USER MOD reduce.3.24.130724 H: found=0, std=0, add=1007, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1001 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 50 MET CE :methyl 146:sc=-0.00377 (180deg=-0.257) USER MOD Set 1.2: A 101 HIS : no HD1:sc=-0.00566 X(o=-0.0094,f=-0.32) USER MOD Set 2.1: A 5 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 8 SER OG : rot 47:sc= 0.804 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 24:sc= 0.0688 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 11 ASN : amide:sc= -1.02 K(o=-1,f=-2!) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 ASN : amide:sc= -2.59! K(o=-2.6!,f=-0.37) USER MOD Single : A 19 GLN : amide:sc= -0.766 K(o=-0.77,f=-1.8) USER MOD Single : A 21 GLN : amide:sc=-0.000466 X(o=-0.00047,f=0) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 27 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 THR OG1 : rot 57:sc= 0.284 USER MOD Single : A 36 SER OG : rot 79:sc= 1.17 USER MOD Single : A 37 CYS SG : rot 180:sc= 0.0651 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 40 CYS SG : rot -104:sc= 1.07 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 MET CE :methyl -167:sc=-0.00716 (180deg=-0.254) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 LYS NZ :NH3+ -149:sc= -0.22 (180deg=-1.09) USER MOD Single : A 48 HIS : no HD1:sc= -0.158 X(o=-0.16,f=-0.0013) USER MOD Single : A 51 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 53 ASN : amide:sc= 0 X(o=0,f=-0.14) USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc= -0.479 X(o=-0.48,f=-0.66) USER MOD Single : A 67 GLN : amide:sc= -6.55! C(o=-6.5!,f=-5.5!) USER MOD Single : A 69 GLN : amide:sc= -1.4 K(o=-1.4,f=-2.2!) USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 MET CE :methyl -167:sc= 0 (180deg=-0.154) USER MOD Single : A 76 THR OG1 : rot 153:sc= -0.167 USER MOD Single : A 80 THR OG1 : rot 48:sc= -0.471 USER MOD Single : A 87 ASN : amide:sc= -3.36 K(o=-3.4,f=-6.7!) USER MOD Single : A 89 THR OG1 : rot 7:sc= 0.192 USER MOD Single : A 95 THR OG1 : rot 180:sc= 0.0212 USER MOD Single : A 97 THR OG1 : rot 75:sc= -0.62 USER MOD Single : A 98 HIS : no HD1:sc= -0.171 K(o=-0.17,f=-0.95) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 HIS : no HD1:sc= -5.84! C(o=-5.8!,f=-5.4!) USER MOD Single : A 112 GLN : amide:sc= -1.95! C(o=-2!,f=-4.9!) USER MOD Single : A 114 TYR OH : rot 180:sc= 0 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 LYS NZ :NH3+ 152:sc= -0.0867 (180deg=-0.559) USER MOD Single : A 118 SER OG : rot 13:sc= 0.978 USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 129 SER OG : rot 40:sc= 0.424 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 7.467 -5.977 -23.135 1.00 0.00 N ATOM 2 CA GLY A 1 8.415 -5.421 -22.187 1.00 0.00 C ATOM 3 C GLY A 1 9.194 -6.492 -21.450 1.00 0.00 C ATOM 4 O GLY A 1 8.748 -6.994 -20.418 1.00 0.00 O ATOM 0 H1 GLY A 1 6.960 -5.205 -23.613 1.00 0.00 H new ATOM 0 H2 GLY A 1 7.976 -6.546 -23.841 1.00 0.00 H new ATOM 0 H3 GLY A 1 6.785 -6.579 -22.631 1.00 0.00 H new ATOM 0 HA2 GLY A 1 9.111 -4.768 -22.714 1.00 0.00 H new ATOM 0 HA3 GLY A 1 7.882 -4.802 -21.465 1.00 0.00 H new ATOM 8 N SER A 2 10.360 -6.845 -21.981 1.00 0.00 N ATOM 9 CA SER A 2 11.200 -7.867 -21.369 1.00 0.00 C ATOM 10 C SER A 2 12.236 -7.237 -20.442 1.00 0.00 C ATOM 11 O SER A 2 12.874 -6.244 -20.791 1.00 0.00 O ATOM 12 CB SER A 2 11.901 -8.695 -22.448 1.00 0.00 C ATOM 13 OG SER A 2 13.034 -8.013 -22.958 1.00 0.00 O ATOM 0 H SER A 2 10.744 -6.438 -22.834 1.00 0.00 H new ATOM 0 HA SER A 2 10.560 -8.521 -20.778 1.00 0.00 H new ATOM 0 HB2 SER A 2 12.207 -9.655 -22.033 1.00 0.00 H new ATOM 0 HB3 SER A 2 11.204 -8.906 -23.259 1.00 0.00 H new ATOM 0 HG SER A 2 13.465 -8.563 -23.645 1.00 0.00 H new ATOM 19 N SER A 3 12.397 -7.823 -19.260 1.00 0.00 N ATOM 20 CA SER A 3 13.352 -7.317 -18.281 1.00 0.00 C ATOM 21 C SER A 3 13.869 -8.446 -17.394 1.00 0.00 C ATOM 22 O SER A 3 13.091 -9.218 -16.835 1.00 0.00 O ATOM 23 CB SER A 3 12.705 -6.232 -17.419 1.00 0.00 C ATOM 24 OG SER A 3 11.514 -6.704 -16.813 1.00 0.00 O ATOM 0 H SER A 3 11.879 -8.648 -18.957 1.00 0.00 H new ATOM 0 HA SER A 3 14.195 -6.887 -18.821 1.00 0.00 H new ATOM 0 HB2 SER A 3 13.405 -5.910 -16.649 1.00 0.00 H new ATOM 0 HB3 SER A 3 12.483 -5.359 -18.033 1.00 0.00 H new ATOM 0 HG SER A 3 11.546 -7.681 -16.745 1.00 0.00 H new ATOM 30 N GLY A 4 15.190 -8.535 -17.270 1.00 0.00 N ATOM 31 CA GLY A 4 15.790 -9.571 -16.450 1.00 0.00 C ATOM 32 C GLY A 4 17.243 -9.822 -16.803 1.00 0.00 C ATOM 33 O GLY A 4 17.716 -9.391 -17.855 1.00 0.00 O ATOM 0 H GLY A 4 15.855 -7.908 -17.723 1.00 0.00 H new ATOM 0 HA2 GLY A 4 15.718 -9.286 -15.400 1.00 0.00 H new ATOM 0 HA3 GLY A 4 15.226 -10.496 -16.568 1.00 0.00 H new ATOM 37 N SER A 5 17.953 -10.520 -15.922 1.00 0.00 N ATOM 38 CA SER A 5 19.362 -10.823 -16.144 1.00 0.00 C ATOM 39 C SER A 5 19.569 -12.319 -16.359 1.00 0.00 C ATOM 40 O SER A 5 18.749 -13.136 -15.941 1.00 0.00 O ATOM 41 CB SER A 5 20.201 -10.345 -14.957 1.00 0.00 C ATOM 42 OG SER A 5 19.773 -10.956 -13.752 1.00 0.00 O ATOM 0 H SER A 5 17.576 -10.886 -15.048 1.00 0.00 H new ATOM 0 HA SER A 5 19.684 -10.297 -17.043 1.00 0.00 H new ATOM 0 HB2 SER A 5 21.251 -10.577 -15.133 1.00 0.00 H new ATOM 0 HB3 SER A 5 20.125 -9.261 -14.866 1.00 0.00 H new ATOM 0 HG SER A 5 20.326 -10.636 -13.009 1.00 0.00 H new ATOM 48 N SER A 6 20.671 -12.669 -17.015 1.00 0.00 N ATOM 49 CA SER A 6 20.985 -14.066 -17.290 1.00 0.00 C ATOM 50 C SER A 6 22.328 -14.452 -16.677 1.00 0.00 C ATOM 51 O SER A 6 23.367 -13.899 -17.034 1.00 0.00 O ATOM 52 CB SER A 6 21.009 -14.318 -18.799 1.00 0.00 C ATOM 53 OG SER A 6 19.747 -14.043 -19.382 1.00 0.00 O ATOM 0 H SER A 6 21.361 -12.005 -17.366 1.00 0.00 H new ATOM 0 HA SER A 6 20.208 -14.683 -16.838 1.00 0.00 H new ATOM 0 HB2 SER A 6 21.772 -13.693 -19.263 1.00 0.00 H new ATOM 0 HB3 SER A 6 21.285 -15.354 -18.993 1.00 0.00 H new ATOM 0 HG SER A 6 19.789 -14.210 -20.347 1.00 0.00 H new ATOM 59 N GLY A 7 22.297 -15.405 -15.751 1.00 0.00 N ATOM 60 CA GLY A 7 23.517 -15.849 -15.102 1.00 0.00 C ATOM 61 C GLY A 7 24.006 -14.869 -14.055 1.00 0.00 C ATOM 62 O GLY A 7 25.199 -14.574 -13.980 1.00 0.00 O ATOM 0 H GLY A 7 21.449 -15.878 -15.438 1.00 0.00 H new ATOM 0 HA2 GLY A 7 23.344 -16.819 -14.635 1.00 0.00 H new ATOM 0 HA3 GLY A 7 24.294 -15.991 -15.853 1.00 0.00 H new ATOM 66 N SER A 8 23.083 -14.361 -13.244 1.00 0.00 N ATOM 67 CA SER A 8 23.426 -13.404 -12.199 1.00 0.00 C ATOM 68 C SER A 8 23.631 -14.110 -10.862 1.00 0.00 C ATOM 69 O SER A 8 22.669 -14.463 -10.179 1.00 0.00 O ATOM 70 CB SER A 8 22.329 -12.346 -12.067 1.00 0.00 C ATOM 71 OG SER A 8 21.084 -12.940 -11.743 1.00 0.00 O ATOM 0 H SER A 8 22.092 -14.597 -13.291 1.00 0.00 H new ATOM 0 HA SER A 8 24.359 -12.916 -12.479 1.00 0.00 H new ATOM 0 HB2 SER A 8 22.604 -11.627 -11.296 1.00 0.00 H new ATOM 0 HB3 SER A 8 22.239 -11.792 -13.002 1.00 0.00 H new ATOM 0 HG SER A 8 21.209 -13.585 -11.016 1.00 0.00 H new ATOM 77 N LEU A 9 24.892 -14.311 -10.494 1.00 0.00 N ATOM 78 CA LEU A 9 25.225 -14.974 -9.238 1.00 0.00 C ATOM 79 C LEU A 9 25.845 -13.991 -8.251 1.00 0.00 C ATOM 80 O LEU A 9 26.094 -14.332 -7.095 1.00 0.00 O ATOM 81 CB LEU A 9 26.189 -16.135 -9.492 1.00 0.00 C ATOM 82 CG LEU A 9 26.113 -17.299 -8.503 1.00 0.00 C ATOM 83 CD1 LEU A 9 26.520 -18.600 -9.177 1.00 0.00 C ATOM 84 CD2 LEU A 9 26.991 -17.026 -7.290 1.00 0.00 C ATOM 0 H LEU A 9 25.700 -14.025 -11.047 1.00 0.00 H new ATOM 0 HA LEU A 9 24.303 -15.362 -8.805 1.00 0.00 H new ATOM 0 HB2 LEU A 9 26.003 -16.523 -10.494 1.00 0.00 H new ATOM 0 HB3 LEU A 9 27.207 -15.744 -9.485 1.00 0.00 H new ATOM 0 HG LEU A 9 25.081 -17.397 -8.165 1.00 0.00 H new ATOM 0 HD11 LEU A 9 26.460 -19.417 -8.458 1.00 0.00 H new ATOM 0 HD12 LEU A 9 25.850 -18.802 -10.013 1.00 0.00 H new ATOM 0 HD13 LEU A 9 27.543 -18.515 -9.545 1.00 0.00 H new ATOM 0 HD21 LEU A 9 26.925 -17.865 -6.597 1.00 0.00 H new ATOM 0 HD22 LEU A 9 28.025 -16.901 -7.610 1.00 0.00 H new ATOM 0 HD23 LEU A 9 26.653 -16.117 -6.793 1.00 0.00 H new ATOM 96 N GLU A 10 26.090 -12.769 -8.715 1.00 0.00 N ATOM 97 CA GLU A 10 26.680 -11.736 -7.871 1.00 0.00 C ATOM 98 C GLU A 10 25.828 -10.470 -7.886 1.00 0.00 C ATOM 99 O GLU A 10 26.352 -9.358 -7.920 1.00 0.00 O ATOM 100 CB GLU A 10 28.100 -11.414 -8.339 1.00 0.00 C ATOM 101 CG GLU A 10 29.008 -10.913 -7.228 1.00 0.00 C ATOM 102 CD GLU A 10 28.784 -9.447 -6.908 1.00 0.00 C ATOM 103 OE1 GLU A 10 28.874 -8.617 -7.836 1.00 0.00 O ATOM 104 OE2 GLU A 10 28.519 -9.132 -5.730 1.00 0.00 O ATOM 0 H GLU A 10 25.889 -12.471 -9.670 1.00 0.00 H new ATOM 0 HA GLU A 10 26.719 -12.115 -6.850 1.00 0.00 H new ATOM 0 HB2 GLU A 10 28.540 -12.308 -8.781 1.00 0.00 H new ATOM 0 HB3 GLU A 10 28.052 -10.661 -9.125 1.00 0.00 H new ATOM 0 HG2 GLU A 10 28.839 -11.507 -6.330 1.00 0.00 H new ATOM 0 HG3 GLU A 10 30.048 -11.063 -7.518 1.00 0.00 H new ATOM 111 N ASN A 11 24.511 -10.650 -7.860 1.00 0.00 N ATOM 112 CA ASN A 11 23.586 -9.522 -7.872 1.00 0.00 C ATOM 113 C ASN A 11 22.751 -9.491 -6.595 1.00 0.00 C ATOM 114 O ASN A 11 22.344 -10.533 -6.080 1.00 0.00 O ATOM 115 CB ASN A 11 22.668 -9.602 -9.093 1.00 0.00 C ATOM 116 CG ASN A 11 23.376 -9.211 -10.375 1.00 0.00 C ATOM 117 OD1 ASN A 11 24.127 -10.002 -10.948 1.00 0.00 O ATOM 118 ND2 ASN A 11 23.141 -7.987 -10.832 1.00 0.00 N ATOM 0 H ASN A 11 24.061 -11.565 -7.831 1.00 0.00 H new ATOM 0 HA ASN A 11 24.171 -8.604 -7.925 1.00 0.00 H new ATOM 0 HB2 ASN A 11 22.283 -10.617 -9.189 1.00 0.00 H new ATOM 0 HB3 ASN A 11 21.809 -8.948 -8.942 1.00 0.00 H new ATOM 0 HD21 ASN A 11 23.590 -7.668 -11.691 1.00 0.00 H new ATOM 0 HD22 ASN A 11 22.511 -7.365 -10.325 1.00 0.00 H new ATOM 125 N LEU A 12 22.500 -8.289 -6.089 1.00 0.00 N ATOM 126 CA LEU A 12 21.713 -8.120 -4.872 1.00 0.00 C ATOM 127 C LEU A 12 20.219 -8.150 -5.181 1.00 0.00 C ATOM 128 O LEU A 12 19.661 -7.179 -5.691 1.00 0.00 O ATOM 129 CB LEU A 12 22.076 -6.803 -4.184 1.00 0.00 C ATOM 130 CG LEU A 12 23.379 -6.802 -3.383 1.00 0.00 C ATOM 131 CD1 LEU A 12 23.816 -5.377 -3.078 1.00 0.00 C ATOM 132 CD2 LEU A 12 23.214 -7.598 -2.097 1.00 0.00 C ATOM 0 H LEU A 12 22.830 -7.417 -6.502 1.00 0.00 H new ATOM 0 HA LEU A 12 21.944 -8.948 -4.202 1.00 0.00 H new ATOM 0 HB2 LEU A 12 22.139 -6.024 -4.944 1.00 0.00 H new ATOM 0 HB3 LEU A 12 21.261 -6.529 -3.514 1.00 0.00 H new ATOM 0 HG LEU A 12 24.154 -7.277 -3.984 1.00 0.00 H new ATOM 0 HD11 LEU A 12 24.745 -5.395 -2.508 1.00 0.00 H new ATOM 0 HD12 LEU A 12 23.974 -4.837 -4.012 1.00 0.00 H new ATOM 0 HD13 LEU A 12 23.043 -4.876 -2.496 1.00 0.00 H new ATOM 0 HD21 LEU A 12 24.151 -7.587 -1.539 1.00 0.00 H new ATOM 0 HD22 LEU A 12 22.426 -7.151 -1.491 1.00 0.00 H new ATOM 0 HD23 LEU A 12 22.947 -8.627 -2.338 1.00 0.00 H new ATOM 144 N ALA A 13 19.578 -9.271 -4.868 1.00 0.00 N ATOM 145 CA ALA A 13 18.149 -9.426 -5.108 1.00 0.00 C ATOM 146 C ALA A 13 17.340 -9.043 -3.873 1.00 0.00 C ATOM 147 O ALA A 13 16.196 -9.471 -3.709 1.00 0.00 O ATOM 148 CB ALA A 13 17.835 -10.855 -5.524 1.00 0.00 C ATOM 0 H ALA A 13 20.026 -10.085 -4.448 1.00 0.00 H new ATOM 0 HA ALA A 13 17.867 -8.753 -5.918 1.00 0.00 H new ATOM 0 HB1 ALA A 13 16.764 -10.956 -5.700 1.00 0.00 H new ATOM 0 HB2 ALA A 13 18.377 -11.095 -6.439 1.00 0.00 H new ATOM 0 HB3 ALA A 13 18.139 -11.540 -4.732 1.00 0.00 H new ATOM 154 N THR A 14 17.940 -8.236 -3.004 1.00 0.00 N ATOM 155 CA THR A 14 17.277 -7.797 -1.783 1.00 0.00 C ATOM 156 C THR A 14 16.886 -6.326 -1.868 1.00 0.00 C ATOM 157 O THR A 14 16.992 -5.589 -0.888 1.00 0.00 O ATOM 158 CB THR A 14 18.174 -8.008 -0.549 1.00 0.00 C ATOM 159 OG1 THR A 14 18.659 -9.355 -0.521 1.00 0.00 O ATOM 160 CG2 THR A 14 17.410 -7.712 0.732 1.00 0.00 C ATOM 0 H THR A 14 18.886 -7.873 -3.124 1.00 0.00 H new ATOM 0 HA THR A 14 16.378 -8.404 -1.677 1.00 0.00 H new ATOM 0 HB THR A 14 19.017 -7.320 -0.618 1.00 0.00 H new ATOM 0 HG1 THR A 14 19.230 -9.481 0.266 1.00 0.00 H new ATOM 0 HG21 THR A 14 18.064 -7.868 1.590 1.00 0.00 H new ATOM 0 HG22 THR A 14 17.067 -6.677 0.720 1.00 0.00 H new ATOM 0 HG23 THR A 14 16.550 -8.378 0.805 1.00 0.00 H new ATOM 168 N ALA A 15 16.431 -5.906 -3.044 1.00 0.00 N ATOM 169 CA ALA A 15 16.022 -4.523 -3.255 1.00 0.00 C ATOM 170 C ALA A 15 14.959 -4.106 -2.244 1.00 0.00 C ATOM 171 O ALA A 15 14.334 -4.937 -1.585 1.00 0.00 O ATOM 172 CB ALA A 15 15.506 -4.336 -4.674 1.00 0.00 C ATOM 0 H ALA A 15 16.336 -6.504 -3.865 1.00 0.00 H new ATOM 0 HA ALA A 15 16.894 -3.885 -3.111 1.00 0.00 H new ATOM 0 HB1 ALA A 15 15.204 -3.299 -4.818 1.00 0.00 H new ATOM 0 HB2 ALA A 15 16.295 -4.586 -5.384 1.00 0.00 H new ATOM 0 HB3 ALA A 15 14.649 -4.989 -4.839 1.00 0.00 H new ATOM 178 N PRO A 16 14.747 -2.787 -2.118 1.00 0.00 N ATOM 179 CA PRO A 16 13.760 -2.229 -1.189 1.00 0.00 C ATOM 180 C PRO A 16 12.327 -2.516 -1.625 1.00 0.00 C ATOM 181 O PRO A 16 11.473 -2.852 -0.804 1.00 0.00 O ATOM 182 CB PRO A 16 14.041 -0.725 -1.233 1.00 0.00 C ATOM 183 CG PRO A 16 14.667 -0.496 -2.566 1.00 0.00 C ATOM 184 CD PRO A 16 15.456 -1.739 -2.872 1.00 0.00 C ATOM 0 HA PRO A 16 13.847 -2.663 -0.193 1.00 0.00 H new ATOM 0 HB2 PRO A 16 13.123 -0.147 -1.122 1.00 0.00 H new ATOM 0 HB3 PRO A 16 14.708 -0.423 -0.425 1.00 0.00 H new ATOM 0 HG2 PRO A 16 13.908 -0.318 -3.328 1.00 0.00 H new ATOM 0 HG3 PRO A 16 15.313 0.382 -2.548 1.00 0.00 H new ATOM 0 HD2 PRO A 16 15.471 -1.953 -3.941 1.00 0.00 H new ATOM 0 HD3 PRO A 16 16.494 -1.645 -2.552 1.00 0.00 H new ATOM 192 N VAL A 17 12.070 -2.382 -2.922 1.00 0.00 N ATOM 193 CA VAL A 17 10.740 -2.629 -3.467 1.00 0.00 C ATOM 194 C VAL A 17 10.216 -3.995 -3.040 1.00 0.00 C ATOM 195 O VAL A 17 9.071 -4.124 -2.607 1.00 0.00 O ATOM 196 CB VAL A 17 10.741 -2.550 -5.005 1.00 0.00 C ATOM 197 CG1 VAL A 17 11.463 -3.748 -5.602 1.00 0.00 C ATOM 198 CG2 VAL A 17 9.318 -2.457 -5.534 1.00 0.00 C ATOM 0 H VAL A 17 12.765 -2.104 -3.615 1.00 0.00 H new ATOM 0 HA VAL A 17 10.086 -1.852 -3.071 1.00 0.00 H new ATOM 0 HB VAL A 17 11.276 -1.649 -5.304 1.00 0.00 H new ATOM 0 HG11 VAL A 17 11.453 -3.674 -6.689 1.00 0.00 H new ATOM 0 HG12 VAL A 17 12.494 -3.764 -5.249 1.00 0.00 H new ATOM 0 HG13 VAL A 17 10.960 -4.665 -5.296 1.00 0.00 H new ATOM 0 HG21 VAL A 17 9.337 -2.402 -6.622 1.00 0.00 H new ATOM 0 HG22 VAL A 17 8.757 -3.339 -5.225 1.00 0.00 H new ATOM 0 HG23 VAL A 17 8.839 -1.563 -5.134 1.00 0.00 H new ATOM 208 N ASN A 18 11.062 -5.013 -3.163 1.00 0.00 N ATOM 209 CA ASN A 18 10.684 -6.371 -2.790 1.00 0.00 C ATOM 210 C ASN A 18 10.167 -6.416 -1.355 1.00 0.00 C ATOM 211 O ASN A 18 9.084 -6.939 -1.092 1.00 0.00 O ATOM 212 CB ASN A 18 11.877 -7.316 -2.944 1.00 0.00 C ATOM 213 CG ASN A 18 12.213 -7.590 -4.397 1.00 0.00 C ATOM 214 OD1 ASN A 18 11.686 -8.523 -5.003 1.00 0.00 O ATOM 215 ND2 ASN A 18 13.096 -6.775 -4.964 1.00 0.00 N ATOM 0 H ASN A 18 12.014 -4.923 -3.518 1.00 0.00 H new ATOM 0 HA ASN A 18 9.885 -6.695 -3.456 1.00 0.00 H new ATOM 0 HB2 ASN A 18 12.746 -6.884 -2.448 1.00 0.00 H new ATOM 0 HB3 ASN A 18 11.659 -8.258 -2.440 1.00 0.00 H new ATOM 0 HD21 ASN A 18 13.362 -6.910 -5.939 1.00 0.00 H new ATOM 0 HD22 ASN A 18 13.508 -6.014 -4.424 1.00 0.00 H new ATOM 222 N GLN A 19 10.949 -5.865 -0.433 1.00 0.00 N ATOM 223 CA GLN A 19 10.570 -5.843 0.975 1.00 0.00 C ATOM 224 C GLN A 19 9.165 -5.274 1.152 1.00 0.00 C ATOM 225 O GLN A 19 8.401 -5.736 2.000 1.00 0.00 O ATOM 226 CB GLN A 19 11.572 -5.016 1.782 1.00 0.00 C ATOM 227 CG GLN A 19 12.999 -5.532 1.691 1.00 0.00 C ATOM 228 CD GLN A 19 14.023 -4.493 2.104 1.00 0.00 C ATOM 229 OE1 GLN A 19 13.672 -3.415 2.584 1.00 0.00 O ATOM 230 NE2 GLN A 19 15.299 -4.813 1.921 1.00 0.00 N ATOM 0 H GLN A 19 11.848 -5.428 -0.635 1.00 0.00 H new ATOM 0 HA GLN A 19 10.576 -6.869 1.343 1.00 0.00 H new ATOM 0 HB2 GLN A 19 11.544 -3.984 1.432 1.00 0.00 H new ATOM 0 HB3 GLN A 19 11.264 -5.006 2.828 1.00 0.00 H new ATOM 0 HG2 GLN A 19 13.104 -6.412 2.325 1.00 0.00 H new ATOM 0 HG3 GLN A 19 13.202 -5.850 0.668 1.00 0.00 H new ATOM 0 HE21 GLN A 19 15.545 -5.718 1.520 1.00 0.00 H new ATOM 0 HE22 GLN A 19 16.033 -4.154 2.182 1.00 0.00 H new ATOM 239 N ILE A 20 8.833 -4.271 0.347 1.00 0.00 N ATOM 240 CA ILE A 20 7.520 -3.641 0.415 1.00 0.00 C ATOM 241 C ILE A 20 6.438 -4.564 -0.134 1.00 0.00 C ATOM 242 O ILE A 20 5.455 -4.856 0.546 1.00 0.00 O ATOM 243 CB ILE A 20 7.492 -2.314 -0.366 1.00 0.00 C ATOM 244 CG1 ILE A 20 8.682 -1.437 0.031 1.00 0.00 C ATOM 245 CG2 ILE A 20 6.181 -1.581 -0.119 1.00 0.00 C ATOM 246 CD1 ILE A 20 8.862 -0.226 -0.856 1.00 0.00 C ATOM 0 H ILE A 20 9.454 -3.877 -0.360 1.00 0.00 H new ATOM 0 HA ILE A 20 7.321 -3.438 1.467 1.00 0.00 H new ATOM 0 HB ILE A 20 7.567 -2.535 -1.431 1.00 0.00 H new ATOM 0 HG12 ILE A 20 8.552 -1.106 1.061 1.00 0.00 H new ATOM 0 HG13 ILE A 20 9.591 -2.037 0.001 1.00 0.00 H new ATOM 0 HG21 ILE A 20 6.177 -0.645 -0.678 1.00 0.00 H new ATOM 0 HG22 ILE A 20 5.349 -2.204 -0.447 1.00 0.00 H new ATOM 0 HG23 ILE A 20 6.078 -1.369 0.945 1.00 0.00 H new ATOM 0 HD11 ILE A 20 9.723 0.349 -0.516 1.00 0.00 H new ATOM 0 HD12 ILE A 20 9.024 -0.549 -1.884 1.00 0.00 H new ATOM 0 HD13 ILE A 20 7.968 0.396 -0.808 1.00 0.00 H new ATOM 258 N GLN A 21 6.628 -5.022 -1.367 1.00 0.00 N ATOM 259 CA GLN A 21 5.668 -5.914 -2.007 1.00 0.00 C ATOM 260 C GLN A 21 5.125 -6.934 -1.011 1.00 0.00 C ATOM 261 O GLN A 21 3.932 -7.235 -1.006 1.00 0.00 O ATOM 262 CB GLN A 21 6.319 -6.634 -3.189 1.00 0.00 C ATOM 263 CG GLN A 21 6.817 -5.694 -4.275 1.00 0.00 C ATOM 264 CD GLN A 21 7.027 -6.395 -5.603 1.00 0.00 C ATOM 265 OE1 GLN A 21 7.752 -7.388 -5.686 1.00 0.00 O ATOM 266 NE2 GLN A 21 6.394 -5.882 -6.651 1.00 0.00 N ATOM 0 H GLN A 21 7.438 -4.790 -1.943 1.00 0.00 H new ATOM 0 HA GLN A 21 4.836 -5.311 -2.371 1.00 0.00 H new ATOM 0 HB2 GLN A 21 7.156 -7.230 -2.824 1.00 0.00 H new ATOM 0 HB3 GLN A 21 5.599 -7.327 -3.623 1.00 0.00 H new ATOM 0 HG2 GLN A 21 6.100 -4.884 -4.406 1.00 0.00 H new ATOM 0 HG3 GLN A 21 7.755 -5.241 -3.955 1.00 0.00 H new ATOM 0 HE21 GLN A 21 5.803 -5.058 -6.537 1.00 0.00 H new ATOM 0 HE22 GLN A 21 6.498 -6.312 -7.570 1.00 0.00 H new ATOM 275 N GLU A 22 6.010 -7.462 -0.171 1.00 0.00 N ATOM 276 CA GLU A 22 5.618 -8.449 0.828 1.00 0.00 C ATOM 277 C GLU A 22 4.622 -7.854 1.820 1.00 0.00 C ATOM 278 O GLU A 22 3.675 -8.519 2.242 1.00 0.00 O ATOM 279 CB GLU A 22 6.849 -8.968 1.574 1.00 0.00 C ATOM 280 CG GLU A 22 7.872 -9.636 0.670 1.00 0.00 C ATOM 281 CD GLU A 22 7.602 -11.115 0.477 1.00 0.00 C ATOM 282 OE1 GLU A 22 6.416 -11.496 0.387 1.00 0.00 O ATOM 283 OE2 GLU A 22 8.578 -11.893 0.416 1.00 0.00 O ATOM 0 H GLU A 22 7.002 -7.223 -0.162 1.00 0.00 H new ATOM 0 HA GLU A 22 5.137 -9.280 0.312 1.00 0.00 H new ATOM 0 HB2 GLU A 22 7.325 -8.137 2.095 1.00 0.00 H new ATOM 0 HB3 GLU A 22 6.529 -9.680 2.335 1.00 0.00 H new ATOM 0 HG2 GLU A 22 7.872 -9.141 -0.301 1.00 0.00 H new ATOM 0 HG3 GLU A 22 8.867 -9.505 1.095 1.00 0.00 H new ATOM 290 N THR A 23 4.843 -6.596 2.189 1.00 0.00 N ATOM 291 CA THR A 23 3.968 -5.911 3.131 1.00 0.00 C ATOM 292 C THR A 23 2.563 -5.751 2.561 1.00 0.00 C ATOM 293 O THR A 23 1.574 -6.056 3.228 1.00 0.00 O ATOM 294 CB THR A 23 4.520 -4.521 3.503 1.00 0.00 C ATOM 295 OG1 THR A 23 5.792 -4.656 4.146 1.00 0.00 O ATOM 296 CG2 THR A 23 3.557 -3.784 4.421 1.00 0.00 C ATOM 0 H THR A 23 5.621 -6.031 1.849 1.00 0.00 H new ATOM 0 HA THR A 23 3.925 -6.529 4.028 1.00 0.00 H new ATOM 0 HB THR A 23 4.636 -3.943 2.586 1.00 0.00 H new ATOM 0 HG1 THR A 23 6.137 -3.769 4.378 1.00 0.00 H new ATOM 0 HG21 THR A 23 3.968 -2.806 4.670 1.00 0.00 H new ATOM 0 HG22 THR A 23 2.599 -3.657 3.917 1.00 0.00 H new ATOM 0 HG23 THR A 23 3.413 -4.360 5.335 1.00 0.00 H new ATOM 304 N ILE A 24 2.483 -5.271 1.324 1.00 0.00 N ATOM 305 CA ILE A 24 1.199 -5.073 0.664 1.00 0.00 C ATOM 306 C ILE A 24 0.515 -6.406 0.379 1.00 0.00 C ATOM 307 O ILE A 24 -0.709 -6.514 0.445 1.00 0.00 O ATOM 308 CB ILE A 24 1.358 -4.298 -0.657 1.00 0.00 C ATOM 309 CG1 ILE A 24 2.332 -5.025 -1.586 1.00 0.00 C ATOM 310 CG2 ILE A 24 1.837 -2.879 -0.385 1.00 0.00 C ATOM 311 CD1 ILE A 24 2.555 -4.316 -2.903 1.00 0.00 C ATOM 0 H ILE A 24 3.292 -5.012 0.759 1.00 0.00 H new ATOM 0 HA ILE A 24 0.581 -4.489 1.346 1.00 0.00 H new ATOM 0 HB ILE A 24 0.387 -4.245 -1.149 1.00 0.00 H new ATOM 0 HG12 ILE A 24 3.289 -5.139 -1.078 1.00 0.00 H new ATOM 0 HG13 ILE A 24 1.954 -6.028 -1.782 1.00 0.00 H new ATOM 0 HG21 ILE A 24 1.945 -2.344 -1.329 1.00 0.00 H new ATOM 0 HG22 ILE A 24 1.110 -2.364 0.243 1.00 0.00 H new ATOM 0 HG23 ILE A 24 2.800 -2.911 0.125 1.00 0.00 H new ATOM 0 HD11 ILE A 24 3.256 -4.888 -3.510 1.00 0.00 H new ATOM 0 HD12 ILE A 24 1.607 -4.225 -3.433 1.00 0.00 H new ATOM 0 HD13 ILE A 24 2.963 -3.323 -2.717 1.00 0.00 H new ATOM 323 N SER A 25 1.316 -7.419 0.064 1.00 0.00 N ATOM 324 CA SER A 25 0.788 -8.746 -0.233 1.00 0.00 C ATOM 325 C SER A 25 0.024 -9.307 0.962 1.00 0.00 C ATOM 326 O SER A 25 -1.029 -9.924 0.805 1.00 0.00 O ATOM 327 CB SER A 25 1.925 -9.695 -0.617 1.00 0.00 C ATOM 328 OG SER A 25 1.446 -10.772 -1.404 1.00 0.00 O ATOM 0 H SER A 25 2.332 -7.347 0.008 1.00 0.00 H new ATOM 0 HA SER A 25 0.099 -8.657 -1.073 1.00 0.00 H new ATOM 0 HB2 SER A 25 2.689 -9.148 -1.170 1.00 0.00 H new ATOM 0 HB3 SER A 25 2.400 -10.082 0.284 1.00 0.00 H new ATOM 0 HG SER A 25 2.192 -11.363 -1.638 1.00 0.00 H new ATOM 334 N ASP A 26 0.562 -9.087 2.157 1.00 0.00 N ATOM 335 CA ASP A 26 -0.068 -9.569 3.380 1.00 0.00 C ATOM 336 C ASP A 26 -1.343 -8.787 3.679 1.00 0.00 C ATOM 337 O ASP A 26 -2.439 -9.346 3.683 1.00 0.00 O ATOM 338 CB ASP A 26 0.901 -9.456 4.558 1.00 0.00 C ATOM 339 CG ASP A 26 0.360 -10.102 5.818 1.00 0.00 C ATOM 340 OD1 ASP A 26 -0.782 -9.780 6.205 1.00 0.00 O ATOM 341 OD2 ASP A 26 1.079 -10.930 6.417 1.00 0.00 O ATOM 0 H ASP A 26 1.433 -8.578 2.304 1.00 0.00 H new ATOM 0 HA ASP A 26 -0.331 -10.617 3.235 1.00 0.00 H new ATOM 0 HB2 ASP A 26 1.848 -9.924 4.291 1.00 0.00 H new ATOM 0 HB3 ASP A 26 1.109 -8.404 4.753 1.00 0.00 H new ATOM 346 N ASN A 27 -1.192 -7.490 3.929 1.00 0.00 N ATOM 347 CA ASN A 27 -2.331 -6.632 4.230 1.00 0.00 C ATOM 348 C ASN A 27 -3.148 -6.351 2.973 1.00 0.00 C ATOM 349 O ASN A 27 -2.647 -6.468 1.854 1.00 0.00 O ATOM 350 CB ASN A 27 -1.855 -5.315 4.847 1.00 0.00 C ATOM 351 CG ASN A 27 -1.087 -5.526 6.138 1.00 0.00 C ATOM 352 OD1 ASN A 27 -1.666 -5.868 7.169 1.00 0.00 O ATOM 353 ND2 ASN A 27 0.224 -5.321 6.086 1.00 0.00 N ATOM 0 H ASN A 27 -0.292 -7.011 3.929 1.00 0.00 H new ATOM 0 HA ASN A 27 -2.967 -7.153 4.946 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -1.221 -4.790 4.132 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -2.716 -4.675 5.040 1.00 0.00 H new ATOM 0 HD21 ASN A 27 0.793 -5.446 6.923 1.00 0.00 H new ATOM 0 HD22 ASN A 27 0.662 -5.038 5.209 1.00 0.00 H new ATOM 360 N CYS A 28 -4.410 -5.979 3.164 1.00 0.00 N ATOM 361 CA CYS A 28 -5.298 -5.681 2.047 1.00 0.00 C ATOM 362 C CYS A 28 -5.137 -4.232 1.596 1.00 0.00 C ATOM 363 O CYS A 28 -4.903 -3.959 0.419 1.00 0.00 O ATOM 364 CB CYS A 28 -6.752 -5.947 2.439 1.00 0.00 C ATOM 365 SG CYS A 28 -7.880 -6.145 1.022 1.00 0.00 S ATOM 0 H CYS A 28 -4.840 -5.877 4.083 1.00 0.00 H new ATOM 0 HA CYS A 28 -5.028 -6.333 1.216 1.00 0.00 H new ATOM 0 HB2 CYS A 28 -6.793 -6.848 3.051 1.00 0.00 H new ATOM 0 HB3 CYS A 28 -7.106 -5.124 3.059 1.00 0.00 H new ATOM 370 N VAL A 29 -5.265 -3.307 2.542 1.00 0.00 N ATOM 371 CA VAL A 29 -5.133 -1.885 2.244 1.00 0.00 C ATOM 372 C VAL A 29 -3.915 -1.289 2.940 1.00 0.00 C ATOM 373 O VAL A 29 -3.859 -1.221 4.168 1.00 0.00 O ATOM 374 CB VAL A 29 -6.389 -1.103 2.671 1.00 0.00 C ATOM 375 CG1 VAL A 29 -6.193 0.388 2.443 1.00 0.00 C ATOM 376 CG2 VAL A 29 -7.612 -1.610 1.921 1.00 0.00 C ATOM 0 H VAL A 29 -5.460 -3.516 3.521 1.00 0.00 H new ATOM 0 HA VAL A 29 -5.010 -1.798 1.164 1.00 0.00 H new ATOM 0 HB VAL A 29 -6.552 -1.264 3.737 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -7.091 0.924 2.750 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -5.343 0.737 3.029 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -6.004 0.573 1.385 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -8.491 -1.047 2.235 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -7.461 -1.480 0.849 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -7.761 -2.667 2.141 1.00 0.00 H new ATOM 386 N VAL A 30 -2.940 -0.856 2.147 1.00 0.00 N ATOM 387 CA VAL A 30 -1.722 -0.262 2.687 1.00 0.00 C ATOM 388 C VAL A 30 -1.610 1.209 2.301 1.00 0.00 C ATOM 389 O VAL A 30 -1.393 1.540 1.135 1.00 0.00 O ATOM 390 CB VAL A 30 -0.468 -1.008 2.194 1.00 0.00 C ATOM 391 CG1 VAL A 30 0.794 -0.295 2.656 1.00 0.00 C ATOM 392 CG2 VAL A 30 -0.482 -2.450 2.676 1.00 0.00 C ATOM 0 H VAL A 30 -2.970 -0.905 1.129 1.00 0.00 H new ATOM 0 HA VAL A 30 -1.783 -0.346 3.772 1.00 0.00 H new ATOM 0 HB VAL A 30 -0.475 -1.013 1.104 1.00 0.00 H new ATOM 0 HG11 VAL A 30 1.670 -0.837 2.298 1.00 0.00 H new ATOM 0 HG12 VAL A 30 0.806 0.719 2.256 1.00 0.00 H new ATOM 0 HG13 VAL A 30 0.812 -0.256 3.745 1.00 0.00 H new ATOM 0 HG21 VAL A 30 0.411 -2.962 2.318 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -0.499 -2.469 3.766 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -1.368 -2.954 2.290 1.00 0.00 H new ATOM 402 N ILE A 31 -1.759 2.086 3.288 1.00 0.00 N ATOM 403 CA ILE A 31 -1.673 3.522 3.052 1.00 0.00 C ATOM 404 C ILE A 31 -0.313 4.068 3.476 1.00 0.00 C ATOM 405 O ILE A 31 -0.068 4.302 4.659 1.00 0.00 O ATOM 406 CB ILE A 31 -2.777 4.284 3.807 1.00 0.00 C ATOM 407 CG1 ILE A 31 -4.154 3.727 3.440 1.00 0.00 C ATOM 408 CG2 ILE A 31 -2.702 5.771 3.497 1.00 0.00 C ATOM 409 CD1 ILE A 31 -5.258 4.185 4.367 1.00 0.00 C ATOM 0 H ILE A 31 -1.940 1.828 4.258 1.00 0.00 H new ATOM 0 HA ILE A 31 -1.806 3.674 1.981 1.00 0.00 H new ATOM 0 HB ILE A 31 -2.624 4.148 4.878 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -4.398 4.027 2.421 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -4.111 2.638 3.450 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -3.489 6.296 4.038 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -1.730 6.158 3.804 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -2.833 5.926 2.426 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -6.205 3.752 4.047 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -5.037 3.862 5.384 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -5.329 5.272 4.339 1.00 0.00 H new ATOM 421 N PHE A 32 0.567 4.270 2.501 1.00 0.00 N ATOM 422 CA PHE A 32 1.902 4.789 2.772 1.00 0.00 C ATOM 423 C PHE A 32 1.903 6.315 2.767 1.00 0.00 C ATOM 424 O PHE A 32 1.638 6.944 1.743 1.00 0.00 O ATOM 425 CB PHE A 32 2.897 4.265 1.735 1.00 0.00 C ATOM 426 CG PHE A 32 3.463 2.916 2.076 1.00 0.00 C ATOM 427 CD1 PHE A 32 4.327 2.764 3.149 1.00 0.00 C ATOM 428 CD2 PHE A 32 3.133 1.800 1.324 1.00 0.00 C ATOM 429 CE1 PHE A 32 4.849 1.524 3.466 1.00 0.00 C ATOM 430 CE2 PHE A 32 3.652 0.558 1.636 1.00 0.00 C ATOM 431 CZ PHE A 32 4.512 0.420 2.708 1.00 0.00 C ATOM 0 H PHE A 32 0.379 4.082 1.516 1.00 0.00 H new ATOM 0 HA PHE A 32 2.204 4.445 3.761 1.00 0.00 H new ATOM 0 HB2 PHE A 32 2.403 4.208 0.765 1.00 0.00 H new ATOM 0 HB3 PHE A 32 3.715 4.979 1.635 1.00 0.00 H new ATOM 0 HD1 PHE A 32 4.595 3.624 3.744 1.00 0.00 H new ATOM 0 HD2 PHE A 32 2.462 1.902 0.484 1.00 0.00 H new ATOM 0 HE1 PHE A 32 5.520 1.419 4.306 1.00 0.00 H new ATOM 0 HE2 PHE A 32 3.386 -0.304 1.042 1.00 0.00 H new ATOM 0 HZ PHE A 32 4.920 -0.549 2.953 1.00 0.00 H new ATOM 441 N SER A 33 2.203 6.904 3.921 1.00 0.00 N ATOM 442 CA SER A 33 2.235 8.356 4.052 1.00 0.00 C ATOM 443 C SER A 33 3.606 8.829 4.524 1.00 0.00 C ATOM 444 O SER A 33 4.327 8.101 5.207 1.00 0.00 O ATOM 445 CB SER A 33 1.156 8.825 5.031 1.00 0.00 C ATOM 446 OG SER A 33 1.523 8.538 6.369 1.00 0.00 O ATOM 0 H SER A 33 2.427 6.398 4.778 1.00 0.00 H new ATOM 0 HA SER A 33 2.039 8.789 3.071 1.00 0.00 H new ATOM 0 HB2 SER A 33 0.997 9.897 4.916 1.00 0.00 H new ATOM 0 HB3 SER A 33 0.210 8.336 4.797 1.00 0.00 H new ATOM 0 HG SER A 33 0.819 8.849 6.975 1.00 0.00 H new ATOM 452 N LYS A 34 3.961 10.056 4.155 1.00 0.00 N ATOM 453 CA LYS A 34 5.245 10.629 4.541 1.00 0.00 C ATOM 454 C LYS A 34 5.049 11.896 5.368 1.00 0.00 C ATOM 455 O LYS A 34 5.901 12.785 5.374 1.00 0.00 O ATOM 456 CB LYS A 34 6.080 10.944 3.298 1.00 0.00 C ATOM 457 CG LYS A 34 5.292 11.624 2.192 1.00 0.00 C ATOM 458 CD LYS A 34 6.205 12.383 1.243 1.00 0.00 C ATOM 459 CE LYS A 34 6.699 11.493 0.113 1.00 0.00 C ATOM 460 NZ LYS A 34 7.726 12.176 -0.722 1.00 0.00 N ATOM 0 H LYS A 34 3.377 10.672 3.589 1.00 0.00 H new ATOM 0 HA LYS A 34 5.773 9.896 5.151 1.00 0.00 H new ATOM 0 HB2 LYS A 34 6.915 11.584 3.584 1.00 0.00 H new ATOM 0 HB3 LYS A 34 6.506 10.018 2.912 1.00 0.00 H new ATOM 0 HG2 LYS A 34 4.726 10.877 1.635 1.00 0.00 H new ATOM 0 HG3 LYS A 34 4.568 12.311 2.629 1.00 0.00 H new ATOM 0 HD2 LYS A 34 5.670 13.237 0.827 1.00 0.00 H new ATOM 0 HD3 LYS A 34 7.058 12.778 1.795 1.00 0.00 H new ATOM 0 HE2 LYS A 34 7.119 10.577 0.529 1.00 0.00 H new ATOM 0 HE3 LYS A 34 5.857 11.201 -0.514 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 8.037 11.537 -1.481 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 7.318 13.036 -1.140 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 8.541 12.432 -0.129 1.00 0.00 H new ATOM 474 N THR A 35 3.920 11.972 6.067 1.00 0.00 N ATOM 475 CA THR A 35 3.612 13.129 6.897 1.00 0.00 C ATOM 476 C THR A 35 4.167 14.410 6.284 1.00 0.00 C ATOM 477 O THR A 35 4.829 15.197 6.959 1.00 0.00 O ATOM 478 CB THR A 35 4.181 12.967 8.320 1.00 0.00 C ATOM 479 OG1 THR A 35 5.612 12.936 8.274 1.00 0.00 O ATOM 480 CG2 THR A 35 3.661 11.693 8.968 1.00 0.00 C ATOM 0 H THR A 35 3.204 11.245 6.074 1.00 0.00 H new ATOM 0 HA THR A 35 2.526 13.197 6.953 1.00 0.00 H new ATOM 0 HB THR A 35 3.856 13.818 8.918 1.00 0.00 H new ATOM 0 HG1 THR A 35 5.943 13.752 7.845 1.00 0.00 H new ATOM 0 HG21 THR A 35 4.076 11.600 9.972 1.00 0.00 H new ATOM 0 HG22 THR A 35 2.573 11.733 9.027 1.00 0.00 H new ATOM 0 HG23 THR A 35 3.961 10.832 8.370 1.00 0.00 H new ATOM 488 N SER A 36 3.890 14.613 4.999 1.00 0.00 N ATOM 489 CA SER A 36 4.365 15.797 4.293 1.00 0.00 C ATOM 490 C SER A 36 3.223 16.476 3.543 1.00 0.00 C ATOM 491 O SER A 36 3.072 17.697 3.592 1.00 0.00 O ATOM 492 CB SER A 36 5.480 15.422 3.316 1.00 0.00 C ATOM 493 OG SER A 36 6.549 14.777 3.987 1.00 0.00 O ATOM 0 H SER A 36 3.339 13.973 4.427 1.00 0.00 H new ATOM 0 HA SER A 36 4.759 16.496 5.031 1.00 0.00 H new ATOM 0 HB2 SER A 36 5.084 14.766 2.541 1.00 0.00 H new ATOM 0 HB3 SER A 36 5.848 16.319 2.817 1.00 0.00 H new ATOM 0 HG SER A 36 6.311 13.842 4.158 1.00 0.00 H new ATOM 499 N CYS A 37 2.421 15.675 2.849 1.00 0.00 N ATOM 500 CA CYS A 37 1.293 16.197 2.087 1.00 0.00 C ATOM 501 C CYS A 37 0.038 16.268 2.952 1.00 0.00 C ATOM 502 O CYS A 37 0.020 15.773 4.078 1.00 0.00 O ATOM 503 CB CYS A 37 1.032 15.323 0.859 1.00 0.00 C ATOM 504 SG CYS A 37 0.329 16.216 -0.547 1.00 0.00 S ATOM 0 H CYS A 37 2.531 14.662 2.799 1.00 0.00 H new ATOM 0 HA CYS A 37 1.544 17.206 1.759 1.00 0.00 H new ATOM 0 HB2 CYS A 37 1.969 14.860 0.550 1.00 0.00 H new ATOM 0 HB3 CYS A 37 0.355 14.516 1.138 1.00 0.00 H new ATOM 0 HG CYS A 37 0.147 15.393 -1.537 1.00 0.00 H new ATOM 510 N SER A 38 -1.009 16.888 2.417 1.00 0.00 N ATOM 511 CA SER A 38 -2.266 17.029 3.142 1.00 0.00 C ATOM 512 C SER A 38 -3.110 15.764 3.017 1.00 0.00 C ATOM 513 O SER A 38 -3.713 15.308 3.989 1.00 0.00 O ATOM 514 CB SER A 38 -3.050 18.233 2.617 1.00 0.00 C ATOM 515 OG SER A 38 -2.302 19.428 2.753 1.00 0.00 O ATOM 0 H SER A 38 -1.012 17.301 1.484 1.00 0.00 H new ATOM 0 HA SER A 38 -2.034 17.187 4.195 1.00 0.00 H new ATOM 0 HB2 SER A 38 -3.304 18.076 1.569 1.00 0.00 H new ATOM 0 HB3 SER A 38 -3.990 18.325 3.162 1.00 0.00 H new ATOM 0 HG SER A 38 -2.825 20.182 2.409 1.00 0.00 H new ATOM 521 N TYR A 39 -3.147 15.202 1.814 1.00 0.00 N ATOM 522 CA TYR A 39 -3.918 13.991 1.559 1.00 0.00 C ATOM 523 C TYR A 39 -3.632 12.930 2.618 1.00 0.00 C ATOM 524 O TYR A 39 -4.432 12.019 2.832 1.00 0.00 O ATOM 525 CB TYR A 39 -3.597 13.440 0.169 1.00 0.00 C ATOM 526 CG TYR A 39 -3.953 14.386 -0.955 1.00 0.00 C ATOM 527 CD1 TYR A 39 -5.115 15.146 -0.908 1.00 0.00 C ATOM 528 CD2 TYR A 39 -3.127 14.521 -2.064 1.00 0.00 C ATOM 529 CE1 TYR A 39 -5.445 16.011 -1.933 1.00 0.00 C ATOM 530 CE2 TYR A 39 -3.448 15.385 -3.093 1.00 0.00 C ATOM 531 CZ TYR A 39 -4.608 16.128 -3.023 1.00 0.00 C ATOM 532 OH TYR A 39 -4.932 16.990 -4.045 1.00 0.00 O ATOM 0 H TYR A 39 -2.652 15.566 1.000 1.00 0.00 H new ATOM 0 HA TYR A 39 -4.976 14.248 1.605 1.00 0.00 H new ATOM 0 HB2 TYR A 39 -2.533 13.210 0.116 1.00 0.00 H new ATOM 0 HB3 TYR A 39 -4.133 12.502 0.027 1.00 0.00 H new ATOM 0 HD1 TYR A 39 -5.772 15.059 -0.055 1.00 0.00 H new ATOM 0 HD2 TYR A 39 -2.218 13.940 -2.123 1.00 0.00 H new ATOM 0 HE1 TYR A 39 -6.354 16.593 -1.881 1.00 0.00 H new ATOM 0 HE2 TYR A 39 -2.794 15.478 -3.948 1.00 0.00 H new ATOM 0 HH TYR A 39 -4.238 16.954 -4.736 1.00 0.00 H new ATOM 542 N CYS A 40 -2.485 13.056 3.277 1.00 0.00 N ATOM 543 CA CYS A 40 -2.092 12.109 4.314 1.00 0.00 C ATOM 544 C CYS A 40 -3.188 11.967 5.365 1.00 0.00 C ATOM 545 O CYS A 40 -3.262 10.959 6.069 1.00 0.00 O ATOM 546 CB CYS A 40 -0.789 12.559 4.977 1.00 0.00 C ATOM 547 SG CYS A 40 -0.989 13.918 6.152 1.00 0.00 S ATOM 0 H CYS A 40 -1.812 13.804 3.112 1.00 0.00 H new ATOM 0 HA CYS A 40 -1.936 11.138 3.844 1.00 0.00 H new ATOM 0 HB2 CYS A 40 -0.345 11.709 5.494 1.00 0.00 H new ATOM 0 HB3 CYS A 40 -0.086 12.864 4.202 1.00 0.00 H new ATOM 0 HG CYS A 40 -0.561 15.022 5.615 1.00 0.00 H new ATOM 553 N THR A 41 -4.038 12.984 5.468 1.00 0.00 N ATOM 554 CA THR A 41 -5.128 12.974 6.434 1.00 0.00 C ATOM 555 C THR A 41 -6.421 12.475 5.799 1.00 0.00 C ATOM 556 O THR A 41 -7.179 11.727 6.417 1.00 0.00 O ATOM 557 CB THR A 41 -5.368 14.376 7.026 1.00 0.00 C ATOM 558 OG1 THR A 41 -6.074 14.270 8.267 1.00 0.00 O ATOM 559 CG2 THR A 41 -6.160 15.243 6.059 1.00 0.00 C ATOM 0 H THR A 41 -3.992 13.825 4.893 1.00 0.00 H new ATOM 0 HA THR A 41 -4.834 12.295 7.235 1.00 0.00 H new ATOM 0 HB THR A 41 -4.399 14.844 7.199 1.00 0.00 H new ATOM 0 HG1 THR A 41 -6.221 15.165 8.637 1.00 0.00 H new ATOM 0 HG21 THR A 41 -6.317 16.228 6.499 1.00 0.00 H new ATOM 0 HG22 THR A 41 -5.606 15.346 5.126 1.00 0.00 H new ATOM 0 HG23 THR A 41 -7.125 14.777 5.859 1.00 0.00 H new ATOM 567 N MET A 42 -6.667 12.893 4.562 1.00 0.00 N ATOM 568 CA MET A 42 -7.869 12.486 3.843 1.00 0.00 C ATOM 569 C MET A 42 -7.971 10.966 3.771 1.00 0.00 C ATOM 570 O MET A 42 -9.049 10.398 3.942 1.00 0.00 O ATOM 571 CB MET A 42 -7.869 13.076 2.431 1.00 0.00 C ATOM 572 CG MET A 42 -7.282 12.145 1.383 1.00 0.00 C ATOM 573 SD MET A 42 -7.208 12.899 -0.253 1.00 0.00 S ATOM 574 CE MET A 42 -8.950 13.004 -0.657 1.00 0.00 C ATOM 0 H MET A 42 -6.051 13.513 4.037 1.00 0.00 H new ATOM 0 HA MET A 42 -8.734 12.865 4.388 1.00 0.00 H new ATOM 0 HB2 MET A 42 -8.892 13.326 2.151 1.00 0.00 H new ATOM 0 HB3 MET A 42 -7.303 14.008 2.435 1.00 0.00 H new ATOM 0 HG2 MET A 42 -6.278 11.848 1.688 1.00 0.00 H new ATOM 0 HG3 MET A 42 -7.882 11.236 1.333 1.00 0.00 H new ATOM 0 HE1 MET A 42 -9.065 13.230 -1.717 1.00 0.00 H new ATOM 0 HE2 MET A 42 -9.433 12.052 -0.435 1.00 0.00 H new ATOM 0 HE3 MET A 42 -9.414 13.793 -0.065 1.00 0.00 H new ATOM 584 N ALA A 43 -6.842 10.313 3.516 1.00 0.00 N ATOM 585 CA ALA A 43 -6.805 8.859 3.423 1.00 0.00 C ATOM 586 C ALA A 43 -7.200 8.214 4.748 1.00 0.00 C ATOM 587 O ALA A 43 -8.132 7.412 4.806 1.00 0.00 O ATOM 588 CB ALA A 43 -5.420 8.392 3.000 1.00 0.00 C ATOM 0 H ALA A 43 -5.941 10.768 3.370 1.00 0.00 H new ATOM 0 HA ALA A 43 -7.528 8.550 2.668 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -5.407 7.304 2.935 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -5.174 8.817 2.027 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -4.685 8.720 3.735 1.00 0.00 H new ATOM 594 N LYS A 44 -6.485 8.569 5.810 1.00 0.00 N ATOM 595 CA LYS A 44 -6.761 8.025 7.134 1.00 0.00 C ATOM 596 C LYS A 44 -8.227 8.217 7.507 1.00 0.00 C ATOM 597 O LYS A 44 -8.898 7.277 7.934 1.00 0.00 O ATOM 598 CB LYS A 44 -5.866 8.696 8.180 1.00 0.00 C ATOM 599 CG LYS A 44 -4.382 8.506 7.922 1.00 0.00 C ATOM 600 CD LYS A 44 -3.540 9.361 8.854 1.00 0.00 C ATOM 601 CE LYS A 44 -2.071 9.335 8.460 1.00 0.00 C ATOM 602 NZ LYS A 44 -1.203 9.926 9.516 1.00 0.00 N ATOM 0 H LYS A 44 -5.710 9.231 5.779 1.00 0.00 H new ATOM 0 HA LYS A 44 -6.547 6.956 7.112 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -6.088 9.763 8.205 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -6.109 8.296 9.164 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -4.120 7.456 8.054 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -4.156 8.763 6.887 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -3.904 10.388 8.836 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -3.650 9.002 9.877 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -1.764 8.306 8.271 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -1.935 9.885 7.529 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -0.210 9.890 9.210 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -1.479 10.915 9.679 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -1.313 9.386 10.398 1.00 0.00 H new ATOM 616 N LYS A 45 -8.720 9.440 7.341 1.00 0.00 N ATOM 617 CA LYS A 45 -10.108 9.755 7.656 1.00 0.00 C ATOM 618 C LYS A 45 -11.061 8.989 6.744 1.00 0.00 C ATOM 619 O LYS A 45 -12.137 8.566 7.168 1.00 0.00 O ATOM 620 CB LYS A 45 -10.355 11.259 7.521 1.00 0.00 C ATOM 621 CG LYS A 45 -9.632 12.091 8.567 1.00 0.00 C ATOM 622 CD LYS A 45 -10.270 13.460 8.729 1.00 0.00 C ATOM 623 CE LYS A 45 -11.366 13.443 9.783 1.00 0.00 C ATOM 624 NZ LYS A 45 -12.671 12.996 9.220 1.00 0.00 N ATOM 0 H LYS A 45 -8.178 10.230 6.990 1.00 0.00 H new ATOM 0 HA LYS A 45 -10.297 9.453 8.686 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -10.039 11.583 6.529 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -11.426 11.451 7.593 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -9.645 11.567 9.523 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -8.586 12.207 8.282 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -9.507 14.187 9.007 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -10.686 13.784 7.775 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -11.076 12.780 10.598 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -11.477 14.441 10.208 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -13.448 13.462 9.732 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -12.719 13.249 8.212 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -12.758 11.965 9.322 1.00 0.00 H new ATOM 638 N LEU A 46 -10.659 8.812 5.491 1.00 0.00 N ATOM 639 CA LEU A 46 -11.476 8.095 4.518 1.00 0.00 C ATOM 640 C LEU A 46 -11.801 6.689 5.011 1.00 0.00 C ATOM 641 O LEU A 46 -12.959 6.363 5.274 1.00 0.00 O ATOM 642 CB LEU A 46 -10.755 8.022 3.171 1.00 0.00 C ATOM 643 CG LEU A 46 -11.441 7.189 2.087 1.00 0.00 C ATOM 644 CD1 LEU A 46 -12.729 7.858 1.635 1.00 0.00 C ATOM 645 CD2 LEU A 46 -10.505 6.976 0.907 1.00 0.00 C ATOM 0 H LEU A 46 -9.771 9.155 5.124 1.00 0.00 H new ATOM 0 HA LEU A 46 -12.411 8.641 4.393 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -10.627 9.037 2.795 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -9.757 7.615 3.337 1.00 0.00 H new ATOM 0 HG LEU A 46 -11.691 6.215 2.507 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -13.203 7.251 0.864 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -13.405 7.958 2.484 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -12.504 8.846 1.232 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -11.009 6.381 0.145 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -10.224 7.942 0.487 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -9.610 6.452 1.242 1.00 0.00 H new ATOM 657 N PHE A 47 -10.770 5.859 5.137 1.00 0.00 N ATOM 658 CA PHE A 47 -10.945 4.487 5.600 1.00 0.00 C ATOM 659 C PHE A 47 -11.445 4.460 7.041 1.00 0.00 C ATOM 660 O PHE A 47 -12.332 3.679 7.387 1.00 0.00 O ATOM 661 CB PHE A 47 -9.627 3.718 5.491 1.00 0.00 C ATOM 662 CG PHE A 47 -9.231 3.405 4.076 1.00 0.00 C ATOM 663 CD1 PHE A 47 -9.696 2.260 3.450 1.00 0.00 C ATOM 664 CD2 PHE A 47 -8.392 4.255 3.373 1.00 0.00 C ATOM 665 CE1 PHE A 47 -9.334 1.969 2.148 1.00 0.00 C ATOM 666 CE2 PHE A 47 -8.027 3.970 2.071 1.00 0.00 C ATOM 667 CZ PHE A 47 -8.498 2.825 1.458 1.00 0.00 C ATOM 0 H PHE A 47 -9.805 6.113 4.925 1.00 0.00 H new ATOM 0 HA PHE A 47 -11.691 4.008 4.966 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -8.835 4.301 5.961 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -9.712 2.787 6.051 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -10.349 1.587 3.985 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -8.019 5.150 3.848 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -9.704 1.074 1.671 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -7.374 4.642 1.533 1.00 0.00 H new ATOM 0 HZ PHE A 47 -8.213 2.600 0.441 1.00 0.00 H new ATOM 677 N HIS A 48 -10.869 5.317 7.878 1.00 0.00 N ATOM 678 CA HIS A 48 -11.256 5.391 9.283 1.00 0.00 C ATOM 679 C HIS A 48 -12.764 5.575 9.422 1.00 0.00 C ATOM 680 O HIS A 48 -13.427 4.824 10.138 1.00 0.00 O ATOM 681 CB HIS A 48 -10.524 6.542 9.975 1.00 0.00 C ATOM 682 CG HIS A 48 -11.084 6.884 11.321 1.00 0.00 C ATOM 683 ND1 HIS A 48 -11.235 8.180 11.766 1.00 0.00 N ATOM 684 CD2 HIS A 48 -11.531 6.089 12.322 1.00 0.00 C ATOM 685 CE1 HIS A 48 -11.750 8.168 12.983 1.00 0.00 C ATOM 686 NE2 HIS A 48 -11.939 6.911 13.343 1.00 0.00 N ATOM 0 H HIS A 48 -10.133 5.970 7.608 1.00 0.00 H new ATOM 0 HA HIS A 48 -10.977 4.452 9.762 1.00 0.00 H new ATOM 0 HB2 HIS A 48 -9.472 6.279 10.084 1.00 0.00 H new ATOM 0 HB3 HIS A 48 -10.567 7.425 9.337 1.00 0.00 H new ATOM 0 HD2 HIS A 48 -11.561 5.009 12.318 1.00 0.00 H new ATOM 0 HE1 HIS A 48 -11.978 9.038 13.581 1.00 0.00 H new ATOM 0 HE2 HIS A 48 -12.325 6.601 14.235 1.00 0.00 H new ATOM 694 N ASP A 49 -13.299 6.577 8.733 1.00 0.00 N ATOM 695 CA ASP A 49 -14.729 6.859 8.780 1.00 0.00 C ATOM 696 C ASP A 49 -15.533 5.682 8.237 1.00 0.00 C ATOM 697 O ASP A 49 -16.658 5.434 8.669 1.00 0.00 O ATOM 698 CB ASP A 49 -15.048 8.123 7.980 1.00 0.00 C ATOM 699 CG ASP A 49 -16.539 8.366 7.852 1.00 0.00 C ATOM 700 OD1 ASP A 49 -17.264 8.144 8.844 1.00 0.00 O ATOM 701 OD2 ASP A 49 -16.980 8.781 6.760 1.00 0.00 O ATOM 0 H ASP A 49 -12.764 7.207 8.135 1.00 0.00 H new ATOM 0 HA ASP A 49 -15.009 7.017 9.821 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -14.583 8.982 8.463 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -14.610 8.040 6.986 1.00 0.00 H new ATOM 706 N MET A 50 -14.948 4.960 7.286 1.00 0.00 N ATOM 707 CA MET A 50 -15.610 3.809 6.684 1.00 0.00 C ATOM 708 C MET A 50 -15.524 2.592 7.599 1.00 0.00 C ATOM 709 O MET A 50 -16.188 1.583 7.369 1.00 0.00 O ATOM 710 CB MET A 50 -14.983 3.486 5.326 1.00 0.00 C ATOM 711 CG MET A 50 -15.079 4.626 4.326 1.00 0.00 C ATOM 712 SD MET A 50 -13.708 4.638 3.154 1.00 0.00 S ATOM 713 CE MET A 50 -13.769 2.956 2.544 1.00 0.00 C ATOM 0 H MET A 50 -14.017 5.152 6.916 1.00 0.00 H new ATOM 0 HA MET A 50 -16.661 4.060 6.541 1.00 0.00 H new ATOM 0 HB2 MET A 50 -13.934 3.229 5.471 1.00 0.00 H new ATOM 0 HB3 MET A 50 -15.472 2.606 4.909 1.00 0.00 H new ATOM 0 HG2 MET A 50 -16.019 4.547 3.779 1.00 0.00 H new ATOM 0 HG3 MET A 50 -15.102 5.574 4.863 1.00 0.00 H new ATOM 0 HE1 MET A 50 -13.475 2.939 1.495 1.00 0.00 H new ATOM 0 HE2 MET A 50 -13.086 2.334 3.123 1.00 0.00 H new ATOM 0 HE3 MET A 50 -14.783 2.570 2.643 1.00 0.00 H new ATOM 723 N ASN A 51 -14.702 2.696 8.638 1.00 0.00 N ATOM 724 CA ASN A 51 -14.529 1.603 9.588 1.00 0.00 C ATOM 725 C ASN A 51 -13.912 0.384 8.909 1.00 0.00 C ATOM 726 O ASN A 51 -14.217 -0.756 9.258 1.00 0.00 O ATOM 727 CB ASN A 51 -15.874 1.225 10.214 1.00 0.00 C ATOM 728 CG ASN A 51 -16.543 2.401 10.900 1.00 0.00 C ATOM 729 OD1 ASN A 51 -17.461 3.012 10.353 1.00 0.00 O ATOM 730 ND2 ASN A 51 -16.084 2.723 12.103 1.00 0.00 N ATOM 0 H ASN A 51 -14.145 3.526 8.844 1.00 0.00 H new ATOM 0 HA ASN A 51 -13.852 1.941 10.373 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -16.535 0.835 9.440 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -15.723 0.424 10.937 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -16.494 3.505 12.613 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -15.321 2.188 12.518 1.00 0.00 H new ATOM 737 N VAL A 52 -13.041 0.634 7.936 1.00 0.00 N ATOM 738 CA VAL A 52 -12.379 -0.442 7.208 1.00 0.00 C ATOM 739 C VAL A 52 -10.926 -0.588 7.646 1.00 0.00 C ATOM 740 O VAL A 52 -10.056 0.164 7.208 1.00 0.00 O ATOM 741 CB VAL A 52 -12.424 -0.202 5.688 1.00 0.00 C ATOM 742 CG1 VAL A 52 -11.701 -1.318 4.949 1.00 0.00 C ATOM 743 CG2 VAL A 52 -13.863 -0.080 5.210 1.00 0.00 C ATOM 0 H VAL A 52 -12.778 1.572 7.634 1.00 0.00 H new ATOM 0 HA VAL A 52 -12.919 -1.360 7.439 1.00 0.00 H new ATOM 0 HB VAL A 52 -11.912 0.736 5.471 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -11.743 -1.131 3.876 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -10.660 -1.352 5.270 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -12.181 -2.271 5.170 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -13.876 0.089 4.133 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -14.402 -1.000 5.439 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -14.344 0.758 5.715 1.00 0.00 H new ATOM 753 N ASN A 53 -10.670 -1.563 8.513 1.00 0.00 N ATOM 754 CA ASN A 53 -9.321 -1.809 9.011 1.00 0.00 C ATOM 755 C ASN A 53 -8.284 -1.541 7.925 1.00 0.00 C ATOM 756 O ASN A 53 -8.219 -2.254 6.923 1.00 0.00 O ATOM 757 CB ASN A 53 -9.194 -3.249 9.510 1.00 0.00 C ATOM 758 CG ASN A 53 -7.825 -3.540 10.094 1.00 0.00 C ATOM 759 OD1 ASN A 53 -6.890 -3.884 9.372 1.00 0.00 O ATOM 760 ND2 ASN A 53 -7.702 -3.402 11.409 1.00 0.00 N ATOM 0 H ASN A 53 -11.379 -2.195 8.885 1.00 0.00 H new ATOM 0 HA ASN A 53 -9.136 -1.127 9.841 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -9.956 -3.437 10.266 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -9.387 -3.935 8.685 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -6.805 -3.584 11.859 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -8.505 -3.114 11.969 1.00 0.00 H new ATOM 767 N TYR A 54 -7.473 -0.509 8.131 1.00 0.00 N ATOM 768 CA TYR A 54 -6.439 -0.146 7.169 1.00 0.00 C ATOM 769 C TYR A 54 -5.049 -0.286 7.784 1.00 0.00 C ATOM 770 O TYR A 54 -4.909 -0.524 8.984 1.00 0.00 O ATOM 771 CB TYR A 54 -6.649 1.288 6.680 1.00 0.00 C ATOM 772 CG TYR A 54 -6.559 2.323 7.779 1.00 0.00 C ATOM 773 CD1 TYR A 54 -7.614 2.520 8.662 1.00 0.00 C ATOM 774 CD2 TYR A 54 -5.420 3.103 7.935 1.00 0.00 C ATOM 775 CE1 TYR A 54 -7.537 3.465 9.667 1.00 0.00 C ATOM 776 CE2 TYR A 54 -5.333 4.048 8.938 1.00 0.00 C ATOM 777 CZ TYR A 54 -6.394 4.226 9.802 1.00 0.00 C ATOM 778 OH TYR A 54 -6.312 5.167 10.802 1.00 0.00 O ATOM 0 H TYR A 54 -7.512 0.091 8.955 1.00 0.00 H new ATOM 0 HA TYR A 54 -6.512 -0.827 6.321 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -5.905 1.515 5.917 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -7.627 1.361 6.203 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -8.509 1.924 8.561 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -4.588 2.968 7.260 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -8.367 3.607 10.343 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -4.439 4.645 9.046 1.00 0.00 H new ATOM 0 HH TYR A 54 -5.441 5.615 10.759 1.00 0.00 H new ATOM 788 N LYS A 55 -4.024 -0.138 6.952 1.00 0.00 N ATOM 789 CA LYS A 55 -2.644 -0.246 7.411 1.00 0.00 C ATOM 790 C LYS A 55 -1.813 0.934 6.917 1.00 0.00 C ATOM 791 O LYS A 55 -1.457 1.006 5.741 1.00 0.00 O ATOM 792 CB LYS A 55 -2.025 -1.558 6.925 1.00 0.00 C ATOM 793 CG LYS A 55 -0.508 -1.579 6.998 1.00 0.00 C ATOM 794 CD LYS A 55 -0.020 -1.678 8.434 1.00 0.00 C ATOM 795 CE LYS A 55 1.402 -2.213 8.503 1.00 0.00 C ATOM 796 NZ LYS A 55 2.122 -1.718 9.709 1.00 0.00 N ATOM 0 H LYS A 55 -4.123 0.057 5.956 1.00 0.00 H new ATOM 0 HA LYS A 55 -2.647 -0.235 8.501 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -2.420 -2.380 7.522 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -2.333 -1.736 5.895 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -0.127 -2.424 6.424 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -0.108 -0.675 6.538 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -0.063 -0.695 8.903 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -0.684 -2.331 9.001 1.00 0.00 H new ATOM 0 HE2 LYS A 55 1.380 -3.303 8.515 1.00 0.00 H new ATOM 0 HE3 LYS A 55 1.946 -1.915 7.607 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 3.087 -2.105 9.720 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 2.165 -0.679 9.685 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 1.617 -2.024 10.565 1.00 0.00 H new ATOM 810 N VAL A 56 -1.505 1.856 7.823 1.00 0.00 N ATOM 811 CA VAL A 56 -0.713 3.031 7.480 1.00 0.00 C ATOM 812 C VAL A 56 0.747 2.845 7.877 1.00 0.00 C ATOM 813 O VAL A 56 1.049 2.270 8.923 1.00 0.00 O ATOM 814 CB VAL A 56 -1.262 4.297 8.164 1.00 0.00 C ATOM 815 CG1 VAL A 56 -0.662 4.458 9.553 1.00 0.00 C ATOM 816 CG2 VAL A 56 -0.987 5.526 7.310 1.00 0.00 C ATOM 0 H VAL A 56 -1.792 1.812 8.801 1.00 0.00 H new ATOM 0 HA VAL A 56 -0.780 3.153 6.399 1.00 0.00 H new ATOM 0 HB VAL A 56 -2.342 4.191 8.271 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -1.062 5.358 10.020 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -0.915 3.590 10.162 1.00 0.00 H new ATOM 0 HG13 VAL A 56 0.422 4.542 9.474 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -1.382 6.411 7.809 1.00 0.00 H new ATOM 0 HG22 VAL A 56 0.088 5.638 7.169 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -1.470 5.410 6.340 1.00 0.00 H new ATOM 826 N VAL A 57 1.651 3.336 7.035 1.00 0.00 N ATOM 827 CA VAL A 57 3.080 3.226 7.299 1.00 0.00 C ATOM 828 C VAL A 57 3.791 4.549 7.037 1.00 0.00 C ATOM 829 O VAL A 57 4.003 4.934 5.888 1.00 0.00 O ATOM 830 CB VAL A 57 3.727 2.128 6.433 1.00 0.00 C ATOM 831 CG1 VAL A 57 5.221 2.044 6.706 1.00 0.00 C ATOM 832 CG2 VAL A 57 3.055 0.787 6.684 1.00 0.00 C ATOM 0 H VAL A 57 1.419 3.814 6.164 1.00 0.00 H new ATOM 0 HA VAL A 57 3.188 2.961 8.351 1.00 0.00 H new ATOM 0 HB VAL A 57 3.588 2.388 5.384 1.00 0.00 H new ATOM 0 HG11 VAL A 57 5.661 1.263 6.086 1.00 0.00 H new ATOM 0 HG12 VAL A 57 5.688 3.000 6.471 1.00 0.00 H new ATOM 0 HG13 VAL A 57 5.386 1.808 7.757 1.00 0.00 H new ATOM 0 HG21 VAL A 57 3.524 0.023 6.064 1.00 0.00 H new ATOM 0 HG22 VAL A 57 3.162 0.518 7.735 1.00 0.00 H new ATOM 0 HG23 VAL A 57 1.997 0.858 6.433 1.00 0.00 H new ATOM 842 N GLU A 58 4.157 5.240 8.112 1.00 0.00 N ATOM 843 CA GLU A 58 4.845 6.521 7.998 1.00 0.00 C ATOM 844 C GLU A 58 6.293 6.324 7.559 1.00 0.00 C ATOM 845 O GLU A 58 7.159 5.991 8.369 1.00 0.00 O ATOM 846 CB GLU A 58 4.801 7.269 9.332 1.00 0.00 C ATOM 847 CG GLU A 58 3.393 7.542 9.832 1.00 0.00 C ATOM 848 CD GLU A 58 3.306 7.576 11.345 1.00 0.00 C ATOM 849 OE1 GLU A 58 3.616 6.547 11.981 1.00 0.00 O ATOM 850 OE2 GLU A 58 2.929 8.633 11.894 1.00 0.00 O ATOM 0 H GLU A 58 3.989 4.935 9.071 1.00 0.00 H new ATOM 0 HA GLU A 58 4.332 7.114 7.241 1.00 0.00 H new ATOM 0 HB2 GLU A 58 5.337 6.688 10.082 1.00 0.00 H new ATOM 0 HB3 GLU A 58 5.329 8.216 9.225 1.00 0.00 H new ATOM 0 HG2 GLU A 58 3.048 8.495 9.431 1.00 0.00 H new ATOM 0 HG3 GLU A 58 2.721 6.773 9.451 1.00 0.00 H new ATOM 857 N LEU A 59 6.548 6.533 6.273 1.00 0.00 N ATOM 858 CA LEU A 59 7.891 6.378 5.724 1.00 0.00 C ATOM 859 C LEU A 59 8.804 7.506 6.194 1.00 0.00 C ATOM 860 O LEU A 59 9.892 7.261 6.716 1.00 0.00 O ATOM 861 CB LEU A 59 7.840 6.352 4.196 1.00 0.00 C ATOM 862 CG LEU A 59 6.884 5.333 3.574 1.00 0.00 C ATOM 863 CD1 LEU A 59 6.721 5.594 2.085 1.00 0.00 C ATOM 864 CD2 LEU A 59 7.382 3.916 3.818 1.00 0.00 C ATOM 0 H LEU A 59 5.843 6.810 5.590 1.00 0.00 H new ATOM 0 HA LEU A 59 8.296 5.432 6.083 1.00 0.00 H new ATOM 0 HB2 LEU A 59 7.560 7.345 3.845 1.00 0.00 H new ATOM 0 HB3 LEU A 59 8.844 6.153 3.822 1.00 0.00 H new ATOM 0 HG LEU A 59 5.909 5.441 4.050 1.00 0.00 H new ATOM 0 HD11 LEU A 59 6.037 4.859 1.660 1.00 0.00 H new ATOM 0 HD12 LEU A 59 6.318 6.595 1.933 1.00 0.00 H new ATOM 0 HD13 LEU A 59 7.691 5.515 1.593 1.00 0.00 H new ATOM 0 HD21 LEU A 59 6.689 3.204 3.368 1.00 0.00 H new ATOM 0 HD22 LEU A 59 8.368 3.795 3.370 1.00 0.00 H new ATOM 0 HD23 LEU A 59 7.446 3.732 4.891 1.00 0.00 H new ATOM 876 N ASP A 60 8.354 8.742 6.007 1.00 0.00 N ATOM 877 CA ASP A 60 9.128 9.908 6.415 1.00 0.00 C ATOM 878 C ASP A 60 9.738 9.699 7.797 1.00 0.00 C ATOM 879 O ASP A 60 10.930 9.935 8.004 1.00 0.00 O ATOM 880 CB ASP A 60 8.246 11.158 6.416 1.00 0.00 C ATOM 881 CG ASP A 60 9.053 12.435 6.544 1.00 0.00 C ATOM 882 OD1 ASP A 60 9.660 12.856 5.537 1.00 0.00 O ATOM 883 OD2 ASP A 60 9.077 13.014 7.651 1.00 0.00 O ATOM 0 H ASP A 60 7.457 8.962 5.575 1.00 0.00 H new ATOM 0 HA ASP A 60 9.937 10.045 5.698 1.00 0.00 H new ATOM 0 HB2 ASP A 60 7.665 11.190 5.495 1.00 0.00 H new ATOM 0 HB3 ASP A 60 7.535 11.097 7.240 1.00 0.00 H new ATOM 888 N LEU A 61 8.915 9.258 8.741 1.00 0.00 N ATOM 889 CA LEU A 61 9.372 9.018 10.105 1.00 0.00 C ATOM 890 C LEU A 61 10.214 7.748 10.182 1.00 0.00 C ATOM 891 O LEU A 61 11.218 7.698 10.894 1.00 0.00 O ATOM 892 CB LEU A 61 8.177 8.908 11.053 1.00 0.00 C ATOM 893 CG LEU A 61 7.065 9.939 10.853 1.00 0.00 C ATOM 894 CD1 LEU A 61 5.875 9.620 11.744 1.00 0.00 C ATOM 895 CD2 LEU A 61 7.582 11.343 11.134 1.00 0.00 C ATOM 0 H LEU A 61 7.927 9.059 8.587 1.00 0.00 H new ATOM 0 HA LEU A 61 9.992 9.862 10.407 1.00 0.00 H new ATOM 0 HB2 LEU A 61 7.746 7.913 10.948 1.00 0.00 H new ATOM 0 HB3 LEU A 61 8.542 8.991 12.077 1.00 0.00 H new ATOM 0 HG LEU A 61 6.738 9.895 9.814 1.00 0.00 H new ATOM 0 HD11 LEU A 61 5.094 10.364 11.588 1.00 0.00 H new ATOM 0 HD12 LEU A 61 5.489 8.631 11.496 1.00 0.00 H new ATOM 0 HD13 LEU A 61 6.188 9.636 12.788 1.00 0.00 H new ATOM 0 HD21 LEU A 61 6.777 12.063 10.987 1.00 0.00 H new ATOM 0 HD22 LEU A 61 7.937 11.401 12.163 1.00 0.00 H new ATOM 0 HD23 LEU A 61 8.402 11.572 10.454 1.00 0.00 H new ATOM 907 N LEU A 62 9.801 6.725 9.442 1.00 0.00 N ATOM 908 CA LEU A 62 10.518 5.455 9.424 1.00 0.00 C ATOM 909 C LEU A 62 11.968 5.654 8.994 1.00 0.00 C ATOM 910 O LEU A 62 12.264 6.502 8.152 1.00 0.00 O ATOM 911 CB LEU A 62 9.826 4.469 8.482 1.00 0.00 C ATOM 912 CG LEU A 62 8.639 3.702 9.067 1.00 0.00 C ATOM 913 CD1 LEU A 62 7.807 3.079 7.958 1.00 0.00 C ATOM 914 CD2 LEU A 62 9.121 2.634 10.038 1.00 0.00 C ATOM 0 H LEU A 62 8.973 6.750 8.847 1.00 0.00 H new ATOM 0 HA LEU A 62 10.511 5.048 10.435 1.00 0.00 H new ATOM 0 HB2 LEU A 62 9.482 5.016 7.604 1.00 0.00 H new ATOM 0 HB3 LEU A 62 10.566 3.746 8.138 1.00 0.00 H new ATOM 0 HG LEU A 62 8.010 4.405 9.613 1.00 0.00 H new ATOM 0 HD11 LEU A 62 6.967 2.538 8.394 1.00 0.00 H new ATOM 0 HD12 LEU A 62 7.431 3.863 7.301 1.00 0.00 H new ATOM 0 HD13 LEU A 62 8.425 2.389 7.383 1.00 0.00 H new ATOM 0 HD21 LEU A 62 8.263 2.098 10.445 1.00 0.00 H new ATOM 0 HD22 LEU A 62 9.772 1.933 9.515 1.00 0.00 H new ATOM 0 HD23 LEU A 62 9.674 3.104 10.851 1.00 0.00 H new ATOM 926 N GLU A 63 12.867 4.866 9.575 1.00 0.00 N ATOM 927 CA GLU A 63 14.285 4.956 9.250 1.00 0.00 C ATOM 928 C GLU A 63 14.545 4.500 7.817 1.00 0.00 C ATOM 929 O GLU A 63 15.527 4.904 7.194 1.00 0.00 O ATOM 930 CB GLU A 63 15.109 4.111 10.223 1.00 0.00 C ATOM 931 CG GLU A 63 15.036 2.619 9.947 1.00 0.00 C ATOM 932 CD GLU A 63 15.444 1.782 11.144 1.00 0.00 C ATOM 933 OE1 GLU A 63 14.655 1.705 12.109 1.00 0.00 O ATOM 934 OE2 GLU A 63 16.551 1.206 11.116 1.00 0.00 O ATOM 0 H GLU A 63 12.638 4.158 10.273 1.00 0.00 H new ATOM 0 HA GLU A 63 14.587 5.999 9.341 1.00 0.00 H new ATOM 0 HB2 GLU A 63 16.150 4.430 10.176 1.00 0.00 H new ATOM 0 HB3 GLU A 63 14.763 4.301 11.239 1.00 0.00 H new ATOM 0 HG2 GLU A 63 14.019 2.357 9.655 1.00 0.00 H new ATOM 0 HG3 GLU A 63 15.682 2.378 9.103 1.00 0.00 H new ATOM 941 N TYR A 64 13.659 3.655 7.302 1.00 0.00 N ATOM 942 CA TYR A 64 13.793 3.140 5.945 1.00 0.00 C ATOM 943 C TYR A 64 12.745 3.756 5.023 1.00 0.00 C ATOM 944 O TYR A 64 12.228 3.095 4.123 1.00 0.00 O ATOM 945 CB TYR A 64 13.661 1.616 5.939 1.00 0.00 C ATOM 946 CG TYR A 64 12.831 1.076 7.082 1.00 0.00 C ATOM 947 CD1 TYR A 64 11.443 1.111 7.035 1.00 0.00 C ATOM 948 CD2 TYR A 64 13.435 0.532 8.209 1.00 0.00 C ATOM 949 CE1 TYR A 64 10.681 0.619 8.077 1.00 0.00 C ATOM 950 CE2 TYR A 64 12.681 0.036 9.255 1.00 0.00 C ATOM 951 CZ TYR A 64 11.304 0.083 9.184 1.00 0.00 C ATOM 952 OH TYR A 64 10.549 -0.409 10.225 1.00 0.00 O ATOM 0 H TYR A 64 12.840 3.312 7.804 1.00 0.00 H new ATOM 0 HA TYR A 64 14.782 3.413 5.576 1.00 0.00 H new ATOM 0 HB2 TYR A 64 13.213 1.302 4.996 1.00 0.00 H new ATOM 0 HB3 TYR A 64 14.656 1.173 5.983 1.00 0.00 H new ATOM 0 HD1 TYR A 64 10.951 1.530 6.169 1.00 0.00 H new ATOM 0 HD2 TYR A 64 14.513 0.496 8.268 1.00 0.00 H new ATOM 0 HE1 TYR A 64 9.603 0.654 8.025 1.00 0.00 H new ATOM 0 HE2 TYR A 64 13.166 -0.386 10.123 1.00 0.00 H new ATOM 0 HH TYR A 64 11.142 -0.751 10.926 1.00 0.00 H new ATOM 962 N GLY A 65 12.436 5.028 5.255 1.00 0.00 N ATOM 963 CA GLY A 65 11.452 5.713 4.438 1.00 0.00 C ATOM 964 C GLY A 65 12.034 6.224 3.135 1.00 0.00 C ATOM 965 O GLY A 65 11.405 6.120 2.083 1.00 0.00 O ATOM 0 H GLY A 65 12.850 5.596 5.994 1.00 0.00 H new ATOM 0 HA2 GLY A 65 10.627 5.034 4.222 1.00 0.00 H new ATOM 0 HA3 GLY A 65 11.037 6.550 5.000 1.00 0.00 H new ATOM 969 N ASN A 66 13.240 6.779 3.204 1.00 0.00 N ATOM 970 CA ASN A 66 13.906 7.310 2.021 1.00 0.00 C ATOM 971 C ASN A 66 14.215 6.197 1.025 1.00 0.00 C ATOM 972 O ASN A 66 14.559 6.460 -0.127 1.00 0.00 O ATOM 973 CB ASN A 66 15.197 8.029 2.417 1.00 0.00 C ATOM 974 CG ASN A 66 15.118 8.638 3.803 1.00 0.00 C ATOM 975 OD1 ASN A 66 14.134 9.290 4.152 1.00 0.00 O ATOM 976 ND2 ASN A 66 16.159 8.429 4.601 1.00 0.00 N ATOM 0 H ASN A 66 13.776 6.872 4.067 1.00 0.00 H new ATOM 0 HA ASN A 66 13.233 8.023 1.544 1.00 0.00 H new ATOM 0 HB2 ASN A 66 16.028 7.325 2.380 1.00 0.00 H new ATOM 0 HB3 ASN A 66 15.411 8.813 1.690 1.00 0.00 H new ATOM 0 HD21 ASN A 66 16.164 8.815 5.545 1.00 0.00 H new ATOM 0 HD22 ASN A 66 16.954 7.882 4.270 1.00 0.00 H new ATOM 983 N GLN A 67 14.090 4.954 1.478 1.00 0.00 N ATOM 984 CA GLN A 67 14.356 3.800 0.626 1.00 0.00 C ATOM 985 C GLN A 67 13.069 3.280 -0.004 1.00 0.00 C ATOM 986 O GLN A 67 13.016 3.015 -1.205 1.00 0.00 O ATOM 987 CB GLN A 67 15.029 2.688 1.434 1.00 0.00 C ATOM 988 CG GLN A 67 14.310 2.360 2.733 1.00 0.00 C ATOM 989 CD GLN A 67 14.980 1.239 3.502 1.00 0.00 C ATOM 990 OE1 GLN A 67 14.466 0.122 3.567 1.00 0.00 O ATOM 991 NE2 GLN A 67 16.133 1.531 4.091 1.00 0.00 N ATOM 0 H GLN A 67 13.806 4.720 2.429 1.00 0.00 H new ATOM 0 HA GLN A 67 15.027 4.116 -0.173 1.00 0.00 H new ATOM 0 HB2 GLN A 67 15.084 1.788 0.822 1.00 0.00 H new ATOM 0 HB3 GLN A 67 16.054 2.983 1.660 1.00 0.00 H new ATOM 0 HG2 GLN A 67 14.271 3.252 3.358 1.00 0.00 H new ATOM 0 HG3 GLN A 67 13.280 2.080 2.513 1.00 0.00 H new ATOM 0 HE21 GLN A 67 16.523 2.470 4.011 1.00 0.00 H new ATOM 0 HE22 GLN A 67 16.629 0.816 4.623 1.00 0.00 H new ATOM 1000 N PHE A 68 12.032 3.136 0.814 1.00 0.00 N ATOM 1001 CA PHE A 68 10.744 2.646 0.337 1.00 0.00 C ATOM 1002 C PHE A 68 9.970 3.753 -0.373 1.00 0.00 C ATOM 1003 O PHE A 68 8.994 3.489 -1.075 1.00 0.00 O ATOM 1004 CB PHE A 68 9.918 2.098 1.503 1.00 0.00 C ATOM 1005 CG PHE A 68 10.552 0.918 2.183 1.00 0.00 C ATOM 1006 CD1 PHE A 68 11.195 -0.061 1.444 1.00 0.00 C ATOM 1007 CD2 PHE A 68 10.504 0.789 3.562 1.00 0.00 C ATOM 1008 CE1 PHE A 68 11.778 -1.148 2.068 1.00 0.00 C ATOM 1009 CE2 PHE A 68 11.085 -0.296 4.191 1.00 0.00 C ATOM 1010 CZ PHE A 68 11.724 -1.265 3.443 1.00 0.00 C ATOM 0 H PHE A 68 12.058 3.352 1.811 1.00 0.00 H new ATOM 0 HA PHE A 68 10.931 1.843 -0.375 1.00 0.00 H new ATOM 0 HB2 PHE A 68 9.766 2.891 2.235 1.00 0.00 H new ATOM 0 HB3 PHE A 68 8.933 1.810 1.136 1.00 0.00 H new ATOM 0 HD1 PHE A 68 11.241 0.026 0.368 1.00 0.00 H new ATOM 0 HD2 PHE A 68 10.007 1.545 4.152 1.00 0.00 H new ATOM 0 HE1 PHE A 68 12.276 -1.905 1.480 1.00 0.00 H new ATOM 0 HE2 PHE A 68 11.039 -0.386 5.266 1.00 0.00 H new ATOM 0 HZ PHE A 68 12.181 -2.113 3.932 1.00 0.00 H new ATOM 1020 N GLN A 69 10.413 4.992 -0.183 1.00 0.00 N ATOM 1021 CA GLN A 69 9.761 6.139 -0.804 1.00 0.00 C ATOM 1022 C GLN A 69 10.037 6.176 -2.304 1.00 0.00 C ATOM 1023 O GLN A 69 9.169 6.542 -3.096 1.00 0.00 O ATOM 1024 CB GLN A 69 10.240 7.438 -0.153 1.00 0.00 C ATOM 1025 CG GLN A 69 9.352 7.911 0.986 1.00 0.00 C ATOM 1026 CD GLN A 69 9.501 9.393 1.266 1.00 0.00 C ATOM 1027 OE1 GLN A 69 10.197 10.106 0.542 1.00 0.00 O ATOM 1028 NE2 GLN A 69 8.847 9.866 2.320 1.00 0.00 N ATOM 0 H GLN A 69 11.220 5.227 0.395 1.00 0.00 H new ATOM 0 HA GLN A 69 8.686 6.040 -0.653 1.00 0.00 H new ATOM 0 HB2 GLN A 69 11.253 7.294 0.223 1.00 0.00 H new ATOM 0 HB3 GLN A 69 10.289 8.218 -0.912 1.00 0.00 H new ATOM 0 HG2 GLN A 69 8.312 7.694 0.745 1.00 0.00 H new ATOM 0 HG3 GLN A 69 9.594 7.349 1.888 1.00 0.00 H new ATOM 0 HE21 GLN A 69 8.282 9.239 2.893 1.00 0.00 H new ATOM 0 HE22 GLN A 69 8.910 10.856 2.557 1.00 0.00 H new ATOM 1037 N ASP A 70 11.251 5.795 -2.687 1.00 0.00 N ATOM 1038 CA ASP A 70 11.641 5.783 -4.092 1.00 0.00 C ATOM 1039 C ASP A 70 11.033 4.586 -4.815 1.00 0.00 C ATOM 1040 O ASP A 70 10.417 4.733 -5.870 1.00 0.00 O ATOM 1041 CB ASP A 70 13.165 5.753 -4.220 1.00 0.00 C ATOM 1042 CG ASP A 70 13.627 5.842 -5.661 1.00 0.00 C ATOM 1043 OD1 ASP A 70 13.251 6.817 -6.346 1.00 0.00 O ATOM 1044 OD2 ASP A 70 14.364 4.937 -6.104 1.00 0.00 O ATOM 0 H ASP A 70 11.982 5.490 -2.044 1.00 0.00 H new ATOM 0 HA ASP A 70 11.263 6.694 -4.556 1.00 0.00 H new ATOM 0 HB2 ASP A 70 13.591 6.581 -3.653 1.00 0.00 H new ATOM 0 HB3 ASP A 70 13.546 4.834 -3.776 1.00 0.00 H new ATOM 1049 N ALA A 71 11.212 3.401 -4.241 1.00 0.00 N ATOM 1050 CA ALA A 71 10.681 2.178 -4.830 1.00 0.00 C ATOM 1051 C ALA A 71 9.184 2.302 -5.095 1.00 0.00 C ATOM 1052 O ALA A 71 8.683 1.830 -6.117 1.00 0.00 O ATOM 1053 CB ALA A 71 10.961 0.990 -3.922 1.00 0.00 C ATOM 0 H ALA A 71 11.721 3.262 -3.368 1.00 0.00 H new ATOM 0 HA ALA A 71 11.181 2.017 -5.785 1.00 0.00 H new ATOM 0 HB1 ALA A 71 10.559 0.084 -4.374 1.00 0.00 H new ATOM 0 HB2 ALA A 71 12.037 0.881 -3.786 1.00 0.00 H new ATOM 0 HB3 ALA A 71 10.488 1.153 -2.954 1.00 0.00 H new ATOM 1059 N LEU A 72 8.475 2.939 -4.170 1.00 0.00 N ATOM 1060 CA LEU A 72 7.034 3.125 -4.304 1.00 0.00 C ATOM 1061 C LEU A 72 6.707 3.994 -5.514 1.00 0.00 C ATOM 1062 O LEU A 72 5.899 3.617 -6.363 1.00 0.00 O ATOM 1063 CB LEU A 72 6.461 3.759 -3.036 1.00 0.00 C ATOM 1064 CG LEU A 72 6.221 2.811 -1.860 1.00 0.00 C ATOM 1065 CD1 LEU A 72 6.125 3.590 -0.558 1.00 0.00 C ATOM 1066 CD2 LEU A 72 4.961 1.989 -2.087 1.00 0.00 C ATOM 0 H LEU A 72 8.874 3.335 -3.319 1.00 0.00 H new ATOM 0 HA LEU A 72 6.579 2.146 -4.450 1.00 0.00 H new ATOM 0 HB2 LEU A 72 7.140 4.546 -2.709 1.00 0.00 H new ATOM 0 HB3 LEU A 72 5.515 4.238 -3.289 1.00 0.00 H new ATOM 0 HG LEU A 72 7.068 2.128 -1.789 1.00 0.00 H new ATOM 0 HD11 LEU A 72 5.954 2.899 0.268 1.00 0.00 H new ATOM 0 HD12 LEU A 72 7.055 4.134 -0.390 1.00 0.00 H new ATOM 0 HD13 LEU A 72 5.297 4.297 -0.617 1.00 0.00 H new ATOM 0 HD21 LEU A 72 4.806 1.320 -1.241 1.00 0.00 H new ATOM 0 HD22 LEU A 72 4.104 2.656 -2.185 1.00 0.00 H new ATOM 0 HD23 LEU A 72 5.069 1.401 -2.999 1.00 0.00 H new ATOM 1078 N TYR A 73 7.341 5.159 -5.587 1.00 0.00 N ATOM 1079 CA TYR A 73 7.118 6.083 -6.693 1.00 0.00 C ATOM 1080 C TYR A 73 7.167 5.353 -8.031 1.00 0.00 C ATOM 1081 O TYR A 73 6.534 5.768 -9.003 1.00 0.00 O ATOM 1082 CB TYR A 73 8.163 7.200 -6.670 1.00 0.00 C ATOM 1083 CG TYR A 73 8.237 7.986 -7.960 1.00 0.00 C ATOM 1084 CD1 TYR A 73 8.974 7.517 -9.041 1.00 0.00 C ATOM 1085 CD2 TYR A 73 7.570 9.197 -8.098 1.00 0.00 C ATOM 1086 CE1 TYR A 73 9.045 8.232 -10.221 1.00 0.00 C ATOM 1087 CE2 TYR A 73 7.635 9.918 -9.275 1.00 0.00 C ATOM 1088 CZ TYR A 73 8.373 9.431 -10.333 1.00 0.00 C ATOM 1089 OH TYR A 73 8.441 10.147 -11.507 1.00 0.00 O ATOM 0 H TYR A 73 8.014 5.486 -4.893 1.00 0.00 H new ATOM 0 HA TYR A 73 6.126 6.520 -6.574 1.00 0.00 H new ATOM 0 HB2 TYR A 73 7.935 7.882 -5.851 1.00 0.00 H new ATOM 0 HB3 TYR A 73 9.141 6.767 -6.462 1.00 0.00 H new ATOM 0 HD1 TYR A 73 9.500 6.578 -8.957 1.00 0.00 H new ATOM 0 HD2 TYR A 73 6.991 9.581 -7.271 1.00 0.00 H new ATOM 0 HE1 TYR A 73 9.623 7.854 -11.051 1.00 0.00 H new ATOM 0 HE2 TYR A 73 7.111 10.858 -9.366 1.00 0.00 H new ATOM 0 HH TYR A 73 7.911 10.967 -11.421 1.00 0.00 H new ATOM 1099 N LYS A 74 7.922 4.261 -8.075 1.00 0.00 N ATOM 1100 CA LYS A 74 8.054 3.469 -9.292 1.00 0.00 C ATOM 1101 C LYS A 74 6.854 2.545 -9.472 1.00 0.00 C ATOM 1102 O LYS A 74 6.273 2.472 -10.554 1.00 0.00 O ATOM 1103 CB LYS A 74 9.344 2.646 -9.252 1.00 0.00 C ATOM 1104 CG LYS A 74 10.604 3.492 -9.212 1.00 0.00 C ATOM 1105 CD LYS A 74 11.803 2.685 -8.741 1.00 0.00 C ATOM 1106 CE LYS A 74 13.091 3.487 -8.846 1.00 0.00 C ATOM 1107 NZ LYS A 74 14.278 2.608 -9.032 1.00 0.00 N ATOM 0 H LYS A 74 8.453 3.904 -7.281 1.00 0.00 H new ATOM 0 HA LYS A 74 8.093 4.154 -10.139 1.00 0.00 H new ATOM 0 HB2 LYS A 74 9.324 1.997 -8.376 1.00 0.00 H new ATOM 0 HB3 LYS A 74 9.379 1.998 -10.128 1.00 0.00 H new ATOM 0 HG2 LYS A 74 10.804 3.896 -10.204 1.00 0.00 H new ATOM 0 HG3 LYS A 74 10.452 4.342 -8.546 1.00 0.00 H new ATOM 0 HD2 LYS A 74 11.650 2.374 -7.708 1.00 0.00 H new ATOM 0 HD3 LYS A 74 11.889 1.777 -9.338 1.00 0.00 H new ATOM 0 HE2 LYS A 74 13.019 4.182 -9.683 1.00 0.00 H new ATOM 0 HE3 LYS A 74 13.220 4.086 -7.945 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 15.136 3.192 -9.099 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 14.362 1.962 -8.221 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 14.167 2.055 -9.906 1.00 0.00 H new ATOM 1121 N MET A 75 6.488 1.842 -8.405 1.00 0.00 N ATOM 1122 CA MET A 75 5.355 0.925 -8.446 1.00 0.00 C ATOM 1123 C MET A 75 4.050 1.682 -8.668 1.00 0.00 C ATOM 1124 O MET A 75 3.049 1.105 -9.094 1.00 0.00 O ATOM 1125 CB MET A 75 5.277 0.119 -7.148 1.00 0.00 C ATOM 1126 CG MET A 75 6.558 -0.631 -6.820 1.00 0.00 C ATOM 1127 SD MET A 75 6.260 -2.130 -5.864 1.00 0.00 S ATOM 1128 CE MET A 75 5.345 -1.470 -4.474 1.00 0.00 C ATOM 0 H MET A 75 6.959 1.890 -7.502 1.00 0.00 H new ATOM 0 HA MET A 75 5.503 0.241 -9.282 1.00 0.00 H new ATOM 0 HB2 MET A 75 5.040 0.793 -6.325 1.00 0.00 H new ATOM 0 HB3 MET A 75 4.457 -0.595 -7.222 1.00 0.00 H new ATOM 0 HG2 MET A 75 7.069 -0.891 -7.747 1.00 0.00 H new ATOM 0 HG3 MET A 75 7.225 0.025 -6.261 1.00 0.00 H new ATOM 0 HE1 MET A 75 5.287 -2.221 -3.686 1.00 0.00 H new ATOM 0 HE2 MET A 75 5.851 -0.583 -4.093 1.00 0.00 H new ATOM 0 HE3 MET A 75 4.338 -1.203 -4.795 1.00 0.00 H new ATOM 1138 N THR A 76 4.067 2.979 -8.374 1.00 0.00 N ATOM 1139 CA THR A 76 2.885 3.815 -8.540 1.00 0.00 C ATOM 1140 C THR A 76 2.932 4.579 -9.858 1.00 0.00 C ATOM 1141 O THR A 76 1.985 4.541 -10.643 1.00 0.00 O ATOM 1142 CB THR A 76 2.741 4.820 -7.382 1.00 0.00 C ATOM 1143 OG1 THR A 76 3.662 5.903 -7.556 1.00 0.00 O ATOM 1144 CG2 THR A 76 2.993 4.143 -6.043 1.00 0.00 C ATOM 0 H THR A 76 4.886 3.472 -8.020 1.00 0.00 H new ATOM 0 HA THR A 76 2.024 3.147 -8.541 1.00 0.00 H new ATOM 0 HB THR A 76 1.722 5.206 -7.390 1.00 0.00 H new ATOM 0 HG1 THR A 76 3.309 6.706 -7.118 1.00 0.00 H new ATOM 0 HG21 THR A 76 2.886 4.873 -5.240 1.00 0.00 H new ATOM 0 HG22 THR A 76 2.272 3.338 -5.901 1.00 0.00 H new ATOM 0 HG23 THR A 76 4.003 3.732 -6.027 1.00 0.00 H new ATOM 1152 N GLY A 77 4.041 5.273 -10.095 1.00 0.00 N ATOM 1153 CA GLY A 77 4.190 6.036 -11.321 1.00 0.00 C ATOM 1154 C GLY A 77 4.375 7.519 -11.062 1.00 0.00 C ATOM 1155 O GLY A 77 4.783 8.264 -11.952 1.00 0.00 O ATOM 0 H GLY A 77 4.838 5.321 -9.461 1.00 0.00 H new ATOM 0 HA2 GLY A 77 5.047 5.658 -11.879 1.00 0.00 H new ATOM 0 HA3 GLY A 77 3.311 5.887 -11.948 1.00 0.00 H new ATOM 1159 N GLU A 78 4.072 7.947 -9.840 1.00 0.00 N ATOM 1160 CA GLU A 78 4.205 9.351 -9.469 1.00 0.00 C ATOM 1161 C GLU A 78 4.577 9.491 -7.995 1.00 0.00 C ATOM 1162 O GLU A 78 4.612 8.506 -7.257 1.00 0.00 O ATOM 1163 CB GLU A 78 2.902 10.101 -9.751 1.00 0.00 C ATOM 1164 CG GLU A 78 1.679 9.458 -9.118 1.00 0.00 C ATOM 1165 CD GLU A 78 1.175 8.264 -9.906 1.00 0.00 C ATOM 1166 OE1 GLU A 78 0.762 8.454 -11.069 1.00 0.00 O ATOM 1167 OE2 GLU A 78 1.193 7.141 -9.359 1.00 0.00 O ATOM 0 H GLU A 78 3.733 7.343 -9.091 1.00 0.00 H new ATOM 0 HA GLU A 78 5.003 9.786 -10.070 1.00 0.00 H new ATOM 0 HB2 GLU A 78 2.995 11.123 -9.385 1.00 0.00 H new ATOM 0 HB3 GLU A 78 2.753 10.161 -10.829 1.00 0.00 H new ATOM 0 HG2 GLU A 78 1.923 9.143 -8.104 1.00 0.00 H new ATOM 0 HG3 GLU A 78 0.883 10.199 -9.039 1.00 0.00 H new ATOM 1174 N ARG A 79 4.854 10.721 -7.576 1.00 0.00 N ATOM 1175 CA ARG A 79 5.224 10.990 -6.192 1.00 0.00 C ATOM 1176 C ARG A 79 4.046 11.573 -5.416 1.00 0.00 C ATOM 1177 O ARG A 79 4.204 12.518 -4.642 1.00 0.00 O ATOM 1178 CB ARG A 79 6.411 11.955 -6.138 1.00 0.00 C ATOM 1179 CG ARG A 79 7.070 12.034 -4.770 1.00 0.00 C ATOM 1180 CD ARG A 79 7.703 13.397 -4.535 1.00 0.00 C ATOM 1181 NE ARG A 79 8.863 13.316 -3.651 1.00 0.00 N ATOM 1182 CZ ARG A 79 10.040 12.829 -4.027 1.00 0.00 C ATOM 1183 NH1 ARG A 79 10.213 12.383 -5.263 1.00 0.00 N ATOM 1184 NH2 ARG A 79 11.048 12.789 -3.165 1.00 0.00 N ATOM 0 H ARG A 79 4.829 11.547 -8.175 1.00 0.00 H new ATOM 0 HA ARG A 79 5.509 10.045 -5.729 1.00 0.00 H new ATOM 0 HB2 ARG A 79 7.154 11.645 -6.873 1.00 0.00 H new ATOM 0 HB3 ARG A 79 6.073 12.950 -6.427 1.00 0.00 H new ATOM 0 HG2 ARG A 79 6.328 11.838 -3.996 1.00 0.00 H new ATOM 0 HG3 ARG A 79 7.831 11.259 -4.686 1.00 0.00 H new ATOM 0 HD2 ARG A 79 8.004 13.826 -5.490 1.00 0.00 H new ATOM 0 HD3 ARG A 79 6.963 14.071 -4.102 1.00 0.00 H new ATOM 0 HE ARG A 79 8.764 13.652 -2.693 1.00 0.00 H new ATOM 0 HH11 ARG A 79 9.441 12.413 -5.929 1.00 0.00 H new ATOM 0 HH12 ARG A 79 11.118 12.010 -5.548 1.00 0.00 H new ATOM 0 HH21 ARG A 79 10.919 13.132 -2.213 1.00 0.00 H new ATOM 0 HH22 ARG A 79 11.952 12.415 -3.454 1.00 0.00 H new ATOM 1198 N THR A 80 2.864 11.003 -5.630 1.00 0.00 N ATOM 1199 CA THR A 80 1.659 11.466 -4.953 1.00 0.00 C ATOM 1200 C THR A 80 1.359 10.618 -3.723 1.00 0.00 C ATOM 1201 O THR A 80 1.114 9.416 -3.829 1.00 0.00 O ATOM 1202 CB THR A 80 0.440 11.435 -5.894 1.00 0.00 C ATOM 1203 OG1 THR A 80 0.393 10.186 -6.594 1.00 0.00 O ATOM 1204 CG2 THR A 80 0.498 12.580 -6.893 1.00 0.00 C ATOM 0 H THR A 80 2.716 10.220 -6.267 1.00 0.00 H new ATOM 0 HA THR A 80 1.845 12.495 -4.644 1.00 0.00 H new ATOM 0 HB THR A 80 -0.460 11.547 -5.290 1.00 0.00 H new ATOM 0 HG1 THR A 80 0.513 9.450 -5.958 1.00 0.00 H new ATOM 0 HG21 THR A 80 -0.373 12.537 -7.547 1.00 0.00 H new ATOM 0 HG22 THR A 80 0.504 13.530 -6.358 1.00 0.00 H new ATOM 0 HG23 THR A 80 1.405 12.495 -7.491 1.00 0.00 H new ATOM 1212 N VAL A 81 1.379 11.251 -2.554 1.00 0.00 N ATOM 1213 CA VAL A 81 1.107 10.554 -1.303 1.00 0.00 C ATOM 1214 C VAL A 81 -0.096 11.158 -0.588 1.00 0.00 C ATOM 1215 O VAL A 81 -0.468 12.311 -0.811 1.00 0.00 O ATOM 1216 CB VAL A 81 2.325 10.597 -0.360 1.00 0.00 C ATOM 1217 CG1 VAL A 81 3.265 9.437 -0.650 1.00 0.00 C ATOM 1218 CG2 VAL A 81 3.051 11.928 -0.489 1.00 0.00 C ATOM 0 H VAL A 81 1.581 12.245 -2.448 1.00 0.00 H new ATOM 0 HA VAL A 81 0.891 9.517 -1.559 1.00 0.00 H new ATOM 0 HB VAL A 81 1.972 10.500 0.667 1.00 0.00 H new ATOM 0 HG11 VAL A 81 4.119 9.483 0.025 1.00 0.00 H new ATOM 0 HG12 VAL A 81 2.737 8.495 -0.503 1.00 0.00 H new ATOM 0 HG13 VAL A 81 3.614 9.500 -1.681 1.00 0.00 H new ATOM 0 HG21 VAL A 81 3.908 11.941 0.184 1.00 0.00 H new ATOM 0 HG22 VAL A 81 3.393 12.058 -1.516 1.00 0.00 H new ATOM 0 HG23 VAL A 81 2.372 12.740 -0.228 1.00 0.00 H new ATOM 1228 N PRO A 82 -0.721 10.363 0.294 1.00 0.00 N ATOM 1229 CA PRO A 82 -0.288 8.990 0.567 1.00 0.00 C ATOM 1230 C PRO A 82 -0.549 8.055 -0.610 1.00 0.00 C ATOM 1231 O PRO A 82 -1.076 8.472 -1.641 1.00 0.00 O ATOM 1232 CB PRO A 82 -1.139 8.582 1.772 1.00 0.00 C ATOM 1233 CG PRO A 82 -2.354 9.440 1.685 1.00 0.00 C ATOM 1234 CD PRO A 82 -1.899 10.744 1.091 1.00 0.00 C ATOM 0 HA PRO A 82 0.786 8.930 0.746 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -1.398 7.524 1.734 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -0.605 8.746 2.708 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -3.118 8.973 1.063 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -2.795 9.593 2.670 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -2.674 11.196 0.472 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -1.644 11.470 1.863 1.00 0.00 H new ATOM 1242 N ARG A 83 -0.176 6.790 -0.448 1.00 0.00 N ATOM 1243 CA ARG A 83 -0.369 5.796 -1.497 1.00 0.00 C ATOM 1244 C ARG A 83 -1.204 4.624 -0.990 1.00 0.00 C ATOM 1245 O ARG A 83 -0.828 3.952 -0.029 1.00 0.00 O ATOM 1246 CB ARG A 83 0.983 5.291 -2.006 1.00 0.00 C ATOM 1247 CG ARG A 83 1.996 6.399 -2.246 1.00 0.00 C ATOM 1248 CD ARG A 83 3.422 5.883 -2.136 1.00 0.00 C ATOM 1249 NE ARG A 83 4.397 6.970 -2.123 1.00 0.00 N ATOM 1250 CZ ARG A 83 4.727 7.674 -3.199 1.00 0.00 C ATOM 1251 NH1 ARG A 83 4.161 7.408 -4.369 1.00 0.00 N ATOM 1252 NH2 ARG A 83 5.623 8.648 -3.107 1.00 0.00 N ATOM 0 H ARG A 83 0.262 6.429 0.400 1.00 0.00 H new ATOM 0 HA ARG A 83 -0.904 6.272 -2.319 1.00 0.00 H new ATOM 0 HB2 ARG A 83 1.393 4.585 -1.283 1.00 0.00 H new ATOM 0 HB3 ARG A 83 0.830 4.743 -2.935 1.00 0.00 H new ATOM 0 HG2 ARG A 83 1.839 6.829 -3.235 1.00 0.00 H new ATOM 0 HG3 ARG A 83 1.840 7.199 -1.522 1.00 0.00 H new ATOM 0 HD2 ARG A 83 3.525 5.293 -1.225 1.00 0.00 H new ATOM 0 HD3 ARG A 83 3.632 5.217 -2.973 1.00 0.00 H new ATOM 0 HE ARG A 83 4.849 7.201 -1.238 1.00 0.00 H new ATOM 0 HH11 ARG A 83 3.470 6.661 -4.443 1.00 0.00 H new ATOM 0 HH12 ARG A 83 4.416 7.950 -5.194 1.00 0.00 H new ATOM 0 HH21 ARG A 83 6.059 8.857 -2.209 1.00 0.00 H new ATOM 0 HH22 ARG A 83 5.876 9.188 -3.934 1.00 0.00 H new ATOM 1266 N ILE A 84 -2.337 4.386 -1.641 1.00 0.00 N ATOM 1267 CA ILE A 84 -3.224 3.296 -1.255 1.00 0.00 C ATOM 1268 C ILE A 84 -3.046 2.092 -2.174 1.00 0.00 C ATOM 1269 O ILE A 84 -2.968 2.234 -3.394 1.00 0.00 O ATOM 1270 CB ILE A 84 -4.700 3.734 -1.283 1.00 0.00 C ATOM 1271 CG1 ILE A 84 -4.931 4.886 -0.303 1.00 0.00 C ATOM 1272 CG2 ILE A 84 -5.608 2.559 -0.951 1.00 0.00 C ATOM 1273 CD1 ILE A 84 -4.718 6.253 -0.915 1.00 0.00 C ATOM 0 H ILE A 84 -2.662 4.933 -2.438 1.00 0.00 H new ATOM 0 HA ILE A 84 -2.956 3.017 -0.236 1.00 0.00 H new ATOM 0 HB ILE A 84 -4.941 4.082 -2.287 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -5.948 4.825 0.084 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -4.259 4.769 0.547 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -6.648 2.885 -0.975 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -5.459 1.766 -1.684 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -5.368 2.184 0.044 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -4.899 7.021 -0.163 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -3.693 6.334 -1.277 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -5.408 6.391 -1.747 1.00 0.00 H new ATOM 1285 N PHE A 85 -2.985 0.905 -1.579 1.00 0.00 N ATOM 1286 CA PHE A 85 -2.817 -0.326 -2.344 1.00 0.00 C ATOM 1287 C PHE A 85 -3.807 -1.392 -1.883 1.00 0.00 C ATOM 1288 O PHE A 85 -3.836 -1.762 -0.710 1.00 0.00 O ATOM 1289 CB PHE A 85 -1.386 -0.848 -2.203 1.00 0.00 C ATOM 1290 CG PHE A 85 -0.400 -0.143 -3.091 1.00 0.00 C ATOM 1291 CD1 PHE A 85 -0.059 1.179 -2.857 1.00 0.00 C ATOM 1292 CD2 PHE A 85 0.185 -0.803 -4.160 1.00 0.00 C ATOM 1293 CE1 PHE A 85 0.847 1.830 -3.673 1.00 0.00 C ATOM 1294 CE2 PHE A 85 1.091 -0.158 -4.979 1.00 0.00 C ATOM 1295 CZ PHE A 85 1.424 1.160 -4.735 1.00 0.00 C ATOM 0 H PHE A 85 -3.049 0.769 -0.570 1.00 0.00 H new ATOM 0 HA PHE A 85 -3.013 -0.102 -3.393 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -1.069 -0.741 -1.165 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -1.372 -1.914 -2.432 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -0.506 1.707 -2.028 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -0.071 -1.834 -4.355 1.00 0.00 H new ATOM 0 HE1 PHE A 85 1.104 2.861 -3.481 1.00 0.00 H new ATOM 0 HE2 PHE A 85 1.539 -0.684 -5.809 1.00 0.00 H new ATOM 0 HZ PHE A 85 2.134 1.666 -5.373 1.00 0.00 H new ATOM 1305 N VAL A 86 -4.618 -1.880 -2.816 1.00 0.00 N ATOM 1306 CA VAL A 86 -5.609 -2.904 -2.508 1.00 0.00 C ATOM 1307 C VAL A 86 -5.161 -4.272 -3.008 1.00 0.00 C ATOM 1308 O VAL A 86 -5.159 -4.535 -4.210 1.00 0.00 O ATOM 1309 CB VAL A 86 -6.977 -2.566 -3.129 1.00 0.00 C ATOM 1310 CG1 VAL A 86 -7.930 -3.745 -2.998 1.00 0.00 C ATOM 1311 CG2 VAL A 86 -7.564 -1.322 -2.479 1.00 0.00 C ATOM 0 H VAL A 86 -4.608 -1.583 -3.792 1.00 0.00 H new ATOM 0 HA VAL A 86 -5.707 -2.932 -1.423 1.00 0.00 H new ATOM 0 HB VAL A 86 -6.834 -2.362 -4.190 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -8.891 -3.487 -3.442 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -7.512 -4.610 -3.514 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -8.070 -3.984 -1.944 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -8.531 -1.098 -2.930 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -7.693 -1.496 -1.411 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -6.889 -0.480 -2.630 1.00 0.00 H new ATOM 1321 N ASN A 87 -4.780 -5.141 -2.077 1.00 0.00 N ATOM 1322 CA ASN A 87 -4.329 -6.484 -2.423 1.00 0.00 C ATOM 1323 C ASN A 87 -3.016 -6.433 -3.199 1.00 0.00 C ATOM 1324 O ASN A 87 -2.744 -7.293 -4.036 1.00 0.00 O ATOM 1325 CB ASN A 87 -5.395 -7.206 -3.250 1.00 0.00 C ATOM 1326 CG ASN A 87 -6.795 -6.975 -2.715 1.00 0.00 C ATOM 1327 OD1 ASN A 87 -6.974 -6.418 -1.632 1.00 0.00 O ATOM 1328 ND2 ASN A 87 -7.797 -7.404 -3.474 1.00 0.00 N ATOM 0 H ASN A 87 -4.775 -4.939 -1.077 1.00 0.00 H new ATOM 0 HA ASN A 87 -4.163 -7.034 -1.497 1.00 0.00 H new ATOM 0 HB2 ASN A 87 -5.343 -6.864 -4.284 1.00 0.00 H new ATOM 0 HB3 ASN A 87 -5.183 -8.275 -3.257 1.00 0.00 H new ATOM 0 HD21 ASN A 87 -8.761 -7.277 -3.166 1.00 0.00 H new ATOM 0 HD22 ASN A 87 -7.603 -7.861 -4.365 1.00 0.00 H new ATOM 1335 N GLY A 88 -2.205 -5.419 -2.914 1.00 0.00 N ATOM 1336 CA GLY A 88 -0.931 -5.275 -3.593 1.00 0.00 C ATOM 1337 C GLY A 88 -1.080 -4.721 -4.996 1.00 0.00 C ATOM 1338 O GLY A 88 -0.419 -5.181 -5.928 1.00 0.00 O ATOM 0 H GLY A 88 -2.408 -4.695 -2.225 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -0.286 -4.616 -3.012 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -0.436 -6.245 -3.640 1.00 0.00 H new ATOM 1342 N THR A 89 -1.954 -3.731 -5.150 1.00 0.00 N ATOM 1343 CA THR A 89 -2.191 -3.116 -6.449 1.00 0.00 C ATOM 1344 C THR A 89 -2.528 -1.636 -6.304 1.00 0.00 C ATOM 1345 O THR A 89 -3.424 -1.265 -5.546 1.00 0.00 O ATOM 1346 CB THR A 89 -3.335 -3.819 -7.204 1.00 0.00 C ATOM 1347 OG1 THR A 89 -2.894 -5.094 -7.684 1.00 0.00 O ATOM 1348 CG2 THR A 89 -3.816 -2.971 -8.371 1.00 0.00 C ATOM 0 H THR A 89 -2.509 -3.338 -4.390 1.00 0.00 H new ATOM 0 HA THR A 89 -1.269 -3.222 -7.021 1.00 0.00 H new ATOM 0 HB THR A 89 -4.165 -3.959 -6.512 1.00 0.00 H new ATOM 0 HG1 THR A 89 -2.000 -5.285 -7.331 1.00 0.00 H new ATOM 0 HG21 THR A 89 -4.624 -3.489 -8.888 1.00 0.00 H new ATOM 0 HG22 THR A 89 -4.179 -2.013 -7.999 1.00 0.00 H new ATOM 0 HG23 THR A 89 -2.991 -2.803 -9.063 1.00 0.00 H new ATOM 1356 N PHE A 90 -1.805 -0.795 -7.036 1.00 0.00 N ATOM 1357 CA PHE A 90 -2.028 0.645 -6.988 1.00 0.00 C ATOM 1358 C PHE A 90 -3.293 1.026 -7.751 1.00 0.00 C ATOM 1359 O PHE A 90 -3.248 1.305 -8.950 1.00 0.00 O ATOM 1360 CB PHE A 90 -0.824 1.388 -7.571 1.00 0.00 C ATOM 1361 CG PHE A 90 -0.925 2.882 -7.449 1.00 0.00 C ATOM 1362 CD1 PHE A 90 -1.587 3.626 -8.412 1.00 0.00 C ATOM 1363 CD2 PHE A 90 -0.358 3.542 -6.371 1.00 0.00 C ATOM 1364 CE1 PHE A 90 -1.680 5.001 -8.302 1.00 0.00 C ATOM 1365 CE2 PHE A 90 -0.448 4.916 -6.255 1.00 0.00 C ATOM 1366 CZ PHE A 90 -1.111 5.646 -7.222 1.00 0.00 C ATOM 0 H PHE A 90 -1.060 -1.086 -7.669 1.00 0.00 H new ATOM 0 HA PHE A 90 -2.154 0.933 -5.944 1.00 0.00 H new ATOM 0 HB2 PHE A 90 0.081 1.051 -7.065 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -0.719 1.124 -8.623 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -2.035 3.126 -9.258 1.00 0.00 H new ATOM 0 HD2 PHE A 90 0.161 2.976 -5.612 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -2.197 5.570 -9.060 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -0.001 5.418 -5.410 1.00 0.00 H new ATOM 0 HZ PHE A 90 -1.184 6.720 -7.133 1.00 0.00 H new ATOM 1376 N ILE A 91 -4.421 1.034 -7.048 1.00 0.00 N ATOM 1377 CA ILE A 91 -5.698 1.381 -7.659 1.00 0.00 C ATOM 1378 C ILE A 91 -5.785 2.877 -7.940 1.00 0.00 C ATOM 1379 O ILE A 91 -6.534 3.313 -8.814 1.00 0.00 O ATOM 1380 CB ILE A 91 -6.881 0.968 -6.762 1.00 0.00 C ATOM 1381 CG1 ILE A 91 -6.971 1.889 -5.544 1.00 0.00 C ATOM 1382 CG2 ILE A 91 -6.735 -0.482 -6.327 1.00 0.00 C ATOM 1383 CD1 ILE A 91 -5.861 1.671 -4.539 1.00 0.00 C ATOM 0 H ILE A 91 -4.476 0.804 -6.056 1.00 0.00 H new ATOM 0 HA ILE A 91 -5.757 0.834 -8.600 1.00 0.00 H new ATOM 0 HB ILE A 91 -7.803 1.063 -7.335 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -6.948 2.926 -5.880 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -7.931 1.735 -5.052 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -7.578 -0.759 -5.694 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -6.715 -1.125 -7.207 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -5.807 -0.603 -5.768 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -5.988 2.358 -3.702 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -5.897 0.644 -4.175 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -4.898 1.854 -5.015 1.00 0.00 H new ATOM 1395 N GLY A 92 -5.013 3.660 -7.193 1.00 0.00 N ATOM 1396 CA GLY A 92 -5.016 5.100 -7.377 1.00 0.00 C ATOM 1397 C GLY A 92 -4.555 5.844 -6.140 1.00 0.00 C ATOM 1398 O GLY A 92 -4.583 5.304 -5.035 1.00 0.00 O ATOM 0 H GLY A 92 -4.385 3.323 -6.463 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -4.368 5.357 -8.215 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -6.022 5.427 -7.640 1.00 0.00 H new ATOM 1402 N GLY A 93 -4.126 7.089 -6.326 1.00 0.00 N ATOM 1403 CA GLY A 93 -3.661 7.888 -5.207 1.00 0.00 C ATOM 1404 C GLY A 93 -4.790 8.319 -4.293 1.00 0.00 C ATOM 1405 O GLY A 93 -5.961 8.087 -4.590 1.00 0.00 O ATOM 0 H GLY A 93 -4.092 7.558 -7.231 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -2.932 7.315 -4.634 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -3.146 8.771 -5.585 1.00 0.00 H new ATOM 1409 N ALA A 94 -4.438 8.947 -3.176 1.00 0.00 N ATOM 1410 CA ALA A 94 -5.431 9.412 -2.215 1.00 0.00 C ATOM 1411 C ALA A 94 -6.697 9.886 -2.920 1.00 0.00 C ATOM 1412 O ALA A 94 -7.781 9.344 -2.704 1.00 0.00 O ATOM 1413 CB ALA A 94 -4.853 10.527 -1.357 1.00 0.00 C ATOM 0 H ALA A 94 -3.472 9.146 -2.914 1.00 0.00 H new ATOM 0 HA ALA A 94 -5.698 8.574 -1.571 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -5.605 10.865 -0.644 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -3.982 10.156 -0.817 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -4.557 11.360 -1.994 1.00 0.00 H new ATOM 1419 N THR A 95 -6.553 10.903 -3.765 1.00 0.00 N ATOM 1420 CA THR A 95 -7.686 11.451 -4.501 1.00 0.00 C ATOM 1421 C THR A 95 -8.504 10.344 -5.155 1.00 0.00 C ATOM 1422 O THR A 95 -9.667 10.131 -4.809 1.00 0.00 O ATOM 1423 CB THR A 95 -7.224 12.442 -5.585 1.00 0.00 C ATOM 1424 OG1 THR A 95 -6.191 13.288 -5.068 1.00 0.00 O ATOM 1425 CG2 THR A 95 -8.388 13.293 -6.072 1.00 0.00 C ATOM 0 H THR A 95 -5.663 11.363 -3.956 1.00 0.00 H new ATOM 0 HA THR A 95 -8.308 11.979 -3.778 1.00 0.00 H new ATOM 0 HB THR A 95 -6.836 11.870 -6.427 1.00 0.00 H new ATOM 0 HG1 THR A 95 -5.902 13.914 -5.764 1.00 0.00 H new ATOM 0 HG21 THR A 95 -8.037 13.985 -6.837 1.00 0.00 H new ATOM 0 HG22 THR A 95 -9.159 12.648 -6.492 1.00 0.00 H new ATOM 0 HG23 THR A 95 -8.802 13.856 -5.236 1.00 0.00 H new ATOM 1433 N ASP A 96 -7.891 9.642 -6.101 1.00 0.00 N ATOM 1434 CA ASP A 96 -8.563 8.555 -6.803 1.00 0.00 C ATOM 1435 C ASP A 96 -9.265 7.624 -5.819 1.00 0.00 C ATOM 1436 O ASP A 96 -10.479 7.433 -5.885 1.00 0.00 O ATOM 1437 CB ASP A 96 -7.560 7.765 -7.645 1.00 0.00 C ATOM 1438 CG ASP A 96 -8.210 7.082 -8.832 1.00 0.00 C ATOM 1439 OD1 ASP A 96 -8.851 7.783 -9.641 1.00 0.00 O ATOM 1440 OD2 ASP A 96 -8.079 5.845 -8.950 1.00 0.00 O ATOM 0 H ASP A 96 -6.930 9.806 -6.400 1.00 0.00 H new ATOM 0 HA ASP A 96 -9.314 8.991 -7.462 1.00 0.00 H new ATOM 0 HB2 ASP A 96 -6.779 8.437 -8.000 1.00 0.00 H new ATOM 0 HB3 ASP A 96 -7.076 7.016 -7.019 1.00 0.00 H new ATOM 1445 N THR A 97 -8.491 7.045 -4.906 1.00 0.00 N ATOM 1446 CA THR A 97 -9.037 6.132 -3.909 1.00 0.00 C ATOM 1447 C THR A 97 -10.357 6.653 -3.351 1.00 0.00 C ATOM 1448 O THR A 97 -11.318 5.899 -3.199 1.00 0.00 O ATOM 1449 CB THR A 97 -8.051 5.916 -2.746 1.00 0.00 C ATOM 1450 OG1 THR A 97 -6.829 5.354 -3.238 1.00 0.00 O ATOM 1451 CG2 THR A 97 -8.650 4.995 -1.693 1.00 0.00 C ATOM 0 H THR A 97 -7.484 7.192 -4.836 1.00 0.00 H new ATOM 0 HA THR A 97 -9.208 5.180 -4.412 1.00 0.00 H new ATOM 0 HB THR A 97 -7.847 6.883 -2.287 1.00 0.00 H new ATOM 0 HG1 THR A 97 -6.316 6.046 -3.706 1.00 0.00 H new ATOM 0 HG21 THR A 97 -7.936 4.857 -0.881 1.00 0.00 H new ATOM 0 HG22 THR A 97 -9.565 5.438 -1.300 1.00 0.00 H new ATOM 0 HG23 THR A 97 -8.879 4.029 -2.143 1.00 0.00 H new ATOM 1459 N HIS A 98 -10.397 7.947 -3.048 1.00 0.00 N ATOM 1460 CA HIS A 98 -11.600 8.569 -2.508 1.00 0.00 C ATOM 1461 C HIS A 98 -12.768 8.428 -3.480 1.00 0.00 C ATOM 1462 O HIS A 98 -13.896 8.150 -3.074 1.00 0.00 O ATOM 1463 CB HIS A 98 -11.346 10.046 -2.208 1.00 0.00 C ATOM 1464 CG HIS A 98 -12.555 10.772 -1.704 1.00 0.00 C ATOM 1465 ND1 HIS A 98 -13.588 10.143 -1.041 1.00 0.00 N ATOM 1466 CD2 HIS A 98 -12.892 12.081 -1.766 1.00 0.00 C ATOM 1467 CE1 HIS A 98 -14.509 11.034 -0.720 1.00 0.00 C ATOM 1468 NE2 HIS A 98 -14.110 12.218 -1.148 1.00 0.00 N ATOM 0 H HIS A 98 -9.610 8.585 -3.167 1.00 0.00 H new ATOM 0 HA HIS A 98 -11.858 8.058 -1.581 1.00 0.00 H new ATOM 0 HB2 HIS A 98 -10.550 10.126 -1.468 1.00 0.00 H new ATOM 0 HB3 HIS A 98 -10.990 10.536 -3.114 1.00 0.00 H new ATOM 0 HD2 HIS A 98 -12.311 12.871 -2.218 1.00 0.00 H new ATOM 0 HE1 HIS A 98 -15.431 10.829 -0.197 1.00 0.00 H new ATOM 0 HE2 HIS A 98 -14.624 13.092 -1.037 1.00 0.00 H new ATOM 1476 N ARG A 99 -12.488 8.623 -4.765 1.00 0.00 N ATOM 1477 CA ARG A 99 -13.516 8.520 -5.794 1.00 0.00 C ATOM 1478 C ARG A 99 -14.018 7.085 -5.919 1.00 0.00 C ATOM 1479 O ARG A 99 -15.224 6.835 -5.919 1.00 0.00 O ATOM 1480 CB ARG A 99 -12.969 9.000 -7.140 1.00 0.00 C ATOM 1481 CG ARG A 99 -14.030 9.115 -8.222 1.00 0.00 C ATOM 1482 CD ARG A 99 -13.414 9.085 -9.612 1.00 0.00 C ATOM 1483 NE ARG A 99 -14.301 9.665 -10.617 1.00 0.00 N ATOM 1484 CZ ARG A 99 -14.051 9.637 -11.921 1.00 0.00 C ATOM 1485 NH1 ARG A 99 -12.948 9.060 -12.376 1.00 0.00 N ATOM 1486 NH2 ARG A 99 -14.907 10.188 -12.773 1.00 0.00 N ATOM 0 H ARG A 99 -11.559 8.853 -5.118 1.00 0.00 H new ATOM 0 HA ARG A 99 -14.353 9.155 -5.502 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -12.494 9.972 -7.004 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -12.194 8.310 -7.475 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -14.744 8.297 -8.121 1.00 0.00 H new ATOM 0 HG3 ARG A 99 -14.587 10.043 -8.090 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -12.471 9.631 -9.602 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -13.183 8.055 -9.884 1.00 0.00 H new ATOM 0 HE ARG A 99 -15.159 10.116 -10.300 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -12.288 8.636 -11.724 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -12.759 9.040 -13.378 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -15.757 10.633 -12.426 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -14.715 10.166 -13.775 1.00 0.00 H new ATOM 1500 N LEU A 100 -13.085 6.145 -6.027 1.00 0.00 N ATOM 1501 CA LEU A 100 -13.432 4.734 -6.154 1.00 0.00 C ATOM 1502 C LEU A 100 -14.569 4.365 -5.206 1.00 0.00 C ATOM 1503 O LEU A 100 -15.614 3.874 -5.634 1.00 0.00 O ATOM 1504 CB LEU A 100 -12.210 3.860 -5.867 1.00 0.00 C ATOM 1505 CG LEU A 100 -11.028 4.023 -6.823 1.00 0.00 C ATOM 1506 CD1 LEU A 100 -9.790 3.341 -6.262 1.00 0.00 C ATOM 1507 CD2 LEU A 100 -11.372 3.465 -8.196 1.00 0.00 C ATOM 0 H LEU A 100 -12.083 6.335 -6.029 1.00 0.00 H new ATOM 0 HA LEU A 100 -13.765 4.558 -7.177 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -11.865 4.074 -4.855 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -12.523 2.816 -5.883 1.00 0.00 H new ATOM 0 HG LEU A 100 -10.814 5.087 -6.929 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -8.959 3.467 -6.956 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -9.532 3.788 -5.302 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -9.990 2.278 -6.126 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -10.519 3.590 -8.863 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -11.613 2.405 -8.108 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -12.231 4.000 -8.601 1.00 0.00 H new ATOM 1519 N HIS A 101 -14.359 4.607 -3.916 1.00 0.00 N ATOM 1520 CA HIS A 101 -15.368 4.304 -2.907 1.00 0.00 C ATOM 1521 C HIS A 101 -16.735 4.835 -3.328 1.00 0.00 C ATOM 1522 O HIS A 101 -17.755 4.174 -3.138 1.00 0.00 O ATOM 1523 CB HIS A 101 -14.968 4.904 -1.559 1.00 0.00 C ATOM 1524 CG HIS A 101 -15.849 4.473 -0.427 1.00 0.00 C ATOM 1525 ND1 HIS A 101 -16.180 3.156 -0.190 1.00 0.00 N ATOM 1526 CD2 HIS A 101 -16.466 5.194 0.538 1.00 0.00 C ATOM 1527 CE1 HIS A 101 -16.965 3.085 0.870 1.00 0.00 C ATOM 1528 NE2 HIS A 101 -17.154 4.308 1.331 1.00 0.00 N ATOM 0 H HIS A 101 -13.500 5.012 -3.545 1.00 0.00 H new ATOM 0 HA HIS A 101 -15.434 3.220 -2.809 1.00 0.00 H new ATOM 0 HB2 HIS A 101 -13.939 4.622 -1.336 1.00 0.00 H new ATOM 0 HB3 HIS A 101 -14.991 5.991 -1.633 1.00 0.00 H new ATOM 0 HD2 HIS A 101 -16.425 6.266 0.662 1.00 0.00 H new ATOM 0 HE1 HIS A 101 -17.381 2.181 1.288 1.00 0.00 H new ATOM 0 HE2 HIS A 101 -17.719 4.555 2.144 1.00 0.00 H new ATOM 1536 N LYS A 102 -16.747 6.034 -3.901 1.00 0.00 N ATOM 1537 CA LYS A 102 -17.988 6.655 -4.350 1.00 0.00 C ATOM 1538 C LYS A 102 -18.543 5.937 -5.575 1.00 0.00 C ATOM 1539 O LYS A 102 -19.707 5.537 -5.596 1.00 0.00 O ATOM 1540 CB LYS A 102 -17.754 8.133 -4.673 1.00 0.00 C ATOM 1541 CG LYS A 102 -17.216 8.934 -3.501 1.00 0.00 C ATOM 1542 CD LYS A 102 -17.647 10.390 -3.576 1.00 0.00 C ATOM 1543 CE LYS A 102 -19.093 10.567 -3.141 1.00 0.00 C ATOM 1544 NZ LYS A 102 -19.214 10.708 -1.663 1.00 0.00 N ATOM 0 H LYS A 102 -15.911 6.595 -4.065 1.00 0.00 H new ATOM 0 HA LYS A 102 -18.718 6.577 -3.544 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -17.054 8.208 -5.505 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -18.693 8.577 -5.005 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -17.569 8.497 -2.567 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -16.128 8.876 -3.488 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -16.999 10.995 -2.942 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -17.526 10.754 -4.596 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -19.513 11.449 -3.626 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -19.680 9.711 -3.473 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -20.215 10.827 -1.406 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -18.837 9.856 -1.201 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -18.675 11.540 -1.348 1.00 0.00 H new ATOM 1558 N GLU A 103 -17.703 5.776 -6.593 1.00 0.00 N ATOM 1559 CA GLU A 103 -18.112 5.105 -7.821 1.00 0.00 C ATOM 1560 C GLU A 103 -18.417 3.633 -7.561 1.00 0.00 C ATOM 1561 O GLU A 103 -19.064 2.969 -8.371 1.00 0.00 O ATOM 1562 CB GLU A 103 -17.019 5.231 -8.885 1.00 0.00 C ATOM 1563 CG GLU A 103 -16.974 6.594 -9.553 1.00 0.00 C ATOM 1564 CD GLU A 103 -16.157 6.591 -10.831 1.00 0.00 C ATOM 1565 OE1 GLU A 103 -15.031 6.052 -10.813 1.00 0.00 O ATOM 1566 OE2 GLU A 103 -16.644 7.127 -11.848 1.00 0.00 O ATOM 0 H GLU A 103 -16.736 6.101 -6.591 1.00 0.00 H new ATOM 0 HA GLU A 103 -19.020 5.587 -8.184 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -16.051 5.029 -8.425 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -17.176 4.467 -9.647 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -17.990 6.919 -9.777 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -16.553 7.321 -8.859 1.00 0.00 H new ATOM 1573 N GLY A 104 -17.945 3.128 -6.425 1.00 0.00 N ATOM 1574 CA GLY A 104 -18.177 1.738 -6.079 1.00 0.00 C ATOM 1575 C GLY A 104 -17.156 0.807 -6.702 1.00 0.00 C ATOM 1576 O GLY A 104 -17.511 -0.224 -7.273 1.00 0.00 O ATOM 0 H GLY A 104 -17.406 3.657 -5.739 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -18.151 1.627 -4.995 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -19.176 1.447 -6.405 1.00 0.00 H new ATOM 1580 N LYS A 105 -15.882 1.171 -6.594 1.00 0.00 N ATOM 1581 CA LYS A 105 -14.805 0.362 -7.152 1.00 0.00 C ATOM 1582 C LYS A 105 -13.695 0.152 -6.126 1.00 0.00 C ATOM 1583 O LYS A 105 -12.583 -0.248 -6.473 1.00 0.00 O ATOM 1584 CB LYS A 105 -14.236 1.028 -8.406 1.00 0.00 C ATOM 1585 CG LYS A 105 -15.270 1.260 -9.494 1.00 0.00 C ATOM 1586 CD LYS A 105 -14.710 2.108 -10.624 1.00 0.00 C ATOM 1587 CE LYS A 105 -15.814 2.618 -11.538 1.00 0.00 C ATOM 1588 NZ LYS A 105 -16.340 1.543 -12.425 1.00 0.00 N ATOM 0 H LYS A 105 -15.571 2.021 -6.125 1.00 0.00 H new ATOM 0 HA LYS A 105 -15.217 -0.611 -7.420 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -13.791 1.984 -8.129 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -13.434 0.407 -8.805 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -15.605 0.301 -9.889 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -16.144 1.752 -9.067 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -14.161 2.953 -10.209 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -13.999 1.520 -11.204 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -16.627 3.022 -10.935 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -15.432 3.437 -12.147 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -17.090 1.930 -13.032 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -15.570 1.175 -13.019 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -16.728 0.772 -11.844 1.00 0.00 H new ATOM 1602 N LEU A 106 -14.004 0.424 -4.863 1.00 0.00 N ATOM 1603 CA LEU A 106 -13.033 0.263 -3.787 1.00 0.00 C ATOM 1604 C LEU A 106 -13.486 -0.809 -2.800 1.00 0.00 C ATOM 1605 O LEU A 106 -12.790 -1.802 -2.583 1.00 0.00 O ATOM 1606 CB LEU A 106 -12.828 1.591 -3.056 1.00 0.00 C ATOM 1607 CG LEU A 106 -11.559 1.703 -2.211 1.00 0.00 C ATOM 1608 CD1 LEU A 106 -11.380 3.125 -1.702 1.00 0.00 C ATOM 1609 CD2 LEU A 106 -11.603 0.721 -1.049 1.00 0.00 C ATOM 0 H LEU A 106 -14.919 0.757 -4.559 1.00 0.00 H new ATOM 0 HA LEU A 106 -12.087 -0.052 -4.228 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -12.820 2.392 -3.795 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -13.688 1.763 -2.409 1.00 0.00 H new ATOM 0 HG LEU A 106 -10.704 1.453 -2.840 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -10.472 3.185 -1.103 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -11.302 3.807 -2.548 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -12.238 3.403 -1.090 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -10.692 0.815 -0.459 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -12.467 0.939 -0.421 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -11.682 -0.295 -1.434 1.00 0.00 H new ATOM 1621 N LEU A 107 -14.657 -0.602 -2.207 1.00 0.00 N ATOM 1622 CA LEU A 107 -15.204 -1.552 -1.244 1.00 0.00 C ATOM 1623 C LEU A 107 -15.297 -2.949 -1.850 1.00 0.00 C ATOM 1624 O LEU A 107 -14.951 -3.949 -1.221 1.00 0.00 O ATOM 1625 CB LEU A 107 -16.587 -1.094 -0.777 1.00 0.00 C ATOM 1626 CG LEU A 107 -17.009 -1.552 0.620 1.00 0.00 C ATOM 1627 CD1 LEU A 107 -17.555 -2.971 0.573 1.00 0.00 C ATOM 1628 CD2 LEU A 107 -15.838 -1.461 1.588 1.00 0.00 C ATOM 0 H LEU A 107 -15.245 0.214 -2.376 1.00 0.00 H new ATOM 0 HA LEU A 107 -14.532 -1.592 -0.387 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -16.616 -0.005 -0.805 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -17.327 -1.451 -1.494 1.00 0.00 H new ATOM 0 HG LEU A 107 -17.800 -0.891 0.975 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -17.850 -3.281 1.576 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -18.421 -3.006 -0.088 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -16.785 -3.645 0.197 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -16.157 -1.791 2.577 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -15.026 -2.098 1.237 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -15.492 -0.429 1.644 1.00 0.00 H new ATOM 1640 N PRO A 108 -15.772 -3.021 -3.102 1.00 0.00 N ATOM 1641 CA PRO A 108 -15.918 -4.290 -3.821 1.00 0.00 C ATOM 1642 C PRO A 108 -14.666 -5.155 -3.731 1.00 0.00 C ATOM 1643 O PRO A 108 -14.734 -6.379 -3.850 1.00 0.00 O ATOM 1644 CB PRO A 108 -16.163 -3.852 -5.268 1.00 0.00 C ATOM 1645 CG PRO A 108 -16.760 -2.492 -5.155 1.00 0.00 C ATOM 1646 CD PRO A 108 -16.203 -1.869 -3.912 1.00 0.00 C ATOM 0 HA PRO A 108 -16.717 -4.904 -3.406 1.00 0.00 H new ATOM 0 HB2 PRO A 108 -15.234 -3.831 -5.838 1.00 0.00 H new ATOM 0 HB3 PRO A 108 -16.836 -4.539 -5.781 1.00 0.00 H new ATOM 0 HG2 PRO A 108 -16.516 -1.890 -6.030 1.00 0.00 H new ATOM 0 HG3 PRO A 108 -17.847 -2.552 -5.102 1.00 0.00 H new ATOM 0 HD2 PRO A 108 -15.369 -1.204 -4.137 1.00 0.00 H new ATOM 0 HD3 PRO A 108 -16.954 -1.274 -3.392 1.00 0.00 H new ATOM 1654 N LEU A 109 -13.522 -4.512 -3.521 1.00 0.00 N ATOM 1655 CA LEU A 109 -12.253 -5.223 -3.414 1.00 0.00 C ATOM 1656 C LEU A 109 -11.898 -5.487 -1.954 1.00 0.00 C ATOM 1657 O LEU A 109 -11.354 -6.538 -1.617 1.00 0.00 O ATOM 1658 CB LEU A 109 -11.138 -4.420 -4.086 1.00 0.00 C ATOM 1659 CG LEU A 109 -11.439 -3.899 -5.491 1.00 0.00 C ATOM 1660 CD1 LEU A 109 -10.642 -2.635 -5.774 1.00 0.00 C ATOM 1661 CD2 LEU A 109 -11.136 -4.966 -6.532 1.00 0.00 C ATOM 0 H LEU A 109 -13.448 -3.500 -3.422 1.00 0.00 H new ATOM 0 HA LEU A 109 -12.358 -6.182 -3.922 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -10.896 -3.569 -3.449 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -10.247 -5.045 -4.135 1.00 0.00 H new ATOM 0 HG LEU A 109 -12.500 -3.655 -5.547 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -10.869 -2.279 -6.779 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -10.908 -1.867 -5.048 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -9.577 -2.852 -5.699 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -11.356 -4.577 -7.526 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -10.083 -5.241 -6.475 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -11.751 -5.845 -6.342 1.00 0.00 H new ATOM 1673 N VAL A 110 -12.210 -4.525 -1.092 1.00 0.00 N ATOM 1674 CA VAL A 110 -11.927 -4.654 0.333 1.00 0.00 C ATOM 1675 C VAL A 110 -12.607 -5.886 0.919 1.00 0.00 C ATOM 1676 O VAL A 110 -12.071 -6.537 1.816 1.00 0.00 O ATOM 1677 CB VAL A 110 -12.387 -3.407 1.112 1.00 0.00 C ATOM 1678 CG1 VAL A 110 -12.013 -3.527 2.581 1.00 0.00 C ATOM 1679 CG2 VAL A 110 -11.790 -2.148 0.502 1.00 0.00 C ATOM 0 H VAL A 110 -12.659 -3.648 -1.355 1.00 0.00 H new ATOM 0 HA VAL A 110 -10.847 -4.757 0.433 1.00 0.00 H new ATOM 0 HB VAL A 110 -13.473 -3.337 1.043 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -12.346 -2.637 3.115 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -12.493 -4.407 3.008 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -10.931 -3.623 2.674 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -12.125 -1.277 1.065 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -10.702 -2.207 0.538 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -12.114 -2.057 -0.535 1.00 0.00 H new ATOM 1689 N HIS A 111 -13.792 -6.201 0.406 1.00 0.00 N ATOM 1690 CA HIS A 111 -14.546 -7.357 0.878 1.00 0.00 C ATOM 1691 C HIS A 111 -14.260 -8.582 0.015 1.00 0.00 C ATOM 1692 O HIS A 111 -15.162 -9.360 -0.293 1.00 0.00 O ATOM 1693 CB HIS A 111 -16.045 -7.052 0.870 1.00 0.00 C ATOM 1694 CG HIS A 111 -16.459 -6.056 1.909 1.00 0.00 C ATOM 1695 ND1 HIS A 111 -17.744 -5.568 2.013 1.00 0.00 N ATOM 1696 CD2 HIS A 111 -15.749 -5.456 2.893 1.00 0.00 C ATOM 1697 CE1 HIS A 111 -17.807 -4.710 3.016 1.00 0.00 C ATOM 1698 NE2 HIS A 111 -16.609 -4.625 3.567 1.00 0.00 N ATOM 0 H HIS A 111 -14.251 -5.672 -0.336 1.00 0.00 H new ATOM 0 HA HIS A 111 -14.231 -7.573 1.899 1.00 0.00 H new ATOM 0 HB2 HIS A 111 -16.326 -6.676 -0.114 1.00 0.00 H new ATOM 0 HB3 HIS A 111 -16.597 -7.979 1.027 1.00 0.00 H new ATOM 0 HD2 HIS A 111 -14.701 -5.604 3.108 1.00 0.00 H new ATOM 0 HE1 HIS A 111 -18.688 -4.170 3.332 1.00 0.00 H new ATOM 0 HE2 HIS A 111 -16.363 -4.037 4.364 1.00 0.00 H new ATOM 1706 N GLN A 112 -12.999 -8.746 -0.372 1.00 0.00 N ATOM 1707 CA GLN A 112 -12.595 -9.875 -1.201 1.00 0.00 C ATOM 1708 C GLN A 112 -11.355 -10.554 -0.628 1.00 0.00 C ATOM 1709 O GLN A 112 -11.247 -11.781 -0.636 1.00 0.00 O ATOM 1710 CB GLN A 112 -12.322 -9.413 -2.633 1.00 0.00 C ATOM 1711 CG GLN A 112 -13.576 -9.300 -3.485 1.00 0.00 C ATOM 1712 CD GLN A 112 -13.955 -10.612 -4.142 1.00 0.00 C ATOM 1713 OE1 GLN A 112 -14.764 -11.374 -3.612 1.00 0.00 O ATOM 1714 NE2 GLN A 112 -13.372 -10.883 -5.304 1.00 0.00 N ATOM 0 H GLN A 112 -12.240 -8.111 -0.125 1.00 0.00 H new ATOM 0 HA GLN A 112 -13.412 -10.597 -1.210 1.00 0.00 H new ATOM 0 HB2 GLN A 112 -11.824 -8.444 -2.605 1.00 0.00 H new ATOM 0 HB3 GLN A 112 -11.633 -10.112 -3.106 1.00 0.00 H new ATOM 0 HG2 GLN A 112 -14.403 -8.957 -2.864 1.00 0.00 H new ATOM 0 HG3 GLN A 112 -13.421 -8.544 -4.255 1.00 0.00 H new ATOM 0 HE21 GLN A 112 -12.707 -10.223 -5.707 1.00 0.00 H new ATOM 0 HE22 GLN A 112 -13.589 -11.751 -5.793 1.00 0.00 H new ATOM 1723 N CYS A 113 -10.421 -9.750 -0.133 1.00 0.00 N ATOM 1724 CA CYS A 113 -9.188 -10.272 0.443 1.00 0.00 C ATOM 1725 C CYS A 113 -9.484 -11.167 1.643 1.00 0.00 C ATOM 1726 O CYS A 113 -9.150 -12.352 1.644 1.00 0.00 O ATOM 1727 CB CYS A 113 -8.270 -9.122 0.865 1.00 0.00 C ATOM 1728 SG CYS A 113 -9.146 -7.701 1.595 1.00 0.00 S ATOM 0 H CYS A 113 -10.495 -8.733 -0.119 1.00 0.00 H new ATOM 0 HA CYS A 113 -8.686 -10.869 -0.318 1.00 0.00 H new ATOM 0 HB2 CYS A 113 -7.544 -9.497 1.586 1.00 0.00 H new ATOM 0 HB3 CYS A 113 -7.709 -8.781 -0.005 1.00 0.00 H new ATOM 1733 N TYR A 114 -10.113 -10.592 2.662 1.00 0.00 N ATOM 1734 CA TYR A 114 -10.453 -11.336 3.869 1.00 0.00 C ATOM 1735 C TYR A 114 -11.816 -12.006 3.729 1.00 0.00 C ATOM 1736 O TYR A 114 -12.454 -12.355 4.724 1.00 0.00 O ATOM 1737 CB TYR A 114 -10.451 -10.407 5.083 1.00 0.00 C ATOM 1738 CG TYR A 114 -11.795 -9.774 5.365 1.00 0.00 C ATOM 1739 CD1 TYR A 114 -12.363 -8.876 4.470 1.00 0.00 C ATOM 1740 CD2 TYR A 114 -12.497 -10.075 6.525 1.00 0.00 C ATOM 1741 CE1 TYR A 114 -13.590 -8.295 4.723 1.00 0.00 C ATOM 1742 CE2 TYR A 114 -13.726 -9.500 6.785 1.00 0.00 C ATOM 1743 CZ TYR A 114 -14.268 -8.611 5.882 1.00 0.00 C ATOM 1744 OH TYR A 114 -15.492 -8.035 6.138 1.00 0.00 O ATOM 0 H TYR A 114 -10.398 -9.613 2.676 1.00 0.00 H new ATOM 0 HA TYR A 114 -9.700 -12.111 4.012 1.00 0.00 H new ATOM 0 HB2 TYR A 114 -10.133 -10.970 5.960 1.00 0.00 H new ATOM 0 HB3 TYR A 114 -9.714 -9.619 4.926 1.00 0.00 H new ATOM 0 HD1 TYR A 114 -11.836 -8.628 3.561 1.00 0.00 H new ATOM 0 HD2 TYR A 114 -12.075 -10.770 7.236 1.00 0.00 H new ATOM 0 HE1 TYR A 114 -14.016 -7.597 4.017 1.00 0.00 H new ATOM 0 HE2 TYR A 114 -14.259 -9.746 7.691 1.00 0.00 H new ATOM 0 HH TYR A 114 -15.836 -8.364 6.995 1.00 0.00 H new ATOM 1754 N LEU A 115 -12.257 -12.184 2.489 1.00 0.00 N ATOM 1755 CA LEU A 115 -13.544 -12.814 2.217 1.00 0.00 C ATOM 1756 C LEU A 115 -13.567 -14.250 2.730 1.00 0.00 C ATOM 1757 O LEU A 115 -12.520 -14.851 2.974 1.00 0.00 O ATOM 1758 CB LEU A 115 -13.838 -12.792 0.716 1.00 0.00 C ATOM 1759 CG LEU A 115 -15.315 -12.822 0.321 1.00 0.00 C ATOM 1760 CD1 LEU A 115 -16.054 -11.637 0.923 1.00 0.00 C ATOM 1761 CD2 LEU A 115 -15.462 -12.831 -1.194 1.00 0.00 C ATOM 0 H LEU A 115 -11.742 -11.901 1.655 1.00 0.00 H new ATOM 0 HA LEU A 115 -14.315 -12.248 2.740 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -13.387 -11.895 0.291 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -13.342 -13.647 0.256 1.00 0.00 H new ATOM 0 HG LEU A 115 -15.757 -13.737 0.715 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -17.103 -11.676 0.631 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -15.978 -11.675 2.010 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -15.611 -10.710 0.561 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -16.520 -12.852 -1.457 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -15.003 -11.934 -1.609 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -14.969 -13.713 -1.602 1.00 0.00 H new ATOM 1773 N LYS A 116 -14.767 -14.797 2.890 1.00 0.00 N ATOM 1774 CA LYS A 116 -14.928 -16.164 3.370 1.00 0.00 C ATOM 1775 C LYS A 116 -14.554 -16.270 4.845 1.00 0.00 C ATOM 1776 O LYS A 116 -13.739 -17.108 5.231 1.00 0.00 O ATOM 1777 CB LYS A 116 -14.066 -17.121 2.544 1.00 0.00 C ATOM 1778 CG LYS A 116 -14.536 -18.565 2.600 1.00 0.00 C ATOM 1779 CD LYS A 116 -13.859 -19.413 1.536 1.00 0.00 C ATOM 1780 CE LYS A 116 -14.525 -20.773 1.400 1.00 0.00 C ATOM 1781 NZ LYS A 116 -15.746 -20.710 0.550 1.00 0.00 N ATOM 0 H LYS A 116 -15.644 -14.314 2.694 1.00 0.00 H new ATOM 0 HA LYS A 116 -15.976 -16.441 3.258 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -14.062 -16.789 1.506 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -13.037 -17.069 2.899 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -14.325 -18.979 3.586 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -15.617 -18.602 2.463 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -13.893 -18.893 0.579 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -12.807 -19.546 1.790 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -13.818 -21.482 0.969 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -14.790 -21.148 2.389 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -16.171 -21.657 0.482 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -16.431 -20.053 0.975 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -15.490 -20.376 -0.401 1.00 0.00 H new ATOM 1795 N LYS A 117 -15.157 -15.417 5.666 1.00 0.00 N ATOM 1796 CA LYS A 117 -14.890 -15.416 7.100 1.00 0.00 C ATOM 1797 C LYS A 117 -15.997 -16.139 7.860 1.00 0.00 C ATOM 1798 O LYS A 117 -17.178 -15.838 7.691 1.00 0.00 O ATOM 1799 CB LYS A 117 -14.758 -13.980 7.614 1.00 0.00 C ATOM 1800 CG LYS A 117 -14.092 -13.881 8.975 1.00 0.00 C ATOM 1801 CD LYS A 117 -15.100 -14.034 10.102 1.00 0.00 C ATOM 1802 CE LYS A 117 -14.674 -13.258 11.339 1.00 0.00 C ATOM 1803 NZ LYS A 117 -14.656 -11.790 11.095 1.00 0.00 N ATOM 0 H LYS A 117 -15.834 -14.717 5.363 1.00 0.00 H new ATOM 0 HA LYS A 117 -13.952 -15.944 7.270 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -14.184 -13.397 6.894 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -15.749 -13.530 7.670 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -13.326 -14.652 9.063 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -13.588 -12.919 9.065 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -16.076 -13.682 9.769 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -15.210 -15.089 10.353 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -15.355 -13.481 12.160 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -13.682 -13.586 11.650 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -14.834 -11.287 11.988 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -13.727 -11.512 10.721 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -15.395 -11.544 10.406 1.00 0.00 H new ATOM 1817 N SER A 118 -15.606 -17.093 8.699 1.00 0.00 N ATOM 1818 CA SER A 118 -16.566 -17.861 9.484 1.00 0.00 C ATOM 1819 C SER A 118 -17.730 -16.982 9.930 1.00 0.00 C ATOM 1820 O SER A 118 -17.553 -16.045 10.709 1.00 0.00 O ATOM 1821 CB SER A 118 -15.881 -18.479 10.704 1.00 0.00 C ATOM 1822 OG SER A 118 -15.571 -17.489 11.670 1.00 0.00 O ATOM 0 H SER A 118 -14.632 -17.353 8.853 1.00 0.00 H new ATOM 0 HA SER A 118 -16.958 -18.659 8.854 1.00 0.00 H new ATOM 0 HB2 SER A 118 -16.531 -19.233 11.147 1.00 0.00 H new ATOM 0 HB3 SER A 118 -14.968 -18.988 10.394 1.00 0.00 H new ATOM 0 HG SER A 118 -16.039 -16.657 11.448 1.00 0.00 H new ATOM 1828 N LYS A 119 -18.922 -17.290 9.430 1.00 0.00 N ATOM 1829 CA LYS A 119 -20.117 -16.531 9.776 1.00 0.00 C ATOM 1830 C LYS A 119 -21.375 -17.367 9.561 1.00 0.00 C ATOM 1831 O LYS A 119 -21.453 -18.155 8.619 1.00 0.00 O ATOM 1832 CB LYS A 119 -20.193 -15.251 8.940 1.00 0.00 C ATOM 1833 CG LYS A 119 -20.473 -15.501 7.469 1.00 0.00 C ATOM 1834 CD LYS A 119 -20.900 -14.228 6.758 1.00 0.00 C ATOM 1835 CE LYS A 119 -21.389 -14.515 5.346 1.00 0.00 C ATOM 1836 NZ LYS A 119 -20.277 -14.478 4.356 1.00 0.00 N ATOM 0 H LYS A 119 -19.086 -18.061 8.783 1.00 0.00 H new ATOM 0 HA LYS A 119 -20.055 -16.266 10.831 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -20.974 -14.608 9.346 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -19.252 -14.709 9.035 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -19.580 -15.904 6.991 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -21.255 -16.254 7.369 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -21.692 -13.741 7.326 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -20.061 -13.533 6.719 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -21.867 -15.494 5.319 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -22.147 -13.783 5.068 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -20.651 -14.678 3.406 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -19.837 -13.536 4.363 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -19.566 -15.194 4.606 1.00 0.00 H new ATOM 1850 N ARG A 120 -22.356 -17.188 10.438 1.00 0.00 N ATOM 1851 CA ARG A 120 -23.610 -17.926 10.343 1.00 0.00 C ATOM 1852 C ARG A 120 -24.536 -17.293 9.309 1.00 0.00 C ATOM 1853 O ARG A 120 -25.734 -17.132 9.547 1.00 0.00 O ATOM 1854 CB ARG A 120 -24.305 -17.971 11.705 1.00 0.00 C ATOM 1855 CG ARG A 120 -25.454 -18.964 11.770 1.00 0.00 C ATOM 1856 CD ARG A 120 -26.012 -19.078 13.180 1.00 0.00 C ATOM 1857 NE ARG A 120 -26.621 -20.383 13.424 1.00 0.00 N ATOM 1858 CZ ARG A 120 -27.814 -20.736 12.957 1.00 0.00 C ATOM 1859 NH1 ARG A 120 -28.521 -19.886 12.226 1.00 0.00 N ATOM 1860 NH2 ARG A 120 -28.300 -21.942 13.222 1.00 0.00 N ATOM 0 H ARG A 120 -22.307 -16.538 11.223 1.00 0.00 H new ATOM 0 HA ARG A 120 -23.380 -18.943 10.026 1.00 0.00 H new ATOM 0 HB2 ARG A 120 -23.571 -18.227 12.470 1.00 0.00 H new ATOM 0 HB3 ARG A 120 -24.681 -16.976 11.944 1.00 0.00 H new ATOM 0 HG2 ARG A 120 -26.245 -18.652 11.088 1.00 0.00 H new ATOM 0 HG3 ARG A 120 -25.111 -19.942 11.433 1.00 0.00 H new ATOM 0 HD2 ARG A 120 -25.212 -18.911 13.901 1.00 0.00 H new ATOM 0 HD3 ARG A 120 -26.754 -18.296 13.340 1.00 0.00 H new ATOM 0 HE ARG A 120 -26.102 -21.060 13.983 1.00 0.00 H new ATOM 0 HH11 ARG A 120 -28.150 -18.958 12.021 1.00 0.00 H new ATOM 0 HH12 ARG A 120 -29.436 -20.159 11.869 1.00 0.00 H new ATOM 0 HH21 ARG A 120 -27.758 -22.598 13.784 1.00 0.00 H new ATOM 0 HH22 ARG A 120 -29.216 -22.213 12.864 1.00 0.00 H new ATOM 1874 N LYS A 121 -23.974 -16.934 8.159 1.00 0.00 N ATOM 1875 CA LYS A 121 -24.748 -16.320 7.087 1.00 0.00 C ATOM 1876 C LYS A 121 -24.364 -16.907 5.733 1.00 0.00 C ATOM 1877 O LYS A 121 -23.211 -17.275 5.512 1.00 0.00 O ATOM 1878 CB LYS A 121 -24.531 -14.805 7.078 1.00 0.00 C ATOM 1879 CG LYS A 121 -25.521 -14.054 6.204 1.00 0.00 C ATOM 1880 CD LYS A 121 -26.856 -13.870 6.905 1.00 0.00 C ATOM 1881 CE LYS A 121 -27.933 -13.398 5.939 1.00 0.00 C ATOM 1882 NZ LYS A 121 -29.294 -13.808 6.382 1.00 0.00 N ATOM 0 H LYS A 121 -22.984 -17.058 7.946 1.00 0.00 H new ATOM 0 HA LYS A 121 -25.802 -16.530 7.268 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -24.603 -14.430 8.099 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -23.520 -14.593 6.731 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -25.110 -13.079 5.941 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -25.671 -14.598 5.272 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -27.162 -14.812 7.360 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -26.747 -13.146 7.712 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -27.891 -12.312 5.851 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -27.736 -13.806 4.948 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -29.999 -13.468 5.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -29.342 -14.845 6.442 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -29.493 -13.398 7.317 1.00 0.00 H new ATOM 1896 N GLU A 122 -25.337 -16.989 4.831 1.00 0.00 N ATOM 1897 CA GLU A 122 -25.098 -17.531 3.499 1.00 0.00 C ATOM 1898 C GLU A 122 -23.798 -16.986 2.914 1.00 0.00 C ATOM 1899 O GLU A 122 -23.332 -15.914 3.300 1.00 0.00 O ATOM 1900 CB GLU A 122 -26.267 -17.196 2.571 1.00 0.00 C ATOM 1901 CG GLU A 122 -26.343 -18.084 1.340 1.00 0.00 C ATOM 1902 CD GLU A 122 -26.700 -19.519 1.678 1.00 0.00 C ATOM 1903 OE1 GLU A 122 -27.612 -19.723 2.506 1.00 0.00 O ATOM 1904 OE2 GLU A 122 -26.068 -20.437 1.115 1.00 0.00 O ATOM 0 H GLU A 122 -26.297 -16.687 4.998 1.00 0.00 H new ATOM 0 HA GLU A 122 -25.011 -18.614 3.586 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -27.199 -17.283 3.129 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -26.181 -16.157 2.254 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -27.086 -17.681 0.651 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -25.384 -18.064 0.822 1.00 0.00 H new ATOM 1911 N PHE A 123 -23.217 -17.733 1.981 1.00 0.00 N ATOM 1912 CA PHE A 123 -21.970 -17.326 1.344 1.00 0.00 C ATOM 1913 C PHE A 123 -21.770 -18.061 0.021 1.00 0.00 C ATOM 1914 O PHE A 123 -22.243 -19.183 -0.154 1.00 0.00 O ATOM 1915 CB PHE A 123 -20.785 -17.597 2.274 1.00 0.00 C ATOM 1916 CG PHE A 123 -20.686 -19.028 2.718 1.00 0.00 C ATOM 1917 CD1 PHE A 123 -21.586 -19.546 3.636 1.00 0.00 C ATOM 1918 CD2 PHE A 123 -19.695 -19.856 2.217 1.00 0.00 C ATOM 1919 CE1 PHE A 123 -21.496 -20.863 4.047 1.00 0.00 C ATOM 1920 CE2 PHE A 123 -19.601 -21.174 2.624 1.00 0.00 C ATOM 1921 CZ PHE A 123 -20.504 -21.678 3.539 1.00 0.00 C ATOM 0 H PHE A 123 -23.589 -18.623 1.649 1.00 0.00 H new ATOM 0 HA PHE A 123 -22.027 -16.257 1.141 1.00 0.00 H new ATOM 0 HB2 PHE A 123 -19.863 -17.319 1.764 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -20.869 -16.957 3.153 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -22.366 -18.914 4.035 1.00 0.00 H new ATOM 0 HD2 PHE A 123 -18.987 -19.467 1.500 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -22.201 -21.254 4.765 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -18.822 -21.808 2.227 1.00 0.00 H new ATOM 0 HZ PHE A 123 -20.434 -22.708 3.857 1.00 0.00 H new ATOM 1931 N GLN A 124 -21.068 -17.417 -0.906 1.00 0.00 N ATOM 1932 CA GLN A 124 -20.807 -18.008 -2.213 1.00 0.00 C ATOM 1933 C GLN A 124 -19.708 -19.062 -2.124 1.00 0.00 C ATOM 1934 O GLN A 124 -19.090 -19.242 -1.075 1.00 0.00 O ATOM 1935 CB GLN A 124 -20.410 -16.924 -3.216 1.00 0.00 C ATOM 1936 CG GLN A 124 -19.130 -16.192 -2.847 1.00 0.00 C ATOM 1937 CD GLN A 124 -18.660 -15.251 -3.939 1.00 0.00 C ATOM 1938 OE1 GLN A 124 -18.169 -15.687 -4.980 1.00 0.00 O ATOM 1939 NE2 GLN A 124 -18.809 -13.953 -3.706 1.00 0.00 N ATOM 0 H GLN A 124 -20.670 -16.487 -0.776 1.00 0.00 H new ATOM 0 HA GLN A 124 -21.722 -18.492 -2.555 1.00 0.00 H new ATOM 0 HB2 GLN A 124 -20.288 -17.378 -4.199 1.00 0.00 H new ATOM 0 HB3 GLN A 124 -21.222 -16.201 -3.297 1.00 0.00 H new ATOM 0 HG2 GLN A 124 -19.291 -15.626 -1.930 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -18.347 -16.921 -2.638 1.00 0.00 H new ATOM 0 HE21 GLN A 124 -19.221 -13.636 -2.828 1.00 0.00 H new ATOM 0 HE22 GLN A 124 -18.511 -13.272 -4.405 1.00 0.00 H new ATOM 1948 N SER A 125 -19.471 -19.757 -3.232 1.00 0.00 N ATOM 1949 CA SER A 125 -18.449 -20.797 -3.278 1.00 0.00 C ATOM 1950 C SER A 125 -17.063 -20.188 -3.468 1.00 0.00 C ATOM 1951 O SER A 125 -16.930 -19.037 -3.881 1.00 0.00 O ATOM 1952 CB SER A 125 -18.745 -21.783 -4.410 1.00 0.00 C ATOM 1953 OG SER A 125 -18.537 -21.182 -5.677 1.00 0.00 O ATOM 0 H SER A 125 -19.972 -19.619 -4.110 1.00 0.00 H new ATOM 0 HA SER A 125 -18.465 -21.331 -2.328 1.00 0.00 H new ATOM 0 HB2 SER A 125 -18.105 -22.659 -4.310 1.00 0.00 H new ATOM 0 HB3 SER A 125 -19.775 -22.131 -4.334 1.00 0.00 H new ATOM 0 HG SER A 125 -18.731 -21.833 -6.384 1.00 0.00 H new ATOM 1959 N GLY A 126 -16.033 -20.972 -3.163 1.00 0.00 N ATOM 1960 CA GLY A 126 -14.670 -20.494 -3.306 1.00 0.00 C ATOM 1961 C GLY A 126 -13.758 -21.525 -3.940 1.00 0.00 C ATOM 1962 O GLY A 126 -13.603 -22.639 -3.441 1.00 0.00 O ATOM 0 H GLY A 126 -16.118 -21.929 -2.820 1.00 0.00 H new ATOM 0 HA2 GLY A 126 -14.667 -19.589 -3.913 1.00 0.00 H new ATOM 0 HA3 GLY A 126 -14.279 -20.221 -2.326 1.00 0.00 H new ATOM 1966 N PRO A 127 -13.135 -21.155 -5.070 1.00 0.00 N ATOM 1967 CA PRO A 127 -12.224 -22.042 -5.798 1.00 0.00 C ATOM 1968 C PRO A 127 -10.921 -22.282 -5.043 1.00 0.00 C ATOM 1969 O PRO A 127 -10.332 -23.360 -5.128 1.00 0.00 O ATOM 1970 CB PRO A 127 -11.955 -21.284 -7.100 1.00 0.00 C ATOM 1971 CG PRO A 127 -12.183 -19.852 -6.758 1.00 0.00 C ATOM 1972 CD PRO A 127 -13.273 -19.842 -5.722 1.00 0.00 C ATOM 0 HA PRO A 127 -12.653 -23.033 -5.946 1.00 0.00 H new ATOM 0 HB2 PRO A 127 -10.937 -21.450 -7.452 1.00 0.00 H new ATOM 0 HB3 PRO A 127 -12.624 -21.613 -7.895 1.00 0.00 H new ATOM 0 HG2 PRO A 127 -11.273 -19.393 -6.371 1.00 0.00 H new ATOM 0 HG3 PRO A 127 -12.477 -19.282 -7.639 1.00 0.00 H new ATOM 0 HD2 PRO A 127 -13.145 -19.025 -5.012 1.00 0.00 H new ATOM 0 HD3 PRO A 127 -14.257 -19.719 -6.175 1.00 0.00 H new ATOM 1980 N SER A 128 -10.476 -21.271 -4.303 1.00 0.00 N ATOM 1981 CA SER A 128 -9.241 -21.371 -3.535 1.00 0.00 C ATOM 1982 C SER A 128 -9.475 -22.117 -2.224 1.00 0.00 C ATOM 1983 O SER A 128 -10.615 -22.392 -1.849 1.00 0.00 O ATOM 1984 CB SER A 128 -8.679 -19.978 -3.249 1.00 0.00 C ATOM 1985 OG SER A 128 -9.459 -19.303 -2.277 1.00 0.00 O ATOM 0 H SER A 128 -10.953 -20.373 -4.219 1.00 0.00 H new ATOM 0 HA SER A 128 -8.518 -21.932 -4.128 1.00 0.00 H new ATOM 0 HB2 SER A 128 -7.650 -20.062 -2.900 1.00 0.00 H new ATOM 0 HB3 SER A 128 -8.656 -19.395 -4.170 1.00 0.00 H new ATOM 0 HG SER A 128 -9.078 -18.416 -2.111 1.00 0.00 H new ATOM 1991 N SER A 129 -8.387 -22.440 -1.532 1.00 0.00 N ATOM 1992 CA SER A 129 -8.473 -23.157 -0.265 1.00 0.00 C ATOM 1993 C SER A 129 -7.728 -22.407 0.835 1.00 0.00 C ATOM 1994 O SER A 129 -6.499 -22.351 0.842 1.00 0.00 O ATOM 1995 CB SER A 129 -7.900 -24.568 -0.414 1.00 0.00 C ATOM 1996 OG SER A 129 -6.583 -24.531 -0.936 1.00 0.00 O ATOM 0 H SER A 129 -7.436 -22.217 -1.827 1.00 0.00 H new ATOM 0 HA SER A 129 -9.524 -23.227 0.015 1.00 0.00 H new ATOM 0 HB2 SER A 129 -7.897 -25.067 0.555 1.00 0.00 H new ATOM 0 HB3 SER A 129 -8.539 -25.156 -1.073 1.00 0.00 H new ATOM 0 HG SER A 129 -6.090 -23.789 -0.528 1.00 0.00 H new ATOM 2002 N GLY A 130 -8.484 -21.829 1.764 1.00 0.00 N ATOM 2003 CA GLY A 130 -7.879 -21.089 2.857 1.00 0.00 C ATOM 2004 C GLY A 130 -7.499 -21.982 4.021 1.00 0.00 C ATOM 2005 O GLY A 130 -7.337 -21.510 5.146 1.00 0.00 O ATOM 0 H GLY A 130 -9.503 -21.860 1.779 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -6.990 -20.573 2.494 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -8.574 -20.323 3.202 1.00 0.00 H new TER 2009 GLY A 130