USER MOD reduce.3.24.130724 H: found=0, std=0, add=1041, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1035 hydrogens (27 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 11 TYR OH : rot 166:sc= 0.248 USER MOD Set 1.2: A 106 THR OG1 : rot 68:sc= 0.69 USER MOD Set 2.1: A 21 THR OG1 : rot -130:sc= 0.0278 USER MOD Set 2.2: A 96 ASN : amide:sc= 0.308 K(o=0.36,f=-0.73) USER MOD Set 2.3: A 98 GLN : amide:sc= 0.0259 K(o=0.36,f=-1.4) USER MOD Set 3.1: A 84 ASN : amide:sc= 1.41 K(o=2.3,f=-2.3) USER MOD Set 3.2: A 87 LYS NZ :NH3+ 176:sc= 0.937 (180deg=0) USER MOD Set 4.1: A 66 TYR OH : rot 180:sc= 0 USER MOD Set 4.2: A 74 LYS NZ :NH3+ 156:sc= 0.846 (180deg=0.495) USER MOD Set 5.1: A 42 CYS SG : rot -37:sc= 0.734 USER MOD Set 5.2: A 62 CYS SG : rot 131:sc= 0.631 USER MOD Set 6.1: A 14 GLN : amide:sc= 0.217 X(o=0.19,f=-0.25) USER MOD Set 6.2: A 17 GLN : amide:sc= -0.0323 X(o=0.19,f=0.13) USER MOD Single : A 3 GLN : amide:sc= 0.738 K(o=0.74,f=-0.055) USER MOD Single : A 6 SER OG : rot 180:sc=-0.00383 USER MOD Single : A 7 GLN : amide:sc= 0.586 K(o=0.59,f=0) USER MOD Single : A 8 HIS : no HD1:sc= -0.165 X(o=-0.16,f=-0.062) USER MOD Single : A 16 LYS NZ :NH3+ 146:sc= 0.51 (180deg=-0.543!) USER MOD Single : A 20 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.0104) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 172:sc= -0.0018 (180deg=-0.092) USER MOD Single : A 39 LYS NZ :NH3+ 168:sc= 0.457 (180deg=0.391) USER MOD Single : A 41 THR OG1 : rot 73:sc= 1.11 USER MOD Single : A 47 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 50 THR OG1 : rot 65:sc= 0.754 USER MOD Single : A 54 LYS NZ :NH3+ -153:sc= 1.18 (180deg=0.536) USER MOD Single : A 64 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 68 ASN : amide:sc= 0.435 X(o=0.44,f=0) USER MOD Single : A 69 THR OG1 : rot 75:sc= 0.918 USER MOD Single : A 78 THR OG1 : rot -38:sc= 0.0121 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 82 TYR OH : rot 165:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ 173:sc= 1.09 (180deg=0.976) USER MOD Single : A 93 LYS NZ :NH3+ 178:sc= 0.037 (180deg=0.0368) USER MOD Single : A 100 MET CE :methyl -148:sc= -0.0548 (180deg=-0.238) USER MOD Single : A 105 GLN : amide:sc= -0.426 K(o=-0.43,f=-3.8!) USER MOD Single : A 111 LYS NZ :NH3+ -147:sc= 0.927 (180deg=0.218) USER MOD Single : A 112 SER OG : rot -30:sc= 0.0965 USER MOD Single : A 113 ASN : amide:sc= 0.813 K(o=0.81,f=-1.7) USER MOD Single : A 114 SER OG : rot -130:sc= 0.786 USER MOD Single : A 115 GLN : amide:sc= 0.872 K(o=0.87,f=-0.077) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 HIS : no HE2:sc= 0.704 K(o=0.7,f=-2.9!) USER MOD Single : A 121 HIS : no HD1:sc= -0.0393 X(o=-0.039,f=0) USER MOD Single : A 122 HIS : no HD1:sc= -0.0964 K(o=-0.096,f=-0.66) USER MOD Single : A 123 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 124 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 125 HIS : no HD1:sc= -1.33! K(o=-1.3!,f=-0.51) USER MOD ----------------------------------------------------------------- HETATM 1 C1 MYR A 1 0.478 1.064 1.264 1.00 25.00 C HETATM 2 O1 MYR A 1 -0.703 1.151 1.502 1.00 25.00 O HETATM 3 C2 MYR A 1 1.026 0.194 0.149 1.00 25.00 C HETATM 4 C3 MYR A 1 0.411 -1.238 0.218 1.00 25.00 C HETATM 5 C4 MYR A 1 0.927 -2.001 1.467 1.00 25.00 C HETATM 6 C5 MYR A 1 0.217 -3.356 1.643 1.00 25.00 C HETATM 7 C6 MYR A 1 0.637 -4.033 2.970 1.00 25.00 C HETATM 8 C7 MYR A 1 -0.294 -5.232 3.313 1.00 25.00 C HETATM 9 C8 MYR A 1 -0.126 -5.740 4.778 1.00 25.00 C HETATM 10 C9 MYR A 1 -0.742 -4.757 5.822 1.00 25.00 C HETATM 11 C10 MYR A 1 -0.810 -5.328 7.266 1.00 25.00 C HETATM 12 C11 MYR A 1 -1.917 -6.414 7.463 1.00 25.00 C HETATM 13 C12 MYR A 1 -3.110 -5.953 8.361 1.00 25.00 C HETATM 14 C13 MYR A 1 -4.217 -5.210 7.563 1.00 25.00 C HETATM 15 C14 MYR A 1 -5.349 -4.722 8.492 1.00 25.00 C HETATM 0 H143 MYR A 1 -5.800 -5.577 8.996 1.00 25.00 H new HETATM 0 H142 MYR A 1 -4.940 -4.038 9.235 1.00 25.00 H new HETATM 0 H141 MYR A 1 -6.107 -4.206 7.902 1.00 25.00 H new HETATM 0 H132 MYR A 1 -3.781 -4.359 7.040 1.00 25.00 H new HETATM 0 H131 MYR A 1 -4.629 -5.875 6.803 1.00 25.00 H new HETATM 0 H122 MYR A 1 -3.546 -6.823 8.852 1.00 25.00 H new HETATM 0 H121 MYR A 1 -2.734 -5.298 9.147 1.00 25.00 H new HETATM 0 H112 MYR A 1 -2.303 -6.705 6.486 1.00 25.00 H new HETATM 0 H111 MYR A 1 -1.465 -7.302 7.905 1.00 25.00 H new HETATM 0 H102 MYR A 1 0.158 -5.758 7.523 1.00 25.00 H new HETATM 0 H101 MYR A 1 -0.989 -4.509 7.963 1.00 25.00 H new HETATM 0 H92 MYR A 1 -0.154 -3.839 5.833 1.00 25.00 H new HETATM 0 H91 MYR A 1 -1.748 -4.487 5.502 1.00 25.00 H new HETATM 0 H82 MYR A 1 -0.600 -6.716 4.878 1.00 25.00 H new HETATM 0 H81 MYR A 1 0.934 -5.877 4.993 1.00 25.00 H new HETATM 0 H72 MYR A 1 -1.331 -4.936 3.155 1.00 25.00 H new HETATM 0 H71 MYR A 1 -0.088 -6.052 2.625 1.00 25.00 H new HETATM 0 H62 MYR A 1 1.667 -4.380 2.893 1.00 25.00 H new HETATM 0 H61 MYR A 1 0.606 -3.303 3.779 1.00 25.00 H new HETATM 0 H52 MYR A 1 -0.863 -3.209 1.631 1.00 25.00 H new HETATM 0 H51 MYR A 1 0.459 -4.009 0.805 1.00 25.00 H new HETATM 0 H42 MYR A 1 2.001 -2.163 1.376 1.00 25.00 H new HETATM 0 H41 MYR A 1 0.771 -1.390 2.356 1.00 25.00 H new HETATM 0 H32 MYR A 1 -0.676 -1.170 0.251 1.00 25.00 H new HETATM 0 H31 MYR A 1 0.668 -1.793 -0.684 1.00 25.00 H new HETATM 0 H22 MYR A 1 0.801 0.646 -0.817 1.00 25.00 H new HETATM 0 H21 MYR A 1 2.112 0.134 0.227 1.00 25.00 H new ATOM 43 N GLY A 2 1.382 1.716 2.003 1.00 25.00 N ATOM 44 CA GLY A 2 1.038 2.485 3.189 1.00 25.00 C ATOM 45 C GLY A 2 0.258 3.743 2.905 1.00 25.00 C ATOM 46 O GLY A 2 -0.912 3.854 3.265 1.00 25.00 O ATOM 0 HA2 GLY A 2 0.456 1.854 3.861 1.00 25.00 H new ATOM 0 HA3 GLY A 2 1.955 2.750 3.715 1.00 25.00 H new ATOM 50 N GLN A 3 0.879 4.700 2.236 1.00 25.00 N ATOM 51 CA GLN A 3 0.190 5.959 1.940 1.00 25.00 C ATOM 52 C GLN A 3 -0.927 5.695 0.930 1.00 25.00 C ATOM 53 O GLN A 3 -1.889 6.438 0.832 1.00 25.00 O ATOM 54 CB GLN A 3 1.166 7.013 1.410 1.00 25.00 C ATOM 55 CG GLN A 3 2.409 7.208 2.289 1.00 25.00 C ATOM 56 CD GLN A 3 2.086 7.378 3.769 1.00 25.00 C ATOM 57 OE1 GLN A 3 1.350 8.272 4.163 1.00 25.00 O ATOM 58 NE2 GLN A 3 2.643 6.525 4.587 1.00 25.00 N ATOM 0 H GLN A 3 1.837 4.640 1.891 1.00 25.00 H new ATOM 0 HA GLN A 3 -0.241 6.352 2.861 1.00 25.00 H new ATOM 0 HB2 GLN A 3 1.484 6.728 0.407 1.00 25.00 H new ATOM 0 HB3 GLN A 3 0.643 7.965 1.320 1.00 25.00 H new ATOM 0 HG2 GLN A 3 3.070 6.350 2.166 1.00 25.00 H new ATOM 0 HG3 GLN A 3 2.956 8.084 1.942 1.00 25.00 H new ATOM 0 HE21 GLN A 3 3.252 5.792 4.223 1.00 25.00 H new ATOM 0 HE22 GLN A 3 2.469 6.592 5.590 1.00 25.00 H new ATOM 67 N GLU A 4 -0.788 4.587 0.223 1.00 25.00 N ATOM 68 CA GLU A 4 -1.776 4.097 -0.733 1.00 25.00 C ATOM 69 C GLU A 4 -3.072 3.698 0.004 1.00 25.00 C ATOM 70 O GLU A 4 -4.158 4.188 -0.308 1.00 25.00 O ATOM 71 CB GLU A 4 -1.111 2.902 -1.429 1.00 25.00 C ATOM 72 CG GLU A 4 -1.856 2.196 -2.523 1.00 25.00 C ATOM 73 CD GLU A 4 -0.988 1.065 -3.118 1.00 25.00 C ATOM 74 OE1 GLU A 4 0.174 1.337 -3.507 1.00 25.00 O ATOM 75 OE2 GLU A 4 -1.428 -0.106 -3.119 1.00 25.00 O ATOM 0 H GLU A 4 0.033 3.986 0.297 1.00 25.00 H new ATOM 0 HA GLU A 4 -2.067 4.852 -1.463 1.00 25.00 H new ATOM 0 HB2 GLU A 4 -0.164 3.247 -1.844 1.00 25.00 H new ATOM 0 HB3 GLU A 4 -0.873 2.164 -0.663 1.00 25.00 H new ATOM 0 HG2 GLU A 4 -2.786 1.783 -2.132 1.00 25.00 H new ATOM 0 HG3 GLU A 4 -2.127 2.906 -3.305 1.00 25.00 H new ATOM 82 N LEU A 5 -2.940 2.865 1.028 1.00 25.00 N ATOM 83 CA LEU A 5 -4.079 2.445 1.856 1.00 25.00 C ATOM 84 C LEU A 5 -4.685 3.609 2.645 1.00 25.00 C ATOM 85 O LEU A 5 -5.904 3.701 2.765 1.00 25.00 O ATOM 86 CB LEU A 5 -3.640 1.355 2.838 1.00 25.00 C ATOM 87 CG LEU A 5 -3.526 -0.075 2.278 1.00 25.00 C ATOM 88 CD1 LEU A 5 -2.756 -0.953 3.258 1.00 25.00 C ATOM 89 CD2 LEU A 5 -4.893 -0.688 2.015 1.00 25.00 C ATOM 0 H LEU A 5 -2.048 2.459 1.313 1.00 25.00 H new ATOM 0 HA LEU A 5 -4.841 2.062 1.177 1.00 25.00 H new ATOM 0 HB2 LEU A 5 -2.671 1.638 3.249 1.00 25.00 H new ATOM 0 HB3 LEU A 5 -4.346 1.340 3.668 1.00 25.00 H new ATOM 0 HG LEU A 5 -2.993 -0.018 1.329 1.00 25.00 H new ATOM 0 HD11 LEU A 5 -2.678 -1.964 2.857 1.00 25.00 H new ATOM 0 HD12 LEU A 5 -1.757 -0.543 3.406 1.00 25.00 H new ATOM 0 HD13 LEU A 5 -3.282 -0.981 4.212 1.00 25.00 H new ATOM 0 HD21 LEU A 5 -4.770 -1.697 1.621 1.00 25.00 H new ATOM 0 HD22 LEU A 5 -5.459 -0.729 2.946 1.00 25.00 H new ATOM 0 HD23 LEU A 5 -5.432 -0.078 1.290 1.00 25.00 H new ATOM 101 N SER A 6 -3.845 4.515 3.136 1.00 25.00 N ATOM 102 CA SER A 6 -4.303 5.728 3.838 1.00 25.00 C ATOM 103 C SER A 6 -5.235 6.631 3.014 1.00 25.00 C ATOM 104 O SER A 6 -5.857 7.531 3.566 1.00 25.00 O ATOM 105 CB SER A 6 -3.091 6.565 4.255 1.00 25.00 C ATOM 106 OG SER A 6 -2.984 6.659 5.667 1.00 25.00 O ATOM 0 H SER A 6 -2.831 4.438 3.063 1.00 25.00 H new ATOM 0 HA SER A 6 -4.876 5.368 4.693 1.00 25.00 H new ATOM 0 HB2 SER A 6 -2.183 6.119 3.849 1.00 25.00 H new ATOM 0 HB3 SER A 6 -3.174 7.565 3.828 1.00 25.00 H new ATOM 0 HG SER A 6 -2.200 7.198 5.900 1.00 25.00 H new ATOM 112 N GLN A 7 -5.328 6.411 1.708 1.00 25.00 N ATOM 113 CA GLN A 7 -6.227 7.203 0.861 1.00 25.00 C ATOM 114 C GLN A 7 -7.557 6.485 0.605 1.00 25.00 C ATOM 115 O GLN A 7 -8.505 7.088 0.107 1.00 25.00 O ATOM 116 CB GLN A 7 -5.543 7.514 -0.472 1.00 25.00 C ATOM 117 CG GLN A 7 -4.358 8.458 -0.322 1.00 25.00 C ATOM 118 CD GLN A 7 -3.576 8.609 -1.602 1.00 25.00 C ATOM 119 OE1 GLN A 7 -3.968 9.325 -2.505 1.00 25.00 O ATOM 120 NE2 GLN A 7 -2.457 7.943 -1.679 1.00 25.00 N ATOM 0 H GLN A 7 -4.797 5.696 1.210 1.00 25.00 H new ATOM 0 HA GLN A 7 -6.448 8.129 1.391 1.00 25.00 H new ATOM 0 HB2 GLN A 7 -5.205 6.583 -0.927 1.00 25.00 H new ATOM 0 HB3 GLN A 7 -6.270 7.956 -1.153 1.00 25.00 H new ATOM 0 HG2 GLN A 7 -4.715 9.436 -0.000 1.00 25.00 H new ATOM 0 HG3 GLN A 7 -3.698 8.086 0.462 1.00 25.00 H new ATOM 0 HE21 GLN A 7 -2.160 7.353 -0.902 1.00 25.00 H new ATOM 0 HE22 GLN A 7 -1.879 8.013 -2.516 1.00 25.00 H new ATOM 129 N HIS A 8 -7.646 5.207 0.951 1.00 25.00 N ATOM 130 CA HIS A 8 -8.888 4.455 0.746 1.00 25.00 C ATOM 131 C HIS A 8 -9.809 4.669 1.938 1.00 25.00 C ATOM 132 O HIS A 8 -9.715 3.978 2.945 1.00 25.00 O ATOM 133 CB HIS A 8 -8.605 2.966 0.528 1.00 25.00 C ATOM 134 CG HIS A 8 -9.390 2.372 -0.600 1.00 25.00 C ATOM 135 ND1 HIS A 8 -8.807 1.699 -1.678 1.00 25.00 N ATOM 136 CD2 HIS A 8 -10.725 2.350 -0.864 1.00 25.00 C ATOM 137 CE1 HIS A 8 -9.767 1.303 -2.506 1.00 25.00 C ATOM 138 NE2 HIS A 8 -10.924 1.686 -2.035 1.00 25.00 N ATOM 0 H HIS A 8 -6.886 4.671 1.370 1.00 25.00 H new ATOM 0 HA HIS A 8 -9.380 4.823 -0.155 1.00 25.00 H new ATOM 0 HB2 HIS A 8 -7.541 2.831 0.332 1.00 25.00 H new ATOM 0 HB3 HIS A 8 -8.832 2.422 1.445 1.00 25.00 H new ATOM 0 HD2 HIS A 8 -11.497 2.786 -0.247 1.00 25.00 H new ATOM 0 HE1 HIS A 8 -9.615 0.752 -3.423 1.00 25.00 H new ATOM 0 HE2 HIS A 8 -11.829 1.515 -2.474 1.00 25.00 H new ATOM 146 N GLU A 9 -10.676 5.657 1.819 1.00 25.00 N ATOM 147 CA GLU A 9 -11.567 6.085 2.901 1.00 25.00 C ATOM 148 C GLU A 9 -12.224 4.971 3.748 1.00 25.00 C ATOM 149 O GLU A 9 -12.244 5.064 4.963 1.00 25.00 O ATOM 150 CB GLU A 9 -12.636 7.036 2.320 1.00 25.00 C ATOM 151 CG GLU A 9 -13.803 6.388 1.514 1.00 25.00 C ATOM 152 CD GLU A 9 -13.363 5.601 0.267 1.00 25.00 C ATOM 153 OE1 GLU A 9 -12.916 4.431 0.401 1.00 25.00 O ATOM 154 OE2 GLU A 9 -13.630 6.073 -0.848 1.00 25.00 O ATOM 0 H GLU A 9 -10.789 6.197 0.961 1.00 25.00 H new ATOM 0 HA GLU A 9 -10.921 6.588 3.620 1.00 25.00 H new ATOM 0 HB2 GLU A 9 -13.069 7.602 3.145 1.00 25.00 H new ATOM 0 HB3 GLU A 9 -12.134 7.753 1.670 1.00 25.00 H new ATOM 0 HG2 GLU A 9 -14.354 5.718 2.174 1.00 25.00 H new ATOM 0 HG3 GLU A 9 -14.494 7.173 1.207 1.00 25.00 H new ATOM 161 N ARG A 10 -12.728 3.913 3.128 1.00 25.00 N ATOM 162 CA ARG A 10 -13.437 2.854 3.862 1.00 25.00 C ATOM 163 C ARG A 10 -12.502 2.090 4.786 1.00 25.00 C ATOM 164 O ARG A 10 -12.883 1.686 5.880 1.00 25.00 O ATOM 165 CB ARG A 10 -14.103 1.896 2.870 1.00 25.00 C ATOM 166 CG ARG A 10 -15.421 2.442 2.306 1.00 25.00 C ATOM 167 CD ARG A 10 -15.615 2.078 0.834 1.00 25.00 C ATOM 168 NE ARG A 10 -15.502 3.279 -0.014 1.00 25.00 N ATOM 169 CZ ARG A 10 -16.514 3.956 -0.547 1.00 25.00 C ATOM 170 NH1 ARG A 10 -17.765 3.594 -0.390 1.00 25.00 N ATOM 171 NH2 ARG A 10 -16.263 5.027 -1.244 1.00 25.00 N ATOM 0 H ARG A 10 -12.664 3.758 2.122 1.00 25.00 H new ATOM 0 HA ARG A 10 -14.200 3.324 4.483 1.00 25.00 H new ATOM 0 HB2 ARG A 10 -13.416 1.698 2.047 1.00 25.00 H new ATOM 0 HB3 ARG A 10 -14.292 0.943 3.364 1.00 25.00 H new ATOM 0 HG2 ARG A 10 -16.254 2.048 2.888 1.00 25.00 H new ATOM 0 HG3 ARG A 10 -15.439 3.526 2.416 1.00 25.00 H new ATOM 0 HD2 ARG A 10 -14.869 1.342 0.534 1.00 25.00 H new ATOM 0 HD3 ARG A 10 -16.592 1.617 0.693 1.00 25.00 H new ATOM 0 HE ARG A 10 -14.561 3.622 -0.209 1.00 25.00 H new ATOM 0 HH11 ARG A 10 -17.991 2.764 0.159 1.00 25.00 H new ATOM 0 HH12 ARG A 10 -18.512 4.142 -0.816 1.00 25.00 H new ATOM 0 HH21 ARG A 10 -15.300 5.336 -1.375 1.00 25.00 H new ATOM 0 HH22 ARG A 10 -17.030 5.557 -1.659 1.00 25.00 H new ATOM 185 N TYR A 11 -11.268 1.930 4.349 1.00 25.00 N ATOM 186 CA TYR A 11 -10.249 1.263 5.144 1.00 25.00 C ATOM 187 C TYR A 11 -9.772 2.198 6.255 1.00 25.00 C ATOM 188 O TYR A 11 -9.532 1.776 7.384 1.00 25.00 O ATOM 189 CB TYR A 11 -9.090 0.865 4.234 1.00 25.00 C ATOM 190 CG TYR A 11 -7.948 0.218 4.963 1.00 25.00 C ATOM 191 CD1 TYR A 11 -8.110 -1.024 5.605 1.00 25.00 C ATOM 192 CD2 TYR A 11 -6.689 0.843 5.018 1.00 25.00 C ATOM 193 CE1 TYR A 11 -7.031 -1.624 6.292 1.00 25.00 C ATOM 194 CE2 TYR A 11 -5.608 0.231 5.693 1.00 25.00 C ATOM 195 CZ TYR A 11 -5.794 -0.994 6.327 1.00 25.00 C ATOM 196 OH TYR A 11 -4.751 -1.571 6.997 1.00 25.00 O ATOM 0 H TYR A 11 -10.942 2.256 3.439 1.00 25.00 H new ATOM 0 HA TYR A 11 -10.660 0.365 5.605 1.00 25.00 H new ATOM 0 HB2 TYR A 11 -9.458 0.180 3.470 1.00 25.00 H new ATOM 0 HB3 TYR A 11 -8.724 1.752 3.717 1.00 25.00 H new ATOM 0 HD1 TYR A 11 -9.067 -1.523 5.572 1.00 25.00 H new ATOM 0 HD2 TYR A 11 -6.547 1.801 4.539 1.00 25.00 H new ATOM 0 HE1 TYR A 11 -7.168 -2.573 6.790 1.00 25.00 H new ATOM 0 HE2 TYR A 11 -4.641 0.712 5.717 1.00 25.00 H new ATOM 0 HH TYR A 11 -3.913 -1.134 6.737 1.00 25.00 H new ATOM 206 N VAL A 12 -9.689 3.484 5.943 1.00 25.00 N ATOM 207 CA VAL A 12 -9.292 4.499 6.924 1.00 25.00 C ATOM 208 C VAL A 12 -10.277 4.543 8.100 1.00 25.00 C ATOM 209 O VAL A 12 -9.857 4.688 9.249 1.00 25.00 O ATOM 210 CB VAL A 12 -9.185 5.907 6.252 1.00 25.00 C ATOM 211 CG1 VAL A 12 -8.856 7.006 7.274 1.00 25.00 C ATOM 212 CG2 VAL A 12 -8.092 5.896 5.182 1.00 25.00 C ATOM 0 H VAL A 12 -9.891 3.856 5.015 1.00 25.00 H new ATOM 0 HA VAL A 12 -8.311 4.224 7.310 1.00 25.00 H new ATOM 0 HB VAL A 12 -10.156 6.124 5.806 1.00 25.00 H new ATOM 0 HG11 VAL A 12 -8.791 7.968 6.766 1.00 25.00 H new ATOM 0 HG12 VAL A 12 -9.641 7.047 8.029 1.00 25.00 H new ATOM 0 HG13 VAL A 12 -7.903 6.784 7.753 1.00 25.00 H new ATOM 0 HG21 VAL A 12 -8.025 6.881 4.720 1.00 25.00 H new ATOM 0 HG22 VAL A 12 -7.136 5.645 5.641 1.00 25.00 H new ATOM 0 HG23 VAL A 12 -8.335 5.154 4.421 1.00 25.00 H new ATOM 222 N GLU A 13 -11.570 4.384 7.846 1.00 25.00 N ATOM 223 CA GLU A 13 -12.552 4.389 8.940 1.00 25.00 C ATOM 224 C GLU A 13 -12.295 3.238 9.916 1.00 25.00 C ATOM 225 O GLU A 13 -12.316 3.430 11.136 1.00 25.00 O ATOM 226 CB GLU A 13 -13.994 4.289 8.417 1.00 25.00 C ATOM 227 CG GLU A 13 -14.438 5.453 7.528 1.00 25.00 C ATOM 228 CD GLU A 13 -14.099 6.807 8.126 1.00 25.00 C ATOM 229 OE1 GLU A 13 -14.487 7.073 9.282 1.00 25.00 O ATOM 230 OE2 GLU A 13 -13.348 7.575 7.484 1.00 25.00 O ATOM 0 H GLU A 13 -11.964 4.252 6.915 1.00 25.00 H new ATOM 0 HA GLU A 13 -12.433 5.341 9.458 1.00 25.00 H new ATOM 0 HB2 GLU A 13 -14.098 3.361 7.855 1.00 25.00 H new ATOM 0 HB3 GLU A 13 -14.671 4.223 9.269 1.00 25.00 H new ATOM 0 HG2 GLU A 13 -13.962 5.362 6.552 1.00 25.00 H new ATOM 0 HG3 GLU A 13 -15.514 5.391 7.365 1.00 25.00 H new ATOM 237 N GLN A 14 -12.005 2.055 9.394 1.00 25.00 N ATOM 238 CA GLN A 14 -11.713 0.910 10.254 1.00 25.00 C ATOM 239 C GLN A 14 -10.372 1.089 10.954 1.00 25.00 C ATOM 240 O GLN A 14 -10.228 0.763 12.132 1.00 25.00 O ATOM 241 CB GLN A 14 -11.718 -0.394 9.453 1.00 25.00 C ATOM 242 CG GLN A 14 -13.098 -0.776 8.923 1.00 25.00 C ATOM 243 CD GLN A 14 -14.146 -0.835 10.022 1.00 25.00 C ATOM 244 OE1 GLN A 14 -15.119 -0.100 10.000 1.00 25.00 O ATOM 245 NE2 GLN A 14 -13.939 -1.683 10.996 1.00 25.00 N ATOM 0 H GLN A 14 -11.965 1.861 8.393 1.00 25.00 H new ATOM 0 HA GLN A 14 -12.497 0.853 11.009 1.00 25.00 H new ATOM 0 HB2 GLN A 14 -11.029 -0.299 8.614 1.00 25.00 H new ATOM 0 HB3 GLN A 14 -11.343 -1.200 10.084 1.00 25.00 H new ATOM 0 HG2 GLN A 14 -13.407 -0.053 8.169 1.00 25.00 H new ATOM 0 HG3 GLN A 14 -13.039 -1.746 8.429 1.00 25.00 H new ATOM 0 HE21 GLN A 14 -13.114 -2.283 10.983 1.00 25.00 H new ATOM 0 HE22 GLN A 14 -14.602 -1.744 11.769 1.00 25.00 H new ATOM 254 N LEU A 15 -9.395 1.655 10.266 1.00 25.00 N ATOM 255 CA LEU A 15 -8.103 1.896 10.894 1.00 25.00 C ATOM 256 C LEU A 15 -8.175 2.952 11.986 1.00 25.00 C ATOM 257 O LEU A 15 -7.361 2.934 12.894 1.00 25.00 O ATOM 258 CB LEU A 15 -7.052 2.331 9.878 1.00 25.00 C ATOM 259 CG LEU A 15 -6.192 1.256 9.201 1.00 25.00 C ATOM 260 CD1 LEU A 15 -5.093 1.986 8.441 1.00 25.00 C ATOM 261 CD2 LEU A 15 -5.546 0.272 10.192 1.00 25.00 C ATOM 0 H LEU A 15 -9.466 1.952 9.293 1.00 25.00 H new ATOM 0 HA LEU A 15 -7.816 0.943 11.338 1.00 25.00 H new ATOM 0 HB2 LEU A 15 -7.562 2.889 9.093 1.00 25.00 H new ATOM 0 HB3 LEU A 15 -6.378 3.027 10.377 1.00 25.00 H new ATOM 0 HG LEU A 15 -6.834 0.659 8.553 1.00 25.00 H new ATOM 0 HD11 LEU A 15 -4.453 1.260 7.941 1.00 25.00 H new ATOM 0 HD12 LEU A 15 -5.541 2.647 7.699 1.00 25.00 H new ATOM 0 HD13 LEU A 15 -4.498 2.575 9.139 1.00 25.00 H new ATOM 0 HD21 LEU A 15 -4.953 -0.460 9.644 1.00 25.00 H new ATOM 0 HD22 LEU A 15 -4.902 0.819 10.880 1.00 25.00 H new ATOM 0 HD23 LEU A 15 -6.325 -0.241 10.755 1.00 25.00 H new ATOM 273 N LYS A 16 -9.147 3.854 11.942 1.00 25.00 N ATOM 274 CA LYS A 16 -9.276 4.853 13.010 1.00 25.00 C ATOM 275 C LYS A 16 -9.598 4.140 14.309 1.00 25.00 C ATOM 276 O LYS A 16 -9.129 4.537 15.374 1.00 25.00 O ATOM 277 CB LYS A 16 -10.367 5.883 12.702 1.00 25.00 C ATOM 278 CG LYS A 16 -9.869 7.083 11.896 1.00 25.00 C ATOM 279 CD LYS A 16 -10.916 8.190 11.835 1.00 25.00 C ATOM 280 CE LYS A 16 -11.964 7.927 10.776 1.00 25.00 C ATOM 281 NZ LYS A 16 -11.549 8.400 9.423 1.00 25.00 N ATOM 0 H LYS A 16 -9.845 3.920 11.201 1.00 25.00 H new ATOM 0 HA LYS A 16 -8.332 5.392 13.091 1.00 25.00 H new ATOM 0 HB2 LYS A 16 -11.170 5.394 12.151 1.00 25.00 H new ATOM 0 HB3 LYS A 16 -10.794 6.238 13.640 1.00 25.00 H new ATOM 0 HG2 LYS A 16 -8.955 7.470 12.346 1.00 25.00 H new ATOM 0 HG3 LYS A 16 -9.617 6.764 10.885 1.00 25.00 H new ATOM 0 HD2 LYS A 16 -11.400 8.284 12.807 1.00 25.00 H new ATOM 0 HD3 LYS A 16 -10.425 9.141 11.630 1.00 25.00 H new ATOM 0 HE2 LYS A 16 -12.172 6.858 10.734 1.00 25.00 H new ATOM 0 HE3 LYS A 16 -12.893 8.421 11.060 1.00 25.00 H new ATOM 0 HZ1 LYS A 16 -11.932 7.760 8.699 1.00 25.00 H new ATOM 0 HZ2 LYS A 16 -11.914 9.361 9.264 1.00 25.00 H new ATOM 0 HZ3 LYS A 16 -10.511 8.410 9.362 1.00 25.00 H new ATOM 295 N GLN A 17 -10.359 3.064 14.212 1.00 25.00 N ATOM 296 CA GLN A 17 -10.687 2.256 15.379 1.00 25.00 C ATOM 297 C GLN A 17 -9.427 1.507 15.821 1.00 25.00 C ATOM 298 O GLN A 17 -9.046 1.554 16.985 1.00 25.00 O ATOM 299 CB GLN A 17 -11.809 1.262 15.036 1.00 25.00 C ATOM 300 CG GLN A 17 -13.099 1.922 14.533 1.00 25.00 C ATOM 301 CD GLN A 17 -13.976 0.960 13.755 1.00 25.00 C ATOM 302 OE1 GLN A 17 -14.200 -0.169 14.163 1.00 25.00 O ATOM 303 NE2 GLN A 17 -14.461 1.402 12.625 1.00 25.00 N ATOM 0 H GLN A 17 -10.763 2.727 13.338 1.00 25.00 H new ATOM 0 HA GLN A 17 -11.038 2.896 16.189 1.00 25.00 H new ATOM 0 HB2 GLN A 17 -11.447 0.571 14.275 1.00 25.00 H new ATOM 0 HB3 GLN A 17 -12.038 0.670 15.922 1.00 25.00 H new ATOM 0 HG2 GLN A 17 -13.659 2.313 15.383 1.00 25.00 H new ATOM 0 HG3 GLN A 17 -12.846 2.772 13.899 1.00 25.00 H new ATOM 0 HE21 GLN A 17 -14.252 2.352 12.317 1.00 25.00 H new ATOM 0 HE22 GLN A 17 -15.049 0.797 12.051 1.00 25.00 H new ATOM 312 N ALA A 18 -8.757 0.863 14.873 1.00 25.00 N ATOM 313 CA ALA A 18 -7.561 0.069 15.167 1.00 25.00 C ATOM 314 C ALA A 18 -6.387 0.880 15.765 1.00 25.00 C ATOM 315 O ALA A 18 -5.745 0.431 16.712 1.00 25.00 O ATOM 316 CB ALA A 18 -7.112 -0.662 13.898 1.00 25.00 C ATOM 0 H ALA A 18 -9.020 0.873 13.888 1.00 25.00 H new ATOM 0 HA ALA A 18 -7.846 -0.642 15.943 1.00 25.00 H new ATOM 0 HB1 ALA A 18 -6.222 -1.253 14.114 1.00 25.00 H new ATOM 0 HB2 ALA A 18 -7.911 -1.320 13.555 1.00 25.00 H new ATOM 0 HB3 ALA A 18 -6.883 0.066 13.120 1.00 25.00 H new ATOM 322 N LEU A 19 -6.109 2.065 15.233 1.00 25.00 N ATOM 323 CA LEU A 19 -5.023 2.900 15.768 1.00 25.00 C ATOM 324 C LEU A 19 -5.365 3.301 17.206 1.00 25.00 C ATOM 325 O LEU A 19 -4.507 3.314 18.088 1.00 25.00 O ATOM 326 CB LEU A 19 -4.818 4.184 14.928 1.00 25.00 C ATOM 327 CG LEU A 19 -3.727 4.164 13.830 1.00 25.00 C ATOM 328 CD1 LEU A 19 -4.279 3.789 12.458 1.00 25.00 C ATOM 329 CD2 LEU A 19 -3.051 5.533 13.707 1.00 25.00 C ATOM 0 H LEU A 19 -6.609 2.471 14.442 1.00 25.00 H new ATOM 0 HA LEU A 19 -4.102 2.318 15.732 1.00 25.00 H new ATOM 0 HB2 LEU A 19 -5.768 4.427 14.452 1.00 25.00 H new ATOM 0 HB3 LEU A 19 -4.587 4.999 15.614 1.00 25.00 H new ATOM 0 HG LEU A 19 -3.009 3.405 14.140 1.00 25.00 H new ATOM 0 HD11 LEU A 19 -3.470 3.791 11.727 1.00 25.00 H new ATOM 0 HD12 LEU A 19 -4.724 2.795 12.504 1.00 25.00 H new ATOM 0 HD13 LEU A 19 -5.038 4.513 12.161 1.00 25.00 H new ATOM 0 HD21 LEU A 19 -2.288 5.494 12.929 1.00 25.00 H new ATOM 0 HD22 LEU A 19 -3.796 6.285 13.447 1.00 25.00 H new ATOM 0 HD23 LEU A 19 -2.587 5.796 14.657 1.00 25.00 H new ATOM 341 N LYS A 20 -6.626 3.643 17.434 1.00 25.00 N ATOM 342 CA LYS A 20 -7.065 4.134 18.740 1.00 25.00 C ATOM 343 C LYS A 20 -7.183 3.046 19.801 1.00 25.00 C ATOM 344 O LYS A 20 -6.863 3.289 20.961 1.00 25.00 O ATOM 345 CB LYS A 20 -8.419 4.839 18.582 1.00 25.00 C ATOM 346 CG LYS A 20 -8.914 5.537 19.844 1.00 25.00 C ATOM 347 CD LYS A 20 -10.258 6.214 19.598 1.00 25.00 C ATOM 348 CE LYS A 20 -10.861 6.748 20.899 1.00 25.00 C ATOM 349 NZ LYS A 20 -10.008 7.818 21.526 1.00 25.00 N ATOM 0 H LYS A 20 -7.366 3.591 16.733 1.00 25.00 H new ATOM 0 HA LYS A 20 -6.296 4.822 19.090 1.00 25.00 H new ATOM 0 HB2 LYS A 20 -8.341 5.574 17.781 1.00 25.00 H new ATOM 0 HB3 LYS A 20 -9.163 4.106 18.271 1.00 25.00 H new ATOM 0 HG2 LYS A 20 -9.010 4.812 20.652 1.00 25.00 H new ATOM 0 HG3 LYS A 20 -8.182 6.278 20.166 1.00 25.00 H new ATOM 0 HD2 LYS A 20 -10.130 7.034 18.891 1.00 25.00 H new ATOM 0 HD3 LYS A 20 -10.947 5.503 19.141 1.00 25.00 H new ATOM 0 HE2 LYS A 20 -11.855 7.149 20.699 1.00 25.00 H new ATOM 0 HE3 LYS A 20 -10.985 5.926 21.604 1.00 25.00 H new ATOM 0 HZ1 LYS A 20 -10.473 8.173 22.386 1.00 25.00 H new ATOM 0 HZ2 LYS A 20 -9.079 7.421 21.773 1.00 25.00 H new ATOM 0 HZ3 LYS A 20 -9.882 8.600 20.853 1.00 25.00 H new ATOM 363 N THR A 21 -7.665 1.869 19.431 1.00 25.00 N ATOM 364 CA THR A 21 -7.952 0.817 20.414 1.00 25.00 C ATOM 365 C THR A 21 -6.709 0.305 21.138 1.00 25.00 C ATOM 366 O THR A 21 -6.811 -0.205 22.248 1.00 25.00 O ATOM 367 CB THR A 21 -8.715 -0.382 19.768 1.00 25.00 C ATOM 368 OG1 THR A 21 -9.322 -1.171 20.794 1.00 25.00 O ATOM 369 CG2 THR A 21 -7.795 -1.287 18.955 1.00 25.00 C ATOM 0 H THR A 21 -7.867 1.612 18.465 1.00 25.00 H new ATOM 0 HA THR A 21 -8.590 1.291 21.160 1.00 25.00 H new ATOM 0 HB THR A 21 -9.463 0.041 19.097 1.00 25.00 H new ATOM 0 HG1 THR A 21 -9.095 -2.115 20.658 1.00 25.00 H new ATOM 0 HG21 THR A 21 -8.375 -2.105 18.527 1.00 25.00 H new ATOM 0 HG22 THR A 21 -7.334 -0.711 18.153 1.00 25.00 H new ATOM 0 HG23 THR A 21 -7.018 -1.693 19.603 1.00 25.00 H new ATOM 377 N ARG A 22 -5.534 0.463 20.539 1.00 25.00 N ATOM 378 CA ARG A 22 -4.297 0.018 21.186 1.00 25.00 C ATOM 379 C ARG A 22 -3.731 1.103 22.109 1.00 25.00 C ATOM 380 O ARG A 22 -2.798 0.860 22.864 1.00 25.00 O ATOM 381 CB ARG A 22 -3.266 -0.402 20.128 1.00 25.00 C ATOM 382 CG ARG A 22 -2.671 -1.805 20.365 1.00 25.00 C ATOM 383 CD ARG A 22 -1.845 -1.866 21.653 1.00 25.00 C ATOM 384 NE ARG A 22 -1.300 -3.206 21.904 1.00 25.00 N ATOM 385 CZ ARG A 22 -0.632 -3.574 22.989 1.00 25.00 C ATOM 386 NH1 ARG A 22 -0.398 -2.747 23.980 1.00 25.00 N ATOM 387 NH2 ARG A 22 -0.193 -4.795 23.079 1.00 25.00 N ATOM 0 H ARG A 22 -5.408 0.889 19.621 1.00 25.00 H new ATOM 0 HA ARG A 22 -4.527 -0.848 21.806 1.00 25.00 H new ATOM 0 HB2 ARG A 22 -3.737 -0.378 19.145 1.00 25.00 H new ATOM 0 HB3 ARG A 22 -2.457 0.328 20.112 1.00 25.00 H new ATOM 0 HG2 ARG A 22 -3.477 -2.537 20.416 1.00 25.00 H new ATOM 0 HG3 ARG A 22 -2.043 -2.081 19.518 1.00 25.00 H new ATOM 0 HD2 ARG A 22 -1.026 -1.149 21.591 1.00 25.00 H new ATOM 0 HD3 ARG A 22 -2.468 -1.566 22.496 1.00 25.00 H new ATOM 0 HE ARG A 22 -1.447 -3.913 21.184 1.00 25.00 H new ATOM 0 HH11 ARG A 22 -0.734 -1.785 23.932 1.00 25.00 H new ATOM 0 HH12 ARG A 22 0.120 -3.066 24.799 1.00 25.00 H new ATOM 0 HH21 ARG A 22 -0.364 -5.456 22.321 1.00 25.00 H new ATOM 0 HH22 ARG A 22 0.322 -5.092 23.908 1.00 25.00 H new ATOM 401 N GLY A 23 -4.289 2.303 22.032 1.00 25.00 N ATOM 402 CA GLY A 23 -3.853 3.400 22.889 1.00 25.00 C ATOM 403 C GLY A 23 -2.493 3.969 22.527 1.00 25.00 C ATOM 404 O GLY A 23 -1.936 4.792 23.257 1.00 25.00 O ATOM 0 H GLY A 23 -5.042 2.543 21.387 1.00 25.00 H new ATOM 0 HA2 GLY A 23 -4.593 4.199 22.842 1.00 25.00 H new ATOM 0 HA3 GLY A 23 -3.825 3.051 23.921 1.00 25.00 H new ATOM 408 N VAL A 24 -1.938 3.523 21.412 1.00 25.00 N ATOM 409 CA VAL A 24 -0.610 3.958 20.994 1.00 25.00 C ATOM 410 C VAL A 24 -0.757 5.314 20.317 1.00 25.00 C ATOM 411 O VAL A 24 -1.559 5.488 19.404 1.00 25.00 O ATOM 412 CB VAL A 24 0.054 2.913 20.053 1.00 25.00 C ATOM 413 CG1 VAL A 24 1.426 3.397 19.573 1.00 25.00 C ATOM 414 CG2 VAL A 24 0.229 1.577 20.798 1.00 25.00 C ATOM 0 H VAL A 24 -2.384 2.860 20.778 1.00 25.00 H new ATOM 0 HA VAL A 24 0.047 4.048 21.859 1.00 25.00 H new ATOM 0 HB VAL A 24 -0.595 2.779 19.188 1.00 25.00 H new ATOM 0 HG11 VAL A 24 1.867 2.647 18.917 1.00 25.00 H new ATOM 0 HG12 VAL A 24 1.311 4.334 19.028 1.00 25.00 H new ATOM 0 HG13 VAL A 24 2.077 3.555 20.433 1.00 25.00 H new ATOM 0 HG21 VAL A 24 0.695 0.849 20.134 1.00 25.00 H new ATOM 0 HG22 VAL A 24 0.862 1.728 21.672 1.00 25.00 H new ATOM 0 HG23 VAL A 24 -0.746 1.207 21.116 1.00 25.00 H new ATOM 424 N LYS A 25 -0.016 6.293 20.815 1.00 25.00 N ATOM 425 CA LYS A 25 -0.122 7.666 20.327 1.00 25.00 C ATOM 426 C LYS A 25 0.686 7.851 19.045 1.00 25.00 C ATOM 427 O LYS A 25 1.820 8.313 19.088 1.00 25.00 O ATOM 428 CB LYS A 25 0.389 8.631 21.405 1.00 25.00 C ATOM 429 CG LYS A 25 -0.370 8.530 22.729 1.00 25.00 C ATOM 430 CD LYS A 25 0.227 9.466 23.774 1.00 25.00 C ATOM 431 CE LYS A 25 -0.459 9.276 25.127 1.00 25.00 C ATOM 432 NZ LYS A 25 0.141 10.164 26.187 1.00 25.00 N ATOM 0 H LYS A 25 0.669 6.164 21.560 1.00 25.00 H new ATOM 0 HA LYS A 25 -1.168 7.878 20.107 1.00 25.00 H new ATOM 0 HB2 LYS A 25 1.446 8.433 21.586 1.00 25.00 H new ATOM 0 HB3 LYS A 25 0.315 9.652 21.031 1.00 25.00 H new ATOM 0 HG2 LYS A 25 -1.419 8.778 22.570 1.00 25.00 H new ATOM 0 HG3 LYS A 25 -0.337 7.503 23.094 1.00 25.00 H new ATOM 0 HD2 LYS A 25 1.295 9.274 23.873 1.00 25.00 H new ATOM 0 HD3 LYS A 25 0.118 10.500 23.448 1.00 25.00 H new ATOM 0 HE2 LYS A 25 -1.523 9.494 25.029 1.00 25.00 H new ATOM 0 HE3 LYS A 25 -0.374 8.234 25.435 1.00 25.00 H new ATOM 0 HZ1 LYS A 25 -0.350 10.007 27.090 1.00 25.00 H new ATOM 0 HZ2 LYS A 25 1.150 9.939 26.298 1.00 25.00 H new ATOM 0 HZ3 LYS A 25 0.037 11.160 25.905 1.00 25.00 H new ATOM 446 N VAL A 26 0.085 7.508 17.916 1.00 25.00 N ATOM 447 CA VAL A 26 0.721 7.667 16.605 1.00 25.00 C ATOM 448 C VAL A 26 -0.284 8.219 15.604 1.00 25.00 C ATOM 449 O VAL A 26 -1.498 8.087 15.777 1.00 25.00 O ATOM 450 CB VAL A 26 1.289 6.312 16.056 1.00 25.00 C ATOM 451 CG1 VAL A 26 2.543 5.905 16.833 1.00 25.00 C ATOM 452 CG2 VAL A 26 0.234 5.191 16.119 1.00 25.00 C ATOM 0 H VAL A 26 -0.854 7.112 17.876 1.00 25.00 H new ATOM 0 HA VAL A 26 1.553 8.360 16.734 1.00 25.00 H new ATOM 0 HB VAL A 26 1.554 6.463 15.010 1.00 25.00 H new ATOM 0 HG11 VAL A 26 2.925 4.963 16.440 1.00 25.00 H new ATOM 0 HG12 VAL A 26 3.304 6.678 16.726 1.00 25.00 H new ATOM 0 HG13 VAL A 26 2.294 5.784 17.887 1.00 25.00 H new ATOM 0 HG21 VAL A 26 0.662 4.267 15.731 1.00 25.00 H new ATOM 0 HG22 VAL A 26 -0.076 5.041 17.153 1.00 25.00 H new ATOM 0 HG23 VAL A 26 -0.631 5.471 15.518 1.00 25.00 H new ATOM 462 N LYS A 27 0.228 8.850 14.561 1.00 25.00 N ATOM 463 CA LYS A 27 -0.595 9.398 13.486 1.00 25.00 C ATOM 464 C LYS A 27 -0.770 8.292 12.449 1.00 25.00 C ATOM 465 O LYS A 27 0.022 7.362 12.398 1.00 25.00 O ATOM 466 CB LYS A 27 0.144 10.607 12.890 1.00 25.00 C ATOM 467 CG LYS A 27 -0.660 11.506 11.961 1.00 25.00 C ATOM 468 CD LYS A 27 0.219 12.664 11.498 1.00 25.00 C ATOM 469 CE LYS A 27 -0.539 13.623 10.588 1.00 25.00 C ATOM 470 NZ LYS A 27 0.359 14.741 10.129 1.00 25.00 N ATOM 0 H LYS A 27 1.229 8.999 14.432 1.00 25.00 H new ATOM 0 HA LYS A 27 -1.574 9.728 13.835 1.00 25.00 H new ATOM 0 HB2 LYS A 27 0.520 11.216 13.712 1.00 25.00 H new ATOM 0 HB3 LYS A 27 1.012 10.240 12.342 1.00 25.00 H new ATOM 0 HG2 LYS A 27 -1.015 10.937 11.102 1.00 25.00 H new ATOM 0 HG3 LYS A 27 -1.542 11.887 12.477 1.00 25.00 H new ATOM 0 HD2 LYS A 27 0.593 13.206 12.367 1.00 25.00 H new ATOM 0 HD3 LYS A 27 1.088 12.272 10.969 1.00 25.00 H new ATOM 0 HE2 LYS A 27 -0.927 13.083 9.724 1.00 25.00 H new ATOM 0 HE3 LYS A 27 -1.398 14.034 11.119 1.00 25.00 H new ATOM 0 HZ1 LYS A 27 -0.175 15.384 9.510 1.00 25.00 H new ATOM 0 HZ2 LYS A 27 0.709 15.267 10.955 1.00 25.00 H new ATOM 0 HZ3 LYS A 27 1.165 14.346 9.604 1.00 25.00 H new ATOM 484 N PHE A 28 -1.750 8.425 11.568 1.00 25.00 N ATOM 485 CA PHE A 28 -1.906 7.478 10.459 1.00 25.00 C ATOM 486 C PHE A 28 -0.652 7.448 9.611 1.00 25.00 C ATOM 487 O PHE A 28 -0.214 6.395 9.193 1.00 25.00 O ATOM 488 CB PHE A 28 -3.063 7.910 9.562 1.00 25.00 C ATOM 489 CG PHE A 28 -4.343 7.199 9.843 1.00 25.00 C ATOM 490 CD1 PHE A 28 -5.075 7.470 11.013 1.00 25.00 C ATOM 491 CD2 PHE A 28 -4.840 6.259 8.925 1.00 25.00 C ATOM 492 CE1 PHE A 28 -6.292 6.807 11.264 1.00 25.00 C ATOM 493 CE2 PHE A 28 -6.052 5.597 9.164 1.00 25.00 C ATOM 494 CZ PHE A 28 -6.784 5.873 10.331 1.00 25.00 C ATOM 0 H PHE A 28 -2.446 9.170 11.593 1.00 25.00 H new ATOM 0 HA PHE A 28 -2.097 6.493 10.884 1.00 25.00 H new ATOM 0 HB2 PHE A 28 -3.221 8.982 9.680 1.00 25.00 H new ATOM 0 HB3 PHE A 28 -2.786 7.741 8.521 1.00 25.00 H new ATOM 0 HD1 PHE A 28 -4.701 8.192 11.724 1.00 25.00 H new ATOM 0 HD2 PHE A 28 -4.282 6.044 8.025 1.00 25.00 H new ATOM 0 HE1 PHE A 28 -6.846 7.014 12.168 1.00 25.00 H new ATOM 0 HE2 PHE A 28 -6.423 4.875 8.452 1.00 25.00 H new ATOM 0 HZ PHE A 28 -7.722 5.370 10.513 1.00 25.00 H new ATOM 504 N ALA A 29 -0.060 8.612 9.389 1.00 25.00 N ATOM 505 CA ALA A 29 1.158 8.706 8.598 1.00 25.00 C ATOM 506 C ALA A 29 2.256 7.840 9.210 1.00 25.00 C ATOM 507 O ALA A 29 3.041 7.231 8.499 1.00 25.00 O ATOM 508 CB ALA A 29 1.619 10.161 8.537 1.00 25.00 C ATOM 0 H ALA A 29 -0.403 9.504 9.745 1.00 25.00 H new ATOM 0 HA ALA A 29 0.953 8.348 7.589 1.00 25.00 H new ATOM 0 HB1 ALA A 29 2.531 10.229 7.944 1.00 25.00 H new ATOM 0 HB2 ALA A 29 0.841 10.770 8.077 1.00 25.00 H new ATOM 0 HB3 ALA A 29 1.814 10.523 9.546 1.00 25.00 H new ATOM 514 N ASP A 30 2.302 7.812 10.532 1.00 25.00 N ATOM 515 CA ASP A 30 3.356 7.116 11.252 1.00 25.00 C ATOM 516 C ASP A 30 3.139 5.619 11.152 1.00 25.00 C ATOM 517 O ASP A 30 4.087 4.868 11.009 1.00 25.00 O ATOM 518 CB ASP A 30 3.354 7.510 12.732 1.00 25.00 C ATOM 519 CG ASP A 30 3.437 9.012 12.952 1.00 25.00 C ATOM 520 OD1 ASP A 30 3.850 9.763 12.041 1.00 25.00 O ATOM 521 OD2 ASP A 30 2.974 9.450 14.027 1.00 25.00 O ATOM 0 H ASP A 30 1.615 8.268 11.133 1.00 25.00 H new ATOM 0 HA ASP A 30 4.312 7.392 10.807 1.00 25.00 H new ATOM 0 HB2 ASP A 30 2.446 7.130 13.201 1.00 25.00 H new ATOM 0 HB3 ASP A 30 4.196 7.029 13.230 1.00 25.00 H new ATOM 526 N LEU A 31 1.886 5.182 11.217 1.00 25.00 N ATOM 527 CA LEU A 31 1.592 3.754 11.117 1.00 25.00 C ATOM 528 C LEU A 31 1.763 3.253 9.695 1.00 25.00 C ATOM 529 O LEU A 31 2.473 2.282 9.441 1.00 25.00 O ATOM 530 CB LEU A 31 0.164 3.429 11.584 1.00 25.00 C ATOM 531 CG LEU A 31 -0.187 1.930 11.427 1.00 25.00 C ATOM 532 CD1 LEU A 31 0.757 1.051 12.231 1.00 25.00 C ATOM 533 CD2 LEU A 31 -1.606 1.642 11.835 1.00 25.00 C ATOM 0 H LEU A 31 1.070 5.782 11.336 1.00 25.00 H new ATOM 0 HA LEU A 31 2.304 3.250 11.771 1.00 25.00 H new ATOM 0 HB2 LEU A 31 0.053 3.717 12.630 1.00 25.00 H new ATOM 0 HB3 LEU A 31 -0.546 4.026 11.012 1.00 25.00 H new ATOM 0 HG LEU A 31 -0.075 1.696 10.368 1.00 25.00 H new ATOM 0 HD11 LEU A 31 0.482 0.005 12.098 1.00 25.00 H new ATOM 0 HD12 LEU A 31 1.779 1.204 11.886 1.00 25.00 H new ATOM 0 HD13 LEU A 31 0.688 1.313 13.287 1.00 25.00 H new ATOM 0 HD21 LEU A 31 -1.812 0.579 11.710 1.00 25.00 H new ATOM 0 HD22 LEU A 31 -1.747 1.918 12.880 1.00 25.00 H new ATOM 0 HD23 LEU A 31 -2.288 2.220 11.211 1.00 25.00 H new ATOM 545 N LEU A 32 1.096 3.909 8.763 1.00 25.00 N ATOM 546 CA LEU A 32 1.125 3.480 7.362 1.00 25.00 C ATOM 547 C LEU A 32 2.524 3.573 6.763 1.00 25.00 C ATOM 548 O LEU A 32 2.841 2.867 5.825 1.00 25.00 O ATOM 549 CB LEU A 32 0.120 4.264 6.513 1.00 25.00 C ATOM 550 CG LEU A 32 -1.353 3.791 6.534 1.00 25.00 C ATOM 551 CD1 LEU A 32 -1.529 2.314 6.202 1.00 25.00 C ATOM 552 CD2 LEU A 32 -2.004 4.056 7.860 1.00 25.00 C ATOM 0 H LEU A 32 0.528 4.737 8.941 1.00 25.00 H new ATOM 0 HA LEU A 32 0.832 2.430 7.351 1.00 25.00 H new ATOM 0 HB2 LEU A 32 0.144 5.304 6.838 1.00 25.00 H new ATOM 0 HB3 LEU A 32 0.465 4.245 5.479 1.00 25.00 H new ATOM 0 HG LEU A 32 -1.836 4.375 5.751 1.00 25.00 H new ATOM 0 HD11 LEU A 32 -2.588 2.057 6.237 1.00 25.00 H new ATOM 0 HD12 LEU A 32 -1.140 2.117 5.203 1.00 25.00 H new ATOM 0 HD13 LEU A 32 -0.985 1.710 6.929 1.00 25.00 H new ATOM 0 HD21 LEU A 32 -3.037 3.710 7.834 1.00 25.00 H new ATOM 0 HD22 LEU A 32 -1.463 3.525 8.643 1.00 25.00 H new ATOM 0 HD23 LEU A 32 -1.985 5.126 8.067 1.00 25.00 H new ATOM 564 N LYS A 33 3.393 4.362 7.370 1.00 25.00 N ATOM 565 CA LYS A 33 4.821 4.376 6.993 1.00 25.00 C ATOM 566 C LYS A 33 5.402 2.956 7.004 1.00 25.00 C ATOM 567 O LYS A 33 6.232 2.596 6.176 1.00 25.00 O ATOM 568 CB LYS A 33 5.597 5.241 7.992 1.00 25.00 C ATOM 569 CG LYS A 33 7.092 5.293 7.773 1.00 25.00 C ATOM 570 CD LYS A 33 7.745 6.125 8.868 1.00 25.00 C ATOM 571 CE LYS A 33 9.260 6.150 8.716 1.00 25.00 C ATOM 572 NZ LYS A 33 9.674 6.844 7.450 1.00 25.00 N ATOM 0 H LYS A 33 3.150 5.004 8.125 1.00 25.00 H new ATOM 0 HA LYS A 33 4.911 4.784 5.986 1.00 25.00 H new ATOM 0 HB2 LYS A 33 5.204 6.257 7.950 1.00 25.00 H new ATOM 0 HB3 LYS A 33 5.406 4.866 8.998 1.00 25.00 H new ATOM 0 HG2 LYS A 33 7.504 4.284 7.775 1.00 25.00 H new ATOM 0 HG3 LYS A 33 7.311 5.725 6.796 1.00 25.00 H new ATOM 0 HD2 LYS A 33 7.357 7.143 8.834 1.00 25.00 H new ATOM 0 HD3 LYS A 33 7.482 5.716 9.844 1.00 25.00 H new ATOM 0 HE2 LYS A 33 9.704 6.657 9.572 1.00 25.00 H new ATOM 0 HE3 LYS A 33 9.644 5.130 8.715 1.00 25.00 H new ATOM 0 HZ1 LYS A 33 10.707 6.964 7.442 1.00 25.00 H new ATOM 0 HZ2 LYS A 33 9.385 6.273 6.630 1.00 25.00 H new ATOM 0 HZ3 LYS A 33 9.217 7.777 7.400 1.00 25.00 H new ATOM 586 N PHE A 34 4.954 2.147 7.946 1.00 25.00 N ATOM 587 CA PHE A 34 5.431 0.777 8.087 1.00 25.00 C ATOM 588 C PHE A 34 4.696 -0.175 7.149 1.00 25.00 C ATOM 589 O PHE A 34 5.239 -1.196 6.744 1.00 25.00 O ATOM 590 CB PHE A 34 5.361 0.375 9.554 1.00 25.00 C ATOM 591 CG PHE A 34 6.360 1.119 10.388 1.00 25.00 C ATOM 592 CD1 PHE A 34 6.029 2.366 10.934 1.00 25.00 C ATOM 593 CD2 PHE A 34 7.661 0.617 10.570 1.00 25.00 C ATOM 594 CE1 PHE A 34 6.980 3.126 11.643 1.00 25.00 C ATOM 595 CE2 PHE A 34 8.628 1.365 11.285 1.00 25.00 C ATOM 596 CZ PHE A 34 8.283 2.629 11.817 1.00 25.00 C ATOM 0 H PHE A 34 4.251 2.416 8.635 1.00 25.00 H new ATOM 0 HA PHE A 34 6.475 0.714 7.780 1.00 25.00 H new ATOM 0 HB2 PHE A 34 4.357 0.565 9.935 1.00 25.00 H new ATOM 0 HB3 PHE A 34 5.539 -0.697 9.645 1.00 25.00 H new ATOM 0 HD1 PHE A 34 5.028 2.751 10.809 1.00 25.00 H new ATOM 0 HD2 PHE A 34 7.925 -0.347 10.161 1.00 25.00 H new ATOM 0 HE1 PHE A 34 6.708 4.088 12.052 1.00 25.00 H new ATOM 0 HE2 PHE A 34 9.624 0.972 11.423 1.00 25.00 H new ATOM 0 HZ PHE A 34 9.018 3.210 12.355 1.00 25.00 H new ATOM 606 N PHE A 35 3.494 0.196 6.741 1.00 25.00 N ATOM 607 CA PHE A 35 2.771 -0.556 5.713 1.00 25.00 C ATOM 608 C PHE A 35 3.487 -0.360 4.360 1.00 25.00 C ATOM 609 O PHE A 35 3.514 -1.258 3.529 1.00 25.00 O ATOM 610 CB PHE A 35 1.315 -0.096 5.610 1.00 25.00 C ATOM 611 CG PHE A 35 0.418 -0.622 6.707 1.00 25.00 C ATOM 612 CD1 PHE A 35 0.699 -0.392 8.071 1.00 25.00 C ATOM 613 CD2 PHE A 35 -0.741 -1.336 6.370 1.00 25.00 C ATOM 614 CE1 PHE A 35 -0.162 -0.890 9.079 1.00 25.00 C ATOM 615 CE2 PHE A 35 -1.609 -1.830 7.372 1.00 25.00 C ATOM 616 CZ PHE A 35 -1.317 -1.609 8.727 1.00 25.00 C ATOM 0 H PHE A 35 2.994 1.009 7.100 1.00 25.00 H new ATOM 0 HA PHE A 35 2.764 -1.612 5.985 1.00 25.00 H new ATOM 0 HB2 PHE A 35 1.288 0.994 5.626 1.00 25.00 H new ATOM 0 HB3 PHE A 35 0.914 -0.411 4.647 1.00 25.00 H new ATOM 0 HD1 PHE A 35 1.579 0.169 8.349 1.00 25.00 H new ATOM 0 HD2 PHE A 35 -0.974 -1.511 5.330 1.00 25.00 H new ATOM 0 HE1 PHE A 35 0.069 -0.717 10.120 1.00 25.00 H new ATOM 0 HE2 PHE A 35 -2.497 -2.378 7.094 1.00 25.00 H new ATOM 0 HZ PHE A 35 -1.976 -1.989 9.494 1.00 25.00 H new ATOM 626 N ASP A 36 4.127 0.788 4.161 1.00 25.00 N ATOM 627 CA ASP A 36 4.948 0.993 2.958 1.00 25.00 C ATOM 628 C ASP A 36 6.187 0.101 3.058 1.00 25.00 C ATOM 629 O ASP A 36 6.649 -0.466 2.071 1.00 25.00 O ATOM 630 CB ASP A 36 5.419 2.452 2.830 1.00 25.00 C ATOM 631 CG ASP A 36 4.299 3.408 2.477 1.00 25.00 C ATOM 632 OD1 ASP A 36 3.679 3.248 1.404 1.00 25.00 O ATOM 633 OD2 ASP A 36 4.038 4.339 3.267 1.00 25.00 O ATOM 0 H ASP A 36 4.099 1.582 4.801 1.00 25.00 H new ATOM 0 HA ASP A 36 4.341 0.747 2.087 1.00 25.00 H new ATOM 0 HB2 ASP A 36 5.873 2.765 3.770 1.00 25.00 H new ATOM 0 HB3 ASP A 36 6.194 2.512 2.066 1.00 25.00 H new ATOM 638 N PHE A 37 6.725 -0.005 4.265 1.00 25.00 N ATOM 639 CA PHE A 37 7.953 -0.762 4.506 1.00 25.00 C ATOM 640 C PHE A 37 7.785 -2.257 4.225 1.00 25.00 C ATOM 641 O PHE A 37 8.677 -2.878 3.649 1.00 25.00 O ATOM 642 CB PHE A 37 8.426 -0.533 5.947 1.00 25.00 C ATOM 643 CG PHE A 37 9.812 -1.051 6.224 1.00 25.00 C ATOM 644 CD1 PHE A 37 10.937 -0.419 5.660 1.00 25.00 C ATOM 645 CD2 PHE A 37 10.006 -2.159 7.070 1.00 25.00 C ATOM 646 CE1 PHE A 37 12.247 -0.894 5.926 1.00 25.00 C ATOM 647 CE2 PHE A 37 11.312 -2.643 7.344 1.00 25.00 C ATOM 648 CZ PHE A 37 12.431 -2.011 6.765 1.00 25.00 C ATOM 0 H PHE A 37 6.329 0.426 5.101 1.00 25.00 H new ATOM 0 HA PHE A 37 8.708 -0.397 3.810 1.00 25.00 H new ATOM 0 HB2 PHE A 37 8.398 0.535 6.163 1.00 25.00 H new ATOM 0 HB3 PHE A 37 7.726 -1.014 6.630 1.00 25.00 H new ATOM 0 HD1 PHE A 37 10.801 0.438 5.017 1.00 25.00 H new ATOM 0 HD2 PHE A 37 9.152 -2.646 7.516 1.00 25.00 H new ATOM 0 HE1 PHE A 37 13.101 -0.401 5.486 1.00 25.00 H new ATOM 0 HE2 PHE A 37 11.448 -3.494 7.995 1.00 25.00 H new ATOM 0 HZ PHE A 37 13.426 -2.382 6.964 1.00 25.00 H new ATOM 658 N VAL A 38 6.643 -2.840 4.576 1.00 25.00 N ATOM 659 CA VAL A 38 6.417 -4.256 4.255 1.00 25.00 C ATOM 660 C VAL A 38 6.336 -4.439 2.738 1.00 25.00 C ATOM 661 O VAL A 38 6.860 -5.408 2.228 1.00 25.00 O ATOM 662 CB VAL A 38 5.164 -4.894 4.987 1.00 25.00 C ATOM 663 CG1 VAL A 38 3.957 -3.994 4.949 1.00 25.00 C ATOM 664 CG2 VAL A 38 4.794 -6.263 4.379 1.00 25.00 C ATOM 0 H VAL A 38 5.878 -2.377 5.067 1.00 25.00 H new ATOM 0 HA VAL A 38 7.275 -4.805 4.642 1.00 25.00 H new ATOM 0 HB VAL A 38 5.460 -5.027 6.028 1.00 25.00 H new ATOM 0 HG11 VAL A 38 3.127 -4.477 5.464 1.00 25.00 H new ATOM 0 HG12 VAL A 38 4.191 -3.051 5.443 1.00 25.00 H new ATOM 0 HG13 VAL A 38 3.679 -3.802 3.913 1.00 25.00 H new ATOM 0 HG21 VAL A 38 3.931 -6.673 4.904 1.00 25.00 H new ATOM 0 HG22 VAL A 38 4.552 -6.139 3.324 1.00 25.00 H new ATOM 0 HG23 VAL A 38 5.638 -6.946 4.480 1.00 25.00 H new ATOM 674 N LYS A 39 5.755 -3.501 1.997 1.00 25.00 N ATOM 675 CA LYS A 39 5.692 -3.658 0.533 1.00 25.00 C ATOM 676 C LYS A 39 7.093 -3.605 -0.085 1.00 25.00 C ATOM 677 O LYS A 39 7.398 -4.360 -0.999 1.00 25.00 O ATOM 678 CB LYS A 39 4.796 -2.583 -0.104 1.00 25.00 C ATOM 679 CG LYS A 39 4.226 -2.994 -1.484 1.00 25.00 C ATOM 680 CD LYS A 39 3.363 -1.881 -2.105 1.00 25.00 C ATOM 681 CE LYS A 39 2.521 -2.399 -3.293 1.00 25.00 C ATOM 682 NZ LYS A 39 1.550 -1.368 -3.863 1.00 25.00 N ATOM 0 H LYS A 39 5.332 -2.648 2.362 1.00 25.00 H new ATOM 0 HA LYS A 39 5.256 -4.636 0.328 1.00 25.00 H new ATOM 0 HB2 LYS A 39 3.969 -2.363 0.571 1.00 25.00 H new ATOM 0 HB3 LYS A 39 5.369 -1.663 -0.216 1.00 25.00 H new ATOM 0 HG2 LYS A 39 5.048 -3.235 -2.159 1.00 25.00 H new ATOM 0 HG3 LYS A 39 3.628 -3.898 -1.375 1.00 25.00 H new ATOM 0 HD2 LYS A 39 2.701 -1.468 -1.344 1.00 25.00 H new ATOM 0 HD3 LYS A 39 4.006 -1.069 -2.443 1.00 25.00 H new ATOM 0 HE2 LYS A 39 3.193 -2.727 -4.086 1.00 25.00 H new ATOM 0 HE3 LYS A 39 1.957 -3.275 -2.971 1.00 25.00 H new ATOM 0 HZ1 LYS A 39 1.173 -1.710 -4.770 1.00 25.00 H new ATOM 0 HZ2 LYS A 39 0.766 -1.223 -3.195 1.00 25.00 H new ATOM 0 HZ3 LYS A 39 2.048 -0.468 -4.013 1.00 25.00 H new ATOM 696 N ASP A 40 7.936 -2.716 0.426 1.00 25.00 N ATOM 697 CA ASP A 40 9.294 -2.533 -0.113 1.00 25.00 C ATOM 698 C ASP A 40 10.253 -3.674 0.278 1.00 25.00 C ATOM 699 O ASP A 40 11.213 -3.948 -0.434 1.00 25.00 O ATOM 700 CB ASP A 40 9.863 -1.186 0.370 1.00 25.00 C ATOM 701 CG ASP A 40 10.914 -0.597 -0.592 1.00 25.00 C ATOM 702 OD1 ASP A 40 10.606 -0.422 -1.799 1.00 25.00 O ATOM 703 OD2 ASP A 40 12.000 -0.185 -0.113 1.00 25.00 O ATOM 0 H ASP A 40 7.711 -2.107 1.213 1.00 25.00 H new ATOM 0 HA ASP A 40 9.213 -2.545 -1.200 1.00 25.00 H new ATOM 0 HB2 ASP A 40 9.046 -0.474 0.487 1.00 25.00 H new ATOM 0 HB3 ASP A 40 10.313 -1.320 1.354 1.00 25.00 H new ATOM 708 N THR A 41 9.987 -4.345 1.397 1.00 25.00 N ATOM 709 CA THR A 41 10.845 -5.460 1.853 1.00 25.00 C ATOM 710 C THR A 41 10.287 -6.827 1.436 1.00 25.00 C ATOM 711 O THR A 41 11.031 -7.768 1.182 1.00 25.00 O ATOM 712 CB THR A 41 11.022 -5.453 3.405 1.00 25.00 C ATOM 713 OG1 THR A 41 11.180 -4.106 3.861 1.00 25.00 O ATOM 714 CG2 THR A 41 12.262 -6.228 3.822 1.00 25.00 C ATOM 0 H THR A 41 9.194 -4.146 2.007 1.00 25.00 H new ATOM 0 HA THR A 41 11.811 -5.306 1.372 1.00 25.00 H new ATOM 0 HB THR A 41 10.138 -5.918 3.841 1.00 25.00 H new ATOM 0 HG1 THR A 41 10.318 -3.642 3.816 1.00 25.00 H new ATOM 0 HG21 THR A 41 12.358 -6.205 4.908 1.00 25.00 H new ATOM 0 HG22 THR A 41 12.175 -7.262 3.487 1.00 25.00 H new ATOM 0 HG23 THR A 41 13.144 -5.774 3.370 1.00 25.00 H new ATOM 722 N CYS A 42 8.968 -6.925 1.365 1.00 25.00 N ATOM 723 CA CYS A 42 8.278 -8.156 0.983 1.00 25.00 C ATOM 724 C CYS A 42 7.370 -7.890 -0.219 1.00 25.00 C ATOM 725 O CYS A 42 6.150 -7.783 -0.069 1.00 25.00 O ATOM 726 CB CYS A 42 7.418 -8.661 2.148 1.00 25.00 C ATOM 727 SG CYS A 42 8.354 -9.039 3.633 1.00 25.00 S ATOM 0 H CYS A 42 8.339 -6.149 1.572 1.00 25.00 H new ATOM 0 HA CYS A 42 9.025 -8.907 0.726 1.00 25.00 H new ATOM 0 HB2 CYS A 42 6.667 -7.908 2.386 1.00 25.00 H new ATOM 0 HB3 CYS A 42 6.882 -9.556 1.830 1.00 25.00 H new ATOM 0 HG CYS A 42 9.497 -9.564 3.304 1.00 25.00 H new ATOM 733 N PRO A 43 7.939 -7.814 -1.434 1.00 25.00 N ATOM 734 CA PRO A 43 7.095 -7.521 -2.601 1.00 25.00 C ATOM 735 C PRO A 43 6.197 -8.695 -2.971 1.00 25.00 C ATOM 736 O PRO A 43 5.234 -8.557 -3.717 1.00 25.00 O ATOM 737 CB PRO A 43 8.122 -7.232 -3.697 1.00 25.00 C ATOM 738 CG PRO A 43 9.292 -8.074 -3.326 1.00 25.00 C ATOM 739 CD PRO A 43 9.352 -7.998 -1.819 1.00 25.00 C ATOM 0 HA PRO A 43 6.403 -6.697 -2.427 1.00 25.00 H new ATOM 0 HB2 PRO A 43 7.738 -7.494 -4.683 1.00 25.00 H new ATOM 0 HB3 PRO A 43 8.385 -6.175 -3.729 1.00 25.00 H new ATOM 0 HG2 PRO A 43 9.165 -9.102 -3.667 1.00 25.00 H new ATOM 0 HG3 PRO A 43 10.210 -7.699 -3.779 1.00 25.00 H new ATOM 0 HD2 PRO A 43 9.772 -8.906 -1.386 1.00 25.00 H new ATOM 0 HD3 PRO A 43 9.973 -7.168 -1.482 1.00 25.00 H new ATOM 747 N TRP A 44 6.506 -9.852 -2.410 1.00 25.00 N ATOM 748 CA TRP A 44 5.727 -11.060 -2.618 1.00 25.00 C ATOM 749 C TRP A 44 4.525 -11.143 -1.676 1.00 25.00 C ATOM 750 O TRP A 44 3.604 -11.896 -1.935 1.00 25.00 O ATOM 751 CB TRP A 44 6.637 -12.266 -2.418 1.00 25.00 C ATOM 752 CG TRP A 44 7.670 -12.009 -1.368 1.00 25.00 C ATOM 753 CD1 TRP A 44 7.461 -11.868 -0.046 1.00 25.00 C ATOM 754 CD2 TRP A 44 9.088 -11.830 -1.554 1.00 25.00 C ATOM 755 NE1 TRP A 44 8.621 -11.630 0.631 1.00 25.00 N ATOM 756 CE2 TRP A 44 9.651 -11.589 -0.266 1.00 25.00 C ATOM 757 CE3 TRP A 44 9.939 -11.836 -2.677 1.00 25.00 C ATOM 758 CZ2 TRP A 44 11.025 -11.350 -0.075 1.00 25.00 C ATOM 759 CZ3 TRP A 44 11.327 -11.602 -2.489 1.00 25.00 C ATOM 760 CH2 TRP A 44 11.851 -11.356 -1.185 1.00 25.00 C ATOM 0 H TRP A 44 7.309 -9.980 -1.794 1.00 25.00 H new ATOM 0 HA TRP A 44 5.331 -11.044 -3.633 1.00 25.00 H new ATOM 0 HB2 TRP A 44 6.038 -13.132 -2.135 1.00 25.00 H new ATOM 0 HB3 TRP A 44 7.128 -12.512 -3.360 1.00 25.00 H new ATOM 0 HD1 TRP A 44 6.490 -11.935 0.423 1.00 25.00 H new ATOM 0 HE1 TRP A 44 8.706 -11.504 1.640 1.00 25.00 H new ATOM 0 HE3 TRP A 44 9.542 -12.016 -3.665 1.00 25.00 H new ATOM 0 HZ2 TRP A 44 11.424 -11.167 0.912 1.00 25.00 H new ATOM 0 HZ3 TRP A 44 11.992 -11.610 -3.340 1.00 25.00 H new ATOM 0 HH2 TRP A 44 12.908 -11.172 -1.062 1.00 25.00 H new ATOM 771 N PHE A 45 4.496 -10.353 -0.610 1.00 25.00 N ATOM 772 CA PHE A 45 3.342 -10.384 0.299 1.00 25.00 C ATOM 773 C PHE A 45 2.049 -9.912 -0.397 1.00 25.00 C ATOM 774 O PHE A 45 1.035 -10.612 -0.339 1.00 25.00 O ATOM 775 CB PHE A 45 3.596 -9.563 1.571 1.00 25.00 C ATOM 776 CG PHE A 45 2.471 -9.652 2.572 1.00 25.00 C ATOM 777 CD1 PHE A 45 1.353 -8.802 2.467 1.00 25.00 C ATOM 778 CD2 PHE A 45 2.509 -10.602 3.612 1.00 25.00 C ATOM 779 CE1 PHE A 45 0.282 -8.900 3.382 1.00 25.00 C ATOM 780 CE2 PHE A 45 1.442 -10.697 4.546 1.00 25.00 C ATOM 781 CZ PHE A 45 0.327 -9.842 4.425 1.00 25.00 C ATOM 0 H PHE A 45 5.233 -9.697 -0.352 1.00 25.00 H new ATOM 0 HA PHE A 45 3.206 -11.425 0.591 1.00 25.00 H new ATOM 0 HB2 PHE A 45 4.518 -9.907 2.039 1.00 25.00 H new ATOM 0 HB3 PHE A 45 3.748 -8.519 1.297 1.00 25.00 H new ATOM 0 HD1 PHE A 45 1.314 -8.066 1.677 1.00 25.00 H new ATOM 0 HD2 PHE A 45 3.357 -11.265 3.700 1.00 25.00 H new ATOM 0 HE1 PHE A 45 -0.574 -8.250 3.280 1.00 25.00 H new ATOM 0 HE2 PHE A 45 1.485 -11.422 5.346 1.00 25.00 H new ATOM 0 HZ PHE A 45 -0.488 -9.910 5.130 1.00 25.00 H new ATOM 791 N PRO A 46 2.067 -8.752 -1.104 1.00 25.00 N ATOM 792 CA PRO A 46 0.795 -8.462 -1.777 1.00 25.00 C ATOM 793 C PRO A 46 0.474 -9.424 -2.923 1.00 25.00 C ATOM 794 O PRO A 46 -0.675 -9.550 -3.309 1.00 25.00 O ATOM 795 CB PRO A 46 1.000 -7.034 -2.294 1.00 25.00 C ATOM 796 CG PRO A 46 2.446 -6.938 -2.528 1.00 25.00 C ATOM 797 CD PRO A 46 3.047 -7.675 -1.362 1.00 25.00 C ATOM 0 HA PRO A 46 -0.054 -8.575 -1.103 1.00 25.00 H new ATOM 0 HB2 PRO A 46 0.436 -6.858 -3.210 1.00 25.00 H new ATOM 0 HB3 PRO A 46 0.665 -6.295 -1.566 1.00 25.00 H new ATOM 0 HG2 PRO A 46 2.729 -7.393 -3.477 1.00 25.00 H new ATOM 0 HG3 PRO A 46 2.778 -5.900 -2.560 1.00 25.00 H new ATOM 0 HD2 PRO A 46 4.032 -8.075 -1.603 1.00 25.00 H new ATOM 0 HD3 PRO A 46 3.170 -7.026 -0.495 1.00 25.00 H new ATOM 805 N GLN A 47 1.481 -10.131 -3.425 1.00 25.00 N ATOM 806 CA GLN A 47 1.276 -11.119 -4.482 1.00 25.00 C ATOM 807 C GLN A 47 0.519 -12.338 -3.946 1.00 25.00 C ATOM 808 O GLN A 47 -0.277 -12.942 -4.652 1.00 25.00 O ATOM 809 CB GLN A 47 2.627 -11.561 -5.054 1.00 25.00 C ATOM 810 CG GLN A 47 2.556 -12.039 -6.496 1.00 25.00 C ATOM 811 CD GLN A 47 2.747 -10.905 -7.479 1.00 25.00 C ATOM 812 OE1 GLN A 47 2.080 -9.888 -7.409 1.00 25.00 O ATOM 813 NE2 GLN A 47 3.689 -11.059 -8.370 1.00 25.00 N ATOM 0 H GLN A 47 2.449 -10.039 -3.117 1.00 25.00 H new ATOM 0 HA GLN A 47 0.681 -10.659 -5.271 1.00 25.00 H new ATOM 0 HB2 GLN A 47 3.328 -10.728 -4.991 1.00 25.00 H new ATOM 0 HB3 GLN A 47 3.029 -12.363 -4.434 1.00 25.00 H new ATOM 0 HG2 GLN A 47 3.320 -12.798 -6.665 1.00 25.00 H new ATOM 0 HG3 GLN A 47 1.591 -12.514 -6.673 1.00 25.00 H new ATOM 0 HE21 GLN A 47 4.227 -11.925 -8.399 1.00 25.00 H new ATOM 0 HE22 GLN A 47 3.887 -10.313 -9.037 1.00 25.00 H new ATOM 822 N GLU A 48 0.752 -12.682 -2.683 1.00 25.00 N ATOM 823 CA GLU A 48 0.018 -13.779 -2.045 1.00 25.00 C ATOM 824 C GLU A 48 -1.429 -13.341 -1.804 1.00 25.00 C ATOM 825 O GLU A 48 -2.335 -14.173 -1.743 1.00 25.00 O ATOM 826 CB GLU A 48 0.661 -14.174 -0.704 1.00 25.00 C ATOM 827 CG GLU A 48 2.039 -14.838 -0.835 1.00 25.00 C ATOM 828 CD GLU A 48 2.570 -15.356 0.504 1.00 25.00 C ATOM 829 OE1 GLU A 48 2.426 -14.654 1.527 1.00 25.00 O ATOM 830 OE2 GLU A 48 3.061 -16.509 0.551 1.00 25.00 O ATOM 0 H GLU A 48 1.437 -12.224 -2.082 1.00 25.00 H new ATOM 0 HA GLU A 48 0.048 -14.645 -2.706 1.00 25.00 H new ATOM 0 HB2 GLU A 48 0.758 -13.282 -0.084 1.00 25.00 H new ATOM 0 HB3 GLU A 48 -0.009 -14.855 -0.180 1.00 25.00 H new ATOM 0 HG2 GLU A 48 1.974 -15.666 -1.541 1.00 25.00 H new ATOM 0 HG3 GLU A 48 2.747 -14.120 -1.250 1.00 25.00 H new ATOM 837 N GLY A 49 -1.625 -12.032 -1.653 1.00 25.00 N ATOM 838 CA GLY A 49 -2.953 -11.449 -1.472 1.00 25.00 C ATOM 839 C GLY A 49 -3.735 -12.038 -0.316 1.00 25.00 C ATOM 840 O GLY A 49 -4.958 -12.064 -0.333 1.00 25.00 O ATOM 0 H GLY A 49 -0.869 -11.347 -1.653 1.00 25.00 H new ATOM 0 HA2 GLY A 49 -2.848 -10.375 -1.316 1.00 25.00 H new ATOM 0 HA3 GLY A 49 -3.525 -11.584 -2.390 1.00 25.00 H new ATOM 844 N THR A 50 -3.024 -12.554 0.671 1.00 25.00 N ATOM 845 CA THR A 50 -3.636 -13.252 1.793 1.00 25.00 C ATOM 846 C THR A 50 -3.099 -12.651 3.073 1.00 25.00 C ATOM 847 O THR A 50 -1.886 -12.528 3.242 1.00 25.00 O ATOM 848 CB THR A 50 -3.264 -14.743 1.754 1.00 25.00 C ATOM 849 OG1 THR A 50 -3.710 -15.332 0.531 1.00 25.00 O ATOM 850 CG2 THR A 50 -3.882 -15.524 2.913 1.00 25.00 C ATOM 0 H THR A 50 -2.006 -12.502 0.719 1.00 25.00 H new ATOM 0 HA THR A 50 -4.720 -13.153 1.739 1.00 25.00 H new ATOM 0 HB THR A 50 -2.178 -14.796 1.836 1.00 25.00 H new ATOM 0 HG1 THR A 50 -3.222 -14.935 -0.220 1.00 25.00 H new ATOM 0 HG21 THR A 50 -3.591 -16.572 2.842 1.00 25.00 H new ATOM 0 HG22 THR A 50 -3.529 -15.112 3.858 1.00 25.00 H new ATOM 0 HG23 THR A 50 -4.968 -15.446 2.866 1.00 25.00 H new ATOM 858 N ILE A 51 -3.989 -12.267 3.973 1.00 25.00 N ATOM 859 CA ILE A 51 -3.592 -11.634 5.220 1.00 25.00 C ATOM 860 C ILE A 51 -4.094 -12.457 6.393 1.00 25.00 C ATOM 861 O ILE A 51 -5.243 -12.386 6.832 1.00 25.00 O ATOM 862 CB ILE A 51 -4.071 -10.172 5.280 1.00 25.00 C ATOM 863 CG1 ILE A 51 -3.478 -9.411 4.078 1.00 25.00 C ATOM 864 CG2 ILE A 51 -3.633 -9.503 6.616 1.00 25.00 C ATOM 865 CD1 ILE A 51 -3.894 -7.999 3.973 1.00 25.00 C ATOM 0 H ILE A 51 -4.996 -12.383 3.862 1.00 25.00 H new ATOM 0 HA ILE A 51 -2.504 -11.601 5.275 1.00 25.00 H new ATOM 0 HB ILE A 51 -5.160 -10.143 5.236 1.00 25.00 H new ATOM 0 HG12 ILE A 51 -2.391 -9.451 4.141 1.00 25.00 H new ATOM 0 HG13 ILE A 51 -3.763 -9.928 3.162 1.00 25.00 H new ATOM 0 HG21 ILE A 51 -3.982 -8.471 6.637 1.00 25.00 H new ATOM 0 HG22 ILE A 51 -4.064 -10.049 7.455 1.00 25.00 H new ATOM 0 HG23 ILE A 51 -2.546 -9.520 6.692 1.00 25.00 H new ATOM 0 HD11 ILE A 51 -3.427 -7.546 3.098 1.00 25.00 H new ATOM 0 HD12 ILE A 51 -4.978 -7.945 3.874 1.00 25.00 H new ATOM 0 HD13 ILE A 51 -3.584 -7.461 4.869 1.00 25.00 H new ATOM 877 N ASP A 52 -3.179 -13.249 6.908 1.00 25.00 N ATOM 878 CA ASP A 52 -3.420 -14.069 8.074 1.00 25.00 C ATOM 879 C ASP A 52 -2.122 -14.041 8.826 1.00 25.00 C ATOM 880 O ASP A 52 -1.096 -13.677 8.260 1.00 25.00 O ATOM 881 CB ASP A 52 -3.749 -15.501 7.696 1.00 25.00 C ATOM 882 CG ASP A 52 -4.006 -16.352 8.899 1.00 25.00 C ATOM 883 OD1 ASP A 52 -4.953 -16.061 9.642 1.00 25.00 O ATOM 884 OD2 ASP A 52 -3.152 -17.210 9.201 1.00 25.00 O ATOM 0 H ASP A 52 -2.238 -13.342 6.525 1.00 25.00 H new ATOM 0 HA ASP A 52 -4.267 -13.697 8.650 1.00 25.00 H new ATOM 0 HB2 ASP A 52 -4.626 -15.513 7.049 1.00 25.00 H new ATOM 0 HB3 ASP A 52 -2.924 -15.923 7.122 1.00 25.00 H new ATOM 889 N ILE A 53 -2.137 -14.430 10.084 1.00 25.00 N ATOM 890 CA ILE A 53 -0.932 -14.399 10.881 1.00 25.00 C ATOM 891 C ILE A 53 0.101 -15.389 10.348 1.00 25.00 C ATOM 892 O ILE A 53 1.295 -15.142 10.429 1.00 25.00 O ATOM 893 CB ILE A 53 -1.282 -14.636 12.362 1.00 25.00 C ATOM 894 CG1 ILE A 53 -0.096 -14.277 13.268 1.00 25.00 C ATOM 895 CG2 ILE A 53 -1.743 -16.083 12.622 1.00 25.00 C ATOM 896 CD1 ILE A 53 0.334 -12.823 13.227 1.00 25.00 C ATOM 0 H ILE A 53 -2.966 -14.769 10.573 1.00 25.00 H new ATOM 0 HA ILE A 53 -0.472 -13.414 10.808 1.00 25.00 H new ATOM 0 HB ILE A 53 -2.117 -13.979 12.604 1.00 25.00 H new ATOM 0 HG12 ILE A 53 -0.354 -14.534 14.295 1.00 25.00 H new ATOM 0 HG13 ILE A 53 0.755 -14.898 12.988 1.00 25.00 H new ATOM 0 HG21 ILE A 53 -1.979 -16.205 13.679 1.00 25.00 H new ATOM 0 HG22 ILE A 53 -2.630 -16.295 12.025 1.00 25.00 H new ATOM 0 HG23 ILE A 53 -0.946 -16.774 12.346 1.00 25.00 H new ATOM 0 HD11 ILE A 53 1.178 -12.674 13.901 1.00 25.00 H new ATOM 0 HD12 ILE A 53 0.630 -12.560 12.212 1.00 25.00 H new ATOM 0 HD13 ILE A 53 -0.496 -12.189 13.539 1.00 25.00 H new ATOM 908 N LYS A 54 -0.349 -16.462 9.711 1.00 25.00 N ATOM 909 CA LYS A 54 0.574 -17.420 9.092 1.00 25.00 C ATOM 910 C LYS A 54 1.374 -16.750 7.971 1.00 25.00 C ATOM 911 O LYS A 54 2.528 -17.091 7.744 1.00 25.00 O ATOM 912 CB LYS A 54 -0.200 -18.632 8.561 1.00 25.00 C ATOM 913 CG LYS A 54 -0.793 -19.500 9.690 1.00 25.00 C ATOM 914 CD LYS A 54 -1.527 -20.751 9.168 1.00 25.00 C ATOM 915 CE LYS A 54 -2.896 -20.441 8.526 1.00 25.00 C ATOM 916 NZ LYS A 54 -3.900 -19.883 9.512 1.00 25.00 N ATOM 0 H LYS A 54 -1.337 -16.695 9.607 1.00 25.00 H new ATOM 0 HA LYS A 54 1.279 -17.765 9.848 1.00 25.00 H new ATOM 0 HB2 LYS A 54 -1.005 -18.288 7.912 1.00 25.00 H new ATOM 0 HB3 LYS A 54 0.464 -19.243 7.949 1.00 25.00 H new ATOM 0 HG2 LYS A 54 0.008 -19.810 10.361 1.00 25.00 H new ATOM 0 HG3 LYS A 54 -1.486 -18.898 10.277 1.00 25.00 H new ATOM 0 HD2 LYS A 54 -0.896 -21.252 8.434 1.00 25.00 H new ATOM 0 HD3 LYS A 54 -1.672 -21.448 9.993 1.00 25.00 H new ATOM 0 HE2 LYS A 54 -2.757 -19.727 7.714 1.00 25.00 H new ATOM 0 HE3 LYS A 54 -3.298 -21.352 8.083 1.00 25.00 H new ATOM 0 HZ1 LYS A 54 -4.863 -20.114 9.195 1.00 25.00 H new ATOM 0 HZ2 LYS A 54 -3.734 -20.301 10.450 1.00 25.00 H new ATOM 0 HZ3 LYS A 54 -3.793 -18.850 9.569 1.00 25.00 H new ATOM 930 N ARG A 55 0.774 -15.770 7.306 1.00 25.00 N ATOM 931 CA ARG A 55 1.466 -15.008 6.257 1.00 25.00 C ATOM 932 C ARG A 55 2.285 -13.880 6.891 1.00 25.00 C ATOM 933 O ARG A 55 3.422 -13.641 6.525 1.00 25.00 O ATOM 934 CB ARG A 55 0.453 -14.384 5.281 1.00 25.00 C ATOM 935 CG ARG A 55 -0.534 -15.360 4.620 1.00 25.00 C ATOM 936 CD ARG A 55 0.101 -16.208 3.525 1.00 25.00 C ATOM 937 NE ARG A 55 -0.910 -16.830 2.655 1.00 25.00 N ATOM 938 CZ ARG A 55 -0.664 -17.493 1.529 1.00 25.00 C ATOM 939 NH1 ARG A 55 0.542 -17.707 1.083 1.00 25.00 N ATOM 940 NH2 ARG A 55 -1.667 -17.945 0.829 1.00 25.00 N ATOM 0 H ARG A 55 -0.190 -15.479 7.470 1.00 25.00 H new ATOM 0 HA ARG A 55 2.118 -15.693 5.715 1.00 25.00 H new ATOM 0 HB2 ARG A 55 -0.119 -13.627 5.817 1.00 25.00 H new ATOM 0 HB3 ARG A 55 1.005 -13.869 4.495 1.00 25.00 H new ATOM 0 HG2 ARG A 55 -0.951 -16.017 5.383 1.00 25.00 H new ATOM 0 HG3 ARG A 55 -1.365 -14.795 4.197 1.00 25.00 H new ATOM 0 HD2 ARG A 55 0.764 -15.586 2.923 1.00 25.00 H new ATOM 0 HD3 ARG A 55 0.717 -16.985 3.979 1.00 25.00 H new ATOM 0 HE ARG A 55 -1.885 -16.745 2.941 1.00 25.00 H new ATOM 0 HH11 ARG A 55 1.347 -17.360 1.604 1.00 25.00 H new ATOM 0 HH12 ARG A 55 0.680 -18.221 0.213 1.00 25.00 H new ATOM 0 HH21 ARG A 55 -2.623 -17.788 1.148 1.00 25.00 H new ATOM 0 HH22 ARG A 55 -1.495 -18.456 -0.037 1.00 25.00 H new ATOM 954 N TRP A 56 1.686 -13.187 7.849 1.00 25.00 N ATOM 955 CA TRP A 56 2.315 -12.029 8.494 1.00 25.00 C ATOM 956 C TRP A 56 3.572 -12.380 9.287 1.00 25.00 C ATOM 957 O TRP A 56 4.482 -11.566 9.407 1.00 25.00 O ATOM 958 CB TRP A 56 1.301 -11.346 9.411 1.00 25.00 C ATOM 959 CG TRP A 56 1.781 -10.027 9.958 1.00 25.00 C ATOM 960 CD1 TRP A 56 2.061 -9.722 11.251 1.00 25.00 C ATOM 961 CD2 TRP A 56 2.056 -8.820 9.216 1.00 25.00 C ATOM 962 NE1 TRP A 56 2.478 -8.430 11.388 1.00 25.00 N ATOM 963 CE2 TRP A 56 2.499 -7.841 10.155 1.00 25.00 C ATOM 964 CE3 TRP A 56 1.981 -8.467 7.854 1.00 25.00 C ATOM 965 CZ2 TRP A 56 2.875 -6.538 9.767 1.00 25.00 C ATOM 966 CZ3 TRP A 56 2.365 -7.162 7.459 1.00 25.00 C ATOM 967 CH2 TRP A 56 2.811 -6.211 8.425 1.00 25.00 C ATOM 0 H TRP A 56 0.755 -13.405 8.204 1.00 25.00 H new ATOM 0 HA TRP A 56 2.631 -11.357 7.696 1.00 25.00 H new ATOM 0 HB2 TRP A 56 0.374 -11.187 8.860 1.00 25.00 H new ATOM 0 HB3 TRP A 56 1.068 -12.012 10.242 1.00 25.00 H new ATOM 0 HD1 TRP A 56 1.965 -10.418 12.072 1.00 25.00 H new ATOM 0 HE1 TRP A 56 2.732 -7.978 12.266 1.00 25.00 H new ATOM 0 HE3 TRP A 56 1.636 -9.181 7.121 1.00 25.00 H new ATOM 0 HZ2 TRP A 56 3.204 -5.815 10.499 1.00 25.00 H new ATOM 0 HZ3 TRP A 56 2.320 -6.884 6.416 1.00 25.00 H new ATOM 0 HH2 TRP A 56 3.103 -5.222 8.103 1.00 25.00 H new ATOM 978 N ARG A 57 3.652 -13.599 9.801 1.00 25.00 N ATOM 979 CA ARG A 57 4.849 -14.032 10.528 1.00 25.00 C ATOM 980 C ARG A 57 6.073 -13.991 9.618 1.00 25.00 C ATOM 981 O ARG A 57 7.104 -13.454 9.997 1.00 25.00 O ATOM 982 CB ARG A 57 4.636 -15.417 11.132 1.00 25.00 C ATOM 983 CG ARG A 57 3.799 -15.352 12.414 1.00 25.00 C ATOM 984 CD ARG A 57 3.153 -16.685 12.731 1.00 25.00 C ATOM 985 NE ARG A 57 2.300 -16.604 13.937 1.00 25.00 N ATOM 986 CZ ARG A 57 1.734 -17.633 14.559 1.00 25.00 C ATOM 987 NH1 ARG A 57 1.953 -18.873 14.196 1.00 25.00 N ATOM 988 NH2 ARG A 57 0.922 -17.413 15.558 1.00 25.00 N ATOM 0 H ARG A 57 2.916 -14.302 9.733 1.00 25.00 H new ATOM 0 HA ARG A 57 5.031 -13.341 11.351 1.00 25.00 H new ATOM 0 HB2 ARG A 57 4.139 -16.059 10.405 1.00 25.00 H new ATOM 0 HB3 ARG A 57 5.602 -15.872 11.351 1.00 25.00 H new ATOM 0 HG2 ARG A 57 4.433 -15.048 13.247 1.00 25.00 H new ATOM 0 HG3 ARG A 57 3.027 -14.590 12.306 1.00 25.00 H new ATOM 0 HD2 ARG A 57 2.553 -17.010 11.881 1.00 25.00 H new ATOM 0 HD3 ARG A 57 3.926 -17.438 12.882 1.00 25.00 H new ATOM 0 HE ARG A 57 2.131 -15.676 14.326 1.00 25.00 H new ATOM 0 HH11 ARG A 57 2.575 -19.073 13.413 1.00 25.00 H new ATOM 0 HH12 ARG A 57 1.501 -19.638 14.697 1.00 25.00 H new ATOM 0 HH21 ARG A 57 0.726 -16.457 15.855 1.00 25.00 H new ATOM 0 HH22 ARG A 57 0.483 -18.197 16.041 1.00 25.00 H new ATOM 1002 N ARG A 58 5.904 -14.434 8.379 1.00 25.00 N ATOM 1003 CA ARG A 58 6.981 -14.361 7.373 1.00 25.00 C ATOM 1004 C ARG A 58 7.491 -12.947 7.113 1.00 25.00 C ATOM 1005 O ARG A 58 8.637 -12.770 6.742 1.00 25.00 O ATOM 1006 CB ARG A 58 6.528 -14.942 6.035 1.00 25.00 C ATOM 1007 CG ARG A 58 6.336 -16.440 6.041 1.00 25.00 C ATOM 1008 CD ARG A 58 6.118 -16.932 4.613 1.00 25.00 C ATOM 1009 NE ARG A 58 6.193 -18.400 4.515 1.00 25.00 N ATOM 1010 CZ ARG A 58 7.316 -19.102 4.386 1.00 25.00 C ATOM 1011 NH1 ARG A 58 8.501 -18.540 4.346 1.00 25.00 N ATOM 1012 NH2 ARG A 58 7.244 -20.401 4.294 1.00 25.00 N ATOM 0 H ARG A 58 5.037 -14.849 8.037 1.00 25.00 H new ATOM 0 HA ARG A 58 7.795 -14.946 7.802 1.00 25.00 H new ATOM 0 HB2 ARG A 58 5.590 -14.468 5.745 1.00 25.00 H new ATOM 0 HB3 ARG A 58 7.264 -14.685 5.273 1.00 25.00 H new ATOM 0 HG2 ARG A 58 7.209 -16.927 6.475 1.00 25.00 H new ATOM 0 HG3 ARG A 58 5.481 -16.705 6.663 1.00 25.00 H new ATOM 0 HD2 ARG A 58 5.144 -16.595 4.259 1.00 25.00 H new ATOM 0 HD3 ARG A 58 6.867 -16.487 3.958 1.00 25.00 H new ATOM 0 HE ARG A 58 5.315 -18.919 4.549 1.00 25.00 H new ATOM 0 HH11 ARG A 58 8.587 -17.526 4.415 1.00 25.00 H new ATOM 0 HH12 ARG A 58 9.336 -19.117 4.246 1.00 25.00 H new ATOM 0 HH21 ARG A 58 6.336 -20.865 4.321 1.00 25.00 H new ATOM 0 HH22 ARG A 58 8.096 -20.953 4.195 1.00 25.00 H new ATOM 1026 N VAL A 59 6.654 -11.942 7.304 1.00 25.00 N ATOM 1027 CA VAL A 59 7.071 -10.553 7.088 1.00 25.00 C ATOM 1028 C VAL A 59 8.104 -10.169 8.131 1.00 25.00 C ATOM 1029 O VAL A 59 9.085 -9.487 7.844 1.00 25.00 O ATOM 1030 CB VAL A 59 5.863 -9.588 7.200 1.00 25.00 C ATOM 1031 CG1 VAL A 59 6.288 -8.144 7.003 1.00 25.00 C ATOM 1032 CG2 VAL A 59 4.814 -9.972 6.180 1.00 25.00 C ATOM 0 H VAL A 59 5.686 -12.053 7.606 1.00 25.00 H new ATOM 0 HA VAL A 59 7.494 -10.474 6.086 1.00 25.00 H new ATOM 0 HB VAL A 59 5.444 -9.674 8.203 1.00 25.00 H new ATOM 0 HG11 VAL A 59 5.417 -7.494 7.088 1.00 25.00 H new ATOM 0 HG12 VAL A 59 7.019 -7.873 7.765 1.00 25.00 H new ATOM 0 HG13 VAL A 59 6.733 -8.027 6.015 1.00 25.00 H new ATOM 0 HG21 VAL A 59 3.965 -9.294 6.259 1.00 25.00 H new ATOM 0 HG22 VAL A 59 5.239 -9.907 5.178 1.00 25.00 H new ATOM 0 HG23 VAL A 59 4.481 -10.993 6.367 1.00 25.00 H new ATOM 1042 N GLY A 60 7.891 -10.635 9.348 1.00 25.00 N ATOM 1043 CA GLY A 60 8.808 -10.322 10.419 1.00 25.00 C ATOM 1044 C GLY A 60 10.080 -11.121 10.287 1.00 25.00 C ATOM 1045 O GLY A 60 11.163 -10.615 10.563 1.00 25.00 O ATOM 0 H GLY A 60 7.101 -11.223 9.614 1.00 25.00 H new ATOM 0 HA2 GLY A 60 9.039 -9.257 10.406 1.00 25.00 H new ATOM 0 HA3 GLY A 60 8.338 -10.534 11.379 1.00 25.00 H new ATOM 1049 N ASP A 61 9.952 -12.344 9.791 1.00 25.00 N ATOM 1050 CA ASP A 61 11.115 -13.190 9.521 1.00 25.00 C ATOM 1051 C ASP A 61 11.974 -12.479 8.469 1.00 25.00 C ATOM 1052 O ASP A 61 13.197 -12.449 8.554 1.00 25.00 O ATOM 1053 CB ASP A 61 10.681 -14.566 8.983 1.00 25.00 C ATOM 1054 CG ASP A 61 9.798 -15.341 9.962 1.00 25.00 C ATOM 1055 OD1 ASP A 61 9.932 -15.163 11.189 1.00 25.00 O ATOM 1056 OD2 ASP A 61 8.944 -16.129 9.481 1.00 25.00 O ATOM 0 H ASP A 61 9.056 -12.776 9.566 1.00 25.00 H new ATOM 0 HA ASP A 61 11.674 -13.351 10.443 1.00 25.00 H new ATOM 0 HB2 ASP A 61 10.141 -14.429 8.046 1.00 25.00 H new ATOM 0 HB3 ASP A 61 11.568 -15.157 8.757 1.00 25.00 H new ATOM 1061 N CYS A 62 11.307 -11.864 7.499 1.00 25.00 N ATOM 1062 CA CYS A 62 11.978 -11.116 6.438 1.00 25.00 C ATOM 1063 C CYS A 62 12.722 -9.906 6.989 1.00 25.00 C ATOM 1064 O CYS A 62 13.879 -9.682 6.657 1.00 25.00 O ATOM 1065 CB CYS A 62 10.952 -10.639 5.413 1.00 25.00 C ATOM 1066 SG CYS A 62 11.636 -10.454 3.746 1.00 25.00 S ATOM 0 H CYS A 62 10.290 -11.869 7.424 1.00 25.00 H new ATOM 0 HA CYS A 62 12.701 -11.785 5.970 1.00 25.00 H new ATOM 0 HB2 CYS A 62 10.124 -11.347 5.382 1.00 25.00 H new ATOM 0 HB3 CYS A 62 10.542 -9.683 5.738 1.00 25.00 H new ATOM 0 HG CYS A 62 10.858 -11.046 2.889 1.00 25.00 H new ATOM 1072 N PHE A 63 12.070 -9.132 7.850 1.00 25.00 N ATOM 1073 CA PHE A 63 12.736 -7.987 8.467 1.00 25.00 C ATOM 1074 C PHE A 63 13.949 -8.450 9.261 1.00 25.00 C ATOM 1075 O PHE A 63 14.951 -7.762 9.286 1.00 25.00 O ATOM 1076 CB PHE A 63 11.819 -7.233 9.438 1.00 25.00 C ATOM 1077 CG PHE A 63 10.595 -6.606 8.803 1.00 25.00 C ATOM 1078 CD1 PHE A 63 10.597 -6.155 7.464 1.00 25.00 C ATOM 1079 CD2 PHE A 63 9.428 -6.430 9.574 1.00 25.00 C ATOM 1080 CE1 PHE A 63 9.446 -5.539 6.905 1.00 25.00 C ATOM 1081 CE2 PHE A 63 8.280 -5.808 9.027 1.00 25.00 C ATOM 1082 CZ PHE A 63 8.292 -5.361 7.691 1.00 25.00 C ATOM 0 H PHE A 63 11.100 -9.271 8.133 1.00 25.00 H new ATOM 0 HA PHE A 63 13.022 -7.323 7.651 1.00 25.00 H new ATOM 0 HB2 PHE A 63 11.493 -7.923 10.217 1.00 25.00 H new ATOM 0 HB3 PHE A 63 12.398 -6.450 9.927 1.00 25.00 H new ATOM 0 HD1 PHE A 63 11.483 -6.280 6.859 1.00 25.00 H new ATOM 0 HD2 PHE A 63 9.409 -6.775 10.597 1.00 25.00 H new ATOM 0 HE1 PHE A 63 9.456 -5.207 5.877 1.00 25.00 H new ATOM 0 HE2 PHE A 63 7.396 -5.676 9.633 1.00 25.00 H new ATOM 0 HZ PHE A 63 7.419 -4.883 7.271 1.00 25.00 H new ATOM 1092 N GLN A 64 13.854 -9.598 9.919 1.00 25.00 N ATOM 1093 CA GLN A 64 14.954 -10.107 10.739 1.00 25.00 C ATOM 1094 C GLN A 64 16.141 -10.500 9.867 1.00 25.00 C ATOM 1095 O GLN A 64 17.285 -10.190 10.185 1.00 25.00 O ATOM 1096 CB GLN A 64 14.478 -11.309 11.561 1.00 25.00 C ATOM 1097 CG GLN A 64 15.496 -11.800 12.578 1.00 25.00 C ATOM 1098 CD GLN A 64 14.951 -12.923 13.430 1.00 25.00 C ATOM 1099 OE1 GLN A 64 14.191 -12.699 14.357 1.00 25.00 O ATOM 1100 NE2 GLN A 64 15.339 -14.133 13.123 1.00 25.00 N ATOM 0 H GLN A 64 13.028 -10.197 9.903 1.00 25.00 H new ATOM 0 HA GLN A 64 15.277 -9.317 11.417 1.00 25.00 H new ATOM 0 HB2 GLN A 64 13.559 -11.040 12.082 1.00 25.00 H new ATOM 0 HB3 GLN A 64 14.233 -12.126 10.883 1.00 25.00 H new ATOM 0 HG2 GLN A 64 16.391 -12.141 12.059 1.00 25.00 H new ATOM 0 HG3 GLN A 64 15.796 -10.971 13.219 1.00 25.00 H new ATOM 0 HE21 GLN A 64 15.976 -14.281 12.340 1.00 25.00 H new ATOM 0 HE22 GLN A 64 15.005 -14.929 13.666 1.00 25.00 H new ATOM 1109 N ASP A 65 15.864 -11.154 8.754 1.00 25.00 N ATOM 1110 CA ASP A 65 16.906 -11.543 7.805 1.00 25.00 C ATOM 1111 C ASP A 65 17.606 -10.303 7.267 1.00 25.00 C ATOM 1112 O ASP A 65 18.832 -10.173 7.318 1.00 25.00 O ATOM 1113 CB ASP A 65 16.258 -12.306 6.655 1.00 25.00 C ATOM 1114 CG ASP A 65 17.273 -12.913 5.711 1.00 25.00 C ATOM 1115 OD1 ASP A 65 17.854 -12.164 4.900 1.00 25.00 O ATOM 1116 OD2 ASP A 65 17.457 -14.147 5.752 1.00 25.00 O ATOM 0 H ASP A 65 14.922 -11.431 8.479 1.00 25.00 H new ATOM 0 HA ASP A 65 17.642 -12.173 8.303 1.00 25.00 H new ATOM 0 HB2 ASP A 65 15.626 -13.097 7.060 1.00 25.00 H new ATOM 0 HB3 ASP A 65 15.608 -11.632 6.098 1.00 25.00 H new ATOM 1121 N TYR A 66 16.801 -9.355 6.816 1.00 25.00 N ATOM 1122 CA TYR A 66 17.311 -8.112 6.262 1.00 25.00 C ATOM 1123 C TYR A 66 18.088 -7.321 7.318 1.00 25.00 C ATOM 1124 O TYR A 66 19.080 -6.661 7.010 1.00 25.00 O ATOM 1125 CB TYR A 66 16.139 -7.285 5.727 1.00 25.00 C ATOM 1126 CG TYR A 66 16.468 -6.524 4.465 1.00 25.00 C ATOM 1127 CD1 TYR A 66 17.412 -5.483 4.470 1.00 25.00 C ATOM 1128 CD2 TYR A 66 15.848 -6.861 3.244 1.00 25.00 C ATOM 1129 CE1 TYR A 66 17.741 -4.799 3.278 1.00 25.00 C ATOM 1130 CE2 TYR A 66 16.166 -6.164 2.050 1.00 25.00 C ATOM 1131 CZ TYR A 66 17.112 -5.141 2.082 1.00 25.00 C ATOM 1132 OH TYR A 66 17.427 -4.456 0.936 1.00 25.00 O ATOM 0 H TYR A 66 15.783 -9.424 6.823 1.00 25.00 H new ATOM 0 HA TYR A 66 17.999 -8.340 5.447 1.00 25.00 H new ATOM 0 HB2 TYR A 66 15.295 -7.947 5.533 1.00 25.00 H new ATOM 0 HB3 TYR A 66 15.821 -6.580 6.495 1.00 25.00 H new ATOM 0 HD1 TYR A 66 17.892 -5.202 5.396 1.00 25.00 H new ATOM 0 HD2 TYR A 66 15.122 -7.660 3.218 1.00 25.00 H new ATOM 0 HE1 TYR A 66 18.480 -4.011 3.294 1.00 25.00 H new ATOM 0 HE2 TYR A 66 15.678 -6.424 1.122 1.00 25.00 H new ATOM 0 HH TYR A 66 16.905 -4.813 0.187 1.00 25.00 H new ATOM 1142 N PHE A 67 17.651 -7.408 8.566 1.00 25.00 N ATOM 1143 CA PHE A 67 18.319 -6.705 9.667 1.00 25.00 C ATOM 1144 C PHE A 67 19.698 -7.295 9.936 1.00 25.00 C ATOM 1145 O PHE A 67 20.648 -6.564 10.169 1.00 25.00 O ATOM 1146 CB PHE A 67 17.468 -6.788 10.939 1.00 25.00 C ATOM 1147 CG PHE A 67 18.054 -6.059 12.118 1.00 25.00 C ATOM 1148 CD1 PHE A 67 18.977 -6.696 12.971 1.00 25.00 C ATOM 1149 CD2 PHE A 67 17.668 -4.736 12.399 1.00 25.00 C ATOM 1150 CE1 PHE A 67 19.520 -6.016 14.087 1.00 25.00 C ATOM 1151 CE2 PHE A 67 18.193 -4.051 13.517 1.00 25.00 C ATOM 1152 CZ PHE A 67 19.126 -4.691 14.360 1.00 25.00 C ATOM 0 H PHE A 67 16.838 -7.956 8.848 1.00 25.00 H new ATOM 0 HA PHE A 67 18.439 -5.661 9.377 1.00 25.00 H new ATOM 0 HB2 PHE A 67 16.479 -6.381 10.729 1.00 25.00 H new ATOM 0 HB3 PHE A 67 17.332 -7.836 11.205 1.00 25.00 H new ATOM 0 HD1 PHE A 67 19.274 -7.715 12.771 1.00 25.00 H new ATOM 0 HD2 PHE A 67 16.961 -4.238 11.752 1.00 25.00 H new ATOM 0 HE1 PHE A 67 20.234 -6.511 14.728 1.00 25.00 H new ATOM 0 HE2 PHE A 67 17.881 -3.039 13.726 1.00 25.00 H new ATOM 0 HZ PHE A 67 19.536 -4.168 15.211 1.00 25.00 H new ATOM 1162 N ASN A 68 19.819 -8.612 9.888 1.00 25.00 N ATOM 1163 CA ASN A 68 21.112 -9.252 10.137 1.00 25.00 C ATOM 1164 C ASN A 68 22.066 -8.985 8.979 1.00 25.00 C ATOM 1165 O ASN A 68 23.269 -8.870 9.172 1.00 25.00 O ATOM 1166 CB ASN A 68 20.942 -10.762 10.318 1.00 25.00 C ATOM 1167 CG ASN A 68 20.530 -11.132 11.718 1.00 25.00 C ATOM 1168 OD1 ASN A 68 21.336 -11.141 12.629 1.00 25.00 O ATOM 1169 ND2 ASN A 68 19.277 -11.435 11.899 1.00 25.00 N ATOM 0 H ASN A 68 19.054 -9.255 9.683 1.00 25.00 H new ATOM 0 HA ASN A 68 21.527 -8.830 11.052 1.00 25.00 H new ATOM 0 HB2 ASN A 68 20.194 -11.127 9.614 1.00 25.00 H new ATOM 0 HB3 ASN A 68 21.880 -11.262 10.075 1.00 25.00 H new ATOM 0 HD21 ASN A 68 18.943 -11.691 12.828 1.00 25.00 H new ATOM 0 HD22 ASN A 68 18.629 -11.417 11.111 1.00 25.00 H new ATOM 1176 N THR A 69 21.522 -8.900 7.777 1.00 25.00 N ATOM 1177 CA THR A 69 22.338 -8.697 6.582 1.00 25.00 C ATOM 1178 C THR A 69 22.815 -7.244 6.415 1.00 25.00 C ATOM 1179 O THR A 69 23.942 -7.007 5.987 1.00 25.00 O ATOM 1180 CB THR A 69 21.542 -9.129 5.324 1.00 25.00 C ATOM 1181 OG1 THR A 69 21.025 -10.447 5.526 1.00 25.00 O ATOM 1182 CG2 THR A 69 22.428 -9.177 4.088 1.00 25.00 C ATOM 0 H THR A 69 20.520 -8.968 7.598 1.00 25.00 H new ATOM 0 HA THR A 69 23.229 -9.313 6.702 1.00 25.00 H new ATOM 0 HB THR A 69 20.747 -8.399 5.172 1.00 25.00 H new ATOM 0 HG1 THR A 69 20.263 -10.409 6.142 1.00 25.00 H new ATOM 0 HG21 THR A 69 21.835 -9.484 3.227 1.00 25.00 H new ATOM 0 HG22 THR A 69 22.850 -8.189 3.904 1.00 25.00 H new ATOM 0 HG23 THR A 69 23.235 -9.893 4.246 1.00 25.00 H new ATOM 1190 N PHE A 70 21.958 -6.272 6.719 1.00 25.00 N ATOM 1191 CA PHE A 70 22.283 -4.857 6.468 1.00 25.00 C ATOM 1192 C PHE A 70 22.337 -3.942 7.702 1.00 25.00 C ATOM 1193 O PHE A 70 22.580 -2.743 7.570 1.00 25.00 O ATOM 1194 CB PHE A 70 21.289 -4.284 5.461 1.00 25.00 C ATOM 1195 CG PHE A 70 21.399 -4.895 4.092 1.00 25.00 C ATOM 1196 CD1 PHE A 70 22.282 -4.349 3.143 1.00 25.00 C ATOM 1197 CD2 PHE A 70 20.626 -6.013 3.738 1.00 25.00 C ATOM 1198 CE1 PHE A 70 22.390 -4.909 1.845 1.00 25.00 C ATOM 1199 CE2 PHE A 70 20.718 -6.580 2.444 1.00 25.00 C ATOM 1200 CZ PHE A 70 21.604 -6.028 1.497 1.00 25.00 C ATOM 0 H PHE A 70 21.040 -6.429 7.136 1.00 25.00 H new ATOM 0 HA PHE A 70 23.304 -4.869 6.086 1.00 25.00 H new ATOM 0 HB2 PHE A 70 20.277 -4.434 5.836 1.00 25.00 H new ATOM 0 HB3 PHE A 70 21.443 -3.208 5.383 1.00 25.00 H new ATOM 0 HD1 PHE A 70 22.885 -3.493 3.406 1.00 25.00 H new ATOM 0 HD2 PHE A 70 19.952 -6.446 4.463 1.00 25.00 H new ATOM 0 HE1 PHE A 70 23.072 -4.481 1.125 1.00 25.00 H new ATOM 0 HE2 PHE A 70 20.110 -7.434 2.183 1.00 25.00 H new ATOM 0 HZ PHE A 70 21.681 -6.459 0.510 1.00 25.00 H new ATOM 1210 N GLY A 71 22.143 -4.498 8.886 1.00 25.00 N ATOM 1211 CA GLY A 71 22.303 -3.734 10.117 1.00 25.00 C ATOM 1212 C GLY A 71 21.155 -2.818 10.531 1.00 25.00 C ATOM 1213 O GLY A 71 20.194 -2.591 9.768 1.00 25.00 O ATOM 0 H GLY A 71 21.875 -5.473 9.023 1.00 25.00 H new ATOM 0 HA2 GLY A 71 22.481 -4.438 10.929 1.00 25.00 H new ATOM 0 HA3 GLY A 71 23.202 -3.125 10.021 1.00 25.00 H new ATOM 1217 N PRO A 72 21.227 -2.253 11.757 1.00 25.00 N ATOM 1218 CA PRO A 72 20.178 -1.372 12.290 1.00 25.00 C ATOM 1219 C PRO A 72 20.062 -0.009 11.609 1.00 25.00 C ATOM 1220 O PRO A 72 19.038 0.666 11.730 1.00 25.00 O ATOM 1221 CB PRO A 72 20.588 -1.205 13.756 1.00 25.00 C ATOM 1222 CG PRO A 72 22.057 -1.339 13.737 1.00 25.00 C ATOM 1223 CD PRO A 72 22.307 -2.443 12.747 1.00 25.00 C ATOM 0 HA PRO A 72 19.193 -1.809 12.128 1.00 25.00 H new ATOM 0 HB2 PRO A 72 20.281 -0.235 14.148 1.00 25.00 H new ATOM 0 HB3 PRO A 72 20.127 -1.964 14.388 1.00 25.00 H new ATOM 0 HG2 PRO A 72 22.539 -0.411 13.430 1.00 25.00 H new ATOM 0 HG3 PRO A 72 22.448 -1.590 14.723 1.00 25.00 H new ATOM 0 HD2 PRO A 72 23.293 -2.359 12.290 1.00 25.00 H new ATOM 0 HD3 PRO A 72 22.256 -3.425 13.217 1.00 25.00 H new ATOM 1231 N GLU A 73 21.091 0.402 10.885 1.00 25.00 N ATOM 1232 CA GLU A 73 21.048 1.666 10.155 1.00 25.00 C ATOM 1233 C GLU A 73 20.207 1.516 8.888 1.00 25.00 C ATOM 1234 O GLU A 73 19.739 2.507 8.321 1.00 25.00 O ATOM 1235 CB GLU A 73 22.465 2.157 9.806 1.00 25.00 C ATOM 1236 CG GLU A 73 23.306 1.210 8.939 1.00 25.00 C ATOM 1237 CD GLU A 73 24.194 0.303 9.776 1.00 25.00 C ATOM 1238 OE1 GLU A 73 23.651 -0.584 10.470 1.00 25.00 O ATOM 1239 OE2 GLU A 73 25.420 0.514 9.785 1.00 25.00 O ATOM 0 H GLU A 73 21.964 -0.116 10.785 1.00 25.00 H new ATOM 0 HA GLU A 73 20.585 2.413 10.799 1.00 25.00 H new ATOM 0 HB2 GLU A 73 22.381 3.113 9.290 1.00 25.00 H new ATOM 0 HB3 GLU A 73 23.004 2.343 10.735 1.00 25.00 H new ATOM 0 HG2 GLU A 73 22.645 0.601 8.323 1.00 25.00 H new ATOM 0 HG3 GLU A 73 23.925 1.796 8.259 1.00 25.00 H new ATOM 1246 N LYS A 74 19.996 0.277 8.451 1.00 25.00 N ATOM 1247 CA LYS A 74 19.180 0.019 7.265 1.00 25.00 C ATOM 1248 C LYS A 74 17.772 -0.385 7.673 1.00 25.00 C ATOM 1249 O LYS A 74 16.799 0.153 7.138 1.00 25.00 O ATOM 1250 CB LYS A 74 19.843 -1.047 6.387 1.00 25.00 C ATOM 1251 CG LYS A 74 19.518 -0.929 4.882 1.00 25.00 C ATOM 1252 CD LYS A 74 18.110 -1.405 4.540 1.00 25.00 C ATOM 1253 CE LYS A 74 17.851 -1.361 3.041 1.00 25.00 C ATOM 1254 NZ LYS A 74 16.461 -1.866 2.735 1.00 25.00 N ATOM 0 H LYS A 74 20.375 -0.559 8.896 1.00 25.00 H new ATOM 0 HA LYS A 74 19.105 0.933 6.676 1.00 25.00 H new ATOM 0 HB2 LYS A 74 20.923 -0.987 6.518 1.00 25.00 H new ATOM 0 HB3 LYS A 74 19.533 -2.032 6.737 1.00 25.00 H new ATOM 0 HG2 LYS A 74 19.630 0.110 4.572 1.00 25.00 H new ATOM 0 HG3 LYS A 74 20.242 -1.512 4.312 1.00 25.00 H new ATOM 0 HD2 LYS A 74 17.971 -2.423 4.904 1.00 25.00 H new ATOM 0 HD3 LYS A 74 17.379 -0.781 5.054 1.00 25.00 H new ATOM 0 HE2 LYS A 74 17.963 -0.340 2.675 1.00 25.00 H new ATOM 0 HE3 LYS A 74 18.590 -1.970 2.519 1.00 25.00 H new ATOM 0 HZ1 LYS A 74 16.141 -1.473 1.827 1.00 25.00 H new ATOM 0 HZ2 LYS A 74 16.474 -2.904 2.678 1.00 25.00 H new ATOM 0 HZ3 LYS A 74 15.810 -1.569 3.489 1.00 25.00 H new ATOM 1268 N VAL A 75 17.637 -1.293 8.630 1.00 25.00 N ATOM 1269 CA VAL A 75 16.305 -1.650 9.120 1.00 25.00 C ATOM 1270 C VAL A 75 16.227 -1.173 10.564 1.00 25.00 C ATOM 1271 O VAL A 75 17.075 -1.517 11.372 1.00 25.00 O ATOM 1272 CB VAL A 75 16.110 -3.201 9.071 1.00 25.00 C ATOM 1273 CG1 VAL A 75 14.729 -3.618 9.622 1.00 25.00 C ATOM 1274 CG2 VAL A 75 16.274 -3.712 7.634 1.00 25.00 C ATOM 0 H VAL A 75 18.410 -1.787 9.076 1.00 25.00 H new ATOM 0 HA VAL A 75 15.530 -1.191 8.506 1.00 25.00 H new ATOM 0 HB VAL A 75 16.875 -3.650 9.705 1.00 25.00 H new ATOM 0 HG11 VAL A 75 14.630 -4.702 9.572 1.00 25.00 H new ATOM 0 HG12 VAL A 75 14.637 -3.293 10.658 1.00 25.00 H new ATOM 0 HG13 VAL A 75 13.944 -3.154 9.025 1.00 25.00 H new ATOM 0 HG21 VAL A 75 16.136 -4.793 7.614 1.00 25.00 H new ATOM 0 HG22 VAL A 75 15.530 -3.239 6.993 1.00 25.00 H new ATOM 0 HG23 VAL A 75 17.273 -3.467 7.273 1.00 25.00 H new ATOM 1284 N PRO A 76 15.155 -0.455 10.936 1.00 25.00 N ATOM 1285 CA PRO A 76 15.143 -0.029 12.337 1.00 25.00 C ATOM 1286 C PRO A 76 14.597 -1.093 13.272 1.00 25.00 C ATOM 1287 O PRO A 76 13.726 -1.873 12.901 1.00 25.00 O ATOM 1288 CB PRO A 76 14.223 1.186 12.306 1.00 25.00 C ATOM 1289 CG PRO A 76 13.242 0.877 11.235 1.00 25.00 C ATOM 1290 CD PRO A 76 14.007 0.093 10.186 1.00 25.00 C ATOM 0 HA PRO A 76 16.144 0.175 12.716 1.00 25.00 H new ATOM 0 HB2 PRO A 76 13.729 1.336 13.266 1.00 25.00 H new ATOM 0 HB3 PRO A 76 14.777 2.099 12.087 1.00 25.00 H new ATOM 0 HG2 PRO A 76 12.407 0.295 11.626 1.00 25.00 H new ATOM 0 HG3 PRO A 76 12.824 1.791 10.812 1.00 25.00 H new ATOM 0 HD2 PRO A 76 13.396 -0.699 9.752 1.00 25.00 H new ATOM 0 HD3 PRO A 76 14.332 0.732 9.365 1.00 25.00 H new ATOM 1298 N VAL A 77 15.023 -1.065 14.524 1.00 25.00 N ATOM 1299 CA VAL A 77 14.486 -1.993 15.518 1.00 25.00 C ATOM 1300 C VAL A 77 13.001 -1.706 15.788 1.00 25.00 C ATOM 1301 O VAL A 77 12.252 -2.585 16.205 1.00 25.00 O ATOM 1302 CB VAL A 77 15.299 -1.946 16.844 1.00 25.00 C ATOM 1303 CG1 VAL A 77 16.738 -2.423 16.597 1.00 25.00 C ATOM 1304 CG2 VAL A 77 15.319 -0.524 17.444 1.00 25.00 C ATOM 0 H VAL A 77 15.730 -0.420 14.878 1.00 25.00 H new ATOM 0 HA VAL A 77 14.577 -2.999 15.107 1.00 25.00 H new ATOM 0 HB VAL A 77 14.810 -2.610 17.558 1.00 25.00 H new ATOM 0 HG11 VAL A 77 17.299 -2.386 17.531 1.00 25.00 H new ATOM 0 HG12 VAL A 77 16.723 -3.447 16.223 1.00 25.00 H new ATOM 0 HG13 VAL A 77 17.215 -1.775 15.862 1.00 25.00 H new ATOM 0 HG21 VAL A 77 15.895 -0.528 18.369 1.00 25.00 H new ATOM 0 HG22 VAL A 77 15.777 0.164 16.734 1.00 25.00 H new ATOM 0 HG23 VAL A 77 14.299 -0.203 17.653 1.00 25.00 H new ATOM 1314 N THR A 78 12.551 -0.494 15.483 1.00 25.00 N ATOM 1315 CA THR A 78 11.140 -0.154 15.673 1.00 25.00 C ATOM 1316 C THR A 78 10.268 -0.814 14.619 1.00 25.00 C ATOM 1317 O THR A 78 9.072 -0.954 14.817 1.00 25.00 O ATOM 1318 CB THR A 78 10.885 1.377 15.671 1.00 25.00 C ATOM 1319 OG1 THR A 78 9.656 1.655 16.343 1.00 25.00 O ATOM 1320 CG2 THR A 78 10.804 1.958 14.279 1.00 25.00 C ATOM 0 H THR A 78 13.128 0.260 15.110 1.00 25.00 H new ATOM 0 HA THR A 78 10.871 -0.536 16.658 1.00 25.00 H new ATOM 0 HB THR A 78 11.732 1.837 16.179 1.00 25.00 H new ATOM 0 HG1 THR A 78 9.002 0.957 16.130 1.00 25.00 H new ATOM 0 HG21 THR A 78 10.624 3.031 14.343 1.00 25.00 H new ATOM 0 HG22 THR A 78 11.742 1.777 13.754 1.00 25.00 H new ATOM 0 HG23 THR A 78 9.987 1.485 13.734 1.00 25.00 H new ATOM 1328 N ALA A 79 10.854 -1.269 13.517 1.00 25.00 N ATOM 1329 CA ALA A 79 10.063 -1.941 12.496 1.00 25.00 C ATOM 1330 C ALA A 79 9.467 -3.211 13.091 1.00 25.00 C ATOM 1331 O ALA A 79 8.330 -3.545 12.815 1.00 25.00 O ATOM 1332 CB ALA A 79 10.916 -2.260 11.282 1.00 25.00 C ATOM 0 H ALA A 79 11.850 -1.188 13.311 1.00 25.00 H new ATOM 0 HA ALA A 79 9.257 -1.285 12.167 1.00 25.00 H new ATOM 0 HB1 ALA A 79 10.306 -2.762 10.531 1.00 25.00 H new ATOM 0 HB2 ALA A 79 11.317 -1.336 10.866 1.00 25.00 H new ATOM 0 HB3 ALA A 79 11.739 -2.912 11.576 1.00 25.00 H new ATOM 1338 N PHE A 80 10.223 -3.880 13.950 1.00 25.00 N ATOM 1339 CA PHE A 80 9.744 -5.091 14.614 1.00 25.00 C ATOM 1340 C PHE A 80 8.694 -4.759 15.665 1.00 25.00 C ATOM 1341 O PHE A 80 7.790 -5.539 15.925 1.00 25.00 O ATOM 1342 CB PHE A 80 10.908 -5.808 15.291 1.00 25.00 C ATOM 1343 CG PHE A 80 11.997 -6.200 14.343 1.00 25.00 C ATOM 1344 CD1 PHE A 80 11.942 -7.431 13.669 1.00 25.00 C ATOM 1345 CD2 PHE A 80 13.090 -5.342 14.115 1.00 25.00 C ATOM 1346 CE1 PHE A 80 12.961 -7.806 12.777 1.00 25.00 C ATOM 1347 CE2 PHE A 80 14.113 -5.699 13.214 1.00 25.00 C ATOM 1348 CZ PHE A 80 14.049 -6.935 12.542 1.00 25.00 C ATOM 0 H PHE A 80 11.172 -3.607 14.206 1.00 25.00 H new ATOM 0 HA PHE A 80 9.297 -5.734 13.856 1.00 25.00 H new ATOM 0 HB2 PHE A 80 11.324 -5.161 16.063 1.00 25.00 H new ATOM 0 HB3 PHE A 80 10.533 -6.701 15.792 1.00 25.00 H new ATOM 0 HD1 PHE A 80 11.108 -8.096 13.838 1.00 25.00 H new ATOM 0 HD2 PHE A 80 13.145 -4.398 14.637 1.00 25.00 H new ATOM 0 HE1 PHE A 80 12.913 -8.759 12.271 1.00 25.00 H new ATOM 0 HE2 PHE A 80 14.942 -5.028 13.040 1.00 25.00 H new ATOM 0 HZ PHE A 80 14.829 -7.216 11.850 1.00 25.00 H new ATOM 1358 N SER A 81 8.820 -3.592 16.272 1.00 25.00 N ATOM 1359 CA SER A 81 7.886 -3.165 17.318 1.00 25.00 C ATOM 1360 C SER A 81 6.542 -2.857 16.674 1.00 25.00 C ATOM 1361 O SER A 81 5.496 -3.333 17.110 1.00 25.00 O ATOM 1362 CB SER A 81 8.420 -1.926 18.043 1.00 25.00 C ATOM 1363 OG SER A 81 7.559 -1.552 19.102 1.00 25.00 O ATOM 0 H SER A 81 9.557 -2.918 16.064 1.00 25.00 H new ATOM 0 HA SER A 81 7.772 -3.962 18.053 1.00 25.00 H new ATOM 0 HB2 SER A 81 9.417 -2.130 18.434 1.00 25.00 H new ATOM 0 HB3 SER A 81 8.516 -1.100 17.338 1.00 25.00 H new ATOM 0 HG SER A 81 7.919 -0.760 19.552 1.00 25.00 H new ATOM 1369 N TYR A 82 6.592 -2.125 15.574 1.00 25.00 N ATOM 1370 CA TYR A 82 5.402 -1.822 14.799 1.00 25.00 C ATOM 1371 C TYR A 82 4.810 -3.104 14.249 1.00 25.00 C ATOM 1372 O TYR A 82 3.613 -3.316 14.302 1.00 25.00 O ATOM 1373 CB TYR A 82 5.760 -0.896 13.644 1.00 25.00 C ATOM 1374 CG TYR A 82 5.553 0.555 13.979 1.00 25.00 C ATOM 1375 CD1 TYR A 82 6.585 1.338 14.551 1.00 25.00 C ATOM 1376 CD2 TYR A 82 4.308 1.157 13.732 1.00 25.00 C ATOM 1377 CE1 TYR A 82 6.369 2.709 14.853 1.00 25.00 C ATOM 1378 CE2 TYR A 82 4.091 2.531 14.025 1.00 25.00 C ATOM 1379 CZ TYR A 82 5.125 3.293 14.576 1.00 25.00 C ATOM 1380 OH TYR A 82 4.917 4.620 14.846 1.00 25.00 O ATOM 0 H TYR A 82 7.452 -1.727 15.196 1.00 25.00 H new ATOM 0 HA TYR A 82 4.673 -1.332 15.444 1.00 25.00 H new ATOM 0 HB2 TYR A 82 6.802 -1.055 13.365 1.00 25.00 H new ATOM 0 HB3 TYR A 82 5.154 -1.154 12.775 1.00 25.00 H new ATOM 0 HD1 TYR A 82 7.545 0.889 14.759 1.00 25.00 H new ATOM 0 HD2 TYR A 82 3.505 0.568 13.314 1.00 25.00 H new ATOM 0 HE1 TYR A 82 7.159 3.299 15.294 1.00 25.00 H new ATOM 0 HE2 TYR A 82 3.132 2.984 13.823 1.00 25.00 H new ATOM 0 HH TYR A 82 4.107 4.925 14.385 1.00 25.00 H new ATOM 1390 N TRP A 83 5.663 -3.977 13.747 1.00 25.00 N ATOM 1391 CA TRP A 83 5.219 -5.245 13.192 1.00 25.00 C ATOM 1392 C TRP A 83 4.465 -6.083 14.227 1.00 25.00 C ATOM 1393 O TRP A 83 3.476 -6.746 13.901 1.00 25.00 O ATOM 1394 CB TRP A 83 6.444 -6.019 12.704 1.00 25.00 C ATOM 1395 CG TRP A 83 6.151 -7.416 12.300 1.00 25.00 C ATOM 1396 CD1 TRP A 83 5.712 -7.860 11.098 1.00 25.00 C ATOM 1397 CD2 TRP A 83 6.283 -8.593 13.118 1.00 25.00 C ATOM 1398 NE1 TRP A 83 5.541 -9.213 11.096 1.00 25.00 N ATOM 1399 CE2 TRP A 83 5.886 -9.703 12.323 1.00 25.00 C ATOM 1400 CE3 TRP A 83 6.701 -8.823 14.446 1.00 25.00 C ATOM 1401 CZ2 TRP A 83 5.903 -11.019 12.810 1.00 25.00 C ATOM 1402 CZ3 TRP A 83 6.722 -10.149 14.940 1.00 25.00 C ATOM 1403 CH2 TRP A 83 6.324 -11.236 14.109 1.00 25.00 C ATOM 0 H TRP A 83 6.672 -3.832 13.711 1.00 25.00 H new ATOM 0 HA TRP A 83 4.535 -5.043 12.368 1.00 25.00 H new ATOM 0 HB2 TRP A 83 6.882 -5.491 11.857 1.00 25.00 H new ATOM 0 HB3 TRP A 83 7.194 -6.030 13.495 1.00 25.00 H new ATOM 0 HD1 TRP A 83 5.521 -7.222 10.248 1.00 25.00 H new ATOM 0 HE1 TRP A 83 5.210 -9.768 10.307 1.00 25.00 H new ATOM 0 HE3 TRP A 83 7.001 -7.999 15.076 1.00 25.00 H new ATOM 0 HZ2 TRP A 83 5.594 -11.843 12.184 1.00 25.00 H new ATOM 0 HZ3 TRP A 83 7.042 -10.338 15.954 1.00 25.00 H new ATOM 0 HH2 TRP A 83 6.352 -12.243 14.499 1.00 25.00 H new ATOM 1414 N ASN A 84 4.921 -6.034 15.473 1.00 25.00 N ATOM 1415 CA ASN A 84 4.310 -6.805 16.560 1.00 25.00 C ATOM 1416 C ASN A 84 2.887 -6.327 16.829 1.00 25.00 C ATOM 1417 O ASN A 84 2.012 -7.129 17.143 1.00 25.00 O ATOM 1418 CB ASN A 84 5.133 -6.685 17.850 1.00 25.00 C ATOM 1419 CG ASN A 84 6.076 -7.849 18.053 1.00 25.00 C ATOM 1420 OD1 ASN A 84 5.667 -8.933 18.442 1.00 25.00 O ATOM 1421 ND2 ASN A 84 7.333 -7.635 17.802 1.00 25.00 N ATOM 0 H ASN A 84 5.717 -5.466 15.761 1.00 25.00 H new ATOM 0 HA ASN A 84 4.287 -7.849 16.247 1.00 25.00 H new ATOM 0 HB2 ASN A 84 5.707 -5.759 17.825 1.00 25.00 H new ATOM 0 HB3 ASN A 84 4.457 -6.618 18.702 1.00 25.00 H new ATOM 0 HD21 ASN A 84 8.013 -8.385 17.928 1.00 25.00 H new ATOM 0 HD22 ASN A 84 7.639 -6.717 17.479 1.00 25.00 H new ATOM 1428 N LEU A 85 2.657 -5.030 16.668 1.00 25.00 N ATOM 1429 CA LEU A 85 1.334 -4.441 16.881 1.00 25.00 C ATOM 1430 C LEU A 85 0.331 -5.006 15.880 1.00 25.00 C ATOM 1431 O LEU A 85 -0.788 -5.339 16.232 1.00 25.00 O ATOM 1432 CB LEU A 85 1.427 -2.912 16.750 1.00 25.00 C ATOM 1433 CG LEU A 85 0.146 -2.105 17.014 1.00 25.00 C ATOM 1434 CD1 LEU A 85 0.506 -0.802 17.720 1.00 25.00 C ATOM 1435 CD2 LEU A 85 -0.588 -1.780 15.706 1.00 25.00 C ATOM 0 H LEU A 85 3.373 -4.359 16.389 1.00 25.00 H new ATOM 0 HA LEU A 85 0.987 -4.692 17.883 1.00 25.00 H new ATOM 0 HB2 LEU A 85 2.196 -2.560 17.438 1.00 25.00 H new ATOM 0 HB3 LEU A 85 1.771 -2.680 15.742 1.00 25.00 H new ATOM 0 HG LEU A 85 -0.513 -2.708 17.639 1.00 25.00 H new ATOM 0 HD11 LEU A 85 -0.401 -0.228 17.908 1.00 25.00 H new ATOM 0 HD12 LEU A 85 0.998 -1.025 18.667 1.00 25.00 H new ATOM 0 HD13 LEU A 85 1.179 -0.221 17.090 1.00 25.00 H new ATOM 0 HD21 LEU A 85 -1.490 -1.209 15.927 1.00 25.00 H new ATOM 0 HD22 LEU A 85 0.064 -1.193 15.059 1.00 25.00 H new ATOM 0 HD23 LEU A 85 -0.860 -2.707 15.202 1.00 25.00 H new ATOM 1447 N ILE A 86 0.733 -5.148 14.628 1.00 25.00 N ATOM 1448 CA ILE A 86 -0.171 -5.725 13.637 1.00 25.00 C ATOM 1449 C ILE A 86 -0.247 -7.243 13.849 1.00 25.00 C ATOM 1450 O ILE A 86 -1.286 -7.861 13.625 1.00 25.00 O ATOM 1451 CB ILE A 86 0.255 -5.403 12.172 1.00 25.00 C ATOM 1452 CG1 ILE A 86 0.134 -3.892 11.869 1.00 25.00 C ATOM 1453 CG2 ILE A 86 -0.663 -6.132 11.194 1.00 25.00 C ATOM 1454 CD1 ILE A 86 1.374 -3.070 12.179 1.00 25.00 C ATOM 0 H ILE A 86 1.653 -4.881 14.276 1.00 25.00 H new ATOM 0 HA ILE A 86 -1.153 -5.274 13.780 1.00 25.00 H new ATOM 0 HB ILE A 86 1.291 -5.722 12.060 1.00 25.00 H new ATOM 0 HG12 ILE A 86 -0.111 -3.767 10.814 1.00 25.00 H new ATOM 0 HG13 ILE A 86 -0.702 -3.489 12.440 1.00 25.00 H new ATOM 0 HG21 ILE A 86 -0.361 -5.903 10.172 1.00 25.00 H new ATOM 0 HG22 ILE A 86 -0.593 -7.207 11.361 1.00 25.00 H new ATOM 0 HG23 ILE A 86 -1.692 -5.807 11.349 1.00 25.00 H new ATOM 0 HD11 ILE A 86 1.189 -2.025 11.932 1.00 25.00 H new ATOM 0 HD12 ILE A 86 1.612 -3.156 13.239 1.00 25.00 H new ATOM 0 HD13 ILE A 86 2.212 -3.439 11.588 1.00 25.00 H new ATOM 1466 N LYS A 87 0.834 -7.850 14.319 1.00 25.00 N ATOM 1467 CA LYS A 87 0.842 -9.295 14.548 1.00 25.00 C ATOM 1468 C LYS A 87 -0.248 -9.688 15.540 1.00 25.00 C ATOM 1469 O LYS A 87 -0.981 -10.628 15.282 1.00 25.00 O ATOM 1470 CB LYS A 87 2.240 -9.768 14.997 1.00 25.00 C ATOM 1471 CG LYS A 87 2.277 -10.680 16.231 1.00 25.00 C ATOM 1472 CD LYS A 87 3.695 -10.981 16.638 1.00 25.00 C ATOM 1473 CE LYS A 87 3.727 -11.681 17.992 1.00 25.00 C ATOM 1474 NZ LYS A 87 5.128 -11.751 18.530 1.00 25.00 N ATOM 0 H LYS A 87 1.707 -7.376 14.548 1.00 25.00 H new ATOM 0 HA LYS A 87 0.619 -9.802 13.609 1.00 25.00 H new ATOM 0 HB2 LYS A 87 2.708 -10.295 14.166 1.00 25.00 H new ATOM 0 HB3 LYS A 87 2.851 -8.889 15.201 1.00 25.00 H new ATOM 0 HG2 LYS A 87 1.752 -10.201 17.057 1.00 25.00 H new ATOM 0 HG3 LYS A 87 1.751 -11.610 16.016 1.00 25.00 H new ATOM 0 HD2 LYS A 87 4.169 -11.611 15.885 1.00 25.00 H new ATOM 0 HD3 LYS A 87 4.269 -10.056 16.687 1.00 25.00 H new ATOM 0 HE2 LYS A 87 3.090 -11.147 18.697 1.00 25.00 H new ATOM 0 HE3 LYS A 87 3.321 -12.688 17.894 1.00 25.00 H new ATOM 0 HZ1 LYS A 87 5.114 -12.171 19.481 1.00 25.00 H new ATOM 0 HZ2 LYS A 87 5.712 -12.338 17.901 1.00 25.00 H new ATOM 0 HZ3 LYS A 87 5.529 -10.793 18.580 1.00 25.00 H new ATOM 1488 N GLU A 88 -0.396 -8.965 16.639 1.00 25.00 N ATOM 1489 CA GLU A 88 -1.429 -9.316 17.614 1.00 25.00 C ATOM 1490 C GLU A 88 -2.814 -9.009 17.047 1.00 25.00 C ATOM 1491 O GLU A 88 -3.773 -9.726 17.325 1.00 25.00 O ATOM 1492 CB GLU A 88 -1.204 -8.595 18.952 1.00 25.00 C ATOM 1493 CG GLU A 88 -1.166 -7.082 18.854 1.00 25.00 C ATOM 1494 CD GLU A 88 -1.011 -6.408 20.196 1.00 25.00 C ATOM 1495 OE1 GLU A 88 -0.054 -6.718 20.936 1.00 25.00 O ATOM 1496 OE2 GLU A 88 -1.824 -5.516 20.501 1.00 25.00 O ATOM 0 H GLU A 88 0.168 -8.150 16.879 1.00 25.00 H new ATOM 0 HA GLU A 88 -1.365 -10.386 17.810 1.00 25.00 H new ATOM 0 HB2 GLU A 88 -1.997 -8.882 19.642 1.00 25.00 H new ATOM 0 HB3 GLU A 88 -0.265 -8.942 19.384 1.00 25.00 H new ATOM 0 HG2 GLU A 88 -0.340 -6.786 18.207 1.00 25.00 H new ATOM 0 HG3 GLU A 88 -2.083 -6.731 18.381 1.00 25.00 H new ATOM 1503 N LEU A 89 -2.910 -7.984 16.208 1.00 25.00 N ATOM 1504 CA LEU A 89 -4.185 -7.619 15.604 1.00 25.00 C ATOM 1505 C LEU A 89 -4.701 -8.711 14.679 1.00 25.00 C ATOM 1506 O LEU A 89 -5.881 -9.023 14.700 1.00 25.00 O ATOM 1507 CB LEU A 89 -4.076 -6.293 14.845 1.00 25.00 C ATOM 1508 CG LEU A 89 -4.098 -5.017 15.710 1.00 25.00 C ATOM 1509 CD1 LEU A 89 -3.783 -3.800 14.838 1.00 25.00 C ATOM 1510 CD2 LEU A 89 -5.455 -4.806 16.399 1.00 25.00 C ATOM 0 H LEU A 89 -2.125 -7.394 15.932 1.00 25.00 H new ATOM 0 HA LEU A 89 -4.901 -7.498 16.417 1.00 25.00 H new ATOM 0 HB2 LEU A 89 -3.151 -6.302 14.269 1.00 25.00 H new ATOM 0 HB3 LEU A 89 -4.897 -6.238 14.130 1.00 25.00 H new ATOM 0 HG LEU A 89 -3.343 -5.137 16.487 1.00 25.00 H new ATOM 0 HD11 LEU A 89 -3.799 -2.899 15.451 1.00 25.00 H new ATOM 0 HD12 LEU A 89 -2.795 -3.918 14.392 1.00 25.00 H new ATOM 0 HD13 LEU A 89 -4.530 -3.715 14.049 1.00 25.00 H new ATOM 0 HD21 LEU A 89 -5.422 -3.895 16.997 1.00 25.00 H new ATOM 0 HD22 LEU A 89 -6.236 -4.716 15.644 1.00 25.00 H new ATOM 0 HD23 LEU A 89 -5.671 -5.657 17.046 1.00 25.00 H new ATOM 1522 N ILE A 90 -3.830 -9.313 13.882 1.00 25.00 N ATOM 1523 CA ILE A 90 -4.269 -10.379 12.980 1.00 25.00 C ATOM 1524 C ILE A 90 -4.418 -11.694 13.742 1.00 25.00 C ATOM 1525 O ILE A 90 -5.355 -12.448 13.503 1.00 25.00 O ATOM 1526 CB ILE A 90 -3.288 -10.626 11.804 1.00 25.00 C ATOM 1527 CG1 ILE A 90 -3.003 -9.330 11.028 1.00 25.00 C ATOM 1528 CG2 ILE A 90 -3.899 -11.651 10.809 1.00 25.00 C ATOM 1529 CD1 ILE A 90 -1.803 -9.460 10.103 1.00 25.00 C ATOM 0 H ILE A 90 -2.835 -9.091 13.837 1.00 25.00 H new ATOM 0 HA ILE A 90 -5.223 -10.045 12.572 1.00 25.00 H new ATOM 0 HB ILE A 90 -2.360 -11.005 12.232 1.00 25.00 H new ATOM 0 HG12 ILE A 90 -3.882 -9.060 10.443 1.00 25.00 H new ATOM 0 HG13 ILE A 90 -2.828 -8.518 11.734 1.00 25.00 H new ATOM 0 HG21 ILE A 90 -3.204 -11.819 9.986 1.00 25.00 H new ATOM 0 HG22 ILE A 90 -4.084 -12.593 11.325 1.00 25.00 H new ATOM 0 HG23 ILE A 90 -4.838 -11.262 10.416 1.00 25.00 H new ATOM 0 HD11 ILE A 90 -1.644 -8.518 9.578 1.00 25.00 H new ATOM 0 HD12 ILE A 90 -0.917 -9.703 10.689 1.00 25.00 H new ATOM 0 HD13 ILE A 90 -1.987 -10.253 9.378 1.00 25.00 H new ATOM 1541 N ASP A 91 -3.499 -11.977 14.656 1.00 25.00 N ATOM 1542 CA ASP A 91 -3.533 -13.239 15.406 1.00 25.00 C ATOM 1543 C ASP A 91 -4.834 -13.335 16.187 1.00 25.00 C ATOM 1544 O ASP A 91 -5.412 -14.406 16.323 1.00 25.00 O ATOM 1545 CB ASP A 91 -2.335 -13.329 16.362 1.00 25.00 C ATOM 1546 CG ASP A 91 -2.148 -14.723 16.948 1.00 25.00 C ATOM 1547 OD1 ASP A 91 -2.858 -15.075 17.915 1.00 25.00 O ATOM 1548 OD2 ASP A 91 -1.229 -15.447 16.475 1.00 25.00 O ATOM 0 H ASP A 91 -2.724 -11.360 14.899 1.00 25.00 H new ATOM 0 HA ASP A 91 -3.474 -14.069 14.702 1.00 25.00 H new ATOM 0 HB2 ASP A 91 -1.429 -13.040 15.829 1.00 25.00 H new ATOM 0 HB3 ASP A 91 -2.470 -12.614 17.174 1.00 25.00 H new ATOM 1553 N LYS A 92 -5.322 -12.197 16.663 1.00 25.00 N ATOM 1554 CA LYS A 92 -6.564 -12.154 17.429 1.00 25.00 C ATOM 1555 C LYS A 92 -7.653 -11.374 16.698 1.00 25.00 C ATOM 1556 O LYS A 92 -8.513 -10.759 17.329 1.00 25.00 O ATOM 1557 CB LYS A 92 -6.290 -11.558 18.820 1.00 25.00 C ATOM 1558 CG LYS A 92 -5.195 -12.306 19.630 1.00 25.00 C ATOM 1559 CD LYS A 92 -5.755 -13.332 20.639 1.00 25.00 C ATOM 1560 CE LYS A 92 -6.497 -14.516 19.993 1.00 25.00 C ATOM 1561 NZ LYS A 92 -5.661 -15.357 19.054 1.00 25.00 N ATOM 0 H LYS A 92 -4.877 -11.289 16.533 1.00 25.00 H new ATOM 0 HA LYS A 92 -6.934 -13.173 17.545 1.00 25.00 H new ATOM 0 HB2 LYS A 92 -5.992 -10.516 18.704 1.00 25.00 H new ATOM 0 HB3 LYS A 92 -7.217 -11.562 19.394 1.00 25.00 H new ATOM 0 HG2 LYS A 92 -4.530 -12.820 18.935 1.00 25.00 H new ATOM 0 HG3 LYS A 92 -4.591 -11.575 20.167 1.00 25.00 H new ATOM 0 HD2 LYS A 92 -4.932 -13.719 21.241 1.00 25.00 H new ATOM 0 HD3 LYS A 92 -6.435 -12.820 21.320 1.00 25.00 H new ATOM 0 HE2 LYS A 92 -6.885 -15.158 20.784 1.00 25.00 H new ATOM 0 HE3 LYS A 92 -7.357 -14.131 19.444 1.00 25.00 H new ATOM 0 HZ1 LYS A 92 -6.204 -16.194 18.760 1.00 25.00 H new ATOM 0 HZ2 LYS A 92 -5.410 -14.795 18.215 1.00 25.00 H new ATOM 0 HZ3 LYS A 92 -4.793 -15.661 19.540 1.00 25.00 H new ATOM 1575 N LYS A 93 -7.655 -11.435 15.368 1.00 25.00 N ATOM 1576 CA LYS A 93 -8.708 -10.768 14.574 1.00 25.00 C ATOM 1577 C LYS A 93 -10.049 -11.439 14.834 1.00 25.00 C ATOM 1578 O LYS A 93 -11.099 -10.837 14.681 1.00 25.00 O ATOM 1579 CB LYS A 93 -8.378 -10.772 13.070 1.00 25.00 C ATOM 1580 CG LYS A 93 -8.373 -12.148 12.394 1.00 25.00 C ATOM 1581 CD LYS A 93 -7.852 -12.037 10.960 1.00 25.00 C ATOM 1582 CE LYS A 93 -7.686 -13.413 10.315 1.00 25.00 C ATOM 1583 NZ LYS A 93 -7.295 -13.329 8.857 1.00 25.00 N ATOM 0 H LYS A 93 -6.954 -11.929 14.816 1.00 25.00 H new ATOM 0 HA LYS A 93 -8.761 -9.725 14.887 1.00 25.00 H new ATOM 0 HB2 LYS A 93 -9.101 -10.138 12.557 1.00 25.00 H new ATOM 0 HB3 LYS A 93 -7.398 -10.316 12.931 1.00 25.00 H new ATOM 0 HG2 LYS A 93 -7.748 -12.837 12.962 1.00 25.00 H new ATOM 0 HG3 LYS A 93 -9.381 -12.562 12.390 1.00 25.00 H new ATOM 0 HD2 LYS A 93 -8.542 -11.437 10.367 1.00 25.00 H new ATOM 0 HD3 LYS A 93 -6.895 -11.516 10.959 1.00 25.00 H new ATOM 0 HE2 LYS A 93 -6.927 -13.976 10.859 1.00 25.00 H new ATOM 0 HE3 LYS A 93 -8.620 -13.967 10.405 1.00 25.00 H new ATOM 0 HZ1 LYS A 93 -7.163 -14.288 8.477 1.00 25.00 H new ATOM 0 HZ2 LYS A 93 -8.046 -12.846 8.324 1.00 25.00 H new ATOM 0 HZ3 LYS A 93 -6.407 -12.795 8.766 1.00 25.00 H new ATOM 1597 N GLU A 94 -9.980 -12.677 15.296 1.00 25.00 N ATOM 1598 CA GLU A 94 -11.152 -13.479 15.638 1.00 25.00 C ATOM 1599 C GLU A 94 -11.988 -12.888 16.786 1.00 25.00 C ATOM 1600 O GLU A 94 -13.176 -13.159 16.881 1.00 25.00 O ATOM 1601 CB GLU A 94 -10.679 -14.900 15.984 1.00 25.00 C ATOM 1602 CG GLU A 94 -9.674 -14.964 17.151 1.00 25.00 C ATOM 1603 CD GLU A 94 -9.002 -16.326 17.292 1.00 25.00 C ATOM 1604 OE1 GLU A 94 -9.225 -17.211 16.444 1.00 25.00 O ATOM 1605 OE2 GLU A 94 -8.188 -16.479 18.233 1.00 25.00 O ATOM 0 H GLU A 94 -9.097 -13.164 15.448 1.00 25.00 H new ATOM 0 HA GLU A 94 -11.816 -13.489 14.774 1.00 25.00 H new ATOM 0 HB2 GLU A 94 -11.548 -15.509 16.233 1.00 25.00 H new ATOM 0 HB3 GLU A 94 -10.221 -15.344 15.100 1.00 25.00 H new ATOM 0 HG2 GLU A 94 -8.909 -14.202 17.005 1.00 25.00 H new ATOM 0 HG3 GLU A 94 -10.190 -14.723 18.080 1.00 25.00 H new ATOM 1612 N VAL A 95 -11.383 -12.044 17.616 1.00 25.00 N ATOM 1613 CA VAL A 95 -12.110 -11.367 18.704 1.00 25.00 C ATOM 1614 C VAL A 95 -12.034 -9.850 18.527 1.00 25.00 C ATOM 1615 O VAL A 95 -12.431 -9.085 19.397 1.00 25.00 O ATOM 1616 CB VAL A 95 -11.564 -11.772 20.112 1.00 25.00 C ATOM 1617 CG1 VAL A 95 -11.852 -13.254 20.390 1.00 25.00 C ATOM 1618 CG2 VAL A 95 -10.052 -11.507 20.225 1.00 25.00 C ATOM 0 H VAL A 95 -10.392 -11.807 17.563 1.00 25.00 H new ATOM 0 HA VAL A 95 -13.151 -11.686 18.650 1.00 25.00 H new ATOM 0 HB VAL A 95 -12.076 -11.159 20.854 1.00 25.00 H new ATOM 0 HG11 VAL A 95 -11.466 -13.521 21.374 1.00 25.00 H new ATOM 0 HG12 VAL A 95 -12.928 -13.427 20.363 1.00 25.00 H new ATOM 0 HG13 VAL A 95 -11.367 -13.868 19.631 1.00 25.00 H new ATOM 0 HG21 VAL A 95 -9.704 -11.799 21.216 1.00 25.00 H new ATOM 0 HG22 VAL A 95 -9.523 -12.088 19.469 1.00 25.00 H new ATOM 0 HG23 VAL A 95 -9.856 -10.446 20.070 1.00 25.00 H new ATOM 1628 N ASN A 96 -11.534 -9.420 17.377 1.00 25.00 N ATOM 1629 CA ASN A 96 -11.423 -7.995 17.060 1.00 25.00 C ATOM 1630 C ASN A 96 -12.099 -7.712 15.721 1.00 25.00 C ATOM 1631 O ASN A 96 -11.431 -7.599 14.690 1.00 25.00 O ATOM 1632 CB ASN A 96 -9.954 -7.567 17.004 1.00 25.00 C ATOM 1633 CG ASN A 96 -9.409 -7.226 18.353 1.00 25.00 C ATOM 1634 OD1 ASN A 96 -9.684 -6.159 18.879 1.00 25.00 O ATOM 1635 ND2 ASN A 96 -8.628 -8.106 18.915 1.00 25.00 N ATOM 0 H ASN A 96 -11.195 -10.039 16.641 1.00 25.00 H new ATOM 0 HA ASN A 96 -11.919 -7.423 17.844 1.00 25.00 H new ATOM 0 HB2 ASN A 96 -9.361 -8.370 16.568 1.00 25.00 H new ATOM 0 HB3 ASN A 96 -9.855 -6.704 16.346 1.00 25.00 H new ATOM 0 HD21 ASN A 96 -8.220 -7.915 19.830 1.00 25.00 H new ATOM 0 HD22 ASN A 96 -8.425 -8.985 18.439 1.00 25.00 H new ATOM 1642 N PRO A 97 -13.435 -7.554 15.716 1.00 25.00 N ATOM 1643 CA PRO A 97 -14.091 -7.320 14.424 1.00 25.00 C ATOM 1644 C PRO A 97 -13.719 -5.987 13.774 1.00 25.00 C ATOM 1645 O PRO A 97 -13.846 -5.828 12.562 1.00 25.00 O ATOM 1646 CB PRO A 97 -15.580 -7.375 14.781 1.00 25.00 C ATOM 1647 CG PRO A 97 -15.633 -6.946 16.202 1.00 25.00 C ATOM 1648 CD PRO A 97 -14.417 -7.588 16.818 1.00 25.00 C ATOM 0 HA PRO A 97 -13.786 -8.054 13.678 1.00 25.00 H new ATOM 0 HB2 PRO A 97 -16.167 -6.713 14.144 1.00 25.00 H new ATOM 0 HB3 PRO A 97 -15.983 -8.380 14.654 1.00 25.00 H new ATOM 0 HG2 PRO A 97 -15.601 -5.860 16.293 1.00 25.00 H new ATOM 0 HG3 PRO A 97 -16.550 -7.280 16.687 1.00 25.00 H new ATOM 0 HD2 PRO A 97 -14.066 -7.036 17.690 1.00 25.00 H new ATOM 0 HD3 PRO A 97 -14.621 -8.607 17.147 1.00 25.00 H new ATOM 1656 N GLN A 98 -13.206 -5.055 14.571 1.00 25.00 N ATOM 1657 CA GLN A 98 -12.791 -3.753 14.066 1.00 25.00 C ATOM 1658 C GLN A 98 -11.664 -3.950 13.066 1.00 25.00 C ATOM 1659 O GLN A 98 -11.677 -3.380 11.974 1.00 25.00 O ATOM 1660 CB GLN A 98 -12.338 -2.828 15.219 1.00 25.00 C ATOM 1661 CG GLN A 98 -11.405 -3.470 16.280 1.00 25.00 C ATOM 1662 CD GLN A 98 -11.033 -2.500 17.381 1.00 25.00 C ATOM 1663 OE1 GLN A 98 -10.818 -1.326 17.136 1.00 25.00 O ATOM 1664 NE2 GLN A 98 -10.932 -2.991 18.589 1.00 25.00 N ATOM 0 H GLN A 98 -13.068 -5.179 15.574 1.00 25.00 H new ATOM 0 HA GLN A 98 -13.638 -3.273 13.576 1.00 25.00 H new ATOM 0 HB2 GLN A 98 -11.827 -1.967 14.788 1.00 25.00 H new ATOM 0 HB3 GLN A 98 -13.226 -2.451 15.726 1.00 25.00 H new ATOM 0 HG2 GLN A 98 -11.898 -4.339 16.716 1.00 25.00 H new ATOM 0 HG3 GLN A 98 -10.498 -3.829 15.793 1.00 25.00 H new ATOM 0 HE21 GLN A 98 -11.120 -3.980 18.755 1.00 25.00 H new ATOM 0 HE22 GLN A 98 -10.665 -2.385 19.365 1.00 25.00 H new ATOM 1673 N VAL A 99 -10.689 -4.771 13.430 1.00 25.00 N ATOM 1674 CA VAL A 99 -9.572 -5.006 12.546 1.00 25.00 C ATOM 1675 C VAL A 99 -9.886 -6.099 11.536 1.00 25.00 C ATOM 1676 O VAL A 99 -9.393 -6.050 10.441 1.00 25.00 O ATOM 1677 CB VAL A 99 -8.244 -5.270 13.313 1.00 25.00 C ATOM 1678 CG1 VAL A 99 -8.144 -6.713 13.807 1.00 25.00 C ATOM 1679 CG2 VAL A 99 -7.045 -4.921 12.420 1.00 25.00 C ATOM 0 H VAL A 99 -10.654 -5.274 14.316 1.00 25.00 H new ATOM 0 HA VAL A 99 -9.411 -4.085 11.986 1.00 25.00 H new ATOM 0 HB VAL A 99 -8.236 -4.628 14.194 1.00 25.00 H new ATOM 0 HG11 VAL A 99 -7.201 -6.852 14.336 1.00 25.00 H new ATOM 0 HG12 VAL A 99 -8.974 -6.925 14.481 1.00 25.00 H new ATOM 0 HG13 VAL A 99 -8.186 -7.393 12.956 1.00 25.00 H new ATOM 0 HG21 VAL A 99 -6.119 -5.108 12.964 1.00 25.00 H new ATOM 0 HG22 VAL A 99 -7.069 -5.537 11.521 1.00 25.00 H new ATOM 0 HG23 VAL A 99 -7.094 -3.869 12.140 1.00 25.00 H new ATOM 1689 N MET A 100 -10.737 -7.058 11.875 1.00 25.00 N ATOM 1690 CA MET A 100 -11.080 -8.135 10.937 1.00 25.00 C ATOM 1691 C MET A 100 -11.679 -7.569 9.653 1.00 25.00 C ATOM 1692 O MET A 100 -11.315 -7.984 8.555 1.00 25.00 O ATOM 1693 CB MET A 100 -12.054 -9.115 11.595 1.00 25.00 C ATOM 1694 CG MET A 100 -12.595 -10.205 10.672 1.00 25.00 C ATOM 1695 SD MET A 100 -11.305 -11.153 9.840 1.00 25.00 S ATOM 1696 CE MET A 100 -11.960 -11.166 8.141 1.00 25.00 C ATOM 0 H MET A 100 -11.202 -7.119 12.781 1.00 25.00 H new ATOM 0 HA MET A 100 -10.166 -8.668 10.676 1.00 25.00 H new ATOM 0 HB2 MET A 100 -11.553 -9.590 12.439 1.00 25.00 H new ATOM 0 HB3 MET A 100 -12.895 -8.552 11.999 1.00 25.00 H new ATOM 0 HG2 MET A 100 -13.217 -10.886 11.253 1.00 25.00 H new ATOM 0 HG3 MET A 100 -13.239 -9.747 9.921 1.00 25.00 H new ATOM 0 HE1 MET A 100 -11.671 -12.094 7.647 1.00 25.00 H new ATOM 0 HE2 MET A 100 -13.047 -11.094 8.170 1.00 25.00 H new ATOM 0 HE3 MET A 100 -11.554 -10.319 7.588 1.00 25.00 H new ATOM 1706 N ALA A 101 -12.537 -6.570 9.772 1.00 25.00 N ATOM 1707 CA ALA A 101 -13.093 -5.938 8.585 1.00 25.00 C ATOM 1708 C ALA A 101 -11.980 -5.249 7.778 1.00 25.00 C ATOM 1709 O ALA A 101 -12.024 -5.212 6.558 1.00 25.00 O ATOM 1710 CB ALA A 101 -14.169 -4.927 8.989 1.00 25.00 C ATOM 0 H ALA A 101 -12.860 -6.184 10.659 1.00 25.00 H new ATOM 0 HA ALA A 101 -13.550 -6.702 7.956 1.00 25.00 H new ATOM 0 HB1 ALA A 101 -14.581 -4.458 8.096 1.00 25.00 H new ATOM 0 HB2 ALA A 101 -14.965 -5.439 9.530 1.00 25.00 H new ATOM 0 HB3 ALA A 101 -13.728 -4.163 9.630 1.00 25.00 H new ATOM 1716 N ALA A 102 -10.973 -4.736 8.470 1.00 25.00 N ATOM 1717 CA ALA A 102 -9.869 -4.036 7.830 1.00 25.00 C ATOM 1718 C ALA A 102 -8.953 -5.047 7.131 1.00 25.00 C ATOM 1719 O ALA A 102 -8.370 -4.752 6.101 1.00 25.00 O ATOM 1720 CB ALA A 102 -9.088 -3.225 8.887 1.00 25.00 C ATOM 0 H ALA A 102 -10.898 -4.793 9.486 1.00 25.00 H new ATOM 0 HA ALA A 102 -10.256 -3.346 7.080 1.00 25.00 H new ATOM 0 HB1 ALA A 102 -8.262 -2.701 8.406 1.00 25.00 H new ATOM 0 HB2 ALA A 102 -9.754 -2.500 9.354 1.00 25.00 H new ATOM 0 HB3 ALA A 102 -8.696 -3.901 9.647 1.00 25.00 H new ATOM 1726 N VAL A 103 -8.853 -6.248 7.684 1.00 25.00 N ATOM 1727 CA VAL A 103 -8.049 -7.318 7.087 1.00 25.00 C ATOM 1728 C VAL A 103 -8.653 -7.685 5.743 1.00 25.00 C ATOM 1729 O VAL A 103 -7.945 -7.792 4.740 1.00 25.00 O ATOM 1730 CB VAL A 103 -8.030 -8.585 8.005 1.00 25.00 C ATOM 1731 CG1 VAL A 103 -7.361 -9.764 7.313 1.00 25.00 C ATOM 1732 CG2 VAL A 103 -7.300 -8.280 9.322 1.00 25.00 C ATOM 0 H VAL A 103 -9.320 -6.512 8.551 1.00 25.00 H new ATOM 0 HA VAL A 103 -7.024 -6.966 6.968 1.00 25.00 H new ATOM 0 HB VAL A 103 -9.065 -8.853 8.216 1.00 25.00 H new ATOM 0 HG11 VAL A 103 -7.365 -10.627 7.979 1.00 25.00 H new ATOM 0 HG12 VAL A 103 -7.905 -10.007 6.401 1.00 25.00 H new ATOM 0 HG13 VAL A 103 -6.332 -9.503 7.063 1.00 25.00 H new ATOM 0 HG21 VAL A 103 -7.295 -9.171 9.950 1.00 25.00 H new ATOM 0 HG22 VAL A 103 -6.274 -7.981 9.108 1.00 25.00 H new ATOM 0 HG23 VAL A 103 -7.813 -7.472 9.843 1.00 25.00 H new ATOM 1742 N ALA A 104 -9.969 -7.841 5.722 1.00 25.00 N ATOM 1743 CA ALA A 104 -10.674 -8.190 4.498 1.00 25.00 C ATOM 1744 C ALA A 104 -10.529 -7.059 3.480 1.00 25.00 C ATOM 1745 O ALA A 104 -10.189 -7.295 2.329 1.00 25.00 O ATOM 1746 CB ALA A 104 -12.144 -8.461 4.810 1.00 25.00 C ATOM 0 H ALA A 104 -10.570 -7.731 6.539 1.00 25.00 H new ATOM 0 HA ALA A 104 -10.242 -9.095 4.070 1.00 25.00 H new ATOM 0 HB1 ALA A 104 -12.669 -8.722 3.891 1.00 25.00 H new ATOM 0 HB2 ALA A 104 -12.220 -9.286 5.518 1.00 25.00 H new ATOM 0 HB3 ALA A 104 -12.594 -7.568 5.244 1.00 25.00 H new ATOM 1752 N GLN A 105 -10.715 -5.829 3.935 1.00 25.00 N ATOM 1753 CA GLN A 105 -10.569 -4.662 3.072 1.00 25.00 C ATOM 1754 C GLN A 105 -9.162 -4.566 2.496 1.00 25.00 C ATOM 1755 O GLN A 105 -8.987 -4.205 1.343 1.00 25.00 O ATOM 1756 CB GLN A 105 -10.873 -3.392 3.866 1.00 25.00 C ATOM 1757 CG GLN A 105 -12.360 -3.154 4.092 1.00 25.00 C ATOM 1758 CD GLN A 105 -12.618 -2.025 5.067 1.00 25.00 C ATOM 1759 OE1 GLN A 105 -11.781 -1.696 5.893 1.00 25.00 O ATOM 1760 NE2 GLN A 105 -13.772 -1.421 4.969 1.00 25.00 N ATOM 0 H GLN A 105 -10.968 -5.611 4.899 1.00 25.00 H new ATOM 0 HA GLN A 105 -11.273 -4.768 2.246 1.00 25.00 H new ATOM 0 HB2 GLN A 105 -10.372 -3.449 4.832 1.00 25.00 H new ATOM 0 HB3 GLN A 105 -10.453 -2.535 3.339 1.00 25.00 H new ATOM 0 HG2 GLN A 105 -12.838 -2.925 3.140 1.00 25.00 H new ATOM 0 HG3 GLN A 105 -12.819 -4.068 4.468 1.00 25.00 H new ATOM 0 HE21 GLN A 105 -14.447 -1.723 4.267 1.00 25.00 H new ATOM 0 HE22 GLN A 105 -13.998 -0.648 5.595 1.00 25.00 H new ATOM 1769 N THR A 106 -8.148 -4.893 3.281 1.00 25.00 N ATOM 1770 CA THR A 106 -6.783 -4.808 2.784 1.00 25.00 C ATOM 1771 C THR A 106 -6.560 -5.878 1.720 1.00 25.00 C ATOM 1772 O THR A 106 -5.949 -5.600 0.701 1.00 25.00 O ATOM 1773 CB THR A 106 -5.745 -4.952 3.912 1.00 25.00 C ATOM 1774 OG1 THR A 106 -6.050 -4.040 4.960 1.00 25.00 O ATOM 1775 CG2 THR A 106 -4.351 -4.605 3.428 1.00 25.00 C ATOM 0 H THR A 106 -8.239 -5.213 4.245 1.00 25.00 H new ATOM 0 HA THR A 106 -6.647 -3.819 2.347 1.00 25.00 H new ATOM 0 HB THR A 106 -5.778 -5.988 4.251 1.00 25.00 H new ATOM 0 HG1 THR A 106 -6.882 -4.314 5.400 1.00 25.00 H new ATOM 0 HG21 THR A 106 -3.643 -4.717 4.249 1.00 25.00 H new ATOM 0 HG22 THR A 106 -4.072 -5.274 2.614 1.00 25.00 H new ATOM 0 HG23 THR A 106 -4.335 -3.575 3.073 1.00 25.00 H new ATOM 1783 N GLU A 107 -7.094 -7.078 1.912 1.00 25.00 N ATOM 1784 CA GLU A 107 -6.973 -8.116 0.882 1.00 25.00 C ATOM 1785 C GLU A 107 -7.669 -7.685 -0.406 1.00 25.00 C ATOM 1786 O GLU A 107 -7.145 -7.900 -1.493 1.00 25.00 O ATOM 1787 CB GLU A 107 -7.582 -9.446 1.332 1.00 25.00 C ATOM 1788 CG GLU A 107 -6.678 -10.277 2.228 1.00 25.00 C ATOM 1789 CD GLU A 107 -7.151 -11.727 2.366 1.00 25.00 C ATOM 1790 OE1 GLU A 107 -7.920 -12.208 1.500 1.00 25.00 O ATOM 1791 OE2 GLU A 107 -6.695 -12.408 3.316 1.00 25.00 O ATOM 0 H GLU A 107 -7.605 -7.358 2.749 1.00 25.00 H new ATOM 0 HA GLU A 107 -5.906 -8.254 0.709 1.00 25.00 H new ATOM 0 HB2 GLU A 107 -8.513 -9.245 1.862 1.00 25.00 H new ATOM 0 HB3 GLU A 107 -7.837 -10.032 0.449 1.00 25.00 H new ATOM 0 HG2 GLU A 107 -5.665 -10.267 1.825 1.00 25.00 H new ATOM 0 HG3 GLU A 107 -6.632 -9.819 3.216 1.00 25.00 H new ATOM 1798 N GLU A 108 -8.836 -7.069 -0.286 1.00 25.00 N ATOM 1799 CA GLU A 108 -9.587 -6.599 -1.455 1.00 25.00 C ATOM 1800 C GLU A 108 -8.763 -5.572 -2.224 1.00 25.00 C ATOM 1801 O GLU A 108 -8.649 -5.633 -3.446 1.00 25.00 O ATOM 1802 CB GLU A 108 -10.899 -5.941 -1.012 1.00 25.00 C ATOM 1803 CG GLU A 108 -11.932 -6.906 -0.436 1.00 25.00 C ATOM 1804 CD GLU A 108 -12.980 -6.195 0.427 1.00 25.00 C ATOM 1805 OE1 GLU A 108 -13.053 -4.942 0.394 1.00 25.00 O ATOM 1806 OE2 GLU A 108 -13.716 -6.893 1.157 1.00 25.00 O ATOM 0 H GLU A 108 -9.289 -6.880 0.608 1.00 25.00 H new ATOM 0 HA GLU A 108 -9.803 -7.456 -2.093 1.00 25.00 H new ATOM 0 HB2 GLU A 108 -10.674 -5.181 -0.264 1.00 25.00 H new ATOM 0 HB3 GLU A 108 -11.339 -5.427 -1.867 1.00 25.00 H new ATOM 0 HG2 GLU A 108 -12.431 -7.429 -1.252 1.00 25.00 H new ATOM 0 HG3 GLU A 108 -11.424 -7.662 0.163 1.00 25.00 H new ATOM 1813 N ILE A 109 -8.176 -4.634 -1.497 1.00 25.00 N ATOM 1814 CA ILE A 109 -7.379 -3.572 -2.105 1.00 25.00 C ATOM 1815 C ILE A 109 -6.108 -4.152 -2.725 1.00 25.00 C ATOM 1816 O ILE A 109 -5.725 -3.757 -3.813 1.00 25.00 O ATOM 1817 CB ILE A 109 -7.046 -2.465 -1.058 1.00 25.00 C ATOM 1818 CG1 ILE A 109 -8.354 -1.770 -0.622 1.00 25.00 C ATOM 1819 CG2 ILE A 109 -6.071 -1.409 -1.648 1.00 25.00 C ATOM 1820 CD1 ILE A 109 -8.262 -1.018 0.706 1.00 25.00 C ATOM 0 H ILE A 109 -8.235 -4.584 -0.480 1.00 25.00 H new ATOM 0 HA ILE A 109 -7.962 -3.109 -2.901 1.00 25.00 H new ATOM 0 HB ILE A 109 -6.563 -2.934 -0.201 1.00 25.00 H new ATOM 0 HG12 ILE A 109 -8.655 -1.070 -1.401 1.00 25.00 H new ATOM 0 HG13 ILE A 109 -9.141 -2.520 -0.546 1.00 25.00 H new ATOM 0 HG21 ILE A 109 -5.857 -0.650 -0.895 1.00 25.00 H new ATOM 0 HG22 ILE A 109 -5.143 -1.897 -1.945 1.00 25.00 H new ATOM 0 HG23 ILE A 109 -6.528 -0.938 -2.518 1.00 25.00 H new ATOM 0 HD11 ILE A 109 -9.225 -0.561 0.933 1.00 25.00 H new ATOM 0 HD12 ILE A 109 -7.994 -1.714 1.501 1.00 25.00 H new ATOM 0 HD13 ILE A 109 -7.501 -0.241 0.632 1.00 25.00 H new ATOM 1832 N LEU A 110 -5.484 -5.124 -2.076 1.00 25.00 N ATOM 1833 CA LEU A 110 -4.284 -5.762 -2.630 1.00 25.00 C ATOM 1834 C LEU A 110 -4.581 -6.430 -3.963 1.00 25.00 C ATOM 1835 O LEU A 110 -3.783 -6.354 -4.887 1.00 25.00 O ATOM 1836 CB LEU A 110 -3.745 -6.825 -1.665 1.00 25.00 C ATOM 1837 CG LEU A 110 -2.547 -6.427 -0.794 1.00 25.00 C ATOM 1838 CD1 LEU A 110 -2.700 -5.079 -0.094 1.00 25.00 C ATOM 1839 CD2 LEU A 110 -2.315 -7.526 0.244 1.00 25.00 C ATOM 0 H LEU A 110 -5.781 -5.491 -1.172 1.00 25.00 H new ATOM 0 HA LEU A 110 -3.541 -4.978 -2.776 1.00 25.00 H new ATOM 0 HB2 LEU A 110 -4.558 -7.128 -1.006 1.00 25.00 H new ATOM 0 HB3 LEU A 110 -3.464 -7.702 -2.248 1.00 25.00 H new ATOM 0 HG LEU A 110 -1.692 -6.316 -1.461 1.00 25.00 H new ATOM 0 HD11 LEU A 110 -1.810 -4.875 0.500 1.00 25.00 H new ATOM 0 HD12 LEU A 110 -2.827 -4.294 -0.840 1.00 25.00 H new ATOM 0 HD13 LEU A 110 -3.573 -5.105 0.558 1.00 25.00 H new ATOM 0 HD21 LEU A 110 -1.466 -7.259 0.873 1.00 25.00 H new ATOM 0 HD22 LEU A 110 -3.205 -7.635 0.864 1.00 25.00 H new ATOM 0 HD23 LEU A 110 -2.109 -8.468 -0.264 1.00 25.00 H new ATOM 1851 N LYS A 111 -5.734 -7.075 -4.054 1.00 25.00 N ATOM 1852 CA LYS A 111 -6.132 -7.789 -5.271 1.00 25.00 C ATOM 1853 C LYS A 111 -6.558 -6.826 -6.377 1.00 25.00 C ATOM 1854 O LYS A 111 -6.482 -7.150 -7.553 1.00 25.00 O ATOM 1855 CB LYS A 111 -7.246 -8.760 -4.940 1.00 25.00 C ATOM 1856 CG LYS A 111 -6.741 -9.889 -4.054 1.00 25.00 C ATOM 1857 CD LYS A 111 -7.874 -10.543 -3.351 1.00 25.00 C ATOM 1858 CE LYS A 111 -7.355 -11.414 -2.210 1.00 25.00 C ATOM 1859 NZ LYS A 111 -8.440 -11.949 -1.320 1.00 25.00 N ATOM 0 H LYS A 111 -6.418 -7.122 -3.299 1.00 25.00 H new ATOM 0 HA LYS A 111 -5.271 -8.341 -5.647 1.00 25.00 H new ATOM 0 HB2 LYS A 111 -8.055 -8.232 -4.436 1.00 25.00 H new ATOM 0 HB3 LYS A 111 -7.659 -9.172 -5.861 1.00 25.00 H new ATOM 0 HG2 LYS A 111 -6.208 -10.623 -4.658 1.00 25.00 H new ATOM 0 HG3 LYS A 111 -6.030 -9.498 -3.326 1.00 25.00 H new ATOM 0 HD2 LYS A 111 -8.554 -9.786 -2.960 1.00 25.00 H new ATOM 0 HD3 LYS A 111 -8.444 -11.152 -4.053 1.00 25.00 H new ATOM 0 HE2 LYS A 111 -6.795 -12.250 -2.628 1.00 25.00 H new ATOM 0 HE3 LYS A 111 -6.657 -10.832 -1.608 1.00 25.00 H new ATOM 0 HZ1 LYS A 111 -8.084 -12.024 -0.346 1.00 25.00 H new ATOM 0 HZ2 LYS A 111 -9.256 -11.305 -1.342 1.00 25.00 H new ATOM 0 HZ3 LYS A 111 -8.732 -12.889 -1.656 1.00 25.00 H new ATOM 1873 N SER A 112 -7.021 -5.651 -5.980 1.00 25.00 N ATOM 1874 CA SER A 112 -7.443 -4.610 -6.921 1.00 25.00 C ATOM 1875 C SER A 112 -6.275 -3.775 -7.440 1.00 25.00 C ATOM 1876 O SER A 112 -6.398 -3.077 -8.448 1.00 25.00 O ATOM 1877 CB SER A 112 -8.424 -3.671 -6.226 1.00 25.00 C ATOM 1878 OG SER A 112 -9.001 -2.762 -7.149 1.00 25.00 O ATOM 0 H SER A 112 -7.117 -5.387 -5.000 1.00 25.00 H new ATOM 0 HA SER A 112 -7.902 -5.116 -7.770 1.00 25.00 H new ATOM 0 HB2 SER A 112 -9.210 -4.253 -5.744 1.00 25.00 H new ATOM 0 HB3 SER A 112 -7.909 -3.118 -5.440 1.00 25.00 H new ATOM 0 HG SER A 112 -8.363 -2.579 -7.870 1.00 25.00 H new ATOM 1884 N ASN A 113 -5.184 -3.780 -6.692 1.00 25.00 N ATOM 1885 CA ASN A 113 -4.034 -2.915 -6.970 1.00 25.00 C ATOM 1886 C ASN A 113 -2.896 -3.733 -7.602 1.00 25.00 C ATOM 1887 O ASN A 113 -3.117 -4.816 -8.125 1.00 25.00 O ATOM 1888 CB ASN A 113 -3.570 -2.224 -5.667 1.00 25.00 C ATOM 1889 CG ASN A 113 -4.525 -1.134 -5.201 1.00 25.00 C ATOM 1890 OD1 ASN A 113 -5.653 -1.015 -5.653 1.00 25.00 O ATOM 1891 ND2 ASN A 113 -4.053 -0.309 -4.310 1.00 25.00 N ATOM 0 H ASN A 113 -5.064 -4.380 -5.876 1.00 25.00 H new ATOM 0 HA ASN A 113 -4.327 -2.142 -7.681 1.00 25.00 H new ATOM 0 HB2 ASN A 113 -3.470 -2.972 -4.881 1.00 25.00 H new ATOM 0 HB3 ASN A 113 -2.582 -1.792 -5.823 1.00 25.00 H new ATOM 0 HD21 ASN A 113 -4.630 0.461 -3.972 1.00 25.00 H new ATOM 0 HD22 ASN A 113 -3.107 -0.433 -3.950 1.00 25.00 H new ATOM 1898 N SER A 114 -1.682 -3.198 -7.569 1.00 25.00 N ATOM 1899 CA SER A 114 -0.524 -3.841 -8.186 1.00 25.00 C ATOM 1900 C SER A 114 0.700 -3.682 -7.290 1.00 25.00 C ATOM 1901 O SER A 114 0.744 -2.797 -6.423 1.00 25.00 O ATOM 1902 CB SER A 114 -0.255 -3.193 -9.551 1.00 25.00 C ATOM 1903 OG SER A 114 0.918 -3.714 -10.161 1.00 25.00 O ATOM 0 H SER A 114 -1.471 -2.309 -7.116 1.00 25.00 H new ATOM 0 HA SER A 114 -0.728 -4.904 -8.318 1.00 25.00 H new ATOM 0 HB2 SER A 114 -1.110 -3.359 -10.207 1.00 25.00 H new ATOM 0 HB3 SER A 114 -0.152 -2.115 -9.428 1.00 25.00 H new ATOM 0 HG SER A 114 1.493 -2.975 -10.449 1.00 25.00 H new ATOM 1909 N GLN A 115 1.715 -4.505 -7.528 1.00 25.00 N ATOM 1910 CA GLN A 115 2.990 -4.394 -6.822 1.00 25.00 C ATOM 1911 C GLN A 115 3.620 -3.043 -7.148 1.00 25.00 C ATOM 1912 O GLN A 115 4.250 -2.413 -6.300 1.00 25.00 O ATOM 1913 CB GLN A 115 3.958 -5.492 -7.277 1.00 25.00 C ATOM 1914 CG GLN A 115 3.546 -6.908 -6.912 1.00 25.00 C ATOM 1915 CD GLN A 115 4.529 -7.928 -7.457 1.00 25.00 C ATOM 1916 OE1 GLN A 115 4.719 -8.039 -8.658 1.00 25.00 O ATOM 1917 NE2 GLN A 115 5.180 -8.646 -6.584 1.00 25.00 N ATOM 0 H GLN A 115 1.680 -5.263 -8.210 1.00 25.00 H new ATOM 0 HA GLN A 115 2.805 -4.494 -5.753 1.00 25.00 H new ATOM 0 HB2 GLN A 115 4.069 -5.431 -8.360 1.00 25.00 H new ATOM 0 HB3 GLN A 115 4.938 -5.293 -6.844 1.00 25.00 H new ATOM 0 HG2 GLN A 115 3.484 -7.003 -5.828 1.00 25.00 H new ATOM 0 HG3 GLN A 115 2.551 -7.112 -7.307 1.00 25.00 H new ATOM 0 HE21 GLN A 115 4.996 -8.528 -5.588 1.00 25.00 H new ATOM 0 HE22 GLN A 115 5.873 -9.326 -6.898 1.00 25.00 H new ATOM 1926 N THR A 116 3.457 -2.611 -8.390 1.00 25.00 N ATOM 1927 CA THR A 116 4.008 -1.350 -8.859 1.00 25.00 C ATOM 1928 C THR A 116 3.043 -0.739 -9.866 1.00 25.00 C ATOM 1929 O THR A 116 2.538 -1.425 -10.747 1.00 25.00 O ATOM 1930 CB THR A 116 5.385 -1.578 -9.528 1.00 25.00 C ATOM 1931 OG1 THR A 116 6.272 -2.178 -8.580 1.00 25.00 O ATOM 1932 CG2 THR A 116 6.012 -0.277 -9.985 1.00 25.00 C ATOM 0 H THR A 116 2.938 -3.126 -9.101 1.00 25.00 H new ATOM 0 HA THR A 116 4.143 -0.677 -8.013 1.00 25.00 H new ATOM 0 HB THR A 116 5.227 -2.219 -10.395 1.00 25.00 H new ATOM 0 HG1 THR A 116 7.146 -2.327 -8.998 1.00 25.00 H new ATOM 0 HG21 THR A 116 6.977 -0.481 -10.449 1.00 25.00 H new ATOM 0 HG22 THR A 116 5.357 0.208 -10.709 1.00 25.00 H new ATOM 0 HG23 THR A 116 6.154 0.380 -9.127 1.00 25.00 H new ATOM 1940 N ASP A 117 2.813 0.555 -9.723 1.00 25.00 N ATOM 1941 CA ASP A 117 1.969 1.335 -10.622 1.00 25.00 C ATOM 1942 C ASP A 117 2.550 2.737 -10.509 1.00 25.00 C ATOM 1943 O ASP A 117 3.292 2.995 -9.553 1.00 25.00 O ATOM 1944 CB ASP A 117 0.507 1.319 -10.162 1.00 25.00 C ATOM 1945 CG ASP A 117 -0.403 2.102 -11.096 1.00 25.00 C ATOM 1946 OD1 ASP A 117 -0.053 2.247 -12.291 1.00 25.00 O ATOM 1947 OD2 ASP A 117 -1.406 2.655 -10.614 1.00 25.00 O ATOM 0 H ASP A 117 3.214 1.107 -8.965 1.00 25.00 H new ATOM 0 HA ASP A 117 1.962 0.948 -11.641 1.00 25.00 H new ATOM 0 HB2 ASP A 117 0.159 0.288 -10.101 1.00 25.00 H new ATOM 0 HB3 ASP A 117 0.440 1.738 -9.158 1.00 25.00 H new ATOM 1952 N LEU A 118 2.221 3.616 -11.451 1.00 25.00 N ATOM 1953 CA LEU A 118 2.667 5.005 -11.507 1.00 25.00 C ATOM 1954 C LEU A 118 4.188 5.209 -11.574 1.00 25.00 C ATOM 1955 O LEU A 118 4.983 4.301 -11.321 1.00 25.00 O ATOM 1956 CB LEU A 118 2.085 5.794 -10.333 1.00 25.00 C ATOM 1957 CG LEU A 118 0.591 5.620 -10.001 1.00 25.00 C ATOM 1958 CD1 LEU A 118 0.260 6.439 -8.752 1.00 25.00 C ATOM 1959 CD2 LEU A 118 -0.307 6.060 -11.158 1.00 25.00 C ATOM 0 H LEU A 118 1.610 3.369 -12.230 1.00 25.00 H new ATOM 0 HA LEU A 118 2.288 5.382 -12.457 1.00 25.00 H new ATOM 0 HB2 LEU A 118 2.656 5.532 -9.442 1.00 25.00 H new ATOM 0 HB3 LEU A 118 2.261 6.852 -10.525 1.00 25.00 H new ATOM 0 HG LEU A 118 0.403 4.561 -9.825 1.00 25.00 H new ATOM 0 HD11 LEU A 118 -0.796 6.322 -8.509 1.00 25.00 H new ATOM 0 HD12 LEU A 118 0.865 6.089 -7.916 1.00 25.00 H new ATOM 0 HD13 LEU A 118 0.475 7.491 -8.939 1.00 25.00 H new ATOM 0 HD21 LEU A 118 -1.352 5.920 -10.881 1.00 25.00 H new ATOM 0 HD22 LEU A 118 -0.127 7.112 -11.378 1.00 25.00 H new ATOM 0 HD23 LEU A 118 -0.083 5.461 -12.041 1.00 25.00 H new ATOM 1971 N GLU A 119 4.599 6.425 -11.904 1.00 25.00 N ATOM 1972 CA GLU A 119 6.022 6.746 -12.017 1.00 25.00 C ATOM 1973 C GLU A 119 6.720 6.900 -10.662 1.00 25.00 C ATOM 1974 O GLU A 119 7.149 7.987 -10.277 1.00 25.00 O ATOM 1975 CB GLU A 119 6.235 8.019 -12.835 1.00 25.00 C ATOM 1976 CG GLU A 119 5.895 7.861 -14.300 1.00 25.00 C ATOM 1977 CD GLU A 119 6.698 8.819 -15.160 1.00 25.00 C ATOM 1978 OE1 GLU A 119 7.954 8.683 -15.180 1.00 25.00 O ATOM 1979 OE2 GLU A 119 6.099 9.710 -15.792 1.00 25.00 O ATOM 0 H GLU A 119 3.973 7.206 -12.098 1.00 25.00 H new ATOM 0 HA GLU A 119 6.473 5.894 -12.526 1.00 25.00 H new ATOM 0 HB2 GLU A 119 5.625 8.818 -12.413 1.00 25.00 H new ATOM 0 HB3 GLU A 119 7.276 8.330 -12.744 1.00 25.00 H new ATOM 0 HG2 GLU A 119 6.093 6.836 -14.613 1.00 25.00 H new ATOM 0 HG3 GLU A 119 4.830 8.040 -14.450 1.00 25.00 H new ATOM 1986 N HIS A 120 6.919 5.787 -9.972 1.00 25.00 N ATOM 1987 CA HIS A 120 7.718 5.766 -8.741 1.00 25.00 C ATOM 1988 C HIS A 120 9.203 5.720 -9.130 1.00 25.00 C ATOM 1989 O HIS A 120 9.952 4.826 -8.730 1.00 25.00 O ATOM 1990 CB HIS A 120 7.326 4.575 -7.858 1.00 25.00 C ATOM 1991 CG HIS A 120 5.999 4.744 -7.180 1.00 25.00 C ATOM 1992 ND1 HIS A 120 4.780 4.375 -7.753 1.00 25.00 N ATOM 1993 CD2 HIS A 120 5.665 5.238 -5.956 1.00 25.00 C ATOM 1994 CE1 HIS A 120 3.803 4.643 -6.897 1.00 25.00 C ATOM 1995 NE2 HIS A 120 4.313 5.162 -5.813 1.00 25.00 N ATOM 0 H HIS A 120 6.539 4.879 -10.240 1.00 25.00 H new ATOM 0 HA HIS A 120 7.529 6.665 -8.155 1.00 25.00 H new ATOM 0 HB2 HIS A 120 7.301 3.673 -8.469 1.00 25.00 H new ATOM 0 HB3 HIS A 120 8.096 4.426 -7.101 1.00 25.00 H new ATOM 0 HD1 HIS A 120 4.660 3.966 -8.680 1.00 25.00 H new ATOM 0 HD2 HIS A 120 6.356 5.625 -5.222 1.00 25.00 H new ATOM 0 HE1 HIS A 120 2.753 4.461 -7.069 1.00 25.00 H new ATOM 2003 N HIS A 121 9.606 6.701 -9.929 1.00 25.00 N ATOM 2004 CA HIS A 121 10.954 6.815 -10.503 1.00 25.00 C ATOM 2005 C HIS A 121 12.036 7.222 -9.481 1.00 25.00 C ATOM 2006 O HIS A 121 13.094 7.713 -9.856 1.00 25.00 O ATOM 2007 CB HIS A 121 10.896 7.865 -11.634 1.00 25.00 C ATOM 2008 CG HIS A 121 11.788 7.563 -12.801 1.00 25.00 C ATOM 2009 ND1 HIS A 121 11.328 7.475 -14.122 1.00 25.00 N ATOM 2010 CD2 HIS A 121 13.130 7.348 -12.890 1.00 25.00 C ATOM 2011 CE1 HIS A 121 12.360 7.209 -14.916 1.00 25.00 C ATOM 2012 NE2 HIS A 121 13.449 7.131 -14.195 1.00 25.00 N ATOM 0 H HIS A 121 8.990 7.465 -10.207 1.00 25.00 H new ATOM 0 HA HIS A 121 11.243 5.829 -10.868 1.00 25.00 H new ATOM 0 HB2 HIS A 121 9.868 7.945 -11.988 1.00 25.00 H new ATOM 0 HB3 HIS A 121 11.169 8.838 -11.225 1.00 25.00 H new ATOM 0 HD2 HIS A 121 13.825 7.349 -12.063 1.00 25.00 H new ATOM 0 HE1 HIS A 121 12.308 7.078 -15.987 1.00 25.00 H new ATOM 0 HE2 HIS A 121 14.385 6.939 -14.553 1.00 25.00 H new ATOM 2020 N HIS A 122 11.770 7.035 -8.194 1.00 25.00 N ATOM 2021 CA HIS A 122 12.709 7.431 -7.142 1.00 25.00 C ATOM 2022 C HIS A 122 12.817 6.368 -6.057 1.00 25.00 C ATOM 2023 O HIS A 122 11.857 6.092 -5.349 1.00 25.00 O ATOM 2024 CB HIS A 122 12.264 8.761 -6.513 1.00 25.00 C ATOM 2025 CG HIS A 122 13.221 9.289 -5.487 1.00 25.00 C ATOM 2026 ND1 HIS A 122 13.270 8.834 -4.164 1.00 25.00 N ATOM 2027 CD2 HIS A 122 14.194 10.238 -5.560 1.00 25.00 C ATOM 2028 CE1 HIS A 122 14.238 9.482 -3.525 1.00 25.00 C ATOM 2029 NE2 HIS A 122 14.799 10.332 -4.344 1.00 25.00 N ATOM 0 H HIS A 122 10.909 6.610 -7.849 1.00 25.00 H new ATOM 0 HA HIS A 122 13.690 7.549 -7.602 1.00 25.00 H new ATOM 0 HB2 HIS A 122 12.143 9.504 -7.301 1.00 25.00 H new ATOM 0 HB3 HIS A 122 11.286 8.625 -6.050 1.00 25.00 H new ATOM 0 HD2 HIS A 122 14.444 10.819 -6.435 1.00 25.00 H new ATOM 0 HE1 HIS A 122 14.517 9.330 -2.493 1.00 25.00 H new ATOM 0 HE2 HIS A 122 15.565 10.963 -4.110 1.00 25.00 H new ATOM 2037 N HIS A 123 14.013 5.823 -5.900 1.00 25.00 N ATOM 2038 CA HIS A 123 14.338 4.886 -4.819 1.00 25.00 C ATOM 2039 C HIS A 123 15.683 5.403 -4.320 1.00 25.00 C ATOM 2040 O HIS A 123 16.228 6.305 -4.949 1.00 25.00 O ATOM 2041 CB HIS A 123 14.425 3.440 -5.336 1.00 25.00 C ATOM 2042 CG HIS A 123 13.095 2.856 -5.720 1.00 25.00 C ATOM 2043 ND1 HIS A 123 12.303 2.084 -4.856 1.00 25.00 N ATOM 2044 CD2 HIS A 123 12.388 2.898 -6.884 1.00 25.00 C ATOM 2045 CE1 HIS A 123 11.204 1.712 -5.501 1.00 25.00 C ATOM 2046 NE2 HIS A 123 11.235 2.193 -6.717 1.00 25.00 N ATOM 0 H HIS A 123 14.798 6.016 -6.522 1.00 25.00 H new ATOM 0 HA HIS A 123 13.583 4.846 -4.034 1.00 25.00 H new ATOM 0 HB2 HIS A 123 15.088 3.412 -6.201 1.00 25.00 H new ATOM 0 HB3 HIS A 123 14.878 2.815 -4.567 1.00 25.00 H new ATOM 0 HD2 HIS A 123 12.691 3.405 -7.788 1.00 25.00 H new ATOM 0 HE1 HIS A 123 10.410 1.108 -5.087 1.00 25.00 H new ATOM 0 HE2 HIS A 123 10.513 2.061 -7.425 1.00 25.00 H new ATOM 2054 N HIS A 124 16.176 4.871 -3.200 1.00 25.00 N ATOM 2055 CA HIS A 124 17.385 5.385 -2.509 1.00 25.00 C ATOM 2056 C HIS A 124 17.108 6.827 -2.044 1.00 25.00 C ATOM 2057 O HIS A 124 15.959 7.283 -2.061 1.00 25.00 O ATOM 2058 CB HIS A 124 18.662 5.339 -3.396 1.00 25.00 C ATOM 2059 CG HIS A 124 19.055 3.964 -3.847 1.00 25.00 C ATOM 2060 ND1 HIS A 124 19.983 3.732 -4.868 1.00 25.00 N ATOM 2061 CD2 HIS A 124 18.691 2.720 -3.426 1.00 25.00 C ATOM 2062 CE1 HIS A 124 20.136 2.422 -5.021 1.00 25.00 C ATOM 2063 NE2 HIS A 124 19.368 1.798 -4.166 1.00 25.00 N ATOM 0 H HIS A 124 15.754 4.067 -2.736 1.00 25.00 H new ATOM 0 HA HIS A 124 17.586 4.735 -1.658 1.00 25.00 H new ATOM 0 HB2 HIS A 124 18.502 5.964 -4.274 1.00 25.00 H new ATOM 0 HB3 HIS A 124 19.491 5.777 -2.840 1.00 25.00 H new ATOM 0 HD2 HIS A 124 17.985 2.502 -2.638 1.00 25.00 H new ATOM 0 HE1 HIS A 124 20.790 1.947 -5.737 1.00 25.00 H new ATOM 0 HE2 HIS A 124 19.289 0.786 -4.069 1.00 25.00 H new ATOM 2071 N HIS A 125 18.152 7.528 -1.635 1.00 25.00 N ATOM 2072 CA HIS A 125 18.084 8.936 -1.281 1.00 25.00 C ATOM 2073 C HIS A 125 19.431 9.419 -1.756 1.00 25.00 C ATOM 2074 O HIS A 125 20.225 8.505 -2.084 1.00 25.00 O ATOM 2075 CB HIS A 125 17.904 9.166 0.233 1.00 25.00 C ATOM 2076 CG HIS A 125 19.096 8.778 1.060 1.00 25.00 C ATOM 2077 ND1 HIS A 125 19.063 7.804 2.064 1.00 25.00 N ATOM 2078 CD2 HIS A 125 20.377 9.240 1.076 1.00 25.00 C ATOM 2079 CE1 HIS A 125 20.271 7.714 2.613 1.00 25.00 C ATOM 2080 NE2 HIS A 125 21.072 8.566 2.030 1.00 25.00 N ATOM 2081 OXT HIS A 125 19.705 10.624 -1.749 1.00 25.00 O ATOM 0 H HIS A 125 19.086 7.129 -1.538 1.00 25.00 H new ATOM 0 HA HIS A 125 17.231 9.453 -1.720 1.00 25.00 H new ATOM 0 HB2 HIS A 125 17.683 10.219 0.406 1.00 25.00 H new ATOM 0 HB3 HIS A 125 17.038 8.599 0.575 1.00 25.00 H new ATOM 0 HD2 HIS A 125 20.775 10.014 0.436 1.00 25.00 H new ATOM 0 HE1 HIS A 125 20.546 7.043 3.414 1.00 25.00 H new ATOM 0 HE2 HIS A 125 22.058 8.703 2.254 1.00 25.00 H new TER 2089 HIS A 125