USER MOD reduce.3.24.130724 H: found=0, std=0, add=808, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 808 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 27 CYS SG : rot -170:sc= -6.23! USER MOD Set 1.2: A 62 TYR OH : rot -30:sc= -1.06 USER MOD Set 2.1: A 24 LYS NZ :NH3+ 143:sc= -0.557 (180deg=-3.01!) USER MOD Set 2.2: A 36 SER OG : rot -139:sc= -0.416 USER MOD Set 3.1: A 14 ASN : amide:sc= -0.0473 X(o=-0.047,f=0) USER MOD Set 3.2: A 78 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 4 TYR OH : rot 77:sc= -4.36! USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 12 THR OG1 : rot 73:sc= 0.431 USER MOD Single : A 13 ASN : amide:sc= -0.527 K(o=-0.53,f=-1.8) USER MOD Single : A 16 THR OG1 : rot -177:sc= -1.8 USER MOD Single : A 22 GLN : amide:sc= -0.361 X(o=-0.36,f=-0.73) USER MOD Single : A 25 SER OG : rot 90:sc= 1.29 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 THR OG1 : rot 13:sc= 0.899 USER MOD Single : A 41 THR OG1 : rot 140:sc= -0.397 USER MOD Single : A 43 SER OG : rot 180:sc= -1.88! USER MOD Single : A 47 SER OG : rot 100:sc= 1.24 USER MOD Single : A 51 SER OG : rot 50:sc= 1.22 USER MOD Single : A 52 HIS : no HD1:sc= -2.14 X(o=-2.1,f=-2.5!) USER MOD Single : A 53 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 ASN : amide:sc= -0.815 K(o=-0.81,f=-0.019) USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 65 HIS : no HD1:sc= -5.49! C(o=-5.5!,f=-6.2!) USER MOD Single : A 70 SER OG : rot -65:sc= -2.02 USER MOD Single : A 77 THR OG1 : rot 64:sc= 1.12 USER MOD Single : A 82 TYR OH : rot 2:sc= -1.62 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 THR OG1 : rot 176:sc= -0.531 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 106 LYS NZ :NH3+ 152:sc= -0.024 (180deg=-0.327) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 20 N ALA A 2 -4.180 15.219 8.658 1.00 35.11 N ATOM 21 CA ALA A 2 -5.455 14.547 8.894 1.00 35.11 C ATOM 22 C ALA A 2 -5.686 13.421 7.905 1.00 35.11 C ATOM 23 O ALA A 2 -6.177 12.356 8.277 1.00 35.11 O ATOM 24 CB ALA A 2 -6.606 15.540 8.843 1.00 35.11 C ATOM 0 HA ALA A 2 -5.413 14.111 9.892 1.00 35.11 H new ATOM 0 HB1 ALA A 2 -7.546 15.017 9.021 1.00 35.11 H new ATOM 0 HB2 ALA A 2 -6.463 16.302 9.609 1.00 35.11 H new ATOM 0 HB3 ALA A 2 -6.635 16.013 7.862 1.00 35.11 H new ATOM 30 N GLU A 3 -5.313 13.639 6.647 1.00 71.76 N ATOM 31 CA GLU A 3 -5.475 12.605 5.634 1.00 71.76 C ATOM 32 C GLU A 3 -4.665 11.391 6.043 1.00 71.76 C ATOM 33 O GLU A 3 -5.109 10.253 5.907 1.00 71.76 O ATOM 34 CB GLU A 3 -5.002 13.107 4.268 1.00 71.76 C ATOM 35 CG GLU A 3 -5.684 14.377 3.812 1.00 71.76 C ATOM 36 CD GLU A 3 -5.310 14.766 2.394 1.00 71.76 C ATOM 37 OE1 GLU A 3 -4.152 15.182 2.179 1.00 71.76 O ATOM 38 OE2 GLU A 3 -6.175 14.653 1.499 1.00 71.76 O ATOM 0 H GLU A 3 -4.902 14.510 6.310 1.00 71.76 H new ATOM 0 HA GLU A 3 -6.530 12.343 5.554 1.00 71.76 H new ATOM 0 HB2 GLU A 3 -3.926 13.278 4.307 1.00 71.76 H new ATOM 0 HB3 GLU A 3 -5.174 12.327 3.526 1.00 71.76 H new ATOM 0 HG2 GLU A 3 -6.764 14.247 3.876 1.00 71.76 H new ATOM 0 HG3 GLU A 3 -5.420 15.190 4.489 1.00 71.76 H new ATOM 45 N TYR A 4 -3.467 11.654 6.551 1.00112.05 N ATOM 46 CA TYR A 4 -2.586 10.592 6.991 1.00112.05 C ATOM 47 C TYR A 4 -3.218 9.804 8.129 1.00112.05 C ATOM 48 O TYR A 4 -3.178 8.574 8.135 1.00112.05 O ATOM 49 CB TYR A 4 -1.230 11.142 7.422 1.00112.05 C ATOM 50 CG TYR A 4 -0.228 10.060 7.711 1.00112.05 C ATOM 51 CD1 TYR A 4 0.164 9.161 6.724 1.00112.05 C ATOM 52 CD2 TYR A 4 0.326 9.937 8.970 1.00112.05 C ATOM 53 CE1 TYR A 4 1.085 8.168 6.992 1.00112.05 C ATOM 54 CE2 TYR A 4 1.242 8.950 9.247 1.00112.05 C ATOM 55 CZ TYR A 4 1.622 8.066 8.258 1.00112.05 C ATOM 56 OH TYR A 4 2.540 7.080 8.535 1.00112.05 O ATOM 0 H TYR A 4 -3.088 12.594 6.666 1.00112.05 H new ATOM 0 HA TYR A 4 -2.429 9.922 6.146 1.00112.05 H new ATOM 0 HB2 TYR A 4 -0.841 11.791 6.638 1.00112.05 H new ATOM 0 HB3 TYR A 4 -1.359 11.758 8.312 1.00112.05 H new ATOM 0 HD1 TYR A 4 -0.259 9.241 5.733 1.00112.05 H new ATOM 0 HD2 TYR A 4 0.035 10.627 9.749 1.00112.05 H new ATOM 0 HE1 TYR A 4 1.382 7.477 6.217 1.00112.05 H new ATOM 0 HE2 TYR A 4 1.664 8.867 10.238 1.00112.05 H new ATOM 0 HH TYR A 4 3.412 7.332 8.166 1.00112.05 H new ATOM 66 N GLY A 5 -3.817 10.512 9.097 1.00 23.54 N ATOM 67 CA GLY A 5 -4.454 9.826 10.208 1.00 23.54 C ATOM 68 C GLY A 5 -5.531 8.881 9.718 1.00 23.54 C ATOM 69 O GLY A 5 -5.607 7.727 10.142 1.00 23.54 O ATOM 0 H GLY A 5 -3.869 11.530 9.127 1.00 23.54 H new ATOM 0 HA2 GLY A 5 -3.706 9.269 10.773 1.00 23.54 H new ATOM 0 HA3 GLY A 5 -4.889 10.557 10.890 1.00 23.54 H new ATOM 73 N THR A 6 -6.339 9.374 8.790 1.00 90.84 N ATOM 74 CA THR A 6 -7.395 8.592 8.187 1.00 90.84 C ATOM 75 C THR A 6 -6.801 7.521 7.288 1.00 90.84 C ATOM 76 O THR A 6 -7.311 6.411 7.223 1.00 90.84 O ATOM 77 CB THR A 6 -8.358 9.511 7.403 1.00 90.84 C ATOM 78 OG1 THR A 6 -9.102 10.332 8.310 1.00 90.84 O ATOM 79 CG2 THR A 6 -9.315 8.722 6.531 1.00 90.84 C ATOM 0 H THR A 6 -6.276 10.329 8.437 1.00 90.84 H new ATOM 0 HA THR A 6 -7.968 8.097 8.971 1.00 90.84 H new ATOM 0 HB THR A 6 -7.749 10.136 6.750 1.00 90.84 H new ATOM 0 HG1 THR A 6 -9.708 10.912 7.804 1.00 90.84 H new ATOM 0 HG21 THR A 6 -9.973 9.409 5.999 1.00 90.84 H new ATOM 0 HG22 THR A 6 -8.748 8.131 5.811 1.00 90.84 H new ATOM 0 HG23 THR A 6 -9.913 8.058 7.155 1.00 90.84 H new ATOM 87 N LEU A 7 -5.706 7.846 6.612 1.00 63.89 N ATOM 88 CA LEU A 7 -5.037 6.882 5.742 1.00 63.89 C ATOM 89 C LEU A 7 -4.727 5.609 6.516 1.00 63.89 C ATOM 90 O LEU A 7 -5.182 4.520 6.167 1.00 63.89 O ATOM 91 CB LEU A 7 -3.744 7.483 5.187 1.00 63.89 C ATOM 92 CG LEU A 7 -2.795 6.486 4.515 1.00 63.89 C ATOM 93 CD1 LEU A 7 -3.420 5.929 3.251 1.00 63.89 C ATOM 94 CD2 LEU A 7 -1.442 7.126 4.237 1.00 63.89 C ATOM 0 H LEU A 7 -5.263 8.764 6.648 1.00 63.89 H new ATOM 0 HA LEU A 7 -5.699 6.640 4.911 1.00 63.89 H new ATOM 0 HB2 LEU A 7 -4.003 8.257 4.464 1.00 63.89 H new ATOM 0 HB3 LEU A 7 -3.212 7.974 6.002 1.00 63.89 H new ATOM 0 HG LEU A 7 -2.626 5.654 5.198 1.00 63.89 H new ATOM 0 HD11 LEU A 7 -2.733 5.222 2.786 1.00 63.89 H new ATOM 0 HD12 LEU A 7 -4.351 5.420 3.499 1.00 63.89 H new ATOM 0 HD13 LEU A 7 -3.626 6.744 2.557 1.00 63.89 H new ATOM 0 HD21 LEU A 7 -0.786 6.398 3.760 1.00 63.89 H new ATOM 0 HD22 LEU A 7 -1.574 7.983 3.577 1.00 63.89 H new ATOM 0 HD23 LEU A 7 -0.996 7.456 5.175 1.00 63.89 H new ATOM 106 N LEU A 8 -3.966 5.772 7.587 1.00 67.93 N ATOM 107 CA LEU A 8 -3.606 4.660 8.441 1.00 67.93 C ATOM 108 C LEU A 8 -4.860 4.009 9.008 1.00 67.93 C ATOM 109 O LEU A 8 -4.951 2.791 9.094 1.00 67.93 O ATOM 110 CB LEU A 8 -2.701 5.144 9.573 1.00 67.93 C ATOM 111 CG LEU A 8 -1.191 5.144 9.279 1.00 67.93 C ATOM 112 CD1 LEU A 8 -0.885 5.593 7.856 1.00 67.93 C ATOM 113 CD2 LEU A 8 -0.456 6.020 10.283 1.00 67.93 C ATOM 0 H LEU A 8 -3.586 6.671 7.883 1.00 67.93 H new ATOM 0 HA LEU A 8 -3.065 3.920 7.852 1.00 67.93 H new ATOM 0 HB2 LEU A 8 -2.998 6.158 9.840 1.00 67.93 H new ATOM 0 HB3 LEU A 8 -2.880 4.518 10.447 1.00 67.93 H new ATOM 0 HG LEU A 8 -0.840 4.117 9.377 1.00 67.93 H new ATOM 0 HD11 LEU A 8 0.193 5.577 7.693 1.00 67.93 H new ATOM 0 HD12 LEU A 8 -1.368 4.918 7.150 1.00 67.93 H new ATOM 0 HD13 LEU A 8 -1.260 6.605 7.705 1.00 67.93 H new ATOM 0 HD21 LEU A 8 0.611 6.010 10.062 1.00 67.93 H new ATOM 0 HD22 LEU A 8 -0.830 7.042 10.217 1.00 67.93 H new ATOM 0 HD23 LEU A 8 -0.622 5.637 11.290 1.00 67.93 H new ATOM 125 N GLN A 9 -5.838 4.838 9.359 1.00 42.21 N ATOM 126 CA GLN A 9 -7.101 4.359 9.892 1.00 42.21 C ATOM 127 C GLN A 9 -7.815 3.519 8.831 1.00 42.21 C ATOM 128 O GLN A 9 -8.429 2.499 9.141 1.00 42.21 O ATOM 129 CB GLN A 9 -7.914 5.593 10.326 1.00 42.21 C ATOM 130 CG GLN A 9 -9.420 5.421 10.381 1.00 42.21 C ATOM 131 CD GLN A 9 -10.002 5.721 11.751 1.00 42.21 C ATOM 132 OE1 GLN A 9 -10.399 6.852 12.037 1.00 42.21 O ATOM 133 NE2 GLN A 9 -10.052 4.707 12.607 1.00 42.21 N ATOM 0 H GLN A 9 -5.775 5.853 9.281 1.00 42.21 H new ATOM 0 HA GLN A 9 -6.962 3.712 10.758 1.00 42.21 H new ATOM 0 HB2 GLN A 9 -7.569 5.900 11.313 1.00 42.21 H new ATOM 0 HB3 GLN A 9 -7.688 6.410 9.641 1.00 42.21 H new ATOM 0 HG2 GLN A 9 -9.882 6.078 9.644 1.00 42.21 H new ATOM 0 HG3 GLN A 9 -9.674 4.399 10.100 1.00 42.21 H new ATOM 0 HE21 GLN A 9 -9.712 3.787 12.328 1.00 42.21 H new ATOM 0 HE22 GLN A 9 -10.430 4.848 13.544 1.00 42.21 H new ATOM 142 N ASP A 10 -7.724 3.954 7.581 1.00 76.39 N ATOM 143 CA ASP A 10 -8.354 3.241 6.481 1.00 76.39 C ATOM 144 C ASP A 10 -7.781 1.839 6.341 1.00 76.39 C ATOM 145 O ASP A 10 -8.532 0.866 6.331 1.00 76.39 O ATOM 146 CB ASP A 10 -8.192 4.013 5.171 1.00 76.39 C ATOM 147 CG ASP A 10 -8.878 5.366 5.206 1.00 76.39 C ATOM 148 OD1 ASP A 10 -9.737 5.575 6.089 1.00 76.39 O ATOM 149 OD2 ASP A 10 -8.556 6.217 4.351 1.00 76.39 O ATOM 0 H ASP A 10 -7.220 4.797 7.305 1.00 76.39 H new ATOM 0 HA ASP A 10 -9.417 3.156 6.704 1.00 76.39 H new ATOM 0 HB2 ASP A 10 -7.131 4.152 4.964 1.00 76.39 H new ATOM 0 HB3 ASP A 10 -8.602 3.422 4.352 1.00 76.39 H new ATOM 154 N LEU A 11 -6.449 1.711 6.276 1.00140.58 N ATOM 155 CA LEU A 11 -5.855 0.388 6.192 1.00140.58 C ATOM 156 C LEU A 11 -6.145 -0.350 7.482 1.00140.58 C ATOM 157 O LEU A 11 -6.372 -1.552 7.465 1.00140.58 O ATOM 158 CB LEU A 11 -4.365 0.446 5.859 1.00140.58 C ATOM 159 CG LEU A 11 -3.423 0.787 7.003 1.00140.58 C ATOM 160 CD1 LEU A 11 -3.026 -0.479 7.755 1.00140.58 C ATOM 161 CD2 LEU A 11 -2.197 1.512 6.453 1.00140.58 C ATOM 0 H LEU A 11 -5.787 2.487 6.280 1.00140.58 H new ATOM 0 HA LEU A 11 -6.303 -0.163 5.365 1.00140.58 H new ATOM 0 HB2 LEU A 11 -4.069 -0.521 5.451 1.00140.58 H new ATOM 0 HB3 LEU A 11 -4.221 1.183 5.069 1.00140.58 H new ATOM 0 HG LEU A 11 -3.928 1.447 7.708 1.00140.58 H new ATOM 0 HD11 LEU A 11 -2.352 -0.221 8.571 1.00140.58 H new ATOM 0 HD12 LEU A 11 -3.918 -0.957 8.159 1.00140.58 H new ATOM 0 HD13 LEU A 11 -2.524 -1.165 7.073 1.00140.58 H new ATOM 0 HD21 LEU A 11 -1.521 1.757 7.272 1.00140.58 H new ATOM 0 HD22 LEU A 11 -1.683 0.868 5.739 1.00140.58 H new ATOM 0 HD23 LEU A 11 -2.510 2.429 5.954 1.00140.58 H new ATOM 173 N THR A 12 -6.216 0.396 8.595 1.00103.83 N ATOM 174 CA THR A 12 -6.569 -0.190 9.871 1.00103.83 C ATOM 175 C THR A 12 -7.971 -0.783 9.759 1.00103.83 C ATOM 176 O THR A 12 -8.252 -1.862 10.272 1.00103.83 O ATOM 177 CB THR A 12 -6.553 0.832 11.015 1.00103.83 C ATOM 178 OG1 THR A 12 -5.293 1.501 11.083 1.00103.83 O ATOM 179 CG2 THR A 12 -6.805 0.133 12.322 1.00103.83 C ATOM 0 H THR A 12 -6.033 1.399 8.625 1.00103.83 H new ATOM 0 HA THR A 12 -5.826 -0.953 10.105 1.00103.83 H new ATOM 0 HB THR A 12 -7.335 1.568 10.825 1.00103.83 H new ATOM 0 HG1 THR A 12 -5.219 2.135 10.340 1.00103.83 H new ATOM 0 HG21 THR A 12 -6.793 0.862 13.133 1.00103.83 H new ATOM 0 HG22 THR A 12 -7.777 -0.358 12.290 1.00103.83 H new ATOM 0 HG23 THR A 12 -6.028 -0.612 12.492 1.00103.83 H new ATOM 187 N ASN A 13 -8.839 -0.077 9.038 1.00 36.97 N ATOM 188 CA ASN A 13 -10.195 -0.554 8.807 1.00 36.97 C ATOM 189 C ASN A 13 -10.140 -1.844 7.989 1.00 36.97 C ATOM 190 O ASN A 13 -10.982 -2.728 8.144 1.00 36.97 O ATOM 191 CB ASN A 13 -11.044 0.508 8.097 1.00 36.97 C ATOM 192 CG ASN A 13 -11.208 1.765 8.930 1.00 36.97 C ATOM 193 OD1 ASN A 13 -10.929 1.770 10.129 1.00 36.97 O ATOM 194 ND2 ASN A 13 -11.668 2.841 8.299 1.00 36.97 N ATOM 0 H ASN A 13 -8.627 0.823 8.607 1.00 36.97 H new ATOM 0 HA ASN A 13 -10.669 -0.755 9.768 1.00 36.97 H new ATOM 0 HB2 ASN A 13 -10.580 0.764 7.145 1.00 36.97 H new ATOM 0 HB3 ASN A 13 -12.027 0.093 7.872 1.00 36.97 H new ATOM 0 HD21 ASN A 13 -11.802 3.714 8.810 1.00 36.97 H new ATOM 0 HD22 ASN A 13 -11.887 2.794 7.304 1.00 36.97 H new ATOM 201 N ASN A 14 -9.110 -1.958 7.142 1.00 84.59 N ATOM 202 CA ASN A 14 -8.908 -3.153 6.329 1.00 84.59 C ATOM 203 C ASN A 14 -7.939 -4.123 7.017 1.00 84.59 C ATOM 204 O ASN A 14 -7.634 -5.192 6.487 1.00 84.59 O ATOM 205 CB ASN A 14 -8.356 -2.765 4.957 1.00 84.59 C ATOM 206 CG ASN A 14 -9.324 -1.914 4.160 1.00 84.59 C ATOM 207 OD1 ASN A 14 -10.434 -2.345 3.844 1.00 84.59 O ATOM 208 ND2 ASN A 14 -8.909 -0.696 3.840 1.00 84.59 N ATOM 0 H ASN A 14 -8.405 -1.234 7.005 1.00 84.59 H new ATOM 0 HA ASN A 14 -9.871 -3.649 6.207 1.00 84.59 H new ATOM 0 HB2 ASN A 14 -7.421 -2.221 5.086 1.00 84.59 H new ATOM 0 HB3 ASN A 14 -8.124 -3.669 4.394 1.00 84.59 H new ATOM 0 HD21 ASN A 14 -9.518 -0.073 3.310 1.00 84.59 H new ATOM 0 HD22 ASN A 14 -7.981 -0.383 4.124 1.00 84.59 H new ATOM 215 N ILE A 15 -7.441 -3.732 8.190 1.00120.44 N ATOM 216 CA ILE A 15 -6.498 -4.528 8.938 1.00120.44 C ATOM 217 C ILE A 15 -7.196 -5.465 9.925 1.00120.44 C ATOM 218 O ILE A 15 -7.898 -5.018 10.832 1.00120.44 O ATOM 219 CB ILE A 15 -5.484 -3.576 9.654 1.00120.44 C ATOM 220 CG1 ILE A 15 -4.085 -4.109 9.520 1.00120.44 C ATOM 221 CG2 ILE A 15 -5.787 -3.309 11.126 1.00120.44 C ATOM 222 CD1 ILE A 15 -3.893 -5.448 10.189 1.00120.44 C ATOM 0 H ILE A 15 -7.688 -2.850 8.640 1.00120.44 H new ATOM 0 HA ILE A 15 -5.954 -5.174 8.249 1.00120.44 H new ATOM 0 HB ILE A 15 -5.586 -2.617 9.146 1.00120.44 H new ATOM 0 HG12 ILE A 15 -3.837 -4.200 8.462 1.00120.44 H new ATOM 0 HG13 ILE A 15 -3.387 -3.391 9.951 1.00120.44 H new ATOM 0 HG21 ILE A 15 -5.031 -2.640 11.537 1.00120.44 H new ATOM 0 HG22 ILE A 15 -6.770 -2.847 11.217 1.00120.44 H new ATOM 0 HG23 ILE A 15 -5.776 -4.250 11.676 1.00120.44 H new ATOM 0 HD11 ILE A 15 -2.862 -5.777 10.056 1.00120.44 H new ATOM 0 HD12 ILE A 15 -4.110 -5.357 11.253 1.00120.44 H new ATOM 0 HD13 ILE A 15 -4.568 -6.178 9.742 1.00120.44 H new ATOM 234 N THR A 16 -6.975 -6.764 9.769 1.00158.94 N ATOM 235 CA THR A 16 -7.555 -7.720 10.688 1.00158.94 C ATOM 236 C THR A 16 -6.609 -7.919 11.835 1.00158.94 C ATOM 237 O THR A 16 -5.403 -7.711 11.693 1.00158.94 O ATOM 238 CB THR A 16 -7.818 -9.092 10.058 1.00158.94 C ATOM 239 OG1 THR A 16 -6.590 -9.714 9.681 1.00158.94 O ATOM 240 CG2 THR A 16 -8.721 -8.975 8.860 1.00158.94 C ATOM 0 H THR A 16 -6.407 -7.170 9.026 1.00158.94 H new ATOM 0 HA THR A 16 -8.515 -7.310 11.002 1.00158.94 H new ATOM 0 HB THR A 16 -8.315 -9.710 10.805 1.00158.94 H new ATOM 0 HG1 THR A 16 -6.778 -10.568 9.238 1.00158.94 H new ATOM 0 HG21 THR A 16 -8.890 -9.964 8.434 1.00158.94 H new ATOM 0 HG22 THR A 16 -9.675 -8.543 9.164 1.00158.94 H new ATOM 0 HG23 THR A 16 -8.254 -8.333 8.113 1.00158.94 H new ATOM 248 N LEU A 17 -7.135 -8.348 12.963 1.00 50.69 N ATOM 249 CA LEU A 17 -6.281 -8.598 14.112 1.00 50.69 C ATOM 250 C LEU A 17 -5.271 -9.686 13.758 1.00 50.69 C ATOM 251 O LEU A 17 -4.118 -9.657 14.192 1.00 50.69 O ATOM 252 CB LEU A 17 -7.092 -9.006 15.347 1.00 50.69 C ATOM 253 CG LEU A 17 -6.508 -8.564 16.704 1.00 50.69 C ATOM 254 CD1 LEU A 17 -7.021 -9.459 17.819 1.00 50.69 C ATOM 255 CD2 LEU A 17 -4.978 -8.566 16.694 1.00 50.69 C ATOM 0 H LEU A 17 -8.128 -8.529 13.111 1.00 50.69 H new ATOM 0 HA LEU A 17 -5.760 -7.673 14.360 1.00 50.69 H new ATOM 0 HB2 LEU A 17 -8.096 -8.593 15.252 1.00 50.69 H new ATOM 0 HB3 LEU A 17 -7.192 -10.091 15.351 1.00 50.69 H new ATOM 0 HG LEU A 17 -6.839 -7.541 16.882 1.00 50.69 H new ATOM 0 HD11 LEU A 17 -6.599 -9.134 18.770 1.00 50.69 H new ATOM 0 HD12 LEU A 17 -8.108 -9.397 17.864 1.00 50.69 H new ATOM 0 HD13 LEU A 17 -6.724 -10.489 17.624 1.00 50.69 H new ATOM 0 HD21 LEU A 17 -4.607 -8.249 17.669 1.00 50.69 H new ATOM 0 HD22 LEU A 17 -4.617 -9.572 16.478 1.00 50.69 H new ATOM 0 HD23 LEU A 17 -4.618 -7.879 15.928 1.00 50.69 H new ATOM 267 N GLU A 18 -5.724 -10.637 12.940 1.00107.93 N ATOM 268 CA GLU A 18 -4.883 -11.733 12.491 1.00107.93 C ATOM 269 C GLU A 18 -3.830 -11.226 11.511 1.00107.93 C ATOM 270 O GLU A 18 -2.645 -11.555 11.621 1.00107.93 O ATOM 271 CB GLU A 18 -5.752 -12.804 11.836 1.00107.93 C ATOM 272 CG GLU A 18 -6.844 -13.322 12.758 1.00107.93 C ATOM 273 CD GLU A 18 -7.606 -14.494 12.174 1.00107.93 C ATOM 274 OE1 GLU A 18 -7.516 -14.711 10.947 1.00107.93 O ATOM 275 OE2 GLU A 18 -8.299 -15.193 12.944 1.00107.93 O ATOM 0 H GLU A 18 -6.676 -10.665 12.576 1.00107.93 H new ATOM 0 HA GLU A 18 -4.368 -12.166 13.348 1.00107.93 H new ATOM 0 HB2 GLU A 18 -6.208 -12.394 10.935 1.00107.93 H new ATOM 0 HB3 GLU A 18 -5.121 -13.636 11.524 1.00107.93 H new ATOM 0 HG2 GLU A 18 -6.399 -13.622 13.707 1.00107.93 H new ATOM 0 HG3 GLU A 18 -7.542 -12.514 12.975 1.00107.93 H new ATOM 282 N ASP A 19 -4.269 -10.400 10.563 1.00 35.40 N ATOM 283 CA ASP A 19 -3.368 -9.823 9.576 1.00 35.40 C ATOM 284 C ASP A 19 -2.288 -9.005 10.264 1.00 35.40 C ATOM 285 O ASP A 19 -1.133 -9.001 9.839 1.00 35.40 O ATOM 286 CB ASP A 19 -4.141 -8.959 8.573 1.00 35.40 C ATOM 287 CG ASP A 19 -4.912 -9.789 7.561 1.00 35.40 C ATOM 288 OD1 ASP A 19 -4.660 -11.009 7.477 1.00 35.40 O ATOM 289 OD2 ASP A 19 -5.774 -9.218 6.859 1.00 35.40 O ATOM 0 H ASP A 19 -5.244 -10.117 10.460 1.00 35.40 H new ATOM 0 HA ASP A 19 -2.893 -10.636 9.027 1.00 35.40 H new ATOM 0 HB2 ASP A 19 -4.835 -8.314 9.113 1.00 35.40 H new ATOM 0 HB3 ASP A 19 -3.444 -8.307 8.047 1.00 35.40 H new ATOM 294 N LEU A 20 -2.668 -8.320 11.343 1.00 45.47 N ATOM 295 CA LEU A 20 -1.720 -7.510 12.097 1.00 45.47 C ATOM 296 C LEU A 20 -0.549 -8.350 12.566 1.00 45.47 C ATOM 297 O LEU A 20 0.598 -7.955 12.419 1.00 45.47 O ATOM 298 CB LEU A 20 -2.392 -6.847 13.305 1.00 45.47 C ATOM 299 CG LEU A 20 -2.471 -5.324 13.254 1.00 45.47 C ATOM 300 CD1 LEU A 20 -2.997 -4.780 14.578 1.00 45.47 C ATOM 301 CD2 LEU A 20 -1.111 -4.702 12.914 1.00 45.47 C ATOM 0 H LEU A 20 -3.620 -8.312 11.710 1.00 45.47 H new ATOM 0 HA LEU A 20 -1.356 -6.729 11.429 1.00 45.47 H new ATOM 0 HB2 LEU A 20 -3.403 -7.244 13.400 1.00 45.47 H new ATOM 0 HB3 LEU A 20 -1.850 -7.136 14.205 1.00 45.47 H new ATOM 0 HG LEU A 20 -3.165 -5.048 12.460 1.00 45.47 H new ATOM 0 HD11 LEU A 20 -3.049 -3.692 14.530 1.00 45.47 H new ATOM 0 HD12 LEU A 20 -3.992 -5.183 14.767 1.00 45.47 H new ATOM 0 HD13 LEU A 20 -2.326 -5.076 15.385 1.00 45.47 H new ATOM 0 HD21 LEU A 20 -1.204 -3.616 12.886 1.00 45.47 H new ATOM 0 HD22 LEU A 20 -0.382 -4.984 13.673 1.00 45.47 H new ATOM 0 HD23 LEU A 20 -0.779 -5.063 11.940 1.00 45.47 H new ATOM 313 N GLU A 21 -0.847 -9.522 13.117 1.00 91.26 N ATOM 314 CA GLU A 21 0.199 -10.414 13.592 1.00 91.26 C ATOM 315 C GLU A 21 1.146 -10.768 12.458 1.00 91.26 C ATOM 316 O GLU A 21 2.326 -11.039 12.683 1.00 91.26 O ATOM 317 CB GLU A 21 -0.381 -11.690 14.188 1.00 91.26 C ATOM 318 CG GLU A 21 -1.255 -11.466 15.413 1.00 91.26 C ATOM 319 CD GLU A 21 -1.753 -12.769 16.016 1.00 91.26 C ATOM 320 OE1 GLU A 21 -1.609 -13.823 15.362 1.00 91.26 O ATOM 321 OE2 GLU A 21 -2.284 -12.733 17.145 1.00 91.26 O ATOM 0 H GLU A 21 -1.796 -9.872 13.244 1.00 91.26 H new ATOM 0 HA GLU A 21 0.746 -9.889 14.375 1.00 91.26 H new ATOM 0 HB2 GLU A 21 -0.969 -12.199 13.425 1.00 91.26 H new ATOM 0 HB3 GLU A 21 0.438 -12.357 14.457 1.00 91.26 H new ATOM 0 HG2 GLU A 21 -0.689 -10.914 16.164 1.00 91.26 H new ATOM 0 HG3 GLU A 21 -2.109 -10.846 15.138 1.00 91.26 H new ATOM 328 N GLN A 22 0.635 -10.733 11.230 1.00 87.96 N ATOM 329 CA GLN A 22 1.469 -11.019 10.077 1.00 87.96 C ATOM 330 C GLN A 22 2.404 -9.850 9.886 1.00 87.96 C ATOM 331 O GLN A 22 3.610 -10.015 9.698 1.00 87.96 O ATOM 332 CB GLN A 22 0.639 -11.251 8.819 1.00 87.96 C ATOM 333 CG GLN A 22 1.477 -11.699 7.635 1.00 87.96 C ATOM 334 CD GLN A 22 0.646 -11.997 6.404 1.00 87.96 C ATOM 335 OE1 GLN A 22 -0.557 -11.735 6.372 1.00 87.96 O ATOM 336 NE2 GLN A 22 1.284 -12.558 5.385 1.00 87.96 N ATOM 0 H GLN A 22 -0.337 -10.513 11.014 1.00 87.96 H new ATOM 0 HA GLN A 22 2.029 -11.938 10.253 1.00 87.96 H new ATOM 0 HB2 GLN A 22 -0.122 -12.004 9.025 1.00 87.96 H new ATOM 0 HB3 GLN A 22 0.115 -10.331 8.560 1.00 87.96 H new ATOM 0 HG2 GLN A 22 2.205 -10.923 7.397 1.00 87.96 H new ATOM 0 HG3 GLN A 22 2.040 -12.590 7.911 1.00 87.96 H new ATOM 0 HE21 GLN A 22 2.282 -12.757 5.456 1.00 87.96 H new ATOM 0 HE22 GLN A 22 0.777 -12.790 4.531 1.00 87.96 H new ATOM 345 N LEU A 23 1.836 -8.650 10.001 1.00 99.30 N ATOM 346 CA LEU A 23 2.605 -7.431 9.914 1.00 99.30 C ATOM 347 C LEU A 23 3.623 -7.438 11.047 1.00 99.30 C ATOM 348 O LEU A 23 4.814 -7.256 10.834 1.00 99.30 O ATOM 349 CB LEU A 23 1.671 -6.220 10.062 1.00 99.30 C ATOM 350 CG LEU A 23 0.494 -6.176 9.086 1.00 99.30 C ATOM 351 CD1 LEU A 23 -0.299 -4.884 9.254 1.00 99.30 C ATOM 352 CD2 LEU A 23 0.980 -6.335 7.650 1.00 99.30 C ATOM 0 H LEU A 23 0.838 -8.507 10.156 1.00 99.30 H new ATOM 0 HA LEU A 23 3.110 -7.366 8.950 1.00 99.30 H new ATOM 0 HB2 LEU A 23 1.279 -6.207 11.079 1.00 99.30 H new ATOM 0 HB3 LEU A 23 2.260 -5.311 9.936 1.00 99.30 H new ATOM 0 HG LEU A 23 -0.170 -7.010 9.312 1.00 99.30 H new ATOM 0 HD11 LEU A 23 -1.131 -4.874 8.550 1.00 99.30 H new ATOM 0 HD12 LEU A 23 -0.684 -4.823 10.272 1.00 99.30 H new ATOM 0 HD13 LEU A 23 0.351 -4.031 9.060 1.00 99.30 H new ATOM 0 HD21 LEU A 23 0.128 -6.301 6.972 1.00 99.30 H new ATOM 0 HD22 LEU A 23 1.669 -5.526 7.408 1.00 99.30 H new ATOM 0 HD23 LEU A 23 1.491 -7.292 7.543 1.00 99.30 H new ATOM 364 N LYS A 24 3.116 -7.709 12.249 1.00114.71 N ATOM 365 CA LYS A 24 3.938 -7.789 13.456 1.00114.71 C ATOM 366 C LYS A 24 5.033 -8.834 13.295 1.00114.71 C ATOM 367 O LYS A 24 6.165 -8.637 13.738 1.00114.71 O ATOM 368 CB LYS A 24 3.070 -8.138 14.673 1.00114.71 C ATOM 369 CG LYS A 24 2.052 -7.064 15.024 1.00114.71 C ATOM 370 CD LYS A 24 1.548 -7.207 16.451 1.00114.71 C ATOM 371 CE LYS A 24 0.818 -8.521 16.671 1.00114.71 C ATOM 372 NZ LYS A 24 1.756 -9.665 16.850 1.00114.71 N ATOM 0 H LYS A 24 2.124 -7.879 12.414 1.00114.71 H new ATOM 0 HA LYS A 24 4.401 -6.815 13.613 1.00114.71 H new ATOM 0 HB2 LYS A 24 2.546 -9.074 14.478 1.00114.71 H new ATOM 0 HB3 LYS A 24 3.717 -8.308 15.533 1.00114.71 H new ATOM 0 HG2 LYS A 24 2.503 -6.080 14.895 1.00114.71 H new ATOM 0 HG3 LYS A 24 1.210 -7.122 14.334 1.00114.71 H new ATOM 0 HD2 LYS A 24 2.390 -7.141 17.140 1.00114.71 H new ATOM 0 HD3 LYS A 24 0.879 -6.378 16.684 1.00114.71 H new ATOM 0 HE2 LYS A 24 0.179 -8.437 17.550 1.00114.71 H new ATOM 0 HE3 LYS A 24 0.165 -8.719 15.821 1.00114.71 H new ATOM 0 HZ1 LYS A 24 1.371 -10.322 17.558 1.00114.71 H new ATOM 0 HZ2 LYS A 24 1.874 -10.162 15.944 1.00114.71 H new ATOM 0 HZ3 LYS A 24 2.679 -9.310 17.173 1.00114.71 H new ATOM 386 N SER A 25 4.693 -9.938 12.638 1.00 75.52 N ATOM 387 CA SER A 25 5.652 -11.010 12.392 1.00 75.52 C ATOM 388 C SER A 25 6.789 -10.471 11.542 1.00 75.52 C ATOM 389 O SER A 25 7.963 -10.754 11.778 1.00 75.52 O ATOM 390 CB SER A 25 4.968 -12.187 11.683 1.00 75.52 C ATOM 391 OG SER A 25 4.097 -12.878 12.562 1.00 75.52 O ATOM 0 H SER A 25 3.760 -10.114 12.266 1.00 75.52 H new ATOM 0 HA SER A 25 6.046 -11.370 13.342 1.00 75.52 H new ATOM 0 HB2 SER A 25 4.406 -11.821 10.824 1.00 75.52 H new ATOM 0 HB3 SER A 25 5.723 -12.874 11.301 1.00 75.52 H new ATOM 0 HG SER A 25 3.202 -12.481 12.515 1.00 75.52 H new ATOM 397 N ALA A 26 6.412 -9.648 10.577 1.00 32.46 N ATOM 398 CA ALA A 26 7.356 -8.995 9.699 1.00 32.46 C ATOM 399 C ALA A 26 8.067 -7.884 10.457 1.00 32.46 C ATOM 400 O ALA A 26 9.242 -7.606 10.225 1.00 32.46 O ATOM 401 CB ALA A 26 6.637 -8.444 8.474 1.00 32.46 C ATOM 0 H ALA A 26 5.438 -9.416 10.384 1.00 32.46 H new ATOM 0 HA ALA A 26 8.098 -9.717 9.359 1.00 32.46 H new ATOM 0 HB1 ALA A 26 7.357 -7.954 7.819 1.00 32.46 H new ATOM 0 HB2 ALA A 26 6.155 -9.261 7.937 1.00 32.46 H new ATOM 0 HB3 ALA A 26 5.883 -7.722 8.789 1.00 32.46 H new ATOM 407 N CYS A 27 7.325 -7.245 11.364 1.00 54.89 N ATOM 408 CA CYS A 27 7.863 -6.156 12.160 1.00 54.89 C ATOM 409 C CYS A 27 8.659 -6.651 13.350 1.00 54.89 C ATOM 410 O CYS A 27 9.194 -5.842 14.089 1.00 54.89 O ATOM 411 CB CYS A 27 6.758 -5.248 12.680 1.00 54.89 C ATOM 412 SG CYS A 27 5.643 -4.617 11.417 1.00 54.89 S ATOM 0 H CYS A 27 6.349 -7.468 11.561 1.00 54.89 H new ATOM 0 HA CYS A 27 8.522 -5.602 11.492 1.00 54.89 H new ATOM 0 HB2 CYS A 27 6.174 -5.797 13.419 1.00 54.89 H new ATOM 0 HB3 CYS A 27 7.214 -4.404 13.197 1.00 54.89 H new ATOM 0 HG CYS A 27 4.883 -3.695 11.930 1.00 54.89 H new ATOM 418 N LYS A 28 8.748 -7.965 13.563 1.00157.95 N ATOM 419 CA LYS A 28 9.506 -8.461 14.720 1.00157.95 C ATOM 420 C LYS A 28 10.903 -7.846 14.737 1.00157.95 C ATOM 421 O LYS A 28 11.448 -7.524 15.793 1.00157.95 O ATOM 422 CB LYS A 28 9.617 -9.977 14.691 1.00157.95 C ATOM 423 CG LYS A 28 8.304 -10.680 14.978 1.00157.95 C ATOM 424 CD LYS A 28 8.508 -11.882 15.880 1.00157.95 C ATOM 425 CE LYS A 28 8.508 -13.182 15.092 1.00157.95 C ATOM 426 NZ LYS A 28 7.795 -14.273 15.814 1.00157.95 N ATOM 0 H LYS A 28 8.324 -8.684 12.977 1.00157.95 H new ATOM 0 HA LYS A 28 8.970 -8.170 15.623 1.00157.95 H new ATOM 0 HB2 LYS A 28 9.982 -10.289 13.712 1.00157.95 H new ATOM 0 HB3 LYS A 28 10.359 -10.294 15.424 1.00157.95 H new ATOM 0 HG2 LYS A 28 7.611 -9.983 15.449 1.00157.95 H new ATOM 0 HG3 LYS A 28 7.848 -10.999 14.041 1.00157.95 H new ATOM 0 HD2 LYS A 28 9.453 -11.780 16.414 1.00157.95 H new ATOM 0 HD3 LYS A 28 7.719 -11.912 16.631 1.00157.95 H new ATOM 0 HE2 LYS A 28 8.035 -13.019 14.124 1.00157.95 H new ATOM 0 HE3 LYS A 28 9.536 -13.488 14.897 1.00157.95 H new ATOM 0 HZ1 LYS A 28 7.819 -15.141 15.242 1.00157.95 H new ATOM 0 HZ2 LYS A 28 8.261 -14.447 16.727 1.00157.95 H new ATOM 0 HZ3 LYS A 28 6.807 -13.993 15.978 1.00157.95 H new ATOM 440 N GLU A 29 11.452 -7.672 13.547 1.00243.70 N ATOM 441 CA GLU A 29 12.766 -7.075 13.378 1.00243.70 C ATOM 442 C GLU A 29 12.737 -5.553 13.573 1.00243.70 C ATOM 443 O GLU A 29 13.713 -4.965 14.037 1.00243.70 O ATOM 444 CB GLU A 29 13.301 -7.401 11.983 1.00243.70 C ATOM 445 CG GLU A 29 13.391 -8.892 11.703 1.00243.70 C ATOM 446 CD GLU A 29 13.962 -9.202 10.332 1.00243.70 C ATOM 447 OE1 GLU A 29 14.110 -8.264 9.519 1.00243.70 O ATOM 448 OE2 GLU A 29 14.257 -10.386 10.068 1.00243.70 O ATOM 0 H GLU A 29 11.001 -7.940 12.672 1.00243.70 H new ATOM 0 HA GLU A 29 13.421 -7.495 14.142 1.00243.70 H new ATOM 0 HB2 GLU A 29 12.655 -6.937 11.237 1.00243.70 H new ATOM 0 HB3 GLU A 29 14.290 -6.957 11.869 1.00243.70 H new ATOM 0 HG2 GLU A 29 14.013 -9.363 12.465 1.00243.70 H new ATOM 0 HG3 GLU A 29 12.397 -9.333 11.785 1.00243.70 H new ATOM 455 N ASP A 30 11.633 -4.914 13.174 1.00108.85 N ATOM 456 CA ASP A 30 11.518 -3.455 13.267 1.00108.85 C ATOM 457 C ASP A 30 10.866 -2.969 14.563 1.00108.85 C ATOM 458 O ASP A 30 11.332 -2.010 15.176 1.00108.85 O ATOM 459 CB ASP A 30 10.730 -2.923 12.064 1.00108.85 C ATOM 460 CG ASP A 30 11.478 -3.103 10.756 1.00108.85 C ATOM 461 OD1 ASP A 30 12.696 -3.376 10.798 1.00108.85 O ATOM 462 OD2 ASP A 30 10.844 -2.970 9.687 1.00108.85 O ATOM 0 H ASP A 30 10.812 -5.379 12.786 1.00108.85 H new ATOM 0 HA ASP A 30 12.536 -3.065 13.268 1.00108.85 H new ATOM 0 HB2 ASP A 30 9.771 -3.438 12.005 1.00108.85 H new ATOM 0 HB3 ASP A 30 10.515 -1.865 12.213 1.00108.85 H new ATOM 467 N ILE A 31 9.771 -3.605 14.956 1.00355.97 N ATOM 468 CA ILE A 31 9.041 -3.208 16.148 1.00355.97 C ATOM 469 C ILE A 31 9.229 -4.198 17.307 1.00355.97 C ATOM 470 O ILE A 31 9.171 -5.411 17.106 1.00355.97 O ATOM 471 CB ILE A 31 7.546 -3.022 15.808 1.00355.97 C ATOM 472 CG1 ILE A 31 6.891 -2.095 16.826 1.00355.97 C ATOM 473 CG2 ILE A 31 6.798 -4.344 15.671 1.00355.97 C ATOM 474 CD1 ILE A 31 6.391 -2.761 18.082 1.00355.97 C ATOM 0 H ILE A 31 9.369 -4.402 14.463 1.00355.97 H new ATOM 0 HA ILE A 31 9.450 -2.257 16.489 1.00355.97 H new ATOM 0 HB ILE A 31 7.487 -2.555 14.825 1.00355.97 H new ATOM 0 HG12 ILE A 31 7.610 -1.325 17.105 1.00355.97 H new ATOM 0 HG13 ILE A 31 6.053 -1.590 16.345 1.00355.97 H new ATOM 0 HG21 ILE A 31 5.753 -4.148 15.432 1.00355.97 H new ATOM 0 HG22 ILE A 31 7.248 -4.936 14.874 1.00355.97 H new ATOM 0 HG23 ILE A 31 6.858 -4.895 16.610 1.00355.97 H new ATOM 0 HD11 ILE A 31 5.944 -2.013 18.737 1.00355.97 H new ATOM 0 HD12 ILE A 31 5.643 -3.511 17.823 1.00355.97 H new ATOM 0 HD13 ILE A 31 7.224 -3.241 18.595 1.00355.97 H new ATOM 486 N PRO A 32 9.474 -3.694 18.541 1.00153.08 N ATOM 487 CA PRO A 32 9.688 -4.550 19.710 1.00153.08 C ATOM 488 C PRO A 32 8.536 -5.516 19.993 1.00153.08 C ATOM 489 O PRO A 32 7.364 -5.167 19.854 1.00153.08 O ATOM 490 CB PRO A 32 9.840 -3.566 20.875 1.00153.08 C ATOM 491 CG PRO A 32 10.204 -2.265 20.254 1.00153.08 C ATOM 492 CD PRO A 32 9.586 -2.261 18.886 1.00153.08 C ATOM 0 HA PRO A 32 10.553 -5.194 19.551 1.00153.08 H new ATOM 0 HB2 PRO A 32 8.913 -3.484 21.442 1.00153.08 H new ATOM 0 HB3 PRO A 32 10.611 -3.898 21.570 1.00153.08 H new ATOM 0 HG2 PRO A 32 9.832 -1.432 20.851 1.00153.08 H new ATOM 0 HG3 PRO A 32 11.287 -2.154 20.192 1.00153.08 H new ATOM 0 HD2 PRO A 32 8.611 -1.774 18.890 1.00153.08 H new ATOM 0 HD3 PRO A 32 10.207 -1.725 18.169 1.00153.08 H new ATOM 500 N SER A 33 8.888 -6.731 20.411 1.00 84.70 N ATOM 501 CA SER A 33 7.900 -7.758 20.738 1.00 84.70 C ATOM 502 C SER A 33 7.046 -7.334 21.933 1.00 84.70 C ATOM 503 O SER A 33 5.863 -7.664 22.012 1.00 84.70 O ATOM 504 CB SER A 33 8.595 -9.087 21.037 1.00 84.70 C ATOM 505 OG SER A 33 7.656 -10.142 21.141 1.00 84.70 O ATOM 0 H SER A 33 9.856 -7.029 20.532 1.00 84.70 H new ATOM 0 HA SER A 33 7.246 -7.885 19.875 1.00 84.70 H new ATOM 0 HB2 SER A 33 9.312 -9.311 20.248 1.00 84.70 H new ATOM 0 HB3 SER A 33 9.159 -9.005 21.966 1.00 84.70 H new ATOM 0 HG SER A 33 8.126 -10.981 21.331 1.00 84.70 H new ATOM 511 N GLU A 34 7.657 -6.601 22.858 1.00109.83 N ATOM 512 CA GLU A 34 6.961 -6.130 24.051 1.00109.83 C ATOM 513 C GLU A 34 5.764 -5.264 23.676 1.00109.83 C ATOM 514 O GLU A 34 4.762 -5.220 24.391 1.00109.83 O ATOM 515 CB GLU A 34 7.912 -5.333 24.941 1.00109.83 C ATOM 516 CG GLU A 34 7.303 -4.956 26.278 1.00109.83 C ATOM 517 CD GLU A 34 7.101 -6.154 27.184 1.00109.83 C ATOM 518 OE1 GLU A 34 7.842 -7.149 27.031 1.00109.83 O ATOM 519 OE2 GLU A 34 6.201 -6.100 28.048 1.00109.83 O ATOM 0 H GLU A 34 8.636 -6.319 22.804 1.00109.83 H new ATOM 0 HA GLU A 34 6.603 -7.003 24.598 1.00109.83 H new ATOM 0 HB2 GLU A 34 8.815 -5.918 25.113 1.00109.83 H new ATOM 0 HB3 GLU A 34 8.215 -4.426 24.418 1.00109.83 H new ATOM 0 HG2 GLU A 34 7.949 -4.233 26.776 1.00109.83 H new ATOM 0 HG3 GLU A 34 6.344 -4.465 26.111 1.00109.83 H new ATOM 526 N LYS A 35 5.876 -4.585 22.546 1.00 73.01 N ATOM 527 CA LYS A 35 4.811 -3.723 22.058 1.00 73.01 C ATOM 528 C LYS A 35 3.904 -4.480 21.089 1.00 73.01 C ATOM 529 O LYS A 35 2.740 -4.134 20.910 1.00 73.01 O ATOM 530 CB LYS A 35 5.440 -2.536 21.351 1.00 73.01 C ATOM 531 CG LYS A 35 6.341 -1.716 22.251 1.00 73.01 C ATOM 532 CD LYS A 35 5.536 -0.873 23.220 1.00 73.01 C ATOM 533 CE LYS A 35 6.434 0.021 24.061 1.00 73.01 C ATOM 534 NZ LYS A 35 6.723 -0.575 25.395 1.00 73.01 N ATOM 0 H LYS A 35 6.700 -4.615 21.945 1.00 73.01 H new ATOM 0 HA LYS A 35 4.203 -3.387 22.898 1.00 73.01 H new ATOM 0 HB2 LYS A 35 6.017 -2.893 20.498 1.00 73.01 H new ATOM 0 HB3 LYS A 35 4.651 -1.896 20.957 1.00 73.01 H new ATOM 0 HG2 LYS A 35 7.003 -2.379 22.807 1.00 73.01 H new ATOM 0 HG3 LYS A 35 6.974 -1.070 21.643 1.00 73.01 H new ATOM 0 HD2 LYS A 35 4.826 -0.259 22.666 1.00 73.01 H new ATOM 0 HD3 LYS A 35 4.954 -1.523 23.873 1.00 73.01 H new ATOM 0 HE2 LYS A 35 7.371 0.195 23.531 1.00 73.01 H new ATOM 0 HE3 LYS A 35 5.957 0.992 24.193 1.00 73.01 H new ATOM 0 HZ1 LYS A 35 7.338 0.066 25.936 1.00 73.01 H new ATOM 0 HZ2 LYS A 35 5.832 -0.718 25.912 1.00 73.01 H new ATOM 0 HZ3 LYS A 35 7.201 -1.490 25.270 1.00 73.01 H new ATOM 548 N SER A 36 4.447 -5.531 20.483 1.00 80.12 N ATOM 549 CA SER A 36 3.701 -6.359 19.550 1.00 80.12 C ATOM 550 C SER A 36 2.477 -6.969 20.225 1.00 80.12 C ATOM 551 O SER A 36 1.434 -7.157 19.597 1.00 80.12 O ATOM 552 CB SER A 36 4.620 -7.452 19.012 1.00 80.12 C ATOM 553 OG SER A 36 3.937 -8.332 18.140 1.00 80.12 O ATOM 0 H SER A 36 5.412 -5.829 20.626 1.00 80.12 H new ATOM 0 HA SER A 36 3.348 -5.742 18.724 1.00 80.12 H new ATOM 0 HB2 SER A 36 5.457 -6.995 18.485 1.00 80.12 H new ATOM 0 HB3 SER A 36 5.038 -8.018 19.845 1.00 80.12 H new ATOM 0 HG SER A 36 4.222 -9.253 18.315 1.00 80.12 H new ATOM 559 N GLU A 37 2.618 -7.280 21.510 1.00 42.03 N ATOM 560 CA GLU A 37 1.533 -7.875 22.282 1.00 42.03 C ATOM 561 C GLU A 37 0.341 -6.929 22.399 1.00 42.03 C ATOM 562 O GLU A 37 -0.810 -7.361 22.335 1.00 42.03 O ATOM 563 CB GLU A 37 2.029 -8.247 23.678 1.00 42.03 C ATOM 564 CG GLU A 37 3.115 -9.311 23.678 1.00 42.03 C ATOM 565 CD GLU A 37 3.574 -9.677 25.078 1.00 42.03 C ATOM 566 OE1 GLU A 37 3.208 -8.957 26.033 1.00 42.03 O ATOM 567 OE2 GLU A 37 4.296 -10.685 25.221 1.00 42.03 O ATOM 0 H GLU A 37 3.476 -7.129 22.040 1.00 42.03 H new ATOM 0 HA GLU A 37 1.204 -8.771 21.755 1.00 42.03 H new ATOM 0 HB2 GLU A 37 2.410 -7.352 24.169 1.00 42.03 H new ATOM 0 HB3 GLU A 37 1.186 -8.601 24.271 1.00 42.03 H new ATOM 0 HG2 GLU A 37 2.743 -10.204 23.176 1.00 42.03 H new ATOM 0 HG3 GLU A 37 3.968 -8.954 23.102 1.00 42.03 H new ATOM 574 N GLU A 38 0.616 -5.640 22.574 1.00 75.99 N ATOM 575 CA GLU A 38 -0.452 -4.650 22.704 1.00 75.99 C ATOM 576 C GLU A 38 -0.932 -4.126 21.357 1.00 75.99 C ATOM 577 O GLU A 38 -1.868 -3.328 21.296 1.00 75.99 O ATOM 578 CB GLU A 38 -0.017 -3.486 23.590 1.00 75.99 C ATOM 579 CG GLU A 38 1.130 -2.673 23.010 1.00 75.99 C ATOM 580 CD GLU A 38 1.588 -1.552 23.924 1.00 75.99 C ATOM 581 OE1 GLU A 38 0.973 -1.363 24.995 1.00 75.99 O ATOM 582 OE2 GLU A 38 2.567 -0.862 23.568 1.00 75.99 O ATOM 0 H GLU A 38 1.560 -5.257 22.629 1.00 75.99 H new ATOM 0 HA GLU A 38 -1.290 -5.164 23.174 1.00 75.99 H new ATOM 0 HB2 GLU A 38 -0.870 -2.828 23.755 1.00 75.99 H new ATOM 0 HB3 GLU A 38 0.280 -3.874 24.564 1.00 75.99 H new ATOM 0 HG2 GLU A 38 1.971 -3.336 22.808 1.00 75.99 H new ATOM 0 HG3 GLU A 38 0.821 -2.251 22.054 1.00 75.99 H new ATOM 589 N ILE A 39 -0.315 -4.584 20.282 1.00131.16 N ATOM 590 CA ILE A 39 -0.717 -4.164 18.955 1.00131.16 C ATOM 591 C ILE A 39 -1.839 -5.060 18.454 1.00131.16 C ATOM 592 O ILE A 39 -1.655 -5.901 17.576 1.00131.16 O ATOM 593 CB ILE A 39 0.487 -4.145 17.982 1.00131.16 C ATOM 594 CG1 ILE A 39 1.422 -3.009 18.384 1.00131.16 C ATOM 595 CG2 ILE A 39 0.045 -3.969 16.529 1.00131.16 C ATOM 596 CD1 ILE A 39 2.800 -3.113 17.784 1.00131.16 C ATOM 0 H ILE A 39 0.463 -5.244 20.303 1.00131.16 H new ATOM 0 HA ILE A 39 -1.091 -3.142 19.005 1.00131.16 H new ATOM 0 HB ILE A 39 1.001 -5.104 18.048 1.00131.16 H new ATOM 0 HG12 ILE A 39 0.976 -2.061 18.084 1.00131.16 H new ATOM 0 HG13 ILE A 39 1.510 -2.990 19.470 1.00131.16 H new ATOM 0 HG21 ILE A 39 0.921 -3.961 15.881 1.00131.16 H new ATOM 0 HG22 ILE A 39 -0.609 -4.793 16.245 1.00131.16 H new ATOM 0 HG23 ILE A 39 -0.493 -3.027 16.424 1.00131.16 H new ATOM 0 HD11 ILE A 39 3.406 -2.270 18.116 1.00131.16 H new ATOM 0 HD12 ILE A 39 3.267 -4.044 18.105 1.00131.16 H new ATOM 0 HD13 ILE A 39 2.725 -3.100 16.697 1.00131.16 H new ATOM 608 N THR A 40 -3.012 -4.845 19.028 1.00160.31 N ATOM 609 CA THR A 40 -4.208 -5.598 18.662 1.00160.31 C ATOM 610 C THR A 40 -5.024 -4.863 17.589 1.00160.31 C ATOM 611 O THR A 40 -6.073 -5.339 17.158 1.00160.31 O ATOM 612 CB THR A 40 -5.096 -5.906 19.900 1.00160.31 C ATOM 613 OG1 THR A 40 -6.447 -6.166 19.494 1.00160.31 O ATOM 614 CG2 THR A 40 -5.076 -4.759 20.908 1.00160.31 C ATOM 0 H THR A 40 -3.165 -4.148 19.757 1.00160.31 H new ATOM 0 HA THR A 40 -3.870 -6.547 18.247 1.00160.31 H new ATOM 0 HB THR A 40 -4.684 -6.792 20.384 1.00160.31 H new ATOM 0 HG1 THR A 40 -6.477 -6.297 18.523 1.00160.31 H new ATOM 0 HG21 THR A 40 -5.708 -5.012 21.759 1.00160.31 H new ATOM 0 HG22 THR A 40 -4.055 -4.594 21.251 1.00160.31 H new ATOM 0 HG23 THR A 40 -5.451 -3.852 20.434 1.00160.31 H new ATOM 622 N THR A 41 -4.518 -3.710 17.163 1.00182.91 N ATOM 623 CA THR A 41 -5.149 -2.892 16.144 1.00182.91 C ATOM 624 C THR A 41 -4.106 -2.147 15.359 1.00182.91 C ATOM 625 O THR A 41 -3.089 -1.721 15.905 1.00182.91 O ATOM 626 CB THR A 41 -6.161 -1.864 16.725 1.00182.91 C ATOM 627 OG1 THR A 41 -6.238 -0.694 15.895 1.00182.91 O ATOM 628 CG2 THR A 41 -5.835 -1.430 18.156 1.00182.91 C ATOM 0 H THR A 41 -3.648 -3.317 17.522 1.00182.91 H new ATOM 0 HA THR A 41 -5.702 -3.578 15.503 1.00182.91 H new ATOM 0 HB THR A 41 -7.120 -2.381 16.744 1.00182.91 H new ATOM 0 HG1 THR A 41 -7.171 -0.400 15.830 1.00182.91 H new ATOM 0 HG21 THR A 41 -6.581 -0.713 18.498 1.00182.91 H new ATOM 0 HG22 THR A 41 -5.842 -2.301 18.811 1.00182.91 H new ATOM 0 HG23 THR A 41 -4.849 -0.966 18.180 1.00182.91 H new ATOM 636 N GLY A 42 -4.393 -1.927 14.083 1.00 66.60 N ATOM 637 CA GLY A 42 -3.483 -1.150 13.272 1.00 66.60 C ATOM 638 C GLY A 42 -3.356 0.234 13.872 1.00 66.60 C ATOM 639 O GLY A 42 -2.299 0.860 13.814 1.00 66.60 O ATOM 0 H GLY A 42 -5.226 -2.267 13.603 1.00 66.60 H new ATOM 0 HA2 GLY A 42 -2.507 -1.634 13.230 1.00 66.60 H new ATOM 0 HA3 GLY A 42 -3.851 -1.085 12.248 1.00 66.60 H new ATOM 643 N SER A 43 -4.447 0.677 14.513 1.00 41.24 N ATOM 644 CA SER A 43 -4.461 1.953 15.197 1.00 41.24 C ATOM 645 C SER A 43 -3.501 1.906 16.379 1.00 41.24 C ATOM 646 O SER A 43 -2.747 2.847 16.624 1.00 41.24 O ATOM 647 CB SER A 43 -5.875 2.295 15.671 1.00 41.24 C ATOM 648 OG SER A 43 -6.774 2.381 14.577 1.00 41.24 O ATOM 0 H SER A 43 -5.326 0.161 14.565 1.00 41.24 H new ATOM 0 HA SER A 43 -4.140 2.731 14.504 1.00 41.24 H new ATOM 0 HB2 SER A 43 -6.221 1.534 16.371 1.00 41.24 H new ATOM 0 HB3 SER A 43 -5.862 3.242 16.210 1.00 41.24 H new ATOM 0 HG SER A 43 -7.671 2.599 14.907 1.00 41.24 H new ATOM 654 N ALA A 44 -3.536 0.785 17.105 1.00 31.60 N ATOM 655 CA ALA A 44 -2.665 0.592 18.264 1.00 31.60 C ATOM 656 C ALA A 44 -1.203 0.580 17.851 1.00 31.60 C ATOM 657 O ALA A 44 -0.325 1.004 18.602 1.00 31.60 O ATOM 658 CB ALA A 44 -3.001 -0.711 18.968 1.00 31.60 C ATOM 0 H ALA A 44 -4.157 -0.000 16.910 1.00 31.60 H new ATOM 0 HA ALA A 44 -2.830 1.426 18.946 1.00 31.60 H new ATOM 0 HB1 ALA A 44 -2.344 -0.840 19.828 1.00 31.60 H new ATOM 0 HB2 ALA A 44 -4.038 -0.686 19.304 1.00 31.60 H new ATOM 0 HB3 ALA A 44 -2.863 -1.543 18.278 1.00 31.60 H new ATOM 664 N TRP A 45 -0.957 0.081 16.650 1.00 71.86 N ATOM 665 CA TRP A 45 0.387 -0.009 16.111 1.00 71.86 C ATOM 666 C TRP A 45 0.840 1.339 15.629 1.00 71.86 C ATOM 667 O TRP A 45 1.877 1.845 16.052 1.00 71.86 O ATOM 668 CB TRP A 45 0.405 -0.992 14.955 1.00 71.86 C ATOM 669 CG TRP A 45 1.768 -1.258 14.420 1.00 71.86 C ATOM 670 CD1 TRP A 45 2.937 -1.357 15.120 1.00 71.86 C ATOM 671 CD2 TRP A 45 2.096 -1.462 13.055 1.00 71.86 C ATOM 672 NE1 TRP A 45 3.975 -1.598 14.257 1.00 71.86 N ATOM 673 CE2 TRP A 45 3.482 -1.666 12.983 1.00 71.86 C ATOM 674 CE3 TRP A 45 1.347 -1.489 11.882 1.00 71.86 C ATOM 675 CZ2 TRP A 45 4.135 -1.889 11.783 1.00 71.86 C ATOM 676 CZ3 TRP A 45 1.991 -1.718 10.690 1.00 71.86 C ATOM 677 CH2 TRP A 45 3.378 -1.914 10.643 1.00 71.86 C ATOM 0 H TRP A 45 -1.682 -0.271 16.025 1.00 71.86 H new ATOM 0 HA TRP A 45 1.062 -0.353 16.895 1.00 71.86 H new ATOM 0 HB2 TRP A 45 -0.038 -1.933 15.282 1.00 71.86 H new ATOM 0 HB3 TRP A 45 -0.223 -0.607 14.152 1.00 71.86 H new ATOM 0 HD1 TRP A 45 3.030 -1.260 16.192 1.00 71.86 H new ATOM 0 HE1 TRP A 45 4.954 -1.708 14.522 1.00 71.86 H new ATOM 0 HE3 TRP A 45 0.279 -1.333 11.908 1.00 71.86 H new ATOM 0 HZ2 TRP A 45 5.204 -2.038 11.748 1.00 71.86 H new ATOM 0 HZ3 TRP A 45 1.419 -1.747 9.774 1.00 71.86 H new ATOM 0 HH2 TRP A 45 3.858 -2.088 9.691 1.00 71.86 H new ATOM 688 N PHE A 46 0.047 1.940 14.751 1.00 81.71 N ATOM 689 CA PHE A 46 0.372 3.252 14.236 1.00 81.71 C ATOM 690 C PHE A 46 0.551 4.228 15.388 1.00 81.71 C ATOM 691 O PHE A 46 1.450 5.053 15.372 1.00 81.71 O ATOM 692 CB PHE A 46 -0.734 3.752 13.323 1.00 81.71 C ATOM 693 CG PHE A 46 -0.886 2.971 12.055 1.00 81.71 C ATOM 694 CD1 PHE A 46 0.211 2.674 11.263 1.00 81.71 C ATOM 695 CD2 PHE A 46 -2.137 2.559 11.643 1.00 81.71 C ATOM 696 CE1 PHE A 46 0.054 1.983 10.073 1.00 81.71 C ATOM 697 CE2 PHE A 46 -2.300 1.869 10.462 1.00 81.71 C ATOM 698 CZ PHE A 46 -1.207 1.584 9.672 1.00 81.71 C ATOM 0 H PHE A 46 -0.817 1.539 14.387 1.00 81.71 H new ATOM 0 HA PHE A 46 1.299 3.181 13.667 1.00 81.71 H new ATOM 0 HB2 PHE A 46 -1.678 3.726 13.867 1.00 81.71 H new ATOM 0 HB3 PHE A 46 -0.539 4.795 13.073 1.00 81.71 H new ATOM 0 HD1 PHE A 46 1.197 2.984 11.576 1.00 81.71 H new ATOM 0 HD2 PHE A 46 -2.999 2.780 12.254 1.00 81.71 H new ATOM 0 HE1 PHE A 46 0.914 1.757 9.460 1.00 81.71 H new ATOM 0 HE2 PHE A 46 -3.285 1.551 10.155 1.00 81.71 H new ATOM 0 HZ PHE A 46 -1.336 1.050 8.742 1.00 81.71 H new ATOM 708 N SER A 47 -0.302 4.107 16.401 1.00 81.62 N ATOM 709 CA SER A 47 -0.204 4.978 17.564 1.00 81.62 C ATOM 710 C SER A 47 1.104 4.736 18.291 1.00 81.62 C ATOM 711 O SER A 47 1.782 5.684 18.686 1.00 81.62 O ATOM 712 CB SER A 47 -1.390 4.775 18.507 1.00 81.62 C ATOM 713 OG SER A 47 -2.615 5.067 17.856 1.00 81.62 O ATOM 0 H SER A 47 -1.058 3.424 16.440 1.00 81.62 H new ATOM 0 HA SER A 47 -0.227 6.011 17.218 1.00 81.62 H new ATOM 0 HB2 SER A 47 -1.401 3.746 18.866 1.00 81.62 H new ATOM 0 HB3 SER A 47 -1.277 5.416 19.381 1.00 81.62 H new ATOM 0 HG SER A 47 -3.043 4.232 17.574 1.00 81.62 H new ATOM 719 N PHE A 48 1.497 3.467 18.422 1.00 49.76 N ATOM 720 CA PHE A 48 2.763 3.150 19.047 1.00 49.76 C ATOM 721 C PHE A 48 3.870 3.718 18.156 1.00 49.76 C ATOM 722 O PHE A 48 4.768 4.425 18.612 1.00 49.76 O ATOM 723 CB PHE A 48 2.917 1.630 19.224 1.00 49.76 C ATOM 724 CG PHE A 48 4.346 1.205 19.171 1.00 49.76 C ATOM 725 CD1 PHE A 48 4.908 0.883 17.962 1.00 49.76 C ATOM 726 CD2 PHE A 48 5.128 1.219 20.302 1.00 49.76 C ATOM 727 CE1 PHE A 48 6.242 0.572 17.873 1.00 49.76 C ATOM 728 CE2 PHE A 48 6.468 0.893 20.231 1.00 49.76 C ATOM 729 CZ PHE A 48 7.028 0.570 19.011 1.00 49.76 C ATOM 0 H PHE A 48 0.959 2.660 18.106 1.00 49.76 H new ATOM 0 HA PHE A 48 2.820 3.591 20.042 1.00 49.76 H new ATOM 0 HB2 PHE A 48 2.484 1.330 20.178 1.00 49.76 H new ATOM 0 HB3 PHE A 48 2.356 1.115 18.444 1.00 49.76 H new ATOM 0 HD1 PHE A 48 4.296 0.874 17.072 1.00 49.76 H new ATOM 0 HD2 PHE A 48 4.691 1.487 21.253 1.00 49.76 H new ATOM 0 HE1 PHE A 48 6.677 0.329 16.915 1.00 49.76 H new ATOM 0 HE2 PHE A 48 7.074 0.891 21.125 1.00 49.76 H new ATOM 0 HZ PHE A 48 8.076 0.317 18.946 1.00 49.76 H new ATOM 739 N LEU A 49 3.760 3.400 16.868 1.00 52.14 N ATOM 740 CA LEU A 49 4.703 3.863 15.860 1.00 52.14 C ATOM 741 C LEU A 49 4.824 5.386 15.934 1.00 52.14 C ATOM 742 O LEU A 49 5.926 5.936 15.960 1.00 52.14 O ATOM 743 CB LEU A 49 4.202 3.424 14.479 1.00 52.14 C ATOM 744 CG LEU A 49 4.992 2.299 13.804 1.00 52.14 C ATOM 745 CD1 LEU A 49 5.233 1.148 14.765 1.00 52.14 C ATOM 746 CD2 LEU A 49 4.256 1.807 12.575 1.00 52.14 C ATOM 0 H LEU A 49 3.013 2.813 16.496 1.00 52.14 H new ATOM 0 HA LEU A 49 5.689 3.432 16.036 1.00 52.14 H new ATOM 0 HB2 LEU A 49 3.164 3.105 14.576 1.00 52.14 H new ATOM 0 HB3 LEU A 49 4.208 4.292 13.819 1.00 52.14 H new ATOM 0 HG LEU A 49 5.960 2.699 13.503 1.00 52.14 H new ATOM 0 HD11 LEU A 49 5.796 0.364 14.259 1.00 52.14 H new ATOM 0 HD12 LEU A 49 5.800 1.505 15.625 1.00 52.14 H new ATOM 0 HD13 LEU A 49 4.276 0.749 15.102 1.00 52.14 H new ATOM 0 HD21 LEU A 49 4.828 1.007 12.104 1.00 52.14 H new ATOM 0 HD22 LEU A 49 3.275 1.430 12.865 1.00 52.14 H new ATOM 0 HD23 LEU A 49 4.134 2.630 11.870 1.00 52.14 H new ATOM 758 N GLU A 50 3.669 6.051 16.010 1.00 63.10 N ATOM 759 CA GLU A 50 3.625 7.506 16.130 1.00 63.10 C ATOM 760 C GLU A 50 4.249 7.927 17.448 1.00 63.10 C ATOM 761 O GLU A 50 5.029 8.876 17.511 1.00 63.10 O ATOM 762 CB GLU A 50 2.189 8.030 16.056 1.00 63.10 C ATOM 763 CG GLU A 50 1.577 7.976 14.666 1.00 63.10 C ATOM 764 CD GLU A 50 0.166 8.536 14.626 1.00 63.10 C ATOM 765 OE1 GLU A 50 -0.399 8.811 15.706 1.00 63.10 O ATOM 766 OE2 GLU A 50 -0.376 8.697 13.512 1.00 63.10 O ATOM 0 H GLU A 50 2.753 5.603 15.990 1.00 63.10 H new ATOM 0 HA GLU A 50 4.186 7.931 15.297 1.00 63.10 H new ATOM 0 HB2 GLU A 50 1.567 7.450 16.737 1.00 63.10 H new ATOM 0 HB3 GLU A 50 2.172 9.061 16.409 1.00 63.10 H new ATOM 0 HG2 GLU A 50 2.206 8.536 13.974 1.00 63.10 H new ATOM 0 HG3 GLU A 50 1.564 6.943 14.319 1.00 63.10 H new ATOM 773 N SER A 51 3.911 7.185 18.497 1.00 75.02 N ATOM 774 CA SER A 51 4.453 7.449 19.826 1.00 75.02 C ATOM 775 C SER A 51 5.977 7.336 19.800 1.00 75.02 C ATOM 776 O SER A 51 6.674 7.974 20.590 1.00 75.02 O ATOM 777 CB SER A 51 3.866 6.476 20.851 1.00 75.02 C ATOM 778 OG SER A 51 2.456 6.603 20.926 1.00 75.02 O ATOM 0 H SER A 51 3.265 6.397 18.453 1.00 75.02 H new ATOM 0 HA SER A 51 4.178 8.462 20.119 1.00 75.02 H new ATOM 0 HB2 SER A 51 4.128 5.454 20.578 1.00 75.02 H new ATOM 0 HB3 SER A 51 4.304 6.667 21.831 1.00 75.02 H new ATOM 0 HG SER A 51 2.076 6.570 20.023 1.00 75.02 H new ATOM 784 N HIS A 52 6.485 6.531 18.867 1.00122.90 N ATOM 785 CA HIS A 52 7.915 6.342 18.705 1.00122.90 C ATOM 786 C HIS A 52 8.376 7.055 17.439 1.00122.90 C ATOM 787 O HIS A 52 7.580 7.715 16.771 1.00122.90 O ATOM 788 CB HIS A 52 8.248 4.850 18.635 1.00122.90 C ATOM 789 CG HIS A 52 8.054 4.149 19.934 1.00122.90 C ATOM 790 ND1 HIS A 52 9.050 3.456 20.591 1.00122.90 N ATOM 791 CD2 HIS A 52 6.957 4.054 20.707 1.00122.90 C ATOM 792 CE1 HIS A 52 8.566 2.963 21.718 1.00122.90 C ATOM 793 NE2 HIS A 52 7.295 3.312 21.811 1.00122.90 N ATOM 0 H HIS A 52 5.916 5.998 18.209 1.00122.90 H new ATOM 0 HA HIS A 52 8.437 6.765 19.563 1.00122.90 H new ATOM 0 HB2 HIS A 52 7.622 4.379 17.877 1.00122.90 H new ATOM 0 HB3 HIS A 52 9.283 4.729 18.314 1.00122.90 H new ATOM 0 HD2 HIS A 52 5.988 4.483 20.497 1.00122.90 H new ATOM 0 HE1 HIS A 52 9.115 2.376 22.439 1.00122.90 H new ATOM 0 HE2 HIS A 52 6.668 3.070 22.578 1.00122.90 H new ATOM 801 N ASN A 53 9.653 6.929 17.106 1.00225.56 N ATOM 802 CA ASN A 53 10.194 7.575 15.912 1.00225.56 C ATOM 803 C ASN A 53 10.124 6.648 14.702 1.00225.56 C ATOM 804 O ASN A 53 10.998 6.681 13.835 1.00225.56 O ATOM 805 CB ASN A 53 11.643 8.009 16.147 1.00225.56 C ATOM 806 CG ASN A 53 11.820 8.763 17.449 1.00225.56 C ATOM 807 OD1 ASN A 53 12.654 8.400 18.279 1.00225.56 O ATOM 808 ND2 ASN A 53 11.043 9.823 17.636 1.00225.56 N ATOM 0 H ASN A 53 10.333 6.389 17.641 1.00225.56 H new ATOM 0 HA ASN A 53 9.584 8.455 15.708 1.00225.56 H new ATOM 0 HB2 ASN A 53 12.286 7.129 16.150 1.00225.56 H new ATOM 0 HB3 ASN A 53 11.969 8.639 15.319 1.00225.56 H new ATOM 0 HD21 ASN A 53 11.125 10.370 18.493 1.00225.56 H new ATOM 0 HD22 ASN A 53 10.364 10.090 16.923 1.00225.56 H new ATOM 815 N LYS A 54 9.097 5.807 14.655 1.00217.59 N ATOM 816 CA LYS A 54 8.944 4.862 13.563 1.00217.59 C ATOM 817 C LYS A 54 7.946 5.337 12.506 1.00217.59 C ATOM 818 O LYS A 54 7.911 4.787 11.408 1.00217.59 O ATOM 819 CB LYS A 54 8.469 3.523 14.118 1.00217.59 C ATOM 820 CG LYS A 54 9.364 2.957 15.211 1.00217.59 C ATOM 821 CD LYS A 54 10.768 2.685 14.699 1.00217.59 C ATOM 822 CE LYS A 54 10.763 1.599 13.637 1.00217.59 C ATOM 823 NZ LYS A 54 12.114 1.002 13.434 1.00217.59 N ATOM 0 H LYS A 54 8.361 5.763 15.360 1.00217.59 H new ATOM 0 HA LYS A 54 9.917 4.767 13.082 1.00217.59 H new ATOM 0 HB2 LYS A 54 7.460 3.642 14.513 1.00217.59 H new ATOM 0 HB3 LYS A 54 8.409 2.803 13.302 1.00217.59 H new ATOM 0 HG2 LYS A 54 9.409 3.658 16.044 1.00217.59 H new ATOM 0 HG3 LYS A 54 8.931 2.033 15.595 1.00217.59 H new ATOM 0 HD2 LYS A 54 11.191 3.600 14.285 1.00217.59 H new ATOM 0 HD3 LYS A 54 11.409 2.384 15.528 1.00217.59 H new ATOM 0 HE2 LYS A 54 10.061 0.816 13.924 1.00217.59 H new ATOM 0 HE3 LYS A 54 10.407 2.016 12.695 1.00217.59 H new ATOM 0 HZ1 LYS A 54 12.062 0.266 12.701 1.00217.59 H new ATOM 0 HZ2 LYS A 54 12.779 1.743 13.134 1.00217.59 H new ATOM 0 HZ3 LYS A 54 12.444 0.580 14.325 1.00217.59 H new ATOM 837 N LEU A 55 7.130 6.347 12.813 1.00 97.75 N ATOM 838 CA LEU A 55 6.149 6.812 11.824 1.00 97.75 C ATOM 839 C LEU A 55 5.681 8.249 12.042 1.00 97.75 C ATOM 840 O LEU A 55 4.948 8.556 12.983 1.00 97.75 O ATOM 841 CB LEU A 55 4.945 5.880 11.834 1.00 97.75 C ATOM 842 CG LEU A 55 3.813 6.246 10.873 1.00 97.75 C ATOM 843 CD1 LEU A 55 3.106 4.999 10.371 1.00 97.75 C ATOM 844 CD2 LEU A 55 2.825 7.160 11.572 1.00 97.75 C ATOM 0 H LEU A 55 7.124 6.845 13.703 1.00 97.75 H new ATOM 0 HA LEU A 55 6.653 6.797 10.858 1.00 97.75 H new ATOM 0 HB2 LEU A 55 5.287 4.873 11.596 1.00 97.75 H new ATOM 0 HB3 LEU A 55 4.541 5.849 12.846 1.00 97.75 H new ATOM 0 HG LEU A 55 4.239 6.764 10.014 1.00 97.75 H new ATOM 0 HD11 LEU A 55 2.305 5.284 9.689 1.00 97.75 H new ATOM 0 HD12 LEU A 55 3.819 4.363 9.847 1.00 97.75 H new ATOM 0 HD13 LEU A 55 2.686 4.454 11.216 1.00 97.75 H new ATOM 0 HD21 LEU A 55 2.020 7.419 10.885 1.00 97.75 H new ATOM 0 HD22 LEU A 55 2.410 6.650 12.441 1.00 97.75 H new ATOM 0 HD23 LEU A 55 3.334 8.069 11.893 1.00 97.75 H new ATOM 856 N ASP A 56 6.089 9.105 11.112 1.00109.16 N ATOM 857 CA ASP A 56 5.706 10.520 11.108 1.00109.16 C ATOM 858 C ASP A 56 4.324 10.704 10.489 1.00109.16 C ATOM 859 O ASP A 56 3.690 9.736 10.085 1.00109.16 O ATOM 860 CB ASP A 56 6.729 11.368 10.350 1.00109.16 C ATOM 861 CG ASP A 56 8.102 11.329 10.987 1.00109.16 C ATOM 862 OD1 ASP A 56 8.184 11.042 12.200 1.00109.16 O ATOM 863 OD2 ASP A 56 9.096 11.587 10.276 1.00109.16 O ATOM 0 H ASP A 56 6.696 8.841 10.336 1.00109.16 H new ATOM 0 HA ASP A 56 5.678 10.855 12.145 1.00109.16 H new ATOM 0 HB2 ASP A 56 6.799 11.013 9.322 1.00109.16 H new ATOM 0 HB3 ASP A 56 6.381 12.400 10.308 1.00109.16 H new ATOM 868 N LYS A 57 3.883 11.955 10.385 1.00 65.03 N ATOM 869 CA LYS A 57 2.586 12.274 9.780 1.00 65.03 C ATOM 870 C LYS A 57 2.630 12.108 8.256 1.00 65.03 C ATOM 871 O LYS A 57 1.593 12.017 7.606 1.00 65.03 O ATOM 872 CB LYS A 57 2.137 13.694 10.174 1.00 65.03 C ATOM 873 CG LYS A 57 2.754 14.806 9.343 1.00 65.03 C ATOM 874 CD LYS A 57 4.258 14.818 9.490 1.00 65.03 C ATOM 875 CE LYS A 57 4.890 15.968 8.718 1.00 65.03 C ATOM 876 NZ LYS A 57 6.236 16.322 9.249 1.00 65.03 N ATOM 0 H LYS A 57 4.404 12.769 10.712 1.00 65.03 H new ATOM 0 HA LYS A 57 1.850 11.568 10.165 1.00 65.03 H new ATOM 0 HB2 LYS A 57 1.052 13.754 10.089 1.00 65.03 H new ATOM 0 HB3 LYS A 57 2.385 13.861 11.222 1.00 65.03 H new ATOM 0 HG2 LYS A 57 2.488 14.672 8.294 1.00 65.03 H new ATOM 0 HG3 LYS A 57 2.346 15.768 9.655 1.00 65.03 H new ATOM 0 HD2 LYS A 57 4.520 14.900 10.545 1.00 65.03 H new ATOM 0 HD3 LYS A 57 4.666 13.872 9.133 1.00 65.03 H new ATOM 0 HE2 LYS A 57 4.975 15.695 7.666 1.00 65.03 H new ATOM 0 HE3 LYS A 57 4.239 16.841 8.769 1.00 65.03 H new ATOM 0 HZ1 LYS A 57 6.631 17.109 8.696 1.00 65.03 H new ATOM 0 HZ2 LYS A 57 6.152 16.607 10.246 1.00 65.03 H new ATOM 0 HZ3 LYS A 57 6.866 15.497 9.177 1.00 65.03 H new ATOM 890 N ASP A 58 3.833 12.068 7.689 1.00165.72 N ATOM 891 CA ASP A 58 3.990 11.902 6.248 1.00165.72 C ATOM 892 C ASP A 58 4.921 10.729 5.916 1.00165.72 C ATOM 893 O ASP A 58 4.968 10.282 4.771 1.00165.72 O ATOM 894 CB ASP A 58 4.521 13.189 5.611 1.00165.72 C ATOM 895 CG ASP A 58 3.509 14.321 5.648 1.00165.72 C ATOM 896 OD1 ASP A 58 2.344 14.070 6.027 1.00165.72 O ATOM 897 OD2 ASP A 58 3.881 15.461 5.299 1.00165.72 O ATOM 0 H ASP A 58 4.710 12.148 8.204 1.00165.72 H new ATOM 0 HA ASP A 58 3.006 11.681 5.835 1.00165.72 H new ATOM 0 HB2 ASP A 58 5.427 13.500 6.131 1.00165.72 H new ATOM 0 HB3 ASP A 58 4.800 12.990 4.576 1.00165.72 H new ATOM 902 N ASN A 59 5.666 10.232 6.910 1.00 98.89 N ATOM 903 CA ASN A 59 6.584 9.117 6.683 1.00 98.89 C ATOM 904 C ASN A 59 5.959 7.788 7.060 1.00 98.89 C ATOM 905 O ASN A 59 5.867 7.437 8.235 1.00 98.89 O ATOM 906 CB ASN A 59 7.881 9.308 7.471 1.00 98.89 C ATOM 907 CG ASN A 59 8.711 10.465 6.953 1.00 98.89 C ATOM 908 OD1 ASN A 59 9.816 10.271 6.445 1.00 98.89 O ATOM 909 ND2 ASN A 59 8.185 11.676 7.078 1.00 98.89 N ATOM 0 H ASN A 59 5.650 10.581 7.868 1.00 98.89 H new ATOM 0 HA ASN A 59 6.807 9.104 5.616 1.00 98.89 H new ATOM 0 HB2 ASN A 59 7.643 9.478 8.521 1.00 98.89 H new ATOM 0 HB3 ASN A 59 8.470 8.392 7.422 1.00 98.89 H new ATOM 0 HD21 ASN A 59 8.699 12.492 6.747 1.00 98.89 H new ATOM 0 HD22 ASN A 59 7.266 11.791 7.505 1.00 98.89 H new ATOM 916 N LEU A 60 5.574 7.034 6.043 1.00196.24 N ATOM 917 CA LEU A 60 5.004 5.714 6.240 1.00196.24 C ATOM 918 C LEU A 60 5.847 4.668 5.505 1.00196.24 C ATOM 919 O LEU A 60 5.371 3.580 5.193 1.00196.24 O ATOM 920 CB LEU A 60 3.534 5.656 5.781 1.00196.24 C ATOM 921 CG LEU A 60 3.191 6.338 4.447 1.00196.24 C ATOM 922 CD1 LEU A 60 3.346 7.848 4.536 1.00196.24 C ATOM 923 CD2 LEU A 60 4.032 5.770 3.315 1.00196.24 C ATOM 0 H LEU A 60 5.647 7.318 5.066 1.00196.24 H new ATOM 0 HA LEU A 60 5.016 5.493 7.307 1.00196.24 H new ATOM 0 HB2 LEU A 60 3.243 4.608 5.710 1.00196.24 H new ATOM 0 HB3 LEU A 60 2.918 6.106 6.560 1.00196.24 H new ATOM 0 HG LEU A 60 2.144 6.128 4.230 1.00196.24 H new ATOM 0 HD11 LEU A 60 3.095 8.297 3.575 1.00196.24 H new ATOM 0 HD12 LEU A 60 2.678 8.238 5.304 1.00196.24 H new ATOM 0 HD13 LEU A 60 4.376 8.093 4.793 1.00196.24 H new ATOM 0 HD21 LEU A 60 3.771 6.269 2.382 1.00196.24 H new ATOM 0 HD22 LEU A 60 5.088 5.932 3.530 1.00196.24 H new ATOM 0 HD23 LEU A 60 3.841 4.701 3.221 1.00196.24 H new ATOM 935 N SER A 61 7.106 5.015 5.216 1.00 66.14 N ATOM 936 CA SER A 61 8.007 4.106 4.510 1.00 66.14 C ATOM 937 C SER A 61 8.240 2.803 5.277 1.00 66.14 C ATOM 938 O SER A 61 8.233 1.723 4.684 1.00 66.14 O ATOM 939 CB SER A 61 9.343 4.795 4.227 1.00 66.14 C ATOM 940 OG SER A 61 10.179 3.977 3.427 1.00 66.14 O ATOM 0 H SER A 61 7.520 5.915 5.460 1.00 66.14 H new ATOM 0 HA SER A 61 7.525 3.846 3.568 1.00 66.14 H new ATOM 0 HB2 SER A 61 9.166 5.744 3.721 1.00 66.14 H new ATOM 0 HB3 SER A 61 9.845 5.023 5.167 1.00 66.14 H new ATOM 0 HG SER A 61 11.026 4.440 3.259 1.00 66.14 H new ATOM 946 N TYR A 62 8.445 2.896 6.590 1.00 59.69 N ATOM 947 CA TYR A 62 8.675 1.707 7.403 1.00 59.69 C ATOM 948 C TYR A 62 7.434 0.826 7.421 1.00 59.69 C ATOM 949 O TYR A 62 7.530 -0.390 7.321 1.00 59.69 O ATOM 950 CB TYR A 62 9.089 2.109 8.838 1.00 59.69 C ATOM 951 CG TYR A 62 8.651 1.140 9.932 1.00 59.69 C ATOM 952 CD1 TYR A 62 8.906 -0.225 9.838 1.00 59.69 C ATOM 953 CD2 TYR A 62 7.952 1.598 11.036 1.00 59.69 C ATOM 954 CE1 TYR A 62 8.477 -1.096 10.821 1.00 59.69 C ATOM 955 CE2 TYR A 62 7.526 0.736 12.022 1.00 59.69 C ATOM 956 CZ TYR A 62 7.790 -0.609 11.912 1.00 59.69 C ATOM 957 OH TYR A 62 7.362 -1.469 12.897 1.00 59.69 O ATOM 0 H TYR A 62 8.456 3.775 7.108 1.00 59.69 H new ATOM 0 HA TYR A 62 9.490 1.134 6.961 1.00 59.69 H new ATOM 0 HB2 TYR A 62 10.174 2.206 8.873 1.00 59.69 H new ATOM 0 HB3 TYR A 62 8.674 3.093 9.057 1.00 59.69 H new ATOM 0 HD1 TYR A 62 9.446 -0.609 8.985 1.00 59.69 H new ATOM 0 HD2 TYR A 62 7.737 2.652 11.126 1.00 59.69 H new ATOM 0 HE1 TYR A 62 8.679 -2.153 10.735 1.00 59.69 H new ATOM 0 HE2 TYR A 62 6.987 1.115 12.878 1.00 59.69 H new ATOM 0 HH TYR A 62 7.177 -2.348 12.506 1.00 59.69 H new ATOM 967 N ILE A 63 6.280 1.448 7.568 1.00 95.89 N ATOM 968 CA ILE A 63 5.030 0.716 7.619 1.00 95.89 C ATOM 969 C ILE A 63 4.680 0.197 6.245 1.00 95.89 C ATOM 970 O ILE A 63 4.310 -0.964 6.073 1.00 95.89 O ATOM 971 CB ILE A 63 3.896 1.590 8.195 1.00 95.89 C ATOM 972 CG1 ILE A 63 3.347 2.595 7.182 1.00 95.89 C ATOM 973 CG2 ILE A 63 4.384 2.343 9.422 1.00 95.89 C ATOM 974 CD1 ILE A 63 2.132 3.316 7.696 1.00 95.89 C ATOM 0 H ILE A 63 6.183 2.460 7.654 1.00 95.89 H new ATOM 0 HA ILE A 63 5.152 -0.136 8.288 1.00 95.89 H new ATOM 0 HB ILE A 63 3.087 0.909 8.460 1.00 95.89 H new ATOM 0 HG12 ILE A 63 4.122 3.322 6.938 1.00 95.89 H new ATOM 0 HG13 ILE A 63 3.095 2.075 6.258 1.00 95.89 H new ATOM 0 HG21 ILE A 63 3.575 2.956 9.819 1.00 95.89 H new ATOM 0 HG22 ILE A 63 4.706 1.631 10.182 1.00 95.89 H new ATOM 0 HG23 ILE A 63 5.222 2.983 9.147 1.00 95.89 H new ATOM 0 HD11 ILE A 63 1.779 4.019 6.941 1.00 95.89 H new ATOM 0 HD12 ILE A 63 1.346 2.594 7.915 1.00 95.89 H new ATOM 0 HD13 ILE A 63 2.389 3.859 8.605 1.00 95.89 H new ATOM 986 N GLU A 64 4.854 1.062 5.259 1.00 77.41 N ATOM 987 CA GLU A 64 4.616 0.700 3.872 1.00 77.41 C ATOM 988 C GLU A 64 5.418 -0.553 3.541 1.00 77.41 C ATOM 989 O GLU A 64 4.993 -1.393 2.752 1.00 77.41 O ATOM 990 CB GLU A 64 5.035 1.840 2.946 1.00 77.41 C ATOM 991 CG GLU A 64 4.705 1.581 1.485 1.00 77.41 C ATOM 992 CD GLU A 64 5.279 2.634 0.556 1.00 77.41 C ATOM 993 OE1 GLU A 64 6.083 3.468 1.023 1.00 77.41 O ATOM 994 OE2 GLU A 64 4.931 2.617 -0.644 1.00 77.41 O ATOM 0 H GLU A 64 5.161 2.025 5.395 1.00 77.41 H new ATOM 0 HA GLU A 64 3.553 0.509 3.728 1.00 77.41 H new ATOM 0 HB2 GLU A 64 4.542 2.758 3.265 1.00 77.41 H new ATOM 0 HB3 GLU A 64 6.108 2.004 3.045 1.00 77.41 H new ATOM 0 HG2 GLU A 64 5.090 0.602 1.199 1.00 77.41 H new ATOM 0 HG3 GLU A 64 3.622 1.546 1.363 1.00 77.41 H new ATOM 1001 N HIS A 65 6.573 -0.679 4.196 1.00 68.54 N ATOM 1002 CA HIS A 65 7.424 -1.839 4.014 1.00 68.54 C ATOM 1003 C HIS A 65 6.752 -3.060 4.613 1.00 68.54 C ATOM 1004 O HIS A 65 6.757 -4.134 4.020 1.00 68.54 O ATOM 1005 CB HIS A 65 8.798 -1.592 4.649 1.00 68.54 C ATOM 1006 CG HIS A 65 9.664 -2.808 4.741 1.00 68.54 C ATOM 1007 ND1 HIS A 65 10.560 -3.184 3.764 1.00 68.54 N ATOM 1008 CD2 HIS A 65 9.753 -3.741 5.714 1.00 68.54 C ATOM 1009 CE1 HIS A 65 11.164 -4.301 4.135 1.00 68.54 C ATOM 1010 NE2 HIS A 65 10.692 -4.658 5.316 1.00 68.54 N ATOM 0 H HIS A 65 6.934 0.011 4.855 1.00 68.54 H new ATOM 0 HA HIS A 65 7.577 -2.017 2.949 1.00 68.54 H new ATOM 0 HB2 HIS A 65 9.321 -0.831 4.069 1.00 68.54 H new ATOM 0 HB3 HIS A 65 8.654 -1.187 5.651 1.00 68.54 H new ATOM 0 HD2 HIS A 65 9.189 -3.761 6.635 1.00 68.54 H new ATOM 0 HE1 HIS A 65 11.915 -4.831 3.569 1.00 68.54 H new ATOM 0 HE2 HIS A 65 10.979 -5.481 5.845 1.00 68.54 H new ATOM 1018 N ILE A 66 6.160 -2.877 5.787 1.00 44.28 N ATOM 1019 CA ILE A 66 5.462 -3.955 6.469 1.00 44.28 C ATOM 1020 C ILE A 66 4.348 -4.472 5.588 1.00 44.28 C ATOM 1021 O ILE A 66 4.233 -5.670 5.333 1.00 44.28 O ATOM 1022 CB ILE A 66 4.886 -3.458 7.805 1.00 44.28 C ATOM 1023 CG1 ILE A 66 6.022 -2.883 8.651 1.00 44.28 C ATOM 1024 CG2 ILE A 66 4.136 -4.564 8.544 1.00 44.28 C ATOM 1025 CD1 ILE A 66 7.202 -3.800 8.819 1.00 44.28 C ATOM 0 H ILE A 66 6.151 -1.988 6.287 1.00 44.28 H new ATOM 0 HA ILE A 66 6.167 -4.761 6.673 1.00 44.28 H new ATOM 0 HB ILE A 66 4.154 -2.674 7.608 1.00 44.28 H new ATOM 0 HG12 ILE A 66 6.363 -1.953 8.195 1.00 44.28 H new ATOM 0 HG13 ILE A 66 5.632 -2.630 9.637 1.00 44.28 H new ATOM 0 HG21 ILE A 66 3.744 -4.173 9.483 1.00 44.28 H new ATOM 0 HG22 ILE A 66 3.311 -4.920 7.927 1.00 44.28 H new ATOM 0 HG23 ILE A 66 4.817 -5.390 8.751 1.00 44.28 H new ATOM 0 HD11 ILE A 66 7.959 -3.311 9.432 1.00 44.28 H new ATOM 0 HD12 ILE A 66 6.881 -4.721 9.305 1.00 44.28 H new ATOM 0 HD13 ILE A 66 7.623 -4.034 7.841 1.00 44.28 H new ATOM 1037 N PHE A 67 3.550 -3.539 5.102 1.00103.95 N ATOM 1038 CA PHE A 67 2.458 -3.870 4.214 1.00103.95 C ATOM 1039 C PHE A 67 3.006 -4.490 2.920 1.00103.95 C ATOM 1040 O PHE A 67 2.383 -5.377 2.337 1.00103.95 O ATOM 1041 CB PHE A 67 1.628 -2.621 3.937 1.00103.95 C ATOM 1042 CG PHE A 67 1.149 -1.984 5.207 1.00103.95 C ATOM 1043 CD1 PHE A 67 0.432 -2.722 6.137 1.00103.95 C ATOM 1044 CD2 PHE A 67 1.437 -0.660 5.486 1.00103.95 C ATOM 1045 CE1 PHE A 67 0.016 -2.150 7.323 1.00103.95 C ATOM 1046 CE2 PHE A 67 1.017 -0.081 6.668 1.00103.95 C ATOM 1047 CZ PHE A 67 0.306 -0.830 7.587 1.00103.95 C ATOM 0 H PHE A 67 3.640 -2.544 5.310 1.00103.95 H new ATOM 0 HA PHE A 67 1.808 -4.608 4.684 1.00103.95 H new ATOM 0 HB2 PHE A 67 2.225 -1.905 3.373 1.00103.95 H new ATOM 0 HB3 PHE A 67 0.772 -2.883 3.315 1.00103.95 H new ATOM 0 HD1 PHE A 67 0.196 -3.756 5.931 1.00103.95 H new ATOM 0 HD2 PHE A 67 1.996 -0.073 4.772 1.00103.95 H new ATOM 0 HE1 PHE A 67 -0.536 -2.737 8.042 1.00103.95 H new ATOM 0 HE2 PHE A 67 1.244 0.955 6.874 1.00103.95 H new ATOM 0 HZ PHE A 67 -0.022 -0.380 8.512 1.00103.95 H new ATOM 1057 N GLU A 68 4.195 -4.030 2.488 1.00 76.40 N ATOM 1058 CA GLU A 68 4.829 -4.565 1.279 1.00 76.40 C ATOM 1059 C GLU A 68 5.336 -5.979 1.516 1.00 76.40 C ATOM 1060 O GLU A 68 5.032 -6.894 0.750 1.00 76.40 O ATOM 1061 CB GLU A 68 6.005 -3.682 0.833 1.00 76.40 C ATOM 1062 CG GLU A 68 6.702 -4.192 -0.424 1.00 76.40 C ATOM 1063 CD GLU A 68 7.929 -3.379 -0.799 1.00 76.40 C ATOM 1064 OE1 GLU A 68 8.270 -2.434 -0.055 1.00 76.40 O ATOM 1065 OE2 GLU A 68 8.550 -3.690 -1.837 1.00 76.40 O ATOM 0 H GLU A 68 4.728 -3.297 2.956 1.00 76.40 H new ATOM 0 HA GLU A 68 4.072 -4.576 0.495 1.00 76.40 H new ATOM 0 HB2 GLU A 68 5.642 -2.670 0.653 1.00 76.40 H new ATOM 0 HB3 GLU A 68 6.732 -3.621 1.643 1.00 76.40 H new ATOM 0 HG2 GLU A 68 6.995 -5.231 -0.273 1.00 76.40 H new ATOM 0 HG3 GLU A 68 5.996 -4.177 -1.255 1.00 76.40 H new ATOM 1072 N ILE A 69 6.118 -6.151 2.575 1.00 33.63 N ATOM 1073 CA ILE A 69 6.669 -7.453 2.898 1.00 33.63 C ATOM 1074 C ILE A 69 5.564 -8.420 3.292 1.00 33.63 C ATOM 1075 O ILE A 69 5.619 -9.611 2.984 1.00 33.63 O ATOM 1076 CB ILE A 69 7.724 -7.353 4.002 1.00 33.63 C ATOM 1077 CG1 ILE A 69 7.111 -6.921 5.336 1.00 33.63 C ATOM 1078 CG2 ILE A 69 8.831 -6.394 3.575 1.00 33.63 C ATOM 1079 CD1 ILE A 69 8.146 -6.714 6.418 1.00 33.63 C ATOM 0 H ILE A 69 6.382 -5.406 3.220 1.00 33.63 H new ATOM 0 HA ILE A 69 7.161 -7.838 2.005 1.00 33.63 H new ATOM 0 HB ILE A 69 8.151 -8.344 4.154 1.00 33.63 H new ATOM 0 HG12 ILE A 69 6.553 -5.996 5.191 1.00 33.63 H new ATOM 0 HG13 ILE A 69 6.396 -7.676 5.663 1.00 33.63 H new ATOM 0 HG21 ILE A 69 9.579 -6.327 4.365 1.00 33.63 H new ATOM 0 HG22 ILE A 69 9.299 -6.762 2.662 1.00 33.63 H new ATOM 0 HG23 ILE A 69 8.407 -5.407 3.392 1.00 33.63 H new ATOM 0 HD11 ILE A 69 7.652 -6.409 7.340 1.00 33.63 H new ATOM 0 HD12 ILE A 69 8.687 -7.645 6.587 1.00 33.63 H new ATOM 0 HD13 ILE A 69 8.847 -5.939 6.108 1.00 33.63 H new ATOM 1091 N SER A 70 4.543 -7.881 3.935 1.00 80.34 N ATOM 1092 CA SER A 70 3.387 -8.669 4.336 1.00 80.34 C ATOM 1093 C SER A 70 2.466 -8.835 3.132 1.00 80.34 C ATOM 1094 O SER A 70 2.478 -8.007 2.220 1.00 80.34 O ATOM 1095 CB SER A 70 2.643 -7.985 5.482 1.00 80.34 C ATOM 1096 OG SER A 70 2.016 -6.791 5.045 1.00 80.34 O ATOM 0 H SER A 70 4.490 -6.895 4.192 1.00 80.34 H new ATOM 0 HA SER A 70 3.717 -9.647 4.686 1.00 80.34 H new ATOM 0 HB2 SER A 70 1.894 -8.664 5.890 1.00 80.34 H new ATOM 0 HB3 SER A 70 3.341 -7.759 6.288 1.00 80.34 H new ATOM 0 HG SER A 70 2.699 -6.141 4.778 1.00 80.34 H new ATOM 1102 N ARG A 71 1.686 -9.907 3.110 1.00144.05 N ATOM 1103 CA ARG A 71 0.793 -10.162 1.987 1.00144.05 C ATOM 1104 C ARG A 71 -0.515 -9.387 2.102 1.00144.05 C ATOM 1105 O ARG A 71 -1.599 -9.970 2.147 1.00144.05 O ATOM 1106 CB ARG A 71 0.521 -11.656 1.846 1.00144.05 C ATOM 1107 CG ARG A 71 1.731 -12.430 1.360 1.00144.05 C ATOM 1108 CD ARG A 71 2.201 -11.933 0.001 1.00144.05 C ATOM 1109 NE ARG A 71 3.173 -12.842 -0.607 1.00144.05 N ATOM 1110 CZ ARG A 71 2.855 -13.866 -1.401 1.00144.05 C ATOM 1111 NH1 ARG A 71 1.587 -14.138 -1.689 1.00144.05 N ATOM 1112 NH2 ARG A 71 3.815 -14.626 -1.907 1.00144.05 N ATOM 0 H ARG A 71 1.653 -10.609 3.850 1.00144.05 H new ATOM 0 HA ARG A 71 1.298 -9.809 1.088 1.00144.05 H new ATOM 0 HB2 ARG A 71 0.203 -12.055 2.809 1.00144.05 H new ATOM 0 HB3 ARG A 71 -0.304 -11.806 1.150 1.00144.05 H new ATOM 0 HG2 ARG A 71 2.540 -12.334 2.084 1.00144.05 H new ATOM 0 HG3 ARG A 71 1.485 -13.490 1.296 1.00144.05 H new ATOM 0 HD2 ARG A 71 1.343 -11.823 -0.662 1.00144.05 H new ATOM 0 HD3 ARG A 71 2.648 -10.945 0.111 1.00144.05 H new ATOM 0 HE ARG A 71 4.161 -12.682 -0.410 1.00144.05 H new ATOM 0 HH11 ARG A 71 0.841 -13.561 -1.302 1.00144.05 H new ATOM 0 HH12 ARG A 71 1.360 -14.924 -2.298 1.00144.05 H new ATOM 0 HH21 ARG A 71 4.791 -14.427 -1.689 1.00144.05 H new ATOM 0 HH22 ARG A 71 3.578 -15.410 -2.515 1.00144.05 H new ATOM 1126 N ARG A 72 -0.403 -8.066 2.137 1.00183.66 N ATOM 1127 CA ARG A 72 -1.573 -7.208 2.232 1.00183.66 C ATOM 1128 C ARG A 72 -1.417 -5.971 1.344 1.00183.66 C ATOM 1129 O ARG A 72 -1.454 -4.839 1.829 1.00183.66 O ATOM 1130 CB ARG A 72 -1.799 -6.798 3.686 1.00183.66 C ATOM 1131 CG ARG A 72 -2.456 -7.888 4.512 1.00183.66 C ATOM 1132 CD ARG A 72 -3.931 -7.613 4.741 1.00183.66 C ATOM 1133 NE ARG A 72 -4.680 -7.548 3.484 1.00183.66 N ATOM 1134 CZ ARG A 72 -5.977 -7.835 3.367 1.00183.66 C ATOM 1135 NH1 ARG A 72 -6.697 -8.183 4.430 1.00183.66 N ATOM 1136 NH2 ARG A 72 -6.563 -7.760 2.180 1.00183.66 N ATOM 0 H ARG A 72 0.486 -7.567 2.101 1.00183.66 H new ATOM 0 HA ARG A 72 -2.442 -7.765 1.881 1.00183.66 H new ATOM 0 HB2 ARG A 72 -0.842 -6.535 4.137 1.00183.66 H new ATOM 0 HB3 ARG A 72 -2.421 -5.904 3.713 1.00183.66 H new ATOM 0 HG2 ARG A 72 -2.340 -8.847 4.006 1.00183.66 H new ATOM 0 HG3 ARG A 72 -1.949 -7.971 5.473 1.00183.66 H new ATOM 0 HD2 ARG A 72 -4.351 -8.395 5.373 1.00183.66 H new ATOM 0 HD3 ARG A 72 -4.045 -6.672 5.280 1.00183.66 H new ATOM 0 HE ARG A 72 -4.177 -7.265 2.643 1.00183.66 H new ATOM 0 HH11 ARG A 72 -6.258 -8.233 5.349 1.00183.66 H new ATOM 0 HH12 ARG A 72 -7.688 -8.400 4.326 1.00183.66 H new ATOM 0 HH21 ARG A 72 -6.022 -7.484 1.361 1.00183.66 H new ATOM 0 HH22 ARG A 72 -7.555 -7.979 2.086 1.00183.66 H new ATOM 1150 N PRO A 73 -1.243 -6.165 0.019 1.00130.67 N ATOM 1151 CA PRO A 73 -1.087 -5.050 -0.918 1.00130.67 C ATOM 1152 C PRO A 73 -2.269 -4.087 -0.890 1.00130.67 C ATOM 1153 O PRO A 73 -2.136 -2.932 -1.284 1.00130.67 O ATOM 1154 CB PRO A 73 -0.969 -5.726 -2.291 1.00130.67 C ATOM 1155 CG PRO A 73 -1.490 -7.106 -2.094 1.00130.67 C ATOM 1156 CD PRO A 73 -1.182 -7.466 -0.670 1.00130.67 C ATOM 0 HA PRO A 73 -0.222 -4.437 -0.664 1.00130.67 H new ATOM 0 HB2 PRO A 73 -1.547 -5.191 -3.044 1.00130.67 H new ATOM 0 HB3 PRO A 73 0.065 -5.741 -2.635 1.00130.67 H new ATOM 0 HG2 PRO A 73 -2.562 -7.149 -2.284 1.00130.67 H new ATOM 0 HG3 PRO A 73 -1.016 -7.804 -2.784 1.00130.67 H new ATOM 0 HD2 PRO A 73 -1.908 -8.172 -0.266 1.00130.67 H new ATOM 0 HD3 PRO A 73 -0.200 -7.929 -0.574 1.00130.67 H new ATOM 1164 N ASP A 74 -3.421 -4.553 -0.414 1.00 56.92 N ATOM 1165 CA ASP A 74 -4.604 -3.698 -0.345 1.00 56.92 C ATOM 1166 C ASP A 74 -4.374 -2.553 0.633 1.00 56.92 C ATOM 1167 O ASP A 74 -4.736 -1.407 0.364 1.00 56.92 O ATOM 1168 CB ASP A 74 -5.831 -4.513 0.077 1.00 56.92 C ATOM 1169 CG ASP A 74 -6.263 -5.506 -0.986 1.00 56.92 C ATOM 1170 OD1 ASP A 74 -5.844 -5.348 -2.152 1.00 56.92 O ATOM 1171 OD2 ASP A 74 -7.026 -6.437 -0.654 1.00 56.92 O ATOM 0 H ASP A 74 -3.561 -5.505 -0.074 1.00 56.92 H new ATOM 0 HA ASP A 74 -4.786 -3.282 -1.336 1.00 56.92 H new ATOM 0 HB2 ASP A 74 -5.608 -5.048 1.000 1.00 56.92 H new ATOM 0 HB3 ASP A 74 -6.657 -3.835 0.293 1.00 56.92 H new ATOM 1176 N LEU A 75 -3.735 -2.866 1.753 1.00 72.53 N ATOM 1177 CA LEU A 75 -3.420 -1.855 2.752 1.00 72.53 C ATOM 1178 C LEU A 75 -2.305 -0.966 2.227 1.00 72.53 C ATOM 1179 O LEU A 75 -2.386 0.261 2.285 1.00 72.53 O ATOM 1180 CB LEU A 75 -2.981 -2.516 4.058 1.00 72.53 C ATOM 1181 CG LEU A 75 -4.072 -3.237 4.858 1.00 72.53 C ATOM 1182 CD1 LEU A 75 -4.748 -4.313 4.021 1.00 72.53 C ATOM 1183 CD2 LEU A 75 -3.449 -3.846 6.099 1.00 72.53 C ATOM 0 H LEU A 75 -3.426 -3.808 1.991 1.00 72.53 H new ATOM 0 HA LEU A 75 -4.309 -1.256 2.948 1.00 72.53 H new ATOM 0 HB2 LEU A 75 -2.194 -3.235 3.829 1.00 72.53 H new ATOM 0 HB3 LEU A 75 -2.539 -1.751 4.696 1.00 72.53 H new ATOM 0 HG LEU A 75 -4.838 -2.516 5.144 1.00 72.53 H new ATOM 0 HD11 LEU A 75 -5.517 -4.807 4.615 1.00 72.53 H new ATOM 0 HD12 LEU A 75 -5.205 -3.857 3.143 1.00 72.53 H new ATOM 0 HD13 LEU A 75 -4.007 -5.047 3.705 1.00 72.53 H new ATOM 0 HD21 LEU A 75 -4.217 -4.362 6.676 1.00 72.53 H new ATOM 0 HD22 LEU A 75 -2.676 -4.557 5.807 1.00 72.53 H new ATOM 0 HD23 LEU A 75 -3.006 -3.058 6.708 1.00 72.53 H new ATOM 1195 N LEU A 76 -1.266 -1.609 1.689 1.00 57.08 N ATOM 1196 CA LEU A 76 -0.125 -0.903 1.117 1.00 57.08 C ATOM 1197 C LEU A 76 -0.580 0.070 0.044 1.00 57.08 C ATOM 1198 O LEU A 76 -0.116 1.205 -0.024 1.00 57.08 O ATOM 1199 CB LEU A 76 0.851 -1.902 0.500 1.00 57.08 C ATOM 1200 CG LEU A 76 2.114 -1.280 -0.112 1.00 57.08 C ATOM 1201 CD1 LEU A 76 3.356 -1.768 0.607 1.00 57.08 C ATOM 1202 CD2 LEU A 76 2.211 -1.594 -1.598 1.00 57.08 C ATOM 0 H LEU A 76 -1.195 -2.625 1.639 1.00 57.08 H new ATOM 0 HA LEU A 76 0.368 -0.350 1.917 1.00 57.08 H new ATOM 0 HB2 LEU A 76 1.151 -2.616 1.267 1.00 57.08 H new ATOM 0 HB3 LEU A 76 0.330 -2.466 -0.274 1.00 57.08 H new ATOM 0 HG LEU A 76 2.044 -0.199 0.008 1.00 57.08 H new ATOM 0 HD11 LEU A 76 4.239 -1.314 0.157 1.00 57.08 H new ATOM 0 HD12 LEU A 76 3.301 -1.488 1.659 1.00 57.08 H new ATOM 0 HD13 LEU A 76 3.422 -2.853 0.523 1.00 57.08 H new ATOM 0 HD21 LEU A 76 3.114 -1.142 -2.007 1.00 57.08 H new ATOM 0 HD22 LEU A 76 2.249 -2.674 -1.740 1.00 57.08 H new ATOM 0 HD23 LEU A 76 1.339 -1.191 -2.113 1.00 57.08 H new ATOM 1214 N THR A 77 -1.504 -0.397 -0.790 1.00 38.46 N ATOM 1215 CA THR A 77 -2.051 0.400 -1.867 1.00 38.46 C ATOM 1216 C THR A 77 -2.618 1.714 -1.347 1.00 38.46 C ATOM 1217 O THR A 77 -2.415 2.759 -1.955 1.00 38.46 O ATOM 1218 CB THR A 77 -3.143 -0.393 -2.605 1.00 38.46 C ATOM 1219 OG1 THR A 77 -2.568 -1.535 -3.249 1.00 38.46 O ATOM 1220 CG2 THR A 77 -3.868 0.454 -3.635 1.00 38.46 C ATOM 0 H THR A 77 -1.890 -1.339 -0.733 1.00 38.46 H new ATOM 0 HA THR A 77 -1.244 0.633 -2.561 1.00 38.46 H new ATOM 0 HB THR A 77 -3.872 -0.710 -1.859 1.00 38.46 H new ATOM 0 HG1 THR A 77 -2.202 -2.142 -2.573 1.00 38.46 H new ATOM 0 HG21 THR A 77 -4.630 -0.148 -4.130 1.00 38.46 H new ATOM 0 HG22 THR A 77 -4.341 1.302 -3.141 1.00 38.46 H new ATOM 0 HG23 THR A 77 -3.155 0.817 -4.375 1.00 38.46 H new ATOM 1228 N MET A 78 -3.327 1.666 -0.224 1.00 70.15 N ATOM 1229 CA MET A 78 -3.893 2.883 0.334 1.00 70.15 C ATOM 1230 C MET A 78 -2.782 3.832 0.748 1.00 70.15 C ATOM 1231 O MET A 78 -2.854 5.035 0.498 1.00 70.15 O ATOM 1232 CB MET A 78 -4.804 2.569 1.521 1.00 70.15 C ATOM 1233 CG MET A 78 -6.037 1.771 1.126 1.00 70.15 C ATOM 1234 SD MET A 78 -7.552 2.419 1.862 1.00 70.15 S ATOM 1235 CE MET A 78 -8.791 1.465 0.990 1.00 70.15 C ATOM 0 H MET A 78 -3.519 0.816 0.306 1.00 70.15 H new ATOM 0 HA MET A 78 -4.499 3.365 -0.433 1.00 70.15 H new ATOM 0 HB2 MET A 78 -4.240 2.010 2.268 1.00 70.15 H new ATOM 0 HB3 MET A 78 -5.116 3.502 1.990 1.00 70.15 H new ATOM 0 HG2 MET A 78 -6.135 1.775 0.040 1.00 70.15 H new ATOM 0 HG3 MET A 78 -5.905 0.733 1.430 1.00 70.15 H new ATOM 0 HE1 MET A 78 -9.783 1.754 1.337 1.00 70.15 H new ATOM 0 HE2 MET A 78 -8.711 1.656 -0.080 1.00 70.15 H new ATOM 0 HE3 MET A 78 -8.634 0.403 1.181 1.00 70.15 H new ATOM 1245 N VAL A 79 -1.739 3.271 1.348 1.00 44.32 N ATOM 1246 CA VAL A 79 -0.588 4.049 1.776 1.00 44.32 C ATOM 1247 C VAL A 79 0.147 4.585 0.560 1.00 44.32 C ATOM 1248 O VAL A 79 0.532 5.753 0.509 1.00 44.32 O ATOM 1249 CB VAL A 79 0.377 3.177 2.602 1.00 44.32 C ATOM 1250 CG1 VAL A 79 1.497 4.014 3.192 1.00 44.32 C ATOM 1251 CG2 VAL A 79 -0.375 2.423 3.687 1.00 44.32 C ATOM 0 H VAL A 79 -1.669 2.273 1.549 1.00 44.32 H new ATOM 0 HA VAL A 79 -0.940 4.875 2.394 1.00 44.32 H new ATOM 0 HB VAL A 79 0.829 2.444 1.934 1.00 44.32 H new ATOM 0 HG11 VAL A 79 2.164 3.374 3.770 1.00 44.32 H new ATOM 0 HG12 VAL A 79 2.058 4.490 2.388 1.00 44.32 H new ATOM 0 HG13 VAL A 79 1.075 4.780 3.843 1.00 44.32 H new ATOM 0 HG21 VAL A 79 0.325 1.813 4.258 1.00 44.32 H new ATOM 0 HG22 VAL A 79 -0.864 3.135 4.353 1.00 44.32 H new ATOM 0 HG23 VAL A 79 -1.126 1.780 3.229 1.00 44.32 H new ATOM 1261 N VAL A 80 0.318 3.715 -0.422 1.00 90.77 N ATOM 1262 CA VAL A 80 0.984 4.069 -1.662 1.00 90.77 C ATOM 1263 C VAL A 80 0.174 5.103 -2.437 1.00 90.77 C ATOM 1264 O VAL A 80 0.687 6.154 -2.818 1.00 90.77 O ATOM 1265 CB VAL A 80 1.174 2.811 -2.543 1.00 90.77 C ATOM 1266 CG1 VAL A 80 1.784 3.176 -3.893 1.00 90.77 C ATOM 1267 CG2 VAL A 80 2.019 1.766 -1.819 1.00 90.77 C ATOM 0 H VAL A 80 -0.000 2.747 -0.381 1.00 90.77 H new ATOM 0 HA VAL A 80 1.956 4.494 -1.412 1.00 90.77 H new ATOM 0 HB VAL A 80 0.192 2.376 -2.731 1.00 90.77 H new ATOM 0 HG11 VAL A 80 1.907 2.274 -4.493 1.00 90.77 H new ATOM 0 HG12 VAL A 80 1.125 3.871 -4.414 1.00 90.77 H new ATOM 0 HG13 VAL A 80 2.756 3.644 -3.738 1.00 90.77 H new ATOM 0 HG21 VAL A 80 2.140 0.890 -2.457 1.00 90.77 H new ATOM 0 HG22 VAL A 80 2.998 2.186 -1.589 1.00 90.77 H new ATOM 0 HG23 VAL A 80 1.523 1.475 -0.893 1.00 90.77 H new ATOM 1277 N ASP A 81 -1.092 4.794 -2.675 1.00 37.97 N ATOM 1278 CA ASP A 81 -1.962 5.693 -3.410 1.00 37.97 C ATOM 1279 C ASP A 81 -2.108 7.007 -2.670 1.00 37.97 C ATOM 1280 O ASP A 81 -2.138 8.075 -3.280 1.00 37.97 O ATOM 1281 CB ASP A 81 -3.338 5.067 -3.634 1.00 37.97 C ATOM 1282 CG ASP A 81 -4.187 5.865 -4.609 1.00 37.97 C ATOM 1283 OD1 ASP A 81 -3.649 6.799 -5.243 1.00 37.97 O ATOM 1284 OD2 ASP A 81 -5.389 5.554 -4.739 1.00 37.97 O ATOM 0 H ASP A 81 -1.537 3.929 -2.369 1.00 37.97 H new ATOM 0 HA ASP A 81 -1.507 5.879 -4.383 1.00 37.97 H new ATOM 0 HB2 ASP A 81 -3.215 4.052 -4.011 1.00 37.97 H new ATOM 0 HB3 ASP A 81 -3.859 4.992 -2.680 1.00 37.97 H new ATOM 1289 N TYR A 82 -2.184 6.926 -1.342 1.00130.70 N ATOM 1290 CA TYR A 82 -2.310 8.117 -0.531 1.00130.70 C ATOM 1291 C TYR A 82 -1.092 9.009 -0.703 1.00130.70 C ATOM 1292 O TYR A 82 -1.210 10.229 -0.811 1.00130.70 O ATOM 1293 CB TYR A 82 -2.475 7.718 0.939 1.00130.70 C ATOM 1294 CG TYR A 82 -2.204 8.838 1.920 1.00130.70 C ATOM 1295 CD1 TYR A 82 -0.898 9.218 2.215 1.00130.70 C ATOM 1296 CD2 TYR A 82 -3.236 9.517 2.536 1.00130.70 C ATOM 1297 CE1 TYR A 82 -0.636 10.241 3.096 1.00130.70 C ATOM 1298 CE2 TYR A 82 -2.977 10.538 3.414 1.00130.70 C ATOM 1299 CZ TYR A 82 -1.681 10.901 3.691 1.00130.70 C ATOM 1300 OH TYR A 82 -1.432 11.932 4.562 1.00130.70 O ATOM 0 H TYR A 82 -2.160 6.052 -0.817 1.00130.70 H new ATOM 0 HA TYR A 82 -3.189 8.676 -0.852 1.00130.70 H new ATOM 0 HB2 TYR A 82 -3.490 7.353 1.093 1.00130.70 H new ATOM 0 HB3 TYR A 82 -1.802 6.889 1.157 1.00130.70 H new ATOM 0 HD1 TYR A 82 -0.076 8.700 1.744 1.00130.70 H new ATOM 0 HD2 TYR A 82 -4.258 9.241 2.324 1.00130.70 H new ATOM 0 HE1 TYR A 82 0.383 10.522 3.317 1.00130.70 H new ATOM 0 HE2 TYR A 82 -3.795 11.059 3.890 1.00130.70 H new ATOM 0 HH TYR A 82 -0.465 12.081 4.625 1.00130.70 H new ATOM 1310 N ARG A 83 0.083 8.388 -0.708 1.00265.02 N ATOM 1311 CA ARG A 83 1.334 9.119 -0.843 1.00265.02 C ATOM 1312 C ARG A 83 1.258 10.073 -2.025 1.00265.02 C ATOM 1313 O ARG A 83 1.612 11.239 -1.912 1.00265.02 O ATOM 1314 CB ARG A 83 2.485 8.112 -1.004 1.00265.02 C ATOM 1315 CG ARG A 83 3.782 8.711 -1.526 1.00265.02 C ATOM 1316 CD ARG A 83 4.082 8.226 -2.936 1.00265.02 C ATOM 1317 NE ARG A 83 5.518 8.228 -3.217 1.00265.02 N ATOM 1318 CZ ARG A 83 6.276 9.330 -3.243 1.00265.02 C ATOM 1319 NH1 ARG A 83 5.734 10.529 -3.073 1.00265.02 N ATOM 1320 NH2 ARG A 83 7.580 9.229 -3.456 1.00265.02 N ATOM 0 H ARG A 83 0.193 7.378 -0.620 1.00265.02 H new ATOM 0 HA ARG A 83 1.516 9.718 0.049 1.00265.02 H new ATOM 0 HB2 ARG A 83 2.679 7.644 -0.039 1.00265.02 H new ATOM 0 HB3 ARG A 83 2.166 7.321 -1.683 1.00265.02 H new ATOM 0 HG2 ARG A 83 3.712 9.799 -1.520 1.00265.02 H new ATOM 0 HG3 ARG A 83 4.604 8.441 -0.863 1.00265.02 H new ATOM 0 HD2 ARG A 83 3.688 7.218 -3.065 1.00265.02 H new ATOM 0 HD3 ARG A 83 3.570 8.864 -3.656 1.00265.02 H new ATOM 0 HE ARG A 83 5.969 7.333 -3.405 1.00265.02 H new ATOM 0 HH11 ARG A 83 4.729 10.618 -2.920 1.00265.02 H new ATOM 0 HH12 ARG A 83 6.322 11.362 -3.095 1.00265.02 H new ATOM 0 HH21 ARG A 83 8.004 8.312 -3.600 1.00265.02 H new ATOM 0 HH22 ARG A 83 8.160 10.068 -3.476 1.00265.02 H new ATOM 1334 N THR A 84 0.767 9.565 -3.136 1.00259.68 N ATOM 1335 CA THR A 84 0.603 10.351 -4.335 1.00259.68 C ATOM 1336 C THR A 84 -0.648 11.232 -4.282 1.00259.68 C ATOM 1337 O THR A 84 -0.631 12.377 -4.735 1.00259.68 O ATOM 1338 CB THR A 84 0.500 9.431 -5.561 1.00259.68 C ATOM 1339 OG1 THR A 84 1.677 8.621 -5.681 1.00259.68 O ATOM 1340 CG2 THR A 84 0.301 10.243 -6.824 1.00259.68 C ATOM 0 H THR A 84 0.471 8.594 -3.231 1.00259.68 H new ATOM 0 HA THR A 84 1.478 10.996 -4.412 1.00259.68 H new ATOM 0 HB THR A 84 -0.364 8.780 -5.425 1.00259.68 H new ATOM 0 HG1 THR A 84 1.595 8.039 -6.466 1.00259.68 H new ATOM 0 HG21 THR A 84 0.231 9.572 -7.680 1.00259.68 H new ATOM 0 HG22 THR A 84 -0.617 10.824 -6.742 1.00259.68 H new ATOM 0 HG23 THR A 84 1.146 10.917 -6.960 1.00259.68 H new ATOM 1348 N ARG A 85 -1.749 10.667 -3.792 1.00220.68 N ATOM 1349 CA ARG A 85 -3.015 11.387 -3.766 1.00220.68 C ATOM 1350 C ARG A 85 -2.942 12.621 -2.869 1.00220.68 C ATOM 1351 O ARG A 85 -3.382 13.697 -3.258 1.00220.68 O ATOM 1352 CB ARG A 85 -4.171 10.439 -3.366 1.00220.68 C ATOM 1353 CG ARG A 85 -4.526 10.407 -1.887 1.00220.68 C ATOM 1354 CD ARG A 85 -5.550 11.476 -1.563 1.00220.68 C ATOM 1355 NE ARG A 85 -6.244 11.209 -0.301 1.00220.68 N ATOM 1356 CZ ARG A 85 -7.463 11.664 -0.002 1.00220.68 C ATOM 1357 NH1 ARG A 85 -8.132 12.429 -0.858 1.00220.68 N ATOM 1358 NH2 ARG A 85 -8.016 11.353 1.162 1.00220.68 N ATOM 0 H ARG A 85 -1.789 9.722 -3.411 1.00220.68 H new ATOM 0 HA ARG A 85 -3.222 11.750 -4.773 1.00220.68 H new ATOM 0 HB2 ARG A 85 -5.061 10.726 -3.927 1.00220.68 H new ATOM 0 HB3 ARG A 85 -3.910 9.428 -3.679 1.00220.68 H new ATOM 0 HG2 ARG A 85 -4.920 9.426 -1.623 1.00220.68 H new ATOM 0 HG3 ARG A 85 -3.628 10.562 -1.288 1.00220.68 H new ATOM 0 HD2 ARG A 85 -5.056 12.446 -1.506 1.00220.68 H new ATOM 0 HD3 ARG A 85 -6.279 11.536 -2.371 1.00220.68 H new ATOM 0 HE ARG A 85 -5.764 10.638 0.395 1.00220.68 H new ATOM 0 HH11 ARG A 85 -7.715 12.675 -1.756 1.00220.68 H new ATOM 0 HH12 ARG A 85 -9.063 12.770 -0.617 1.00220.68 H new ATOM 0 HH21 ARG A 85 -7.510 10.767 1.827 1.00220.68 H new ATOM 0 HH22 ARG A 85 -8.947 11.699 1.393 1.00220.68 H new ATOM 1372 N VAL A 86 -2.356 12.473 -1.687 1.00 63.58 N ATOM 1373 CA VAL A 86 -2.210 13.605 -0.785 1.00 63.58 C ATOM 1374 C VAL A 86 -1.075 14.492 -1.276 1.00 63.58 C ATOM 1375 O VAL A 86 -1.112 15.705 -1.111 1.00 63.58 O ATOM 1376 CB VAL A 86 -1.990 13.158 0.678 1.00 63.58 C ATOM 1377 CG1 VAL A 86 -1.610 14.334 1.577 1.00 63.58 C ATOM 1378 CG2 VAL A 86 -3.261 12.495 1.186 1.00 63.58 C ATOM 0 H VAL A 86 -1.979 11.593 -1.336 1.00 63.58 H new ATOM 0 HA VAL A 86 -3.138 14.176 -0.790 1.00 63.58 H new ATOM 0 HB VAL A 86 -1.161 12.450 0.706 1.00 63.58 H new ATOM 0 HG11 VAL A 86 -1.464 13.980 2.597 1.00 63.58 H new ATOM 0 HG12 VAL A 86 -0.687 14.786 1.214 1.00 63.58 H new ATOM 0 HG13 VAL A 86 -2.408 15.076 1.562 1.00 63.58 H new ATOM 0 HG21 VAL A 86 -3.117 12.175 2.218 1.00 63.58 H new ATOM 0 HG22 VAL A 86 -4.086 13.205 1.138 1.00 63.58 H new ATOM 0 HG23 VAL A 86 -3.492 11.628 0.567 1.00 63.58 H new ATOM 1583 N LEU A 99 15.602 26.075 2.140 1.00281.45 N ATOM 1584 CA LEU A 99 15.791 27.011 3.240 1.00281.45 C ATOM 1585 C LEU A 99 15.020 26.574 4.477 1.00281.45 C ATOM 1586 O LEU A 99 13.802 26.402 4.438 1.00281.45 O ATOM 1587 CB LEU A 99 15.352 28.409 2.823 1.00281.45 C ATOM 1588 CG LEU A 99 16.401 29.203 2.047 1.00281.45 C ATOM 1589 CD1 LEU A 99 16.831 28.436 0.808 1.00281.45 C ATOM 1590 CD2 LEU A 99 15.859 30.573 1.675 1.00281.45 C ATOM 0 HA LEU A 99 16.852 27.025 3.488 1.00281.45 H new ATOM 0 HB2 LEU A 99 14.454 28.326 2.211 1.00281.45 H new ATOM 0 HB3 LEU A 99 15.078 28.971 3.716 1.00281.45 H new ATOM 0 HG LEU A 99 17.275 29.345 2.682 1.00281.45 H new ATOM 0 HD11 LEU A 99 17.579 29.013 0.264 1.00281.45 H new ATOM 0 HD12 LEU A 99 17.257 27.477 1.103 1.00281.45 H new ATOM 0 HD13 LEU A 99 15.966 28.267 0.166 1.00281.45 H new ATOM 0 HD21 LEU A 99 16.618 31.127 1.123 1.00281.45 H new ATOM 0 HD22 LEU A 99 14.971 30.457 1.054 1.00281.45 H new ATOM 0 HD23 LEU A 99 15.599 31.120 2.581 1.00281.45 H new ATOM 1602 N THR A 100 15.743 26.392 5.575 1.00235.89 N ATOM 1603 CA THR A 100 15.135 25.970 6.826 1.00235.89 C ATOM 1604 C THR A 100 14.825 27.156 7.742 1.00235.89 C ATOM 1605 O THR A 100 13.708 27.672 7.739 1.00235.89 O ATOM 1606 CB THR A 100 16.033 24.960 7.556 1.00235.89 C ATOM 1607 OG1 THR A 100 17.320 25.536 7.811 1.00235.89 O ATOM 1608 CG2 THR A 100 16.196 23.705 6.722 1.00235.89 C ATOM 0 H THR A 100 16.752 26.531 5.622 1.00235.89 H new ATOM 0 HA THR A 100 14.190 25.489 6.574 1.00235.89 H new ATOM 0 HB THR A 100 15.562 24.701 8.504 1.00235.89 H new ATOM 0 HG1 THR A 100 17.862 24.908 8.334 1.00235.89 H new ATOM 0 HG21 THR A 100 16.835 22.997 7.251 1.00235.89 H new ATOM 0 HG22 THR A 100 15.219 23.253 6.549 1.00235.89 H new ATOM 0 HG23 THR A 100 16.652 23.961 5.765 1.00235.89 H new ATOM 1616 N ARG A 101 15.814 27.583 8.528 1.00326.00 N ATOM 1617 CA ARG A 101 15.631 28.702 9.440 1.00326.00 C ATOM 1618 C ARG A 101 16.023 30.012 8.770 1.00326.00 C ATOM 1619 O ARG A 101 17.156 30.473 8.904 1.00326.00 O ATOM 1620 CB ARG A 101 16.451 28.485 10.707 1.00326.00 C ATOM 1621 CG ARG A 101 16.198 27.135 11.357 1.00326.00 C ATOM 1622 CD ARG A 101 17.099 26.061 10.782 1.00326.00 C ATOM 1623 NE ARG A 101 17.368 25.006 11.759 1.00326.00 N ATOM 1624 CZ ARG A 101 18.379 24.146 11.671 1.00326.00 C ATOM 1625 NH1 ARG A 101 19.233 24.207 10.655 1.00326.00 N ATOM 1626 NH2 ARG A 101 18.542 23.222 12.609 1.00326.00 N ATOM 0 H ARG A 101 16.746 27.169 8.548 1.00326.00 H new ATOM 0 HA ARG A 101 14.577 28.760 9.710 1.00326.00 H new ATOM 0 HB2 ARG A 101 17.510 28.573 10.466 1.00326.00 H new ATOM 0 HB3 ARG A 101 16.220 29.275 11.422 1.00326.00 H new ATOM 0 HG2 ARG A 101 16.363 27.212 12.432 1.00326.00 H new ATOM 0 HG3 ARG A 101 15.155 26.851 11.214 1.00326.00 H new ATOM 0 HD2 ARG A 101 16.632 25.628 9.897 1.00326.00 H new ATOM 0 HD3 ARG A 101 18.039 26.508 10.460 1.00326.00 H new ATOM 0 HE ARG A 101 16.740 24.925 12.559 1.00326.00 H new ATOM 0 HH11 ARG A 101 19.117 24.918 9.933 1.00326.00 H new ATOM 0 HH12 ARG A 101 20.005 23.543 10.597 1.00326.00 H new ATOM 0 HH21 ARG A 101 17.893 23.173 13.394 1.00326.00 H new ATOM 0 HH22 ARG A 101 19.316 22.561 12.545 1.00326.00 H new ATOM 1640 N ILE A 102 15.087 30.596 8.033 1.00164.55 N ATOM 1641 CA ILE A 102 15.340 31.839 7.321 1.00164.55 C ATOM 1642 C ILE A 102 14.297 32.898 7.675 1.00164.55 C ATOM 1643 O ILE A 102 13.354 33.127 6.921 1.00164.55 O ATOM 1644 CB ILE A 102 15.353 31.608 5.795 1.00164.55 C ATOM 1645 CG1 ILE A 102 16.478 30.643 5.417 1.00164.55 C ATOM 1646 CG2 ILE A 102 15.521 32.921 5.037 1.00164.55 C ATOM 1647 CD1 ILE A 102 16.257 29.222 5.879 1.00164.55 C ATOM 0 H ILE A 102 14.144 30.227 7.913 1.00164.55 H new ATOM 0 HA ILE A 102 16.321 32.199 7.631 1.00164.55 H new ATOM 0 HB ILE A 102 14.394 31.173 5.515 1.00164.55 H new ATOM 0 HG12 ILE A 102 16.596 30.647 4.333 1.00164.55 H new ATOM 0 HG13 ILE A 102 17.413 31.009 5.840 1.00164.55 H new ATOM 0 HG21 ILE A 102 15.526 32.724 3.965 1.00164.55 H new ATOM 0 HG22 ILE A 102 14.695 33.589 5.279 1.00164.55 H new ATOM 0 HG23 ILE A 102 16.462 33.389 5.324 1.00164.55 H new ATOM 0 HD11 ILE A 102 17.100 28.604 5.570 1.00164.55 H new ATOM 0 HD12 ILE A 102 16.171 29.202 6.965 1.00164.55 H new ATOM 0 HD13 ILE A 102 15.340 28.833 5.435 1.00164.55 H new ATOM 1659 N PRO A 103 14.460 33.568 8.827 1.00 72.69 N ATOM 1660 CA PRO A 103 13.533 34.616 9.263 1.00 72.69 C ATOM 1661 C PRO A 103 13.429 35.755 8.248 1.00 72.69 C ATOM 1662 O PRO A 103 12.433 36.477 8.212 1.00 72.69 O ATOM 1663 CB PRO A 103 14.141 35.117 10.575 1.00 72.69 C ATOM 1664 CG PRO A 103 15.555 34.654 10.559 1.00 72.69 C ATOM 1665 CD PRO A 103 15.560 33.372 9.785 1.00 72.69 C ATOM 0 HA PRO A 103 12.516 34.239 9.373 1.00 72.69 H new ATOM 0 HB2 PRO A 103 14.084 36.203 10.644 1.00 72.69 H new ATOM 0 HB3 PRO A 103 13.606 34.714 11.435 1.00 72.69 H new ATOM 0 HG2 PRO A 103 16.203 35.395 10.091 1.00 72.69 H new ATOM 0 HG3 PRO A 103 15.927 34.500 11.572 1.00 72.69 H new ATOM 0 HD2 PRO A 103 16.512 33.207 9.280 1.00 72.69 H new ATOM 0 HD3 PRO A 103 15.387 32.510 10.429 1.00 72.69 H new ATOM 1673 N SER A 104 14.462 35.907 7.418 1.00159.85 N ATOM 1674 CA SER A 104 14.481 36.956 6.400 1.00159.85 C ATOM 1675 C SER A 104 13.723 36.539 5.133 1.00159.85 C ATOM 1676 O SER A 104 13.646 37.305 4.173 1.00159.85 O ATOM 1677 CB SER A 104 15.923 37.316 6.043 1.00159.85 C ATOM 1678 OG SER A 104 16.626 37.801 7.175 1.00159.85 O ATOM 0 H SER A 104 15.294 35.318 7.431 1.00159.85 H new ATOM 0 HA SER A 104 13.977 37.827 6.819 1.00159.85 H new ATOM 0 HB2 SER A 104 16.432 36.438 5.644 1.00159.85 H new ATOM 0 HB3 SER A 104 15.928 38.072 5.257 1.00159.85 H new ATOM 0 HG SER A 104 17.546 38.022 6.919 1.00159.85 H new ATOM 1684 N ALA A 105 13.157 35.331 5.134 1.00293.58 N ATOM 1685 CA ALA A 105 12.404 34.835 3.987 1.00293.58 C ATOM 1686 C ALA A 105 11.243 33.969 4.455 1.00293.58 C ATOM 1687 O ALA A 105 10.077 34.321 4.271 1.00293.58 O ATOM 1688 CB ALA A 105 13.312 34.051 3.052 1.00293.58 C ATOM 0 H ALA A 105 13.207 34.680 5.918 1.00293.58 H new ATOM 0 HA ALA A 105 12.003 35.687 3.439 1.00293.58 H new ATOM 0 HB1 ALA A 105 12.734 33.689 2.202 1.00293.58 H new ATOM 0 HB2 ALA A 105 14.114 34.698 2.696 1.00293.58 H new ATOM 0 HB3 ALA A 105 13.741 33.204 3.587 1.00293.58 H new ATOM 1694 N LYS A 106 11.570 32.843 5.082 1.00328.40 N ATOM 1695 CA LYS A 106 10.556 31.936 5.602 1.00328.40 C ATOM 1696 C LYS A 106 10.093 32.424 6.968 1.00328.40 C ATOM 1697 O LYS A 106 10.913 32.861 7.777 1.00328.40 O ATOM 1698 CB LYS A 106 11.121 30.521 5.731 1.00328.40 C ATOM 1699 CG LYS A 106 11.752 29.990 4.458 1.00328.40 C ATOM 1700 CD LYS A 106 12.065 28.508 4.578 1.00328.40 C ATOM 1701 CE LYS A 106 10.796 27.672 4.675 1.00328.40 C ATOM 1702 NZ LYS A 106 10.552 27.187 6.062 1.00328.40 N ATOM 0 H LYS A 106 12.530 32.538 5.242 1.00328.40 H new ATOM 0 HA LYS A 106 9.713 31.916 4.911 1.00328.40 H new ATOM 0 HB2 LYS A 106 11.867 30.510 6.526 1.00328.40 H new ATOM 0 HB3 LYS A 106 10.320 29.847 6.036 1.00328.40 H new ATOM 0 HG2 LYS A 106 11.077 30.155 3.618 1.00328.40 H new ATOM 0 HG3 LYS A 106 12.667 30.542 4.245 1.00328.40 H new ATOM 0 HD2 LYS A 106 12.647 28.188 3.714 1.00328.40 H new ATOM 0 HD3 LYS A 106 12.682 28.336 5.460 1.00328.40 H new ATOM 0 HE2 LYS A 106 9.944 28.266 4.344 1.00328.40 H new ATOM 0 HE3 LYS A 106 10.871 26.819 4.001 1.00328.40 H new ATOM 0 HZ1 LYS A 106 9.531 27.055 6.209 1.00328.40 H new ATOM 0 HZ2 LYS A 106 11.042 26.281 6.204 1.00328.40 H new ATOM 0 HZ3 LYS A 106 10.913 27.886 6.743 1.00328.40 H new ATOM 1716 N LYS A 107 8.790 32.364 7.232 1.00281.61 N ATOM 1717 CA LYS A 107 8.277 32.825 8.517 1.00281.61 C ATOM 1718 C LYS A 107 8.025 31.686 9.498 1.00281.61 C ATOM 1719 O LYS A 107 7.573 30.600 9.134 1.00281.61 O ATOM 1720 CB LYS A 107 6.999 33.639 8.354 1.00281.61 C ATOM 1721 CG LYS A 107 7.176 34.893 7.516 1.00281.61 C ATOM 1722 CD LYS A 107 5.892 35.705 7.460 1.00281.61 C ATOM 1723 CE LYS A 107 5.570 36.344 8.806 1.00281.61 C ATOM 1724 NZ LYS A 107 5.634 37.830 8.747 1.00281.61 N ATOM 0 H LYS A 107 8.084 32.008 6.588 1.00281.61 H new ATOM 0 HA LYS A 107 9.060 33.460 8.931 1.00281.61 H new ATOM 0 HB2 LYS A 107 6.235 33.011 7.895 1.00281.61 H new ATOM 0 HB3 LYS A 107 6.630 33.921 9.340 1.00281.61 H new ATOM 0 HG2 LYS A 107 7.977 35.503 7.935 1.00281.61 H new ATOM 0 HG3 LYS A 107 7.480 34.618 6.506 1.00281.61 H new ATOM 0 HD2 LYS A 107 5.986 36.482 6.701 1.00281.61 H new ATOM 0 HD3 LYS A 107 5.067 35.061 7.156 1.00281.61 H new ATOM 0 HE2 LYS A 107 4.574 36.036 9.124 1.00281.61 H new ATOM 0 HE3 LYS A 107 6.271 35.980 9.557 1.00281.61 H new ATOM 0 HZ1 LYS A 107 5.409 38.225 9.682 1.00281.61 H new ATOM 0 HZ2 LYS A 107 6.591 38.125 8.468 1.00281.61 H new ATOM 0 HZ3 LYS A 107 4.947 38.180 8.049 1.00281.61 H new ATOM 1738 N TYR A 108 8.315 31.985 10.753 1.00309.62 N ATOM 1739 CA TYR A 108 8.139 31.068 11.873 1.00309.62 C ATOM 1740 C TYR A 108 6.681 30.665 12.058 1.00309.62 C ATOM 1741 O TYR A 108 5.773 31.479 11.894 1.00309.62 O ATOM 1742 CB TYR A 108 8.609 31.765 13.150 1.00309.62 C ATOM 1743 CG TYR A 108 7.804 33.018 13.447 1.00309.62 C ATOM 1744 CD1 TYR A 108 8.137 34.240 12.870 1.00309.62 C ATOM 1745 CD2 TYR A 108 6.697 32.971 14.282 1.00309.62 C ATOM 1746 CE1 TYR A 108 7.398 35.374 13.120 1.00309.62 C ATOM 1747 CE2 TYR A 108 5.948 34.105 14.536 1.00309.62 C ATOM 1748 CZ TYR A 108 6.304 35.304 13.954 1.00309.62 C ATOM 1749 OH TYR A 108 5.561 36.433 14.206 1.00309.62 O ATOM 0 H TYR A 108 8.688 32.893 11.031 1.00309.62 H new ATOM 0 HA TYR A 108 8.719 30.168 11.666 1.00309.62 H new ATOM 0 HB2 TYR A 108 8.528 31.075 13.990 1.00309.62 H new ATOM 0 HB3 TYR A 108 9.663 32.026 13.053 1.00309.62 H new ATOM 0 HD1 TYR A 108 8.992 34.300 12.213 1.00309.62 H new ATOM 0 HD2 TYR A 108 6.416 32.034 14.741 1.00309.62 H new ATOM 0 HE1 TYR A 108 7.674 36.314 12.665 1.00309.62 H new ATOM 0 HE2 TYR A 108 5.088 34.052 15.187 1.00309.62 H new ATOM 0 HH TYR A 108 4.824 36.211 14.813 1.00309.62 H new ATOM 1759 N LYS A 109 6.473 29.416 12.447 1.00276.51 N ATOM 1760 CA LYS A 109 5.132 28.914 12.710 1.00276.51 C ATOM 1761 C LYS A 109 4.868 28.789 14.207 1.00276.51 C ATOM 1762 O LYS A 109 3.930 28.108 14.623 1.00276.51 O ATOM 1763 CB LYS A 109 4.907 27.578 12.013 1.00276.51 C ATOM 1764 CG LYS A 109 6.040 26.593 12.231 1.00276.51 C ATOM 1765 CD LYS A 109 5.791 25.293 11.487 1.00276.51 C ATOM 1766 CE LYS A 109 4.508 24.625 11.957 1.00276.51 C ATOM 1767 NZ LYS A 109 4.371 23.246 11.417 1.00276.51 N ATOM 0 H LYS A 109 7.216 28.731 12.588 1.00276.51 H new ATOM 0 HA LYS A 109 4.424 29.638 12.305 1.00276.51 H new ATOM 0 HB2 LYS A 109 3.977 27.139 12.375 1.00276.51 H new ATOM 0 HB3 LYS A 109 4.784 27.749 10.944 1.00276.51 H new ATOM 0 HG2 LYS A 109 6.978 27.034 11.894 1.00276.51 H new ATOM 0 HG3 LYS A 109 6.148 26.390 13.296 1.00276.51 H new ATOM 0 HD2 LYS A 109 5.730 25.490 10.417 1.00276.51 H new ATOM 0 HD3 LYS A 109 6.632 24.617 11.639 1.00276.51 H new ATOM 0 HE2 LYS A 109 4.494 24.591 13.046 1.00276.51 H new ATOM 0 HE3 LYS A 109 3.652 25.224 11.646 1.00276.51 H new ATOM 0 HZ1 LYS A 109 3.484 22.825 11.760 1.00276.51 H new ATOM 0 HZ2 LYS A 109 4.359 23.280 10.378 1.00276.51 H new ATOM 0 HZ3 LYS A 109 5.175 22.667 11.735 1.00276.51 H new ATOM 1781 N ASP A 110 5.674 29.480 15.016 1.00203.92 N ATOM 1782 CA ASP A 110 5.493 29.471 16.466 1.00203.92 C ATOM 1783 C ASP A 110 4.079 29.929 16.806 1.00203.92 C ATOM 1784 O ASP A 110 3.485 29.497 17.795 1.00203.92 O ATOM 1785 CB ASP A 110 6.520 30.389 17.138 1.00203.92 C ATOM 1786 CG ASP A 110 7.928 29.826 17.080 1.00203.92 C ATOM 1787 OD1 ASP A 110 8.078 28.630 16.751 1.00203.92 O ATOM 1788 OD2 ASP A 110 8.881 30.580 17.369 1.00203.92 O ATOM 0 H ASP A 110 6.455 30.050 14.692 1.00203.92 H new ATOM 0 HA ASP A 110 5.642 28.457 16.837 1.00203.92 H new ATOM 0 HB2 ASP A 110 6.502 31.365 16.653 1.00203.92 H new ATOM 0 HB3 ASP A 110 6.237 30.545 18.179 1.00203.92 H new ATOM 1793 N ILE A 111 3.545 30.791 15.946 1.00 50.97 N ATOM 1794 CA ILE A 111 2.206 31.306 16.092 1.00 50.97 C ATOM 1795 C ILE A 111 1.224 30.315 15.466 1.00 50.97 C ATOM 1796 O ILE A 111 1.596 29.537 14.586 1.00 50.97 O ATOM 1797 CB ILE A 111 2.125 32.727 15.450 1.00 50.97 C ATOM 1798 CG1 ILE A 111 2.637 33.803 16.430 1.00 50.97 C ATOM 1799 CG2 ILE A 111 0.715 33.080 14.982 1.00 50.97 C ATOM 1800 CD1 ILE A 111 3.855 33.401 17.248 1.00 50.97 C ATOM 0 H ILE A 111 4.039 31.148 15.128 1.00 50.97 H new ATOM 0 HA ILE A 111 1.939 31.414 17.143 1.00 50.97 H new ATOM 0 HB ILE A 111 2.767 32.705 14.570 1.00 50.97 H new ATOM 0 HG12 ILE A 111 2.879 34.703 15.864 1.00 50.97 H new ATOM 0 HG13 ILE A 111 1.829 34.064 17.114 1.00 50.97 H new ATOM 0 HG21 ILE A 111 0.716 34.078 14.544 1.00 50.97 H new ATOM 0 HG22 ILE A 111 0.388 32.356 14.235 1.00 50.97 H new ATOM 0 HG23 ILE A 111 0.033 33.058 15.832 1.00 50.97 H new ATOM 0 HD11 ILE A 111 4.139 34.222 17.906 1.00 50.97 H new ATOM 0 HD12 ILE A 111 3.617 32.522 17.847 1.00 50.97 H new ATOM 0 HD13 ILE A 111 4.683 33.170 16.578 1.00 50.97 H new ATOM 1812 N ILE A 112 -0.016 30.330 15.931 1.00108.96 N ATOM 1813 CA ILE A 112 -1.020 29.413 15.416 1.00108.96 C ATOM 1814 C ILE A 112 -1.804 30.031 14.266 1.00108.96 C ATOM 1815 O ILE A 112 -2.497 31.033 14.437 1.00108.96 O ATOM 1816 CB ILE A 112 -2.002 28.982 16.527 1.00108.96 C ATOM 1817 CG1 ILE A 112 -1.231 28.432 17.727 1.00108.96 C ATOM 1818 CG2 ILE A 112 -2.989 27.942 16.008 1.00108.96 C ATOM 1819 CD1 ILE A 112 -0.329 27.265 17.384 1.00108.96 C ATOM 0 H ILE A 112 -0.349 30.962 16.659 1.00108.96 H new ATOM 0 HA ILE A 112 -0.487 28.536 15.047 1.00108.96 H new ATOM 0 HB ILE A 112 -2.568 29.858 16.843 1.00108.96 H new ATOM 0 HG12 ILE A 112 -0.629 29.231 18.159 1.00108.96 H new ATOM 0 HG13 ILE A 112 -1.941 28.119 18.492 1.00108.96 H new ATOM 0 HG21 ILE A 112 -3.670 27.655 16.809 1.00108.96 H new ATOM 0 HG22 ILE A 112 -3.560 28.363 15.180 1.00108.96 H new ATOM 0 HG23 ILE A 112 -2.444 27.064 15.663 1.00108.96 H new ATOM 0 HD11 ILE A 112 0.186 26.927 18.283 1.00108.96 H new ATOM 0 HD12 ILE A 112 -0.928 26.449 16.980 1.00108.96 H new ATOM 0 HD13 ILE A 112 0.405 27.578 16.642 1.00108.96 H new