE A 85 -2.465 -0.740 -2.708 1.00 25.00 H new ATOM 0 HD11 ILE A 85 -2.349 -4.458 -0.543 1.00 25.00 H new ATOM 0 HD12 ILE A 85 -1.709 -4.821 -2.163 1.00 25.00 H new ATOM 0 HD13 ILE A 85 -1.271 -3.297 -1.354 1.00 25.00 H new ATOM 1180 N ASP A 86 -4.291 -0.449 -5.865 1.00 25.00 N ATOM 1181 CA ASP A 86 -3.971 0.141 -7.162 1.00 25.00 C ATOM 1182 C ASP A 86 -2.549 0.649 -7.122 1.00 25.00 C ATOM 1183 O ASP A 86 -2.127 1.341 -6.195 1.00 25.00 O ATOM 1184 CB ASP A 86 -4.901 1.294 -7.492 1.00 25.00 C ATOM 1185 CG ASP A 86 -4.737 1.806 -8.921 1.00 25.00 C ATOM 1186 OD1 ASP A 86 -3.979 1.193 -9.715 1.00 25.00 O ATOM 1187 OD2 ASP A 86 -5.333 2.861 -9.239 1.00 25.00 O ATOM 0 H ASP A 86 -4.719 0.198 -5.202 1.00 25.00 H new ATOM 0 HA ASP A 86 -4.092 -0.622 -7.931 1.00 25.00 H new ATOM 0 HB2 ASP A 86 -5.933 0.975 -7.343 1.00 25.00 H new ATOM 0 HB3 ASP A 86 -4.717 2.112 -6.796 1.00 25.00 H new ATOM 1192 N VAL A 87 -1.818 0.269 -8.146 1.00 25.00 N ATOM 1193 CA VAL A 87 -0.396 0.579 -8.283 1.00 25.00 C ATOM 1194 C VAL A 87 -0.073 0.979 -9.721 1.00 25.00 C ATOM 1195 O VAL A 87 1.064 0.868 -10.161 1.00 25.00 O ATOM 1196 CB VAL A 87 0.495 -0.654 -7.897 1.00 25.00 C ATOM 1197 CG1 VAL A 87 0.325 -1.009 -6.414 1.00 25.00 C ATOM 1198 CG2 VAL A 87 0.144 -1.876 -8.755 1.00 25.00 C ATOM 0 H VAL A 87 -2.193 -0.273 -8.924 1.00 25.00 H new ATOM 0 HA VAL A 87 -0.179 1.406 -7.607 1.00 25.00 H new ATOM 0 HB VAL A 87 1.533 -0.377 -8.081 1.00 25.00 H new ATOM 0 HG11 VAL A 87 0.952 -1.866 -6.171 1.00 25.00 H new ATOM 0 HG12 VAL A 87 0.620 -0.158 -5.800 1.00 25.00 H new ATOM 0 HG13 VAL A 87 -0.718 -1.255 -6.216 1.00 25.00 H new ATOM 0 HG21 VAL A 87 0.776 -2.716 -8.467 1.00 25.00 H new ATOM 0 HG22 VAL A 87 -0.902 -2.140 -8.602 1.00 25.00 H new ATOM 0 HG23 VAL A 87 0.309 -1.642 -9.807 1.00 25.00 H new ATOM 1208 N SER A 88 -1.080 1.400 -10.473 1.00 25.00 N ATOM 1209 CA SER A 88 -0.902 1.703 -11.900 1.00 25.00 C ATOM 1210 C SER A 88 0.242 2.692 -12.190 1.00 25.00 C ATOM 1211 O SER A 88 0.978 2.516 -13.152 1.00 25.00 O ATOM 1212 CB SER A 88 -2.215 2.232 -12.485 1.00 25.00 C ATOM 1213 OG SER A 88 -2.134 2.360 -13.892 1.00 25.00 O ATOM 0 H SER A 88 -2.029 1.542 -10.127 1.00 25.00 H new ATOM 0 HA SER A 88 -0.620 0.766 -12.380 1.00 25.00 H new ATOM 0 HB2 SER A 88 -3.030 1.557 -12.225 1.00 25.00 H new ATOM 0 HB3 SER A 88 -2.450 3.200 -12.042 1.00 25.00 H new ATOM 0 HG SER A 88 -2.986 2.698 -14.239 1.00 25.00 H new ATOM 1219 N ALA A 89 0.433 3.693 -11.336 1.00 25.00 N ATOM 1220 CA ALA A 89 1.518 4.669 -11.531 1.00 25.00 C ATOM 1221 C ALA A 89 2.910 4.131 -11.166 1.00 25.00 C ATOM 1222 O ALA A 89 3.907 4.822 -11.362 1.00 25.00 O ATOM 1223 CB ALA A 89 1.235 5.932 -10.725 1.00 25.00 C ATOM 0 H ALA A 89 -0.139 3.855 -10.508 1.00 25.00 H new ATOM 0 HA ALA A 89 1.538 4.888 -12.598 1.00 25.00 H new ATOM 0 HB1 ALA A 89 2.043 6.648 -10.875 1.00 25.00 H new ATOM 0 HB2 ALA A 89 0.294 6.372 -11.056 1.00 25.00 H new ATOM 0 HB3 ALA A 89 1.166 5.680 -9.667 1.00 25.00 H new ATOM 1229 N LEU A 90 2.969 2.932 -10.603 1.00 25.00 N ATOM 1230 CA LEU A 90 4.244 2.316 -10.223 1.00 25.00 C ATOM 1231 C LEU A 90 4.570 1.255 -11.263 1.00 25.00 C ATOM 1232 O LEU A 90 5.703 1.097 -11.684 1.00 25.00 O ATOM 1233 CB LEU A 90 4.151 1.659 -8.835 1.00 25.00 C ATOM 1234 CG LEU A 90 3.353 2.394 -7.750 1.00 25.00 C ATOM 1235 CD1 LEU A 90 3.389 1.578 -6.455 1.00 25.00 C ATOM 1236 CD2 LEU A 90 3.887 3.798 -7.468 1.00 25.00 C ATOM 0 H LEU A 90 2.149 2.361 -10.397 1.00 25.00 H new ATOM 0 HA LEU A 90 5.020 3.080 -10.179 1.00 25.00 H new ATOM 0 HB2 LEU A 90 3.712 0.669 -8.961 1.00 25.00 H new ATOM 0 HB3 LEU A 90 5.166 1.513 -8.464 1.00 25.00 H new ATOM 0 HG LEU A 90 2.333 2.501 -8.119 1.00 25.00 H new ATOM 0 HD11 LEU A 90 2.823 2.097 -5.682 1.00 25.00 H new ATOM 0 HD12 LEU A 90 2.948 0.597 -6.631 1.00 25.00 H new ATOM 0 HD13 LEU A 90 4.422 1.458 -6.129 1.00 25.00 H new ATOM 0 HD21 LEU A 90 3.283 4.268 -6.692 1.00 25.00 H new ATOM 0 HD22 LEU A 90 4.922 3.733 -7.132 1.00 25.00 H new ATOM 0 HD23 LEU A 90 3.838 4.396 -8.378 1.00 25.00 H new ATOM 1248 N GLY A 91 3.531 0.539 -11.671 1.00 25.00 N ATOM 1249 CA GLY A 91 3.641 -0.458 -12.729 1.00 25.00 C ATOM 1250 C GLY A 91 4.277 -1.778 -12.331 1.00 25.00 C ATOM 1251 O GLY A 91 4.274 -2.727 -13.109 1.00 25.00 O ATOM 0 H GLY A 91 2.593 0.631 -11.281 1.00 25.00 H new ATOM 0 HA2 GLY A 91 2.643 -0.660 -13.117 1.00 25.00 H new ATOM 0 HA3 GLY A 91 4.220 -0.030 -13.547 1.00 25.00 H new ATOM 1255 N PHE A 92 4.833 -1.849 -11.132 1.00 25.00 N ATOM 1256 CA PHE A 92 5.513 -3.060 -10.678 1.00 25.00 C ATOM 1257 C PHE A 92 4.516 -4.207 -10.503 1.00 25.00 C ATOM 1258 O PHE A 92 3.472 -4.041 -9.863 1.00 25.00 O ATOM 1259 CB PHE A 92 6.241 -2.790 -9.357 1.00 25.00 C ATOM 1260 CG PHE A 92 7.084 -1.537 -9.372 1.00 25.00 C ATOM 1261 CD1 PHE A 92 8.004 -1.294 -10.412 1.00 25.00 C ATOM 1262 CD2 PHE A 92 6.954 -0.584 -8.346 1.00 25.00 C ATOM 1263 CE1 PHE A 92 8.785 -0.112 -10.430 1.00 25.00 C ATOM 1264 CE2 PHE A 92 7.727 0.605 -8.361 1.00 25.00 C ATOM 1265 CZ PHE A 92 8.645 0.836 -9.400 1.00 25.00 C ATOM 0 H PHE A 92 4.829 -1.087 -10.454 1.00 25.00 H new ATOM 0 HA PHE A 92 6.242 -3.350 -11.434 1.00 25.00 H new ATOM 0 HB2 PHE A 92 5.505 -2.712 -8.556 1.00 25.00 H new ATOM 0 HB3 PHE A 92 6.878 -3.643 -9.123 1.00 25.00 H new ATOM 0 HD1 PHE A 92 8.115 -2.018 -11.205 1.00 25.00 H new ATOM 0 HD2 PHE A 92 6.259 -0.759 -7.539 1.00 25.00 H new ATOM 0 HE1 PHE A 92 9.486 0.061 -11.233 1.00 25.00 H new ATOM 0 HE2 PHE A 92 7.610 1.334 -7.573 1.00 25.00 H new ATOM 0 HZ PHE A 92 9.240 1.737 -9.408 1.00 25.00 H new ATOM 1275 N ILE A 93 4.832 -5.359 -11.082 1.00 25.00 N ATOM 1276 CA ILE A 93 3.947 -6.533 -11.011 1.00 25.00 C ATOM 1277 C ILE A 93 4.723 -7.855 -10.885 1.00 25.00 C ATOM 1278 O ILE A 93 4.349 -8.717 -10.093 1.00 25.00 O ATOM 1279 CB ILE A 93 2.960 -6.562 -12.249 1.00 25.00 C ATOM 1280 CG1 ILE A 93 2.118 -7.859 -12.286 1.00 25.00 C ATOM 1281 CG2 ILE A 93 3.713 -6.386 -13.599 1.00 25.00 C ATOM 1282 CD1 ILE A 93 1.187 -8.063 -11.080 1.00 25.00 C ATOM 0 H ILE A 93 5.692 -5.513 -11.608 1.00 25.00 H new ATOM 0 HA ILE A 93 3.359 -6.435 -10.099 1.00 25.00 H new ATOM 0 HB ILE A 93 2.286 -5.715 -12.117 1.00 25.00 H new ATOM 0 HG12 ILE A 93 1.516 -7.858 -13.195 1.00 25.00 H new ATOM 0 HG13 ILE A 93 2.794 -8.712 -12.353 1.00 25.00 H new ATOM 0 HG21 ILE A 93 2.997 -6.412 -14.421 1.00 25.00 H new ATOM 0 HG22 ILE A 93 4.235 -5.429 -13.602 1.00 25.00 H new ATOM 0 HG23 ILE A 93 4.435 -7.193 -13.721 1.00 25.00 H new ATOM 0 HD11 ILE A 93 0.639 -8.998 -11.197 1.00 25.00 H new ATOM 0 HD12 ILE A 93 1.779 -8.101 -10.166 1.00 25.00 H new ATOM 0 HD13 ILE A 93 0.481 -7.234 -11.021 1.00 25.00 H new ATOM 1294 N GLY A 94 5.817 -8.009 -11.624 1.00 25.00 N ATOM 1295 CA GLY A 94 6.605 -9.231 -11.525 1.00 25.00 C ATOM 1296 C GLY A 94 7.179 -9.358 -10.128 1.00 25.00 C ATOM 1297 O GLY A 94 7.465 -8.352 -9.506 1.00 25.00 O ATOM 0 H GLY A 94 6.172 -7.318 -12.285 1.00 25.00 H new ATOM 0 HA2 GLY A 94 5.982 -10.096 -11.752 1.00 25.00 H new ATOM 0 HA3 GLY A 94 7.410 -9.216 -12.259 1.00 25.00 H new ATOM 1301 N LEU A 95 7.331 -10.576 -9.627 1.00 25.00 N ATOM 1302 CA LEU A 95 7.786 -10.807 -8.244 1.00 25.00 C ATOM 1303 C LEU A 95 9.179 -11.432 -8.195 1.00 25.00 C ATOM 1304 O LEU A 95 9.622 -11.940 -7.175 1.00 25.00 O ATOM 1305 CB LEU A 95 6.814 -11.768 -7.567 1.00 25.00 C ATOM 1306 CG LEU A 95 5.333 -11.343 -7.489 1.00 25.00 C ATOM 1307 CD1 LEU A 95 4.521 -12.460 -6.846 1.00 25.00 C ATOM 1308 CD2 LEU A 95 5.151 -10.049 -6.690 1.00 25.00 C ATOM 0 H LEU A 95 7.147 -11.430 -10.153 1.00 25.00 H new ATOM 0 HA LEU A 95 7.823 -9.842 -7.739 1.00 25.00 H new ATOM 0 HB2 LEU A 95 6.863 -12.722 -8.092 1.00 25.00 H new ATOM 0 HB3 LEU A 95 7.168 -11.944 -6.551 1.00 25.00 H new ATOM 0 HG LEU A 95 4.983 -11.157 -8.504 1.00 25.00 H new ATOM 0 HD11 LEU A 95 3.474 -12.162 -6.790 1.00 25.00 H new ATOM 0 HD12 LEU A 95 4.609 -13.366 -7.446 1.00 25.00 H new ATOM 0 HD13 LEU A 95 4.898 -12.652 -5.842 1.00 25.00 H new ATOM 0 HD21 LEU A 95 4.094 -9.786 -6.660 1.00 25.00 H new ATOM 0 HD22 LEU A 95 5.518 -10.194 -5.674 1.00 25.00 H new ATOM 0 HD23 LEU A 95 5.712 -9.245 -7.167 1.00 25.00 H new ATOM 1320 N GLY A 96 9.812 -11.467 -9.352 1.00 25.00 N ATOM 1321 CA GLY A 96 11.049 -12.220 -9.526 1.00 25.00 C ATOM 1322 C GLY A 96 12.306 -11.805 -8.773 1.00 25.00 C ATOM 1323 O GLY A 96 13.045 -12.676 -8.330 1.00 25.00 O ATOM 0 H GLY A 96 9.492 -10.983 -10.191 1.00 25.00 H new ATOM 0 HA2 GLY A 96 10.838 -13.256 -9.259 1.00 25.00 H new ATOM 0 HA3 GLY A 96 11.289 -12.208 -10.589 1.00 25.00 H new ATOM 1327 N ASN A 97 12.621 -10.515 -8.691 1.00 25.00 N ATOM 1328 CA ASN A 97 13.923 -10.101 -8.135 1.00 25.00 C ATOM 1329 C ASN A 97 13.899 -8.985 -7.093 1.00 25.00 C ATOM 1330 O ASN A 97 14.835 -8.855 -6.311 1.00 25.00 O ATOM 1331 CB ASN A 97 14.839 -9.641 -9.281 1.00 25.00 C ATOM 1332 CG ASN A 97 15.028 -10.699 -10.336 1.00 25.00 C ATOM 1333 OD1 ASN A 97 14.634 -10.520 -11.473 1.00 25.00 O ATOM 1334 ND2 ASN A 97 15.637 -11.795 -9.976 1.00 25.00 N ATOM 0 H ASN A 97 12.017 -9.750 -8.991 1.00 25.00 H new ATOM 0 HA ASN A 97 14.282 -10.989 -7.614 1.00 25.00 H new ATOM 0 HB2 ASN A 97 14.418 -8.747 -9.741 1.00 25.00 H new ATOM 0 HB3 ASN A 97 15.811 -9.362 -8.874 1.00 25.00 H new ATOM 0 HD21 ASN A 97 15.797 -12.537 -10.657 1.00 25.00 H new ATOM 0 HD22 ASN A 97 15.954 -11.910 -9.013 1.00 25.00 H new ATOM 1341 N GLY A 98 12.885 -8.135 -7.116 1.00 25.00 N ATOM 1342 CA GLY A 98 12.865 -6.977 -6.230 1.00 25.00 C ATOM 1343 C GLY A 98 13.679 -5.829 -6.793 1.00 25.00 C ATOM 1344 O GLY A 98 13.922 -4.836 -6.108 1.00 25.00 O ATOM 0 H GLY A 98 12.074 -8.220 -7.729 1.00 25.00 H new ATOM 0 HA2 GLY A 98 11.836 -6.653 -6.077 1.00 25.00 H new ATOM 0 HA3 GLY A 98 13.259 -7.259 -5.253 1.00 25.00 H new ATOM 1348 N TYR A 99 14.112 -5.980 -8.037 1.00 25.00 N ATOM 1349 CA TYR A 99 14.916 -4.982 -8.742 1.00 25.00 C ATOM 1350 C TYR A 99 14.430 -4.961 -10.184 1.00 25.00 C ATOM 1351 O TYR A 99 13.692 -5.856 -10.584 1.00 25.00 O ATOM 1352 CB TYR A 99 16.405 -5.361 -8.718 1.00 25.00 C ATOM 1353 CG TYR A 99 17.037 -5.332 -7.338 1.00 25.00 C ATOM 1354 CD1 TYR A 99 17.606 -4.146 -6.832 1.00 25.00 C ATOM 1355 CD2 TYR A 99 17.093 -6.492 -6.542 1.00 25.00 C ATOM 1356 CE1 TYR A 99 18.210 -4.116 -5.546 1.00 25.00 C ATOM 1357 CE2 TYR A 99 17.696 -6.468 -5.256 1.00 25.00 C ATOM 1358 CZ TYR A 99 18.249 -5.279 -4.773 1.00 25.00 C ATOM 1359 OH TYR A 99 18.821 -5.245 -3.529 1.00 25.00 O ATOM 0 H TYR A 99 13.914 -6.810 -8.596 1.00 25.00 H new ATOM 0 HA TYR A 99 14.810 -4.008 -8.263 1.00 25.00 H new ATOM 0 HB2 TYR A 99 16.520 -6.361 -9.136 1.00 25.00 H new ATOM 0 HB3 TYR A 99 16.952 -4.679 -9.369 1.00 25.00 H new ATOM 0 HD1 TYR A 99 17.583 -3.247 -7.430 1.00 25.00 H new ATOM 0 HD2 TYR A 99 16.671 -7.414 -6.915 1.00 25.00 H new ATOM 0 HE1 TYR A 99 18.637 -3.199 -5.168 1.00 25.00 H new ATOM 0 HE2 TYR A 99 17.727 -7.364 -4.654 1.00 25.00 H new ATOM 0 HH TYR A 99 18.767 -6.134 -3.120 1.00 25.00 H new ATOM 1369 N ALA A 100 14.854 -3.959 -10.950 1.00 25.00 N ATOM 1370 CA ALA A 100 14.508 -3.830 -12.372 1.00 25.00 C ATOM 1371 C ALA A 100 12.991 -3.890 -12.618 1.00 25.00 C ATOM 1372 O ALA A 100 12.521 -4.574 -13.520 1.00 25.00 O ATOM 1373 CB ALA A 100 15.245 -4.909 -13.201 1.00 25.00 C ATOM 0 H ALA A 100 15.451 -3.207 -10.604 1.00 25.00 H new ATOM 0 HA ALA A 100 14.837 -2.843 -12.698 1.00 25.00 H new ATOM 0 HB1 ALA A 100 14.980 -4.803 -14.253 1.00 25.00 H new ATOM 0 HB2 ALA A 100 16.322 -4.786 -13.083 1.00 25.00 H new ATOM 0 HB3 ALA A 100 14.953 -5.899 -12.851 1.00 25.00 H new ATOM 1379 N GLY A 101 12.232 -3.182 -11.792 1.00 25.00 N ATOM 1380 CA GLY A 101 10.790 -3.112 -11.980 1.00 25.00 C ATOM 1381 C GLY A 101 10.015 -4.282 -11.404 1.00 25.00 C ATOM 1382 O GLY A 101 8.786 -4.322 -11.489 1.00 25.00 O ATOM 0 H GLY A 101 12.586 -2.654 -10.994 1.00 25.00 H new ATOM 0 HA2 GLY A 101 10.423 -2.192 -11.525 1.00 25.00 H new ATOM 0 HA3 GLY A 101 10.580 -3.046 -13.047 1.00 25.00 H new ATOM 1386 N THR A 102 10.706 -5.233 -10.795 1.00 25.00 N ATOM 1387 CA THR A 102 10.025 -6.352 -10.152 1.00 25.00 C ATOM 1388 C THR A 102 10.010 -6.115 -8.655 1.00 25.00 C ATOM 1389 O THR A 102 10.766 -5.292 -8.129 1.00 25.00 O ATOM 1390 CB THR A 102 10.689 -7.719 -10.449 1.00 25.00 C ATOM 1391 OG1 THR A 102 11.990 -7.767 -9.870 1.00 25.00 O ATOM 1392 CG2 THR A 102 10.821 -7.959 -11.943 1.00 25.00 C ATOM 0 H THR A 102 11.724 -5.256 -10.731 1.00 25.00 H new ATOM 0 HA THR A 102 9.014 -6.398 -10.557 1.00 25.00 H new ATOM 0 HB THR A 102 10.051 -8.491 -10.019 1.00 25.00 H new ATOM 0 HG1 THR A 102 12.488 -6.960 -10.117 1.00 25.00 H new ATOM 0 HG21 THR A 102 11.291 -8.927 -12.116 1.00 25.00 H new ATOM 0 HG22 THR A 102 9.832 -7.948 -12.402 1.00 25.00 H new ATOM 0 HG23 THR A 102 11.435 -7.174 -12.385 1.00 25.00 H new ATOM 1400 N LEU A 103 9.137 -6.833 -7.976 1.00 25.00 N ATOM 1401 CA LEU A 103 8.993 -6.758 -6.536 1.00 25.00 C ATOM 1402 C LEU A 103 9.635 -7.995 -5.950 1.00 25.00 C ATOM 1403 O LEU A 103 9.933 -8.943 -6.662 1.00 25.00 O ATOM 1404 CB LEU A 103 7.508 -6.756 -6.142 1.00 25.00 C ATOM 1405 CG LEU A 103 6.663 -5.580 -6.592 1.00 25.00 C ATOM 1406 CD1 LEU A 103 5.464 -6.058 -7.406 1.00 25.00 C ATOM 1407 CD2 LEU A 103 6.185 -4.766 -5.385 1.00 25.00 C ATOM 0 H LEU A 103 8.498 -7.495 -8.416 1.00 25.00 H new ATOM 0 HA LEU A 103 9.459 -5.844 -6.168 1.00 25.00 H new ATOM 0 HB2 LEU A 103 7.055 -7.666 -6.536 1.00 25.00 H new ATOM 0 HB3 LEU A 103 7.449 -6.816 -5.055 1.00 25.00 H new ATOM 0 HG LEU A 103 7.282 -4.942 -7.223 1.00 25.00 H new ATOM 0 HD11 LEU A 103 4.871 -5.199 -7.719 1.00 25.00 H new ATOM 0 HD12 LEU A 103 5.814 -6.598 -8.286 1.00 25.00 H new ATOM 0 HD13 LEU A 103 4.850 -6.720 -6.795 1.00 25.00 H new ATOM 0 HD21 LEU A 103 5.580 -3.927 -5.729 1.00 25.00 H new ATOM 0 HD22 LEU A 103 5.586 -5.401 -4.732 1.00 25.00 H new ATOM 0 HD23 LEU A 103 7.048 -4.390 -4.835 1.00 25.00 H new ATOM 1419 N ALA A 104 9.765 -7.989 -4.639 1.00 25.00 N ATOM 1420 CA ALA A 104 10.112 -9.152 -3.855 1.00 25.00 C ATOM 1421 C ALA A 104 9.145 -8.990 -2.691 1.00 25.00 C ATOM 1422 O ALA A 104 8.879 -7.858 -2.263 1.00 25.00 O ATOM 1423 CB ALA A 104 11.573 -9.098 -3.391 1.00 25.00 C ATOM 0 H ALA A 104 9.628 -7.150 -4.076 1.00 25.00 H new ATOM 0 HA ALA A 104 10.035 -10.103 -4.382 1.00 25.00 H new ATOM 0 HB1 ALA A 104 11.801 -9.988 -2.804 1.00 25.00 H new ATOM 0 HB2 ALA A 104 12.230 -9.058 -4.260 1.00 25.00 H new ATOM 0 HB3 ALA A 104 11.728 -8.210 -2.779 1.00 25.00 H new ATOM 1429 N VAL A 105 8.577 -10.085 -2.223 1.00 25.00 N ATOM 1430 CA VAL A 105 7.577 -10.041 -1.170 1.00 25.00 C ATOM 1431 C VAL A 105 8.036 -10.966 -0.056 1.00 25.00 C ATOM 1432 O VAL A 105 8.713 -11.961 -0.304 1.00 25.00 O ATOM 1433 CB VAL A 105 6.176 -10.417 -1.748 1.00 25.00 C ATOM 1434 CG1 VAL A 105 6.123 -11.882 -2.220 1.00 25.00 C ATOM 1435 CG2 VAL A 105 5.059 -10.137 -0.733 1.00 25.00 C ATOM 0 H VAL A 105 8.793 -11.024 -2.558 1.00 25.00 H new ATOM 0 HA VAL A 105 7.471 -9.038 -0.758 1.00 25.00 H new ATOM 0 HB VAL A 105 6.014 -9.782 -2.619 1.00 25.00 H new ATOM 0 HG11 VAL A 105 5.131 -12.101 -2.615 1.00 25.00 H new ATOM 0 HG12 VAL A 105 6.867 -12.040 -3.001 1.00 25.00 H new ATOM 0 HG13 VAL A 105 6.333 -12.543 -1.379 1.00 25.00 H new ATOM 0 HG21 VAL A 105 4.097 -10.410 -1.166 1.00 25.00 H new ATOM 0 HG22 VAL A 105 5.231 -10.725 0.168 1.00 25.00 H new ATOM 0 HG23 VAL A 105 5.055 -9.077 -0.479 1.00 25.00 H new ATOM 1445 N SER A 106 7.730 -10.597 1.176 1.00 25.00 N ATOM 1446 CA SER A 106 8.144 -11.361 2.341 1.00 25.00 C ATOM 1447 C SER A 106 7.065 -11.221 3.397 1.00 25.00 C ATOM 1448 O SER A 106 6.184 -10.369 3.278 1.00 25.00 O ATOM 1449 CB SER A 106 9.479 -10.836 2.864 1.00 25.00 C ATOM 1450 OG SER A 106 9.382 -9.457 3.166 1.00 25.00 O ATOM 0 H SER A 106 7.189 -9.761 1.397 1.00 25.00 H new ATOM 0 HA SER A 106 8.277 -12.411 2.082 1.00 25.00 H new ATOM 0 HB2 SER A 106 9.771 -11.391 3.756 1.00 25.00 H new ATOM 0 HB3 SER A 106 10.258 -10.998 2.119 1.00 25.00 H new ATOM 0 HG SER A 106 10.244 -9.134 3.502 1.00 25.00 H new ATOM 1456 N LEU A 107 7.122 -12.069 4.409 1.00 25.00 N ATOM 1457 CA LEU A 107 6.122 -12.100 5.468 1.00 25.00 C ATOM 1458 C LEU A 107 6.830 -12.098 6.811 1.00 25.00 C ATOM 1459 O LEU A 107 8.014 -12.423 6.889 1.00 25.00 O ATOM 1460 CB LEU A 107 5.293 -13.389 5.363 1.00 25.00 C ATOM 1461 CG LEU A 107 4.363 -13.554 4.152 1.00 25.00 C ATOM 1462 CD1 LEU A 107 3.919 -15.011 4.038 1.00 25.00 C ATOM 1463 CD2 LEU A 107 3.138 -12.660 4.280 1.00 25.00 C ATOM 0 H LEU A 107 7.865 -12.759 4.522 1.00 25.00 H new ATOM 0 HA LEU A 107 5.470 -11.232 5.373 1.00 25.00 H new ATOM 0 HB2 LEU A 107 5.984 -14.232 5.370 1.00 25.00 H new ATOM 0 HB3 LEU A 107 4.685 -13.469 6.264 1.00 25.00 H new ATOM 0 HG LEU A 107 4.913 -13.263 3.257 1.00 25.00 H new ATOM 0 HD11 LEU A 107 3.259 -15.124 3.178 1.00 25.00 H new ATOM 0 HD12 LEU A 107 4.794 -15.649 3.911 1.00 25.00 H new ATOM 0 HD13 LEU A 107 3.387 -15.301 4.944 1.00 25.00 H new ATOM 0 HD21 LEU A 107 2.496 -12.796 3.410 1.00 25.00 H new ATOM 0 HD22 LEU A 107 2.587 -12.925 5.182 1.00 25.00 H new ATOM 0 HD23 LEU A 107 3.453 -11.618 4.340 1.00 25.00 H new ATOM 1475 N SER A 108 6.087 -11.816 7.870 1.00 25.00 N ATOM 1476 CA SER A 108 6.592 -12.026 9.222 1.00 25.00 C ATOM 1477 C SER A 108 6.554 -13.530 9.464 1.00 25.00 C ATOM 1478 O SER A 108 5.973 -14.269 8.674 1.00 25.00 O ATOM 1479 CB SER A 108 5.723 -11.308 10.257 1.00 25.00 C ATOM 1480 OG SER A 108 4.389 -11.794 10.238 1.00 25.00 O ATOM 0 H SER A 108 5.139 -11.444 7.823 1.00 25.00 H new ATOM 0 HA SER A 108 7.601 -11.625 9.321 1.00 25.00 H new ATOM 0 HB2 SER A 108 6.148 -11.447 11.251 1.00 25.00 H new ATOM 0 HB3 SER A 108 5.725 -10.237 10.056 1.00 25.00 H new ATOM 0 HG SER A 108 3.858 -11.318 10.910 1.00 25.00 H new ATOM 1486 N ALA A 109 7.135 -13.978 10.567 1.00 25.00 N ATOM 1487 CA ALA A 109 7.197 -15.406 10.884 1.00 25.00 C ATOM 1488 C ALA A 109 5.818 -16.084 10.956 1.00 25.00 C ATOM 1489 O ALA A 109 5.710 -17.284 10.741 1.00 25.00 O ATOM 1490 CB ALA A 109 7.936 -15.593 12.217 1.00 25.00 C ATOM 0 H ALA A 109 7.573 -13.375 11.263 1.00 25.00 H new ATOM 0 HA ALA A 109 7.732 -15.889 10.067 1.00 25.00 H new ATOM 0 HB1 ALA A 109 7.986 -16.655 12.460 1.00 25.00 H new ATOM 0 HB2 ALA A 109 8.946 -15.192 12.132 1.00 25.00 H new ATOM 0 HB3 ALA A 109 7.401 -15.065 13.007 1.00 25.00 H new ATOM 1496 N ASP A 110 4.779 -15.321 11.268 1.00 25.00 N ATOM 1497 CA ASP A 110 3.447 -15.879 11.469 1.00 25.00 C ATOM 1498 C ASP A 110 2.580 -15.632 10.244 1.00 25.00 C ATOM 1499 O ASP A 110 1.399 -15.956 10.224 1.00 25.00 O ATOM 1500 CB ASP A 110 2.805 -15.195 12.674 1.00 25.00 C ATOM 1501 CG ASP A 110 3.775 -15.004 13.817 1.00 25.00 C ATOM 1502 OD1 ASP A 110 3.956 -15.927 14.633 1.00 25.00 O ATOM 1503 OD2 ASP A 110 4.381 -13.902 13.878 1.00 25.00 O ATOM 0 H ASP A 110 4.833 -14.310 11.388 1.00 25.00 H new ATOM 0 HA ASP A 110 3.530 -16.953 11.636 1.00 25.00 H new ATOM 0 HB2 ASP A 110 2.412 -14.225 12.370 1.00 25.00 H new ATOM 0 HB3 ASP A 110 1.958 -15.789 13.016 1.00 25.00 H new ATOM 1508 N GLY A 111 3.152 -14.958 9.255 1.00 25.00 N ATOM 1509 CA GLY A 111 2.398 -14.558 8.077 1.00 25.00 C ATOM 1510 C GLY A 111 1.459 -13.393 8.348 1.00 25.00 C ATOM 1511 O GLY A 111 0.734 -12.956 7.457 1.00 25.00 O ATOM 0 H GLY A 111 4.133 -14.678 9.246 1.00 25.00 H new ATOM 0 HA2 GLY A 111 3.092 -14.283 7.283 1.00 25.00 H new ATOM 0 HA3 GLY A 111 1.820 -15.408 7.715 1.00 25.00 H new ATOM 1515 N LEU A 112 1.454 -12.900 9.582 1.00 25.00 N ATOM 1516 CA LEU A 112 0.492 -11.863 10.002 1.00 25.00 C ATOM 1517 C LEU A 112 0.829 -10.464 9.496 1.00 25.00 C ATOM 1518 O LEU A 112 0.024 -9.533 9.614 1.00 25.00 O ATOM 1519 CB LEU A 112 0.396 -11.826 11.533 1.00 25.00 C ATOM 1520 CG LEU A 112 -0.266 -13.045 12.199 1.00 25.00 C ATOM 1521 CD1 LEU A 112 -0.102 -12.942 13.716 1.00 25.00 C ATOM 1522 CD2 LEU A 112 -1.753 -13.146 11.847 1.00 25.00 C ATOM 0 H LEU A 112 2.100 -13.195 10.314 1.00 25.00 H new ATOM 0 HA LEU A 112 -0.461 -12.143 9.553 1.00 25.00 H new ATOM 0 HB2 LEU A 112 1.402 -11.718 11.937 1.00 25.00 H new ATOM 0 HB3 LEU A 112 -0.160 -10.934 11.821 1.00 25.00 H new ATOM 0 HG LEU A 112 0.225 -13.944 11.826 1.00 25.00 H new ATOM 0 HD11 LEU A 112 -0.570 -13.804 14.192 1.00 25.00 H new ATOM 0 HD12 LEU A 112 0.959 -12.920 13.967 1.00 25.00 H new ATOM 0 HD13 LEU A 112 -0.578 -12.028 14.072 1.00 25.00 H new ATOM 0 HD21 LEU A 112 -2.184 -14.019 12.336 1.00 25.00 H new ATOM 0 HD22 LEU A 112 -2.269 -12.248 12.187 1.00 25.00 H new ATOM 0 HD23 LEU A 112 -1.866 -13.243 10.767 1.00 25.00 H new ATOM 1534 N ARG A 113 2.018 -10.306 8.939 1.00 25.00 N ATOM 1535 CA ARG A 113 2.439 -9.033 8.359 1.00 25.00 C ATOM 1536 C ARG A 113 3.112 -9.355 7.048 1.00 25.00 C ATOM 1537 O ARG A 113 3.714 -10.418 6.919 1.00 25.00 O ATOM 1538 CB ARG A 113 3.415 -8.299 9.280 1.00 25.00 C ATOM 1539 CG ARG A 113 2.822 -7.936 10.628 1.00 25.00 C ATOM 1540 CD ARG A 113 3.781 -7.094 11.445 1.00 25.00 C ATOM 1541 NE ARG A 113 3.034 -6.126 12.258 1.00 25.00 N ATOM 1542 CZ ARG A 113 2.660 -6.279 13.519 1.00 25.00 C ATOM 1543 NH1 ARG A 113 2.962 -7.341 14.228 1.00 25.00 N ATOM 1544 NH2 ARG A 113 1.952 -5.337 14.069 1.00 25.00 N ATOM 0 H ARG A 113 2.716 -11.047 8.874 1.00 25.00 H new ATOM 0 HA ARG A 113 1.578 -8.379 8.218 1.00 25.00 H new ATOM 0 HB2 ARG A 113 4.294 -8.924 9.436 1.00 25.00 H new ATOM 0 HB3 ARG A 113 3.754 -7.389 8.785 1.00 25.00 H new ATOM 0 HG2 ARG A 113 1.890 -7.390 10.482 1.00 25.00 H new ATOM 0 HG3 ARG A 113 2.576 -8.846 11.176 1.00 25.00 H new ATOM 0 HD2 ARG A 113 4.382 -7.735 12.090 1.00 25.00 H new ATOM 0 HD3 ARG A 113 4.471 -6.570 10.784 1.00 25.00 H new ATOM 0 HE ARG A 113 2.778 -5.248 11.806 1.00 25.00 H new ATOM 0 HH11 ARG A 113 3.508 -8.095 13.810 1.00 25.00 H new ATOM 0 HH12 ARG A 113 2.651 -7.413 15.197 1.00 25.00 H new ATOM 0 HH21 ARG A 113 1.699 -4.508 13.530 1.00 25.00 H new ATOM 0 HH22 ARG A 113 1.649 -5.427 15.039 1.00 25.00 H new ATOM 1558 N THR A 114 3.016 -8.443 6.099 1.00 25.00 N ATOM 1559 CA THR A 114 3.596 -8.624 4.767 1.00 25.00 C ATOM 1560 C THR A 114 4.428 -7.407 4.426 1.00 25.00 C ATOM 1561 O THR A 114 4.036 -6.288 4.737 1.00 25.00 O ATOM 1562 CB THR A 114 2.486 -8.761 3.703 1.00 25.00 C ATOM 1563 OG1 THR A 114 1.515 -9.702 4.155 1.00 25.00 O ATOM 1564 CG2 THR A 114 3.026 -9.245 2.363 1.00 25.00 C ATOM 0 H THR A 114 2.535 -7.552 6.223 1.00 25.00 H new ATOM 0 HA THR A 114 4.205 -9.528 4.772 1.00 25.00 H new ATOM 0 HB THR A 114 2.050 -7.772 3.562 1.00 25.00 H new ATOM 0 HG1 THR A 114 1.603 -10.534 3.644 1.00 25.00 H new ATOM 0 HG21 THR A 114 2.207 -9.325 1.648 1.00 25.00 H new ATOM 0 HG22 THR A 114 3.764 -8.535 1.990 1.00 25.00 H new ATOM 0 HG23 THR A 114 3.493 -10.221 2.490 1.00 25.00 H new ATOM 1572 N TYR A 115 5.556 -7.609 3.769 1.00 25.00 N ATOM 1573 CA TYR A 115 6.411 -6.507 3.354 1.00 25.00 C ATOM 1574 C TYR A 115 6.686 -6.662 1.867 1.00 25.00 C ATOM 1575 O TYR A 115 6.943 -7.772 1.395 1.00 25.00 O ATOM 1576 CB TYR A 115 7.709 -6.526 4.160 1.00 25.00 C ATOM 1577 CG TYR A 115 7.468 -6.795 5.634 1.00 25.00 C ATOM 1578 CD1 TYR A 115 6.941 -5.794 6.476 1.00 25.00 C ATOM 1579 CD2 TYR A 115 7.743 -8.065 6.189 1.00 25.00 C ATOM 1580 CE1 TYR A 115 6.694 -6.056 7.852 1.00 25.00 C ATOM 1581 CE2 TYR A 115 7.497 -8.328 7.564 1.00 25.00 C ATOM 1582 CZ TYR A 115 6.980 -7.320 8.380 1.00 25.00 C ATOM 1583 OH TYR A 115 6.752 -7.565 9.710 1.00 25.00 O ATOM 0 H TYR A 115 5.905 -8.532 3.509 1.00 25.00 H new ATOM 0 HA TYR A 115 5.924 -5.549 3.536 1.00 25.00 H new ATOM 0 HB2 TYR A 115 8.373 -7.291 3.757 1.00 25.00 H new ATOM 0 HB3 TYR A 115 8.219 -5.569 4.046 1.00 25.00 H new ATOM 0 HD1 TYR A 115 6.722 -4.817 6.071 1.00 25.00 H new ATOM 0 HD2 TYR A 115 8.145 -8.846 5.560 1.00 25.00 H new ATOM 0 HE1 TYR A 115 6.287 -5.283 8.487 1.00 25.00 H new ATOM 0 HE2 TYR A 115 7.709 -9.304 7.976 1.00 25.00 H new ATOM 0 HH TYR A 115 7.001 -8.489 9.920 1.00 25.00 H new ATOM 1593 N LEU A 116 6.576 -5.570 1.126 1.00 25.00 N ATOM 1594 CA LEU A 116 6.739 -5.587 -0.324 1.00 25.00 C ATOM 1595 C LEU A 116 7.836 -4.599 -0.676 1.00 25.00 C ATOM 1596 O LEU A 116 7.784 -3.447 -0.253 1.00 25.00 O ATOM 1597 CB LEU A 116 5.442 -5.154 -1.033 1.00 25.00 C ATOM 1598 CG LEU A 116 4.174 -6.016 -0.870 1.00 25.00 C ATOM 1599 CD1 LEU A 116 3.390 -5.699 0.420 1.00 25.00 C ATOM 1600 CD2 LEU A 116 3.259 -5.778 -2.073 1.00 25.00 C ATOM 0 H LEU A 116 6.372 -4.647 1.510 1.00 25.00 H new ATOM 0 HA LEU A 116 6.986 -6.598 -0.647 1.00 25.00 H new ATOM 0 HB2 LEU A 116 5.201 -4.147 -0.691 1.00 25.00 H new ATOM 0 HB3 LEU A 116 5.658 -5.085 -2.099 1.00 25.00 H new ATOM 0 HG LEU A 116 4.495 -7.056 -0.807 1.00 25.00 H new ATOM 0 HD11 LEU A 116 2.509 -6.338 0.477 1.00 25.00 H new ATOM 0 HD12 LEU A 116 4.026 -5.880 1.286 1.00 25.00 H new ATOM 0 HD13 LEU A 116 3.080 -4.654 0.410 1.00 25.00 H new ATOM 0 HD21 LEU A 116 2.358 -6.382 -1.970 1.00 25.00 H new ATOM 0 HD22 LEU A 116 2.986 -4.724 -2.119 1.00 25.00 H new ATOM 0 HD23 LEU A 116 3.781 -6.058 -2.988 1.00 25.00 H new ATOM 1612 N LYS A 117 8.820 -5.038 -1.448 1.00 25.00 N ATOM 1613 CA LYS A 117 9.932 -4.174 -1.846 1.00 25.00 C ATOM 1614 C LYS A 117 10.152 -4.280 -3.340 1.00 25.00 C ATOM 1615 O LYS A 117 10.221 -5.370 -3.870 1.00 25.00 O ATOM 1616 CB LYS A 117 11.205 -4.592 -1.087 1.00 25.00 C ATOM 1617 CG LYS A 117 12.443 -3.730 -1.384 1.00 25.00 C ATOM 1618 CD LYS A 117 13.352 -4.359 -2.439 1.00 25.00 C ATOM 1619 CE LYS A 117 14.508 -3.428 -2.763 1.00 25.00 C ATOM 1620 NZ LYS A 117 15.387 -4.029 -3.814 1.00 25.00 N ATOM 0 H LYS A 117 8.875 -5.989 -1.814 1.00 25.00 H new ATOM 0 HA LYS A 117 9.696 -3.139 -1.599 1.00 25.00 H new ATOM 0 HB2 LYS A 117 11.002 -4.555 -0.017 1.00 25.00 H new ATOM 0 HB3 LYS A 117 11.434 -5.629 -1.333 1.00 25.00 H new ATOM 0 HG2 LYS A 117 12.123 -2.745 -1.725 1.00 25.00 H new ATOM 0 HG3 LYS A 117 13.008 -3.581 -0.464 1.00 25.00 H new ATOM 0 HD2 LYS A 117 13.735 -5.313 -2.076 1.00 25.00 H new ATOM 0 HD3 LYS A 117 12.780 -4.568 -3.343 1.00 25.00 H new ATOM 0 HE2 LYS A 117 14.124 -2.468 -3.108 1.00 25.00 H new ATOM 0 HE3 LYS A 117 15.090 -3.234 -1.862 1.00 25.00 H new ATOM 0 HZ1 LYS A 117 16.102 -3.333 -4.108 1.00 25.00 H new ATOM 0 HZ2 LYS A 117 15.861 -4.871 -3.430 1.00 25.00 H new ATOM 0 HZ3 LYS A 117 14.810 -4.301 -4.635 1.00 25.00 H new ATOM 1634 N SER A 118 10.310 -3.152 -4.004 1.00 25.00 N ATOM 1635 CA SER A 118 10.632 -3.111 -5.426 1.00 25.00 C ATOM 1636 C SER A 118 11.709 -2.058 -5.582 1.00 25.00 C ATOM 1637 O SER A 118 11.938 -1.269 -4.663 1.00 25.00 O ATOM 1638 CB SER A 118 9.397 -2.737 -6.250 1.00 25.00 C ATOM 1639 OG SER A 118 9.670 -2.817 -7.639 1.00 25.00 O ATOM 0 H SER A 118 10.219 -2.231 -3.575 1.00 25.00 H new ATOM 0 HA SER A 118 10.970 -4.084 -5.782 1.00 25.00 H new ATOM 0 HB2 SER A 118 8.572 -3.404 -5.999 1.00 25.00 H new ATOM 0 HB3 SER A 118 9.078 -1.726 -5.996 1.00 25.00 H new ATOM 0 HG SER A 118 10.034 -3.702 -7.850 1.00 25.00 H new ATOM 1645 N TYR A 119 12.386 -2.052 -6.718 1.00 25.00 N ATOM 1646 CA TYR A 119 13.435 -1.084 -6.992 1.00 25.00 C ATOM 1647 C TYR A 119 13.506 -0.885 -8.498 1.00 25.00 C ATOM 1648 O TYR A 119 13.458 -1.855 -9.260 1.00 25.00 O ATOM 1649 CB TYR A 119 14.769 -1.606 -6.448 1.00 25.00 C ATOM 1650 CG TYR A 119 15.964 -0.724 -6.727 1.00 25.00 C ATOM 1651 CD1 TYR A 119 16.712 -0.878 -7.911 1.00 25.00 C ATOM 1652 CD2 TYR A 119 16.377 0.250 -5.798 1.00 25.00 C ATOM 1653 CE1 TYR A 119 17.855 -0.083 -8.158 1.00 25.00 C ATOM 1654 CE2 TYR A 119 17.515 1.059 -6.050 1.00 25.00 C ATOM 1655 CZ TYR A 119 18.244 0.881 -7.226 1.00 25.00 C ATOM 1656 OH TYR A 119 19.351 1.651 -7.464 1.00 25.00 O ATOM 0 H TYR A 119 12.225 -2.716 -7.475 1.00 25.00 H new ATOM 0 HA TYR A 119 13.222 -0.132 -6.506 1.00 25.00 H new ATOM 0 HB2 TYR A 119 14.678 -1.737 -5.370 1.00 25.00 H new ATOM 0 HB3 TYR A 119 14.957 -2.591 -6.874 1.00 25.00 H new ATOM 0 HD1 TYR A 119 16.408 -1.614 -8.641 1.00 25.00 H new ATOM 0 HD2 TYR A 119 15.821 0.383 -4.882 1.00 25.00 H new ATOM 0 HE1 TYR A 119 18.425 -0.221 -9.065 1.00 25.00 H new ATOM 0 HE2 TYR A 119 17.816 1.810 -5.334 1.00 25.00 H new ATOM 0 HH TYR A 119 19.483 2.273 -6.718 1.00 25.00 H new ATOM 1666 N ASP A 120 13.628 0.361 -8.920 1.00 25.00 N ATOM 1667 CA ASP A 120 13.753 0.705 -10.337 1.00 25.00 C ATOM 1668 C ASP A 120 15.074 1.415 -10.540 1.00 25.00 C ATOM 1669 O ASP A 120 15.506 2.138 -9.652 1.00 25.00 O ATOM 1670 CB ASP A 120 12.646 1.666 -10.772 1.00 25.00 C ATOM 1671 CG ASP A 120 12.899 2.216 -12.160 1.00 25.00 C ATOM 1672 OD1 ASP A 120 13.073 1.381 -13.057 1.00 25.00 O ATOM 1673 OD2 ASP A 120 13.188 3.428 -12.308 1.00 25.00 O ATOM 0 H ASP A 120 13.644 1.167 -8.295 1.00 25.00 H new ATOM 0 HA ASP A 120 13.685 -0.212 -10.922 1.00 25.00 H new ATOM 0 HB2 ASP A 120 11.687 1.149 -10.754 1.00 25.00 H new ATOM 0 HB3 ASP A 120 12.578 2.489 -10.061 1.00 25.00 H new ATOM 1678 N ALA A 121 15.676 1.270 -11.715 1.00 25.00 N ATOM 1679 CA ALA A 121 16.870 2.022 -12.073 1.00 25.00 C ATOM 1680 C ALA A 121 16.838 2.485 -13.520 1.00 25.00 C ATOM 1681 O ALA A 121 17.849 2.909 -14.068 1.00 25.00 O ATOM 1682 CB ALA A 121 18.124 1.193 -11.796 1.00 25.00 C ATOM 0 H ALA A 121 15.352 0.632 -12.441 1.00 25.00 H new ATOM 0 HA ALA A 121 16.895 2.916 -11.450 1.00 25.00 H new ATOM 0 HB1 ALA A 121 19.008 1.769 -12.069 1.00 25.00 H new ATOM 0 HB2 ALA A 121 18.167 0.942 -10.736 1.00 25.00 H new ATOM 0 HB3 ALA A 121 18.092 0.277 -12.385 1.00 25.00 H new ATOM 1688 N ASP A 122 15.663 2.431 -14.109 1.00 25.00 N ATOM 1689 CA ASP A 122 15.483 2.857 -15.501 1.00 25.00 C ATOM 1690 C ASP A 122 15.446 4.376 -15.522 1.00 25.00 C ATOM 1691 O ASP A 122 15.999 5.017 -16.415 1.00 25.00 O ATOM 1692 CB ASP A 122 14.175 2.319 -16.098 1.00 25.00 C ATOM 1693 CG ASP A 122 14.250 0.834 -16.454 1.00 25.00 C ATOM 1694 OD1 ASP A 122 15.173 0.130 -15.980 1.00 25.00 O ATOM 1695 OD2 ASP A 122 13.391 0.383 -17.241 1.00 25.00 O ATOM 0 H ASP A 122 14.812 2.098 -13.655 1.00 25.00 H new ATOM 0 HA ASP A 122 16.306 2.465 -16.098 1.00 25.00 H new ATOM 0 HB2 ASP A 122 13.365 2.476 -15.386 1.00 25.00 H new ATOM 0 HB3 ASP A 122 13.928 2.890 -16.993 1.00 25.00 H new ATOM 1700 N ALA A 123 14.796 4.954 -14.518 1.00 25.00 N ATOM 1701 CA ALA A 123 14.695 6.409 -14.412 1.00 25.00 C ATOM 1702 C ALA A 123 14.684 6.896 -12.958 1.00 25.00 C ATOM 1703 O ALA A 123 14.287 8.031 -12.686 1.00 25.00 O ATOM 1704 CB ALA A 123 13.428 6.887 -15.143 1.00 25.00 C ATOM 0 H ALA A 123 14.332 4.442 -13.768 1.00 25.00 H new ATOM 0 HA ALA A 123 15.582 6.836 -14.879 1.00 25.00 H new ATOM 0 HB1 ALA A 123 13.350 7.971 -15.065 1.00 25.00 H new ATOM 0 HB2 ALA A 123 13.484 6.601 -16.193 1.00 25.00 H new ATOM 0 HB3 ALA A 123 12.550 6.427 -14.689 1.00 25.00 H new ATOM 1710 N GLN A 124 15.067 6.033 -12.022 1.00 25.00 N ATOM 1711 CA GLN A 124 15.027 6.380 -10.592 1.00 25.00 C ATOM 1712 C GLN A 124 16.284 6.040 -9.813 1.00 25.00 C ATOM 1713 O GLN A 124 16.943 6.910 -9.243 1.00 25.00 O ATOM 1714 CB GLN A 124 13.841 5.671 -9.925 1.00 25.00 C ATOM 1715 CG GLN A 124 12.493 6.244 -10.317 1.00 25.00 C ATOM 1716 CD GLN A 124 12.290 7.636 -9.758 1.00 25.00 C ATOM 1717 OE1 GLN A 124 12.259 7.834 -8.554 1.00 25.00 O ATOM 1718 NE2 GLN A 124 12.176 8.607 -10.623 1.00 25.00 N ATOM 0 H GLN A 124 15.408 5.092 -12.219 1.00 25.00 H new ATOM 0 HA GLN A 124 14.930 7.465 -10.565 1.00 25.00 H new ATOM 0 HB2 GLN A 124 13.867 4.613 -10.187 1.00 25.00 H new ATOM 0 HB3 GLN A 124 13.953 5.734 -8.843 1.00 25.00 H new ATOM 0 HG2 GLN A 124 12.413 6.273 -11.404 1.00 25.00 H new ATOM 0 HG3 GLN A 124 11.700 5.588 -9.956 1.00 25.00 H new ATOM 0 HE21 GLN A 124 12.206 8.406 -11.622 1.00 25.00 H new ATOM 0 HE22 GLN A 124 12.057 9.567 -10.299 1.00 25.00 H new ATOM 1727 N GLY A 125 16.548 4.754 -9.722 1.00 25.00 N ATOM 1728 CA GLY A 125 17.621 4.247 -8.882 1.00 25.00 C ATOM 1729 C GLY A 125 17.158 4.270 -7.432 1.00 25.00 C ATOM 1730 O GLY A 125 17.931 4.579 -6.522 1.00 25.00 O ATOM 0 H GLY A 125 16.031 4.032 -10.223 1.00 25.00 H new ATOM 0 HA2 GLY A 125 17.885 3.232 -9.178 1.00 25.00 H new ATOM 0 HA3 GLY A 125 18.516 4.857 -9.003 1.00 25.00 H new ATOM 1734 N ARG A 126 15.866 4.019 -7.226 1.00 25.00 N ATOM 1735 CA ARG A 126 15.237 4.142 -5.901 1.00 25.00 C ATOM 1736 C ARG A 126 14.368 2.947 -5.574 1.00 25.00 C ATOM 1737 O ARG A 126 13.881 2.256 -6.468 1.00 25.00 O ATOM 1738 CB ARG A 126 14.349 5.398 -5.836 1.00 25.00 C ATOM 1739 CG ARG A 126 15.054 6.712 -6.167 1.00 25.00 C ATOM 1740 CD ARG A 126 16.159 7.044 -5.174 1.00 25.00 C ATOM 1741 NE ARG A 126 17.086 8.033 -5.742 1.00 25.00 N ATOM 1742 CZ ARG A 126 18.275 8.342 -5.242 1.00 25.00 C ATOM 1743 NH1 ARG A 126 18.743 7.782 -4.150 1.00 25.00 N ATOM 1744 NH2 ARG A 126 19.010 9.228 -5.852 1.00 25.00 N ATOM 0 H ARG A 126 15.225 3.726 -7.964 1.00 25.00 H new ATOM 0 HA ARG A 126 16.051 4.207 -5.179 1.00 25.00 H new ATOM 0 HB2 ARG A 126 13.514 5.269 -6.525 1.00 25.00 H new ATOM 0 HB3 ARG A 126 13.927 5.473 -4.834 1.00 25.00 H new ATOM 0 HG2 ARG A 126 15.477 6.652 -7.170 1.00 25.00 H new ATOM 0 HG3 ARG A 126 14.323 7.521 -6.177 1.00 25.00 H new ATOM 0 HD2 ARG A 126 15.723 7.433 -4.254 1.00 25.00 H new ATOM 0 HD3 ARG A 126 16.703 6.137 -4.911 1.00 25.00 H new ATOM 0 HE ARG A 126 16.792 8.521 -6.588 1.00 25.00 H new ATOM 0 HH11 ARG A 126 18.187 7.084 -3.656 1.00 25.00 H new ATOM 0 HH12 ARG A 126 19.662 8.045 -3.796 1.00 25.00 H new ATOM 0 HH21 ARG A 126 18.669 9.675 -6.703 1.00 25.00 H new ATOM 0 HH22 ARG A 126 19.926 9.475 -5.478 1.00 25.00 H new ATOM 1758 N SER A 127 14.149 2.736 -4.284 1.00 25.00 N ATOM 1759 CA SER A 127 13.284 1.665 -3.811 1.00 25.00 C ATOM 1760 C SER A 127 11.858 2.171 -3.669 1.00 25.00 C ATOM 1761 O SER A 127 11.629 3.325 -3.297 1.00 25.00 O ATOM 1762 CB SER A 127 13.757 1.164 -2.447 1.00 25.00 C ATOM 1763 OG SER A 127 15.089 0.687 -2.508 1.00 25.00 O ATOM 0 H SER A 127 14.563 3.298 -3.540 1.00 25.00 H new ATOM 0 HA SER A 127 13.322 0.852 -4.536 1.00 25.00 H new ATOM 0 HB2 SER A 127 13.691 1.971 -1.718 1.00 25.00 H new ATOM 0 HB3 SER A 127 13.098 0.367 -2.101 1.00 25.00 H new ATOM 0 HG SER A 127 15.365 0.374 -1.621 1.00 25.00 H new ATOM 1769 N PHE A 128 10.905 1.293 -3.919 1.00 25.00 N ATOM 1770 CA PHE A 128 9.489 1.598 -3.765 1.00 25.00 C ATOM 1771 C PHE A 128 8.917 0.462 -2.946 1.00 25.00 C ATOM 1772 O PHE A 128 9.072 -0.700 -3.307 1.00 25.00 O ATOM 1773 CB PHE A 128 8.824 1.711 -5.131 1.00 25.00 C ATOM 1774 CG PHE A 128 9.337 2.869 -5.942 1.00 25.00 C ATOM 1775 CD1 PHE A 128 10.463 2.723 -6.778 1.00 25.00 C ATOM 1776 CD2 PHE A 128 8.708 4.127 -5.860 1.00 25.00 C ATOM 1777 CE1 PHE A 128 10.965 3.822 -7.514 1.00 25.00 C ATOM 1778 CE2 PHE A 128 9.200 5.232 -6.591 1.00 25.00 C ATOM 1779 CZ PHE A 128 10.333 5.080 -7.412 1.00 25.00 C ATOM 0 H PHE A 128 11.089 0.341 -4.237 1.00 25.00 H new ATOM 0 HA PHE A 128 9.319 2.553 -3.268 1.00 25.00 H new ATOM 0 HB2 PHE A 128 8.986 0.787 -5.685 1.00 25.00 H new ATOM 0 HB3 PHE A 128 7.748 1.817 -4.997 1.00 25.00 H new ATOM 0 HD1 PHE A 128 10.948 1.761 -6.857 1.00 25.00 H new ATOM 0 HD2 PHE A 128 7.839 4.248 -5.231 1.00 25.00 H new ATOM 0 HE1 PHE A 128 11.828 3.699 -8.151 1.00 25.00 H new ATOM 0 HE2 PHE A 128 8.708 6.191 -6.520 1.00 25.00 H new ATOM 0 HZ PHE A 128 10.718 5.925 -7.963 1.00 25.00 H new ATOM 1789 N GLU A 129 8.424 0.778 -1.757 1.00 25.00 N ATOM 1790 CA GLU A 129 8.131 -0.252 -0.762 1.00 25.00 C ATOM 1791 C GLU A 129 6.817 0.004 -0.036 1.00 25.00 C ATOM 1792 O GLU A 129 6.430 1.156 0.176 1.00 25.00 O ATOM 1793 CB GLU A 129 9.285 -0.321 0.254 1.00 25.00 C ATOM 1794 CG GLU A 129 10.661 -0.519 -0.410 1.00 25.00 C ATOM 1795 CD GLU A 129 11.788 -0.764 0.576 1.00 25.00 C ATOM 1796 OE1 GLU A 129 11.628 -1.590 1.493 1.00 25.00 O ATOM 1797 OE2 GLU A 129 12.840 -0.102 0.445 1.00 25.00 O ATOM 0 H GLU A 129 8.219 1.731 -1.456 1.00 25.00 H new ATOM 0 HA GLU A 129 8.031 -1.203 -1.286 1.00 25.00 H new ATOM 0 HB2 GLU A 129 9.300 0.597 0.841 1.00 25.00 H new ATOM 0 HB3 GLU A 129 9.102 -1.141 0.949 1.00 25.00 H new ATOM 0 HG2 GLU A 129 10.604 -1.362 -1.099 1.00 25.00 H new ATOM 0 HG3 GLU A 129 10.897 0.363 -1.005 1.00 25.00 H new ATOM 1804 N LEU A 130 6.134 -1.074 0.328 1.00 25.00 N ATOM 1805 CA LEU A 130 4.841 -1.019 1.018 1.00 25.00 C ATOM 1806 C LEU A 130 4.846 -2.095 2.097 1.00 25.00 C ATOM 1807 O LEU A 130 5.670 -3.008 2.057 1.00 25.00 O ATOM 1808 CB LEU A 130 3.678 -1.312 0.052 1.00 25.00 C ATOM 1809 CG LEU A 130 3.392 -0.283 -1.055 1.00 25.00 C ATOM 1810 CD1 LEU A 130 4.105 -0.639 -2.368 1.00 25.00 C ATOM 1811 CD2 LEU A 130 1.886 -0.203 -1.303 1.00 25.00 C ATOM 0 H LEU A 130 6.462 -2.024 0.153 1.00 25.00 H new ATOM 0 HA LEU A 130 4.702 -0.021 1.434 1.00 25.00 H new ATOM 0 HB2 LEU A 130 3.872 -2.273 -0.425 1.00 25.00 H new ATOM 0 HB3 LEU A 130 2.771 -1.428 0.645 1.00 25.00 H new ATOM 0 HG LEU A 130 3.773 0.681 -0.717 1.00 25.00 H new ATOM 0 HD11 LEU A 130 3.876 0.114 -3.122 1.00 25.00 H new ATOM 0 HD12 LEU A 130 5.182 -0.669 -2.201 1.00 25.00 H new ATOM 0 HD13 LEU A 130 3.764 -1.615 -2.714 1.00 25.00 H new ATOM 0 HD21 LEU A 130 1.685 0.526 -2.088 1.00 25.00 H new ATOM 0 HD22 LEU A 130 1.516 -1.180 -1.613 1.00 25.00 H new ATOM 0 HD23 LEU A 130 1.382 0.102 -0.386 1.00 25.00 H new ATOM 1823 N ALA A 131 3.906 -2.023 3.025 1.00 25.00 N ATOM 1824 CA ALA A 131 3.752 -3.056 4.041 1.00 25.00 C ATOM 1825 C ALA A 131 2.269 -3.245 4.361 1.00 25.00 C ATOM 1826 O ALA A 131 1.478 -2.309 4.245 1.00 25.00 O ATOM 1827 CB ALA A 131 4.536 -2.671 5.300 1.00 25.00 C ATOM 0 H ALA A 131 3.235 -1.258 3.097 1.00 25.00 H new ATOM 0 HA ALA A 131 4.149 -3.999 3.665 1.00 25.00 H new ATOM 0 HB1 ALA A 131 4.416 -3.448 6.055 1.00 25.00 H new ATOM 0 HB2 ALA A 131 5.592 -2.565 5.053 1.00 25.00 H new ATOM 0 HB3 ALA A 131 4.158 -1.726 5.689 1.00 25.00 H new ATOM 1833 N LEU A 132 1.910 -4.450 4.776 1.00 25.00 N ATOM 1834 CA LEU A 132 0.543 -4.780 5.170 1.00 25.00 C ATOM 1835 C LEU A 132 0.603 -5.352 6.573 1.00 25.00 C ATOM 1836 O LEU A 132 1.354 -6.290 6.820 1.00 25.00 O ATOM 1837 CB LEU A 132 -0.065 -5.852 4.248 1.00 25.00 C ATOM 1838 CG LEU A 132 -0.011 -5.645 2.727 1.00 25.00 C ATOM 1839 CD1 LEU A 132 -0.563 -6.886 2.023 1.00 25.00 C ATOM 1840 CD2 LEU A 132 -0.796 -4.434 2.292 1.00 25.00 C ATOM 0 H LEU A 132 2.560 -5.233 4.850 1.00 25.00 H new ATOM 0 HA LEU A 132 -0.072 -3.882 5.110 1.00 25.00 H new ATOM 0 HB2 LEU A 132 0.432 -6.796 4.469 1.00 25.00 H new ATOM 0 HB3 LEU A 132 -1.112 -5.970 4.527 1.00 25.00 H new ATOM 0 HG LEU A 132 1.031 -5.483 2.452 1.00 25.00 H new ATOM 0 HD11 LEU A 132 -0.525 -6.739 0.944 1.00 25.00 H new ATOM 0 HD12 LEU A 132 0.038 -7.755 2.293 1.00 25.00 H new ATOM 0 HD13 LEU A 132 -1.596 -7.050 2.331 1.00 25.00 H new ATOM 0 HD21 LEU A 132 -0.730 -4.327 1.209 1.00 25.00 H new ATOM 0 HD22 LEU A 132 -1.840 -4.554 2.581 1.00 25.00 H new ATOM 0 HD23 LEU A 132 -0.387 -3.544 2.770 1.00 25.00 H new ATOM 1852 N ASP A 133 -0.206 -4.829 7.471 1.00 25.00 N ATOM 1853 CA ASP A 133 -0.323 -5.385 8.819 1.00 25.00 C ATOM 1854 C ASP A 133 -1.724 -5.973 8.938 1.00 25.00 C ATOM 1855 O ASP A 133 -2.668 -5.464 8.330 1.00 25.00 O ATOM 1856 CB ASP A 133 -0.151 -4.291 9.878 1.00 25.00 C ATOM 1857 CG ASP A 133 1.247 -4.245 10.468 1.00 25.00 C ATOM 1858 OD1 ASP A 133 2.216 -4.661 9.806 1.00 25.00 O ATOM 1859 OD2 ASP A 133 1.377 -3.827 11.643 1.00 25.00 O ATOM 0 H ASP A 133 -0.798 -4.016 7.298 1.00 25.00 H new ATOM 0 HA ASP A 133 0.449 -6.137 8.981 1.00 25.00 H new ATOM 0 HB2 ASP A 133 -0.383 -3.323 9.433 1.00 25.00 H new ATOM 0 HB3 ASP A 133 -0.872 -4.454 10.680 1.00 25.00 H new ATOM 1864 N GLY A 134 -1.869 -7.045 9.707 1.00 25.00 N ATOM 1865 CA GLY A 134 -3.168 -7.688 9.841 1.00 25.00 C ATOM 1866 C GLY A 134 -3.455 -8.521 8.610 1.00 25.00 C ATOM 1867 O GLY A 134 -4.594 -8.687 8.198 1.00 25.00 O ATOM 0 H GLY A 134 -1.116 -7.481 10.239 1.00 25.00 H new ATOM 0 HA2 GLY A 134 -3.182 -8.319 10.730 1.00 25.00 H new ATOM 0 HA3 GLY A 134 -3.945 -6.935 9.972 1.00 25.00 H new ATOM 1871 N ASN A 135 -2.390 -9.012 7.996 1.00 25.00 N ATOM 1872 CA ASN A 135 -2.495 -9.800 6.776 1.00 25.00 C ATOM 1873 C ASN A 135 -3.133 -11.161 7.038 1.00 25.00 C ATOM 1874 O ASN A 135 -2.561 -12.010 7.725 1.00 25.00 O ATOM 1875 CB ASN A 135 -1.106 -10.029 6.188 1.00 25.00 C ATOM 1876 CG ASN A 135 -1.150 -10.842 4.926 1.00 25.00 C ATOM 1877 OD1 ASN A 135 -1.767 -10.454 3.946 1.00 25.00 O ATOM 1878 ND2 ASN A 135 -0.510 -11.974 4.940 1.00 25.00 N ATOM 0 H ASN A 135 -1.434 -8.877 8.326 1.00 25.00 H new ATOM 0 HA ASN A 135 -3.123 -9.242 6.081 1.00 25.00 H new ATOM 0 HB2 ASN A 135 -0.638 -9.067 5.982 1.00 25.00 H new ATOM 0 HB3 ASN A 135 -0.481 -10.536 6.923 1.00 25.00 H new ATOM 0 HD21 ASN A 135 -0.512 -12.571 4.113 1.00 25.00 H new ATOM 0 HD22 ASN A 135 -0.006 -12.264 5.778 1.00 25.00 H new ATOM 1885 N HIS A 136 -4.285 -11.395 6.432 1.00 25.00 N ATOM 1886 CA HIS A 136 -4.941 -12.698 6.503 1.00 25.00 C ATOM 1887 C HIS A 136 -4.304 -13.648 5.502 1.00 25.00 C ATOM 1888 O HIS A 136 -4.855 -13.925 4.446 1.00 25.00 O ATOM 1889 CB HIS A 136 -6.445 -12.560 6.270 1.00 25.00 C ATOM 1890 CG HIS A 136 -7.134 -11.699 7.283 1.00 25.00 C ATOM 1891 ND1 HIS A 136 -7.292 -10.336 7.179 1.00 25.00 N ATOM 1892 CD2 HIS A 136 -7.734 -12.032 8.459 1.00 25.00 C ATOM 1893 CE1 HIS A 136 -7.961 -9.914 8.247 1.00 25.00 C ATOM 1894 NE2 HIS A 136 -8.250 -10.906 9.066 1.00 25.00 N ATOM 0 H HIS A 136 -4.790 -10.700 5.883 1.00 25.00 H new ATOM 0 HA HIS A 136 -4.806 -13.113 7.502 1.00 25.00 H new ATOM 0 HB2 HIS A 136 -6.613 -12.143 5.277 1.00 25.00 H new ATOM 0 HB3 HIS A 136 -6.898 -13.551 6.280 1.00 25.00 H new ATOM 0 HD1 HIS A 136 -6.954 -9.751 6.415 1.00 25.00 H new ATOM 0 HD2 HIS A 136 -7.797 -13.033 8.859 1.00 25.00 H new ATOM 0 HE1 HIS A 136 -8.235 -8.884 8.423 1.00 25.00 H new ATOM 1902 N ALA A 137 -3.145 -14.183 5.870 1.00 25.00 N ATOM 1903 CA ALA A 137 -2.443 -15.169 5.051 1.00 25.00 C ATOM 1904 C ALA A 137 -3.316 -16.417 4.886 1.00 25.00 C ATOM 1905 O ALA A 137 -3.234 -17.118 3.887 1.00 25.00 O ATOM 1906 CB ALA A 137 -1.103 -15.536 5.706 1.00 25.00 C ATOM 0 H ALA A 137 -2.666 -13.948 6.740 1.00 25.00 H new ATOM 0 HA ALA A 137 -2.244 -14.745 4.067 1.00 25.00 H new ATOM 0 HB1 ALA A 137 -0.586 -16.271 5.089 1.00 25.00 H new ATOM 0 HB2 ALA A 137 -0.486 -14.642 5.798 1.00 25.00 H new ATOM 0 HB3 ALA A 137 -1.285 -15.955 6.696 1.00 25.00 H new ATOM 1912 N ALA A 138 -4.190 -16.645 5.858 1.00 25.00 N ATOM 1913 CA ALA A 138 -5.137 -17.753 5.804 1.00 25.00 C ATOM 1914 C ALA A 138 -6.081 -17.611 4.601 1.00 25.00 C ATOM 1915 O ALA A 138 -6.596 -18.604 4.098 1.00 25.00 O ATOM 1916 CB ALA A 138 -5.945 -17.803 7.110 1.00 25.00 C ATOM 0 H ALA A 138 -4.263 -16.073 6.699 1.00 25.00 H new ATOM 0 HA ALA A 138 -4.580 -18.682 5.686 1.00 25.00 H new ATOM 0 HB1 ALA A 138 -6.652 -18.631 7.069 1.00 25.00 H new ATOM 0 HB2 ALA A 138 -5.267 -17.946 7.952 1.00 25.00 H new ATOM 0 HB3 ALA A 138 -6.489 -16.867 7.237 1.00 25.00 H new ATOM 1922 N THR A 139 -6.293 -16.383 4.141 1.00 25.00 N ATOM 1923 CA THR A 139 -7.156 -16.132 2.978 1.00 25.00 C ATOM 1924 C THR A 139 -6.384 -15.456 1.842 1.00 25.00 C ATOM 1925 O THR A 139 -6.920 -14.586 1.153 1.00 25.00 O ATOM 1926 CB THR A 139 -8.357 -15.233 3.360 1.00 25.00 C ATOM 1927 OG1 THR A 139 -7.884 -13.954 3.783 1.00 25.00 O ATOM 1928 CG2 THR A 139 -9.161 -15.836 4.496 1.00 25.00 C ATOM 0 H THR A 139 -5.883 -15.543 4.550 1.00 25.00 H new ATOM 0 HA THR A 139 -7.516 -17.104 2.640 1.00 25.00 H new ATOM 0 HB THR A 139 -8.993 -15.142 2.480 1.00 25.00 H new ATOM 0 HG1 THR A 139 -6.916 -13.996 3.933 1.00 25.00 H new ATOM 0 HG21 THR A 139 -9.996 -15.179 4.739 1.00 25.00 H new ATOM 0 HG22 THR A 139 -9.542 -16.812 4.194 1.00 25.00 H new ATOM 0 HG23 THR A 139 -8.523 -15.951 5.372 1.00 25.00 H new ATOM 1936 N LEU A 140 -5.114 -15.813 1.684 1.00 25.00 N ATOM 1937 CA LEU A 140 -4.253 -15.180 0.677 1.00 25.00 C ATOM 1938 C LEU A 140 -4.825 -15.291 -0.741 1.00 25.00 C ATOM 1939 O LEU A 140 -5.587 -16.201 -1.059 1.00 25.00 O ATOM 1940 CB LEU A 140 -2.829 -15.773 0.728 1.00 25.00 C ATOM 1941 CG LEU A 140 -2.612 -17.230 0.261 1.00 25.00 C ATOM 1942 CD1 LEU A 140 -2.341 -17.339 -1.253 1.00 25.00 C ATOM 1943 CD2 LEU A 140 -1.417 -17.826 1.008 1.00 25.00 C ATOM 0 H LEU A 140 -4.653 -16.536 2.237 1.00 25.00 H new ATOM 0 HA LEU A 140 -4.209 -14.119 0.923 1.00 25.00 H new ATOM 0 HB2 LEU A 140 -2.184 -15.134 0.126 1.00 25.00 H new ATOM 0 HB3 LEU A 140 -2.478 -15.701 1.757 1.00 25.00 H new ATOM 0 HG LEU A 140 -3.532 -17.774 0.477 1.00 25.00 H new ATOM 0 HD11 LEU A 140 -2.197 -18.385 -1.522 1.00 25.00 H new ATOM 0 HD12 LEU A 140 -3.190 -16.936 -1.805 1.00 25.00 H new ATOM 0 HD13 LEU A 140 -1.444 -16.773 -1.504 1.00 25.00 H new ATOM 0 HD21 LEU A 140 -1.260 -18.854 0.682 1.00 25.00 H new ATOM 0 HD22 LEU A 140 -0.525 -17.237 0.795 1.00 25.00 H new ATOM 0 HD23 LEU A 140 -1.614 -17.812 2.080 1.00 25.00 H new ATOM 1955 N SER A 141 -4.433 -14.354 -1.594 1.00 25.00 N ATOM 1956 CA SER A 141 -4.914 -14.302 -2.969 1.00 25.00 C ATOM 1957 C SER A 141 -3.844 -13.701 -3.870 1.00 25.00 C ATOM 1958 O SER A 141 -3.067 -12.858 -3.438 1.00 25.00 O ATOM 1959 CB SER A 141 -6.172 -13.433 -3.033 1.00 25.00 C ATOM 1960 OG SER A 141 -6.647 -13.298 -4.364 1.00 25.00 O ATOM 0 H SER A 141 -3.776 -13.612 -1.354 1.00 25.00 H new ATOM 0 HA SER A 141 -5.144 -15.313 -3.307 1.00 25.00 H new ATOM 0 HB2 SER A 141 -6.951 -13.874 -2.411 1.00 25.00 H new ATOM 0 HB3 SER A 141 -5.955 -12.447 -2.622 1.00 25.00 H new ATOM 0 HG SER A 141 -7.452 -12.739 -4.369 1.00 25.00 H new ATOM 1966 N ALA A 142 -3.835 -14.110 -5.132 1.00 25.00 N ATOM 1967 CA ALA A 142 -2.912 -13.561 -6.130 1.00 25.00 C ATOM 1968 C ALA A 142 -3.546 -12.326 -6.796 1.00 25.00 C ATOM 1969 O ALA A 142 -2.991 -11.742 -7.729 1.00 25.00 O ATOM 1970 CB ALA A 142 -2.598 -14.634 -7.186 1.00 25.00 C ATOM 0 H ALA A 142 -4.462 -14.828 -5.496 1.00 25.00 H new ATOM 0 HA ALA A 142 -1.984 -13.261 -5.644 1.00 25.00 H new ATOM 0 HB1 ALA A 142 -1.912 -14.225 -7.928 1.00 25.00 H new ATOM 0 HB2 ALA A 142 -2.138 -15.496 -6.703 1.00 25.00 H new ATOM 0 HB3 ALA A 142 -3.521 -14.942 -7.677 1.00 25.00 H new ATOM 1976 N GLY A 143 -4.741 -11.971 -6.344 1.00 25.00 N ATOM 1977 CA GLY A 143 -5.497 -10.890 -6.956 1.00 25.00 C ATOM 1978 C GLY A 143 -5.435 -9.552 -6.248 1.00 25.00 C ATOM 1979 O GLY A 143 -6.210 -8.671 -6.587 1.00 25.00 O ATOM 0 H GLY A 143 -5.207 -12.417 -5.554 1.00 25.00 H new ATOM 0 HA2 GLY A 143 -5.139 -10.755 -7.977 1.00 25.00 H new ATOM 0 HA3 GLY A 143 -6.541 -11.196 -7.022 1.00 25.00 H new ATOM 1983 N ASN A 144 -4.557 -9.388 -5.264 1.00 25.00 N ATOM 1984 CA ASN A 144 -4.506 -8.135 -4.492 1.00 25.00 C ATOM 1985 C ASN A 144 -4.148 -6.935 -5.365 1.00 25.00 C ATOM 1986 O ASN A 144 -4.704 -5.849 -5.231 1.00 25.00 O ATOM 1987 CB ASN A 144 -3.447 -8.239 -3.388 1.00 25.00 C ATOM 1988 CG ASN A 144 -3.642 -9.434 -2.514 1.00 25.00 C ATOM 1989 OD1 ASN A 144 -4.730 -9.731 -2.089 1.00 25.00 O ATOM 1990 ND2 ASN A 144 -2.586 -10.152 -2.284 1.00 25.00 N ATOM 0 H ASN A 144 -3.876 -10.092 -4.979 1.00 25.00 H new ATOM 0 HA ASN A 144 -5.501 -7.987 -4.072 1.00 25.00 H new ATOM 0 HB2 ASN A 144 -2.457 -8.284 -3.842 1.00 25.00 H new ATOM 0 HB3 ASN A 144 -3.476 -7.338 -2.776 1.00 25.00 H new ATOM 0 HD21 ASN A 144 -2.659 -11.002 -1.725 1.00 25.00 H new ATOM 0 HD22 ASN A 144 -1.683 -9.866 -2.662 1.00 25.00 H new ATOM 1997 N ILE A 145 -3.173 -7.141 -6.235 1.00 25.00 N ATOM 1998 CA ILE A 145 -2.664 -6.088 -7.106 1.00 25.00 C ATOM 1999 C ILE A 145 -3.719 -5.837 -8.184 1.00 25.00 C ATOM 2000 O ILE A 145 -4.364 -6.774 -8.640 1.00 25.00 O ATOM 2001 CB ILE A 145 -1.289 -6.516 -7.736 1.00 25.00 C ATOM 2002 CG1 ILE A 145 -0.283 -6.838 -6.600 1.00 25.00 C ATOM 2003 CG2 ILE A 145 -0.717 -5.394 -8.632 1.00 25.00 C ATOM 2004 CD1 ILE A 145 1.125 -7.277 -7.070 1.00 25.00 C ATOM 0 H ILE A 145 -2.711 -8.042 -6.359 1.00 25.00 H new ATOM 0 HA ILE A 145 -2.483 -5.171 -6.545 1.00 25.00 H new ATOM 0 HB ILE A 145 -1.450 -7.399 -8.354 1.00 25.00 H new ATOM 0 HG12 ILE A 145 -0.179 -5.956 -5.968 1.00 25.00 H new ATOM 0 HG13 ILE A 145 -0.703 -7.628 -5.978 1.00 25.00 H new ATOM 0 HG21 ILE A 145 0.234 -5.716 -9.055 1.00 25.00 H new ATOM 0 HG22 ILE A 145 -1.419 -5.179 -9.438 1.00 25.00 H new ATOM 0 HG23 ILE A 145 -0.563 -4.495 -8.035 1.00 25.00 H new ATOM 0 HD11 ILE A 145 1.752 -7.479 -6.202 1.00 25.00 H new ATOM 0 HD12 ILE A 145 1.042 -8.180 -7.675 1.00 25.00 H new ATOM 0 HD13 ILE A 145 1.574 -6.482 -7.665 1.00 25.00 H new ATOM 2016 N VAL A 146 -3.884 -4.585 -8.597 1.00 25.00 N ATOM 2017 CA VAL A 146 -4.865 -4.213 -9.627 1.00 25.00 C ATOM 2018 C VAL A 146 -4.733 -5.034 -10.926 1.00 25.00 C ATOM 2019 O VAL A 146 -5.737 -5.380 -11.541 1.00 25.00 O ATOM 2020 CB VAL A 146 -4.796 -2.670 -9.913 1.00 25.00 C ATOM 2021 CG1 VAL A 146 -3.465 -2.264 -10.584 1.00 25.00 C ATOM 2022 CG2 VAL A 146 -5.983 -2.208 -10.757 1.00 25.00 C ATOM 0 H VAL A 146 -3.347 -3.798 -8.233 1.00 25.00 H new ATOM 0 HA VAL A 146 -5.849 -4.456 -9.227 1.00 25.00 H new ATOM 0 HB VAL A 146 -4.845 -2.169 -8.946 1.00 25.00 H new ATOM 0 HG11 VAL A 146 -3.461 -1.189 -10.763 1.00 25.00 H new ATOM 0 HG12 VAL A 146 -2.633 -2.526 -9.930 1.00 25.00 H new ATOM 0 HG13 VAL A 146 -3.360 -2.790 -11.533 1.00 25.00 H new ATOM 0 HG21 VAL A 146 -5.906 -1.136 -10.937 1.00 25.00 H new ATOM 0 HG22 VAL A 146 -5.980 -2.737 -11.710 1.00 25.00 H new ATOM 0 HG23 VAL A 146 -6.911 -2.421 -10.227 1.00 25.00 H new ATOM 2032 N PHE A 147 -3.513 -5.399 -11.299 1.00 25.00 N ATOM 2033 CA PHE A 147 -3.273 -6.191 -12.509 1.00 25.00 C ATOM 2034 C PHE A 147 -3.656 -7.666 -12.340 1.00 25.00 C ATOM 2035 O PHE A 147 -3.815 -8.386 -13.324 1.00 25.00 O ATOM 2036 CB PHE A 147 -1.788 -6.120 -12.877 1.00 25.00 C ATOM 2037 CG PHE A 147 -1.243 -4.715 -12.951 1.00 25.00 C ATOM 2038 CD1 PHE A 147 -1.796 -3.772 -13.842 1.00 25.00 C ATOM 2039 CD2 PHE A 147 -0.157 -4.330 -12.142 1.00 25.00 C ATOM 2040 CE1 PHE A 147 -1.271 -2.453 -13.918 1.00 25.00 C ATOM 2041 CE2 PHE A 147 0.381 -3.024 -12.217 1.00 25.00 C ATOM 2042 CZ PHE A 147 -0.180 -2.083 -13.102 1.00 25.00 C ATOM 0 H PHE A 147 -2.667 -5.160 -10.781 1.00 25.00 H new ATOM 0 HA PHE A 147 -3.900 -5.768 -13.293 1.00 25.00 H new ATOM 0 HB2 PHE A 147 -1.214 -6.684 -12.141 1.00 25.00 H new ATOM 0 HB3 PHE A 147 -1.639 -6.608 -13.840 1.00 25.00 H new ATOM 0 HD1 PHE A 147 -2.626 -4.055 -14.473 1.00 25.00 H new ATOM 0 HD2 PHE A 147 0.272 -5.043 -11.453 1.00 25.00 H new ATOM 0 HE1 PHE A 147 -1.706 -1.736 -14.598 1.00 25.00 H new ATOM 0 HE2 PHE A 147 1.221 -2.749 -11.596 1.00 25.00 H new ATOM 0 HZ PHE A 147 0.223 -1.082 -13.156 1.00 25.00 H new ATOM 2052 N ALA A 148 -3.785 -8.092 -11.085 1.00 25.00 N ATOM 2053 CA ALA A 148 -4.057 -9.482 -10.707 1.00 25.00 C ATOM 2054 C ALA A 148 -2.969 -10.433 -11.241 1.00 25.00 C ATOM 2055 O ALA A 148 -1.891 -9.992 -11.628 1.00 25.00 O ATOM 2056 CB ALA A 148 -5.474 -9.911 -11.180 1.00 25.00 C ATOM 0 H ALA A 148 -3.702 -7.468 -10.283 1.00 25.00 H new ATOM 0 HA ALA A 148 -4.033 -9.548 -9.619 1.00 25.00 H new ATOM 0 HB1 ALA A 148 -5.657 -10.946 -10.890 1.00 25.00 H new ATOM 0 HB2 ALA A 148 -6.222 -9.267 -10.718 1.00 25.00 H new ATOM 0 HB3 ALA A 148 -5.538 -9.822 -12.264 1.00 25.00 H new ATOM 2062 N ALA A 149 -3.260 -11.732 -11.200 1.00 25.00 N ATOM 2063 CA ALA A 149 -2.357 -12.793 -11.675 1.00 25.00 C ATOM 2064 C ALA A 149 -0.953 -12.772 -11.033 1.00 25.00 C ATOM 2065 O ALA A 149 -0.004 -13.313 -11.597 1.00 25.00 O ATOM 2066 CB ALA A 149 -2.250 -12.741 -13.217 1.00 25.00 C ATOM 0 H ALA A 149 -4.142 -12.088 -10.831 1.00 25.00 H new ATOM 0 HA ALA A 149 -2.805 -13.735 -11.358 1.00 25.00 H new ATOM 0 HB1 ALA A 149 -1.580 -13.529 -13.562 1.00 25.00 H new ATOM 0 HB2 ALA A 149 -3.237 -12.886 -13.655 1.00 25.00 H new ATOM 0 HB3 ALA A 149 -1.857 -11.771 -13.522 1.00 25.00 H new ATOM 2072 N ALA A 150 -0.837 -12.180 -9.852 1.00 25.00 N ATOM 2073 CA ALA A 150 0.442 -12.083 -9.146 1.00 25.00 C ATOM 2074 C ALA A 150 0.755 -13.389 -8.400 1.00 25.00 C ATOM 2075 O ALA A 150 0.810 -13.425 -7.171 1.00 25.00 O ATOM 2076 CB ALA A 150 0.404 -10.901 -8.172 1.00 25.00 C ATOM 0 H ALA A 150 -1.620 -11.754 -9.355 1.00 25.00 H new ATOM 0 HA ALA A 150 1.235 -11.918 -9.876 1.00 25.00 H new ATOM 0 HB1 ALA A 150 1.357 -10.831 -7.648 1.00 25.00 H new ATOM 0 HB2 ALA A 150 0.226 -9.979 -8.725 1.00 25.00 H new ATOM 0 HB3 ALA A 150 -0.398 -11.051 -7.449 1.00 25.00 H new ATOM 2082 N THR A 151 0.895 -14.468 -9.150 1.00 25.00 N ATOM 2083 CA THR A 151 1.180 -15.777 -8.574 1.00 25.00 C ATOM 2084 C THR A 151 2.667 -15.810 -8.176 1.00 25.00 C ATOM 2085 O THR A 151 3.506 -15.203 -8.852 1.00 25.00 O ATOM 2086 CB THR A 151 0.814 -16.916 -9.584 1.00 25.00 C ATOM 2087 OG1 THR A 151 0.823 -18.181 -8.921 1.00 25.00 O ATOM 2088 CG2 THR A 151 1.775 -16.984 -10.763 1.00 25.00 C ATOM 0 H THR A 151 0.816 -14.466 -10.167 1.00 25.00 H new ATOM 0 HA THR A 151 0.571 -15.946 -7.686 1.00 25.00 H new ATOM 0 HB THR A 151 -0.180 -16.684 -9.966 1.00 25.00 H new ATOM 0 HG1 THR A 151 0.591 -18.887 -9.560 1.00 25.00 H new ATOM 0 HG21 THR A 151 1.474 -17.791 -11.431 1.00 25.00 H new ATOM 0 HG22 THR A 151 1.755 -16.038 -11.304 1.00 25.00 H new ATOM 0 HG23 THR A 151 2.785 -17.172 -10.399 1.00 25.00 H new ATOM 2096 N PRO A 152 3.007 -16.468 -7.050 1.00 25.00 N ATOM 2097 CA PRO A 152 4.428 -16.506 -6.688 1.00 25.00 C ATOM 2098 C PRO A 152 5.226 -17.476 -7.557 1.00 25.00 C ATOM 2099 O PRO A 152 4.656 -18.295 -8.279 1.00 25.00 O ATOM 2100 CB PRO A 152 4.390 -16.980 -5.235 1.00 25.00 C ATOM 2101 CG PRO A 152 3.214 -17.876 -5.190 1.00 25.00 C ATOM 2102 CD PRO A 152 2.185 -17.197 -6.062 1.00 25.00 C ATOM 0 HA PRO A 152 4.921 -15.544 -6.829 1.00 25.00 H new ATOM 0 HB2 PRO A 152 5.305 -17.506 -4.961 1.00 25.00 H new ATOM 0 HB3 PRO A 152 4.283 -16.144 -4.544 1.00 25.00 H new ATOM 0 HG2 PRO A 152 3.458 -18.870 -5.565 1.00 25.00 H new ATOM 0 HG3 PRO A 152 2.849 -18.001 -4.170 1.00 25.00 H new ATOM 0 HD2 PRO A 152 1.525 -17.919 -6.542 1.00 25.00 H new ATOM 0 HD3 PRO A 152 1.553 -16.521 -5.487 1.00 25.00 H new ATOM 2110 N GLY A 153 6.546 -17.397 -7.454 1.00 25.00 N ATOM 2111 CA GLY A 153 7.437 -18.283 -8.178 1.00 25.00 C ATOM 2112 C GLY A 153 8.747 -18.228 -7.438 1.00 25.00 C ATOM 2113 O GLY A 153 8.810 -17.423 -6.481 1.00 25.00 O ATOM 2114 OXT GLY A 153 9.697 -18.949 -7.793 1.00 25.00 O ATOM 0 H GLY A 153 7.026 -16.716 -6.865 1.00 25.00 H new ATOM 0 HA2 GLY A 153 7.044 -19.299 -8.205 1.00 25.00 H new ATOM 0 HA3 GLY A 153 7.557 -17.960 -9.212 1.00 25.00 H new TER 2118 GLY A 153 HETATM 2119 CA CA A 201 -2.657 15.095 4.251 1.00 25.00 CA HETATM 2120 CA CA A 202 -16.685 3.243 5.752 1.00 25.00 CA HETATM 2121 CA CA A 203 -0.377 11.244 2.512 1.00 25.00 CA HETATM 2122 CA CA A 204 -13.950 -0.620 5.074 1.00 25.00 CA HETATM 2123 CA CA A 205 1.716 7.401 0.700 1.00 25.00 CA HETATM 2124 CA CA A 206 -10.949 -4.744 4.220 1.00 25.00 CA