USER MOD reduce.3.24.130724 H: found=0, std=0, add=1011, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1009 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 59 THR OG1 : rot -172:sc= 0.995 USER MOD Set 1.2: A 109 LYS NZ :NH3+ -161:sc= 1.11 (180deg=-0.302) USER MOD Set 2.1: A 28 THR OG1 : rot 180:sc= -0.11 USER MOD Set 2.2: A 31 GLN : amide:sc= -0.279 X(o=-0.39,f=-0.41) USER MOD Single : A 1 GLY N :NH3+ -134:sc= 0.037 (180deg=0) USER MOD Single : A 8 TYR OH : rot 180:sc= 0 USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 GLN : amide:sc= 0.563 K(o=0.56,f=0) USER MOD Single : A 13 THR OG1 : rot 82:sc= 0.00629 USER MOD Single : A 16 THR OG1 : rot 90:sc= -0.0663 USER MOD Single : A 17 SER OG : rot 116:sc= 1.21 USER MOD Single : A 20 ASN : amide:sc= -1.54 K(o=-1.5,f=-0.29) USER MOD Single : A 26 ASN : amide:sc= -0.101 X(o=-0.1,f=0) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot 180:sc= 0.169 USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 39 LYS NZ :NH3+ 151:sc= 0.16 (180deg=0.0205) USER MOD Single : A 41 ASN : amide:sc= 0.638 K(o=0.64,f=-3!) USER MOD Single : A 42 LYS NZ :NH3+ -149:sc= 1.1 (180deg=0.343) USER MOD Single : A 44 TYR OH : rot 15:sc= 0 USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 MET CE :methyl 168:sc= -1.03 (180deg=-1.33) USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 THR OG1 : rot 109:sc= 1.32 USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 THR OG1 : rot -170:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 ASN : amide:sc= -3.9 X(o=-3.9,f=-3.9!) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 ASN : amide:sc= -0.0484 X(o=-0.048,f=0) USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 MET CE :methyl 178:sc= -0.941 (180deg=-0.946) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 SER OG : rot 38:sc= 0.14 USER MOD Single : A 83 GLN : amide:sc= -0.0647 X(o=-0.065,f=-0.065) USER MOD Single : A 84 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 LYS NZ :NH3+ -173:sc= 1.39 (180deg=1.02) USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 MET CE :methyl -179:sc= -0.0217 (180deg=-0.0238) USER MOD Single : A 102 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 104 ASN : amide:sc=0.000361 K(o=0.00036,f=-1.3) USER MOD Single : A 105 SER OG : rot -130:sc= 0 USER MOD Single : A 107 GLN : amide:sc= -0.409 X(o=-0.41,f=0) USER MOD Single : A 112 SER OG : rot 102:sc= 0.168 USER MOD Single : A 113 SER OG : rot 56:sc= 1.32 USER MOD Single : A 115 THR OG1 : rot 180:sc= -0.282 USER MOD Single : A 116 THR OG1 : rot 180:sc= 0.11 USER MOD Single : A 119 TYR OH : rot 180:sc= 0 USER MOD Single : A 120 SER OG : rot 69:sc= 0.934 USER MOD Single : A 121 GLN : amide:sc= 0.583 K(o=0.58,f=-1.2!) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -22.217 16.961 -4.138 1.00 0.00 N ATOM 2 CA GLY A 1 -22.032 16.825 -2.689 1.00 0.00 C ATOM 3 C GLY A 1 -21.008 15.757 -2.392 1.00 0.00 C ATOM 4 O GLY A 1 -20.029 15.623 -3.128 1.00 0.00 O ATOM 0 H1 GLY A 1 -22.210 17.969 -4.396 1.00 0.00 H new ATOM 0 H2 GLY A 1 -21.445 16.471 -4.634 1.00 0.00 H new ATOM 0 H3 GLY A 1 -23.127 16.540 -4.413 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -21.709 17.776 -2.265 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -22.981 16.571 -2.216 1.00 0.00 H new ATOM 8 N ALA A 2 -21.219 14.986 -1.332 1.00 0.00 N ATOM 9 CA ALA A 2 -20.596 13.693 -1.086 1.00 0.00 C ATOM 10 C ALA A 2 -21.731 12.717 -0.752 1.00 0.00 C ATOM 11 O ALA A 2 -22.892 13.137 -0.668 1.00 0.00 O ATOM 12 CB ALA A 2 -19.578 13.821 0.055 1.00 0.00 C ATOM 0 H ALA A 2 -21.859 15.259 -0.586 1.00 0.00 H new ATOM 0 HA ALA A 2 -20.045 13.327 -1.952 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -19.113 12.852 0.238 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -18.812 14.545 -0.221 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -20.086 14.156 0.960 1.00 0.00 H new ATOM 18 N GLU A 3 -21.422 11.431 -0.585 1.00 0.00 N ATOM 19 CA GLU A 3 -22.389 10.415 -0.170 1.00 0.00 C ATOM 20 C GLU A 3 -21.680 9.150 0.354 1.00 0.00 C ATOM 21 O GLU A 3 -22.273 8.070 0.373 1.00 0.00 O ATOM 22 CB GLU A 3 -23.307 10.071 -1.360 1.00 0.00 C ATOM 23 CG GLU A 3 -24.659 9.500 -0.891 1.00 0.00 C ATOM 24 CD GLU A 3 -25.808 10.493 -1.037 1.00 0.00 C ATOM 25 OE1 GLU A 3 -26.111 10.932 -2.173 1.00 0.00 O ATOM 26 OE2 GLU A 3 -26.452 10.842 -0.018 1.00 0.00 O ATOM 0 H GLU A 3 -20.483 11.062 -0.736 1.00 0.00 H new ATOM 0 HA GLU A 3 -22.989 10.814 0.648 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -23.478 10.966 -1.958 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -22.810 9.346 -2.005 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -24.887 8.602 -1.465 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -24.577 9.198 0.153 1.00 0.00 H new ATOM 33 N ALA A 4 -20.389 9.247 0.715 1.00 0.00 N ATOM 34 CA ALA A 4 -19.471 8.111 0.774 1.00 0.00 C ATOM 35 C ALA A 4 -19.538 7.340 -0.549 1.00 0.00 C ATOM 36 O ALA A 4 -19.938 6.169 -0.588 1.00 0.00 O ATOM 37 CB ALA A 4 -19.730 7.243 2.017 1.00 0.00 C ATOM 0 H ALA A 4 -19.954 10.132 0.976 1.00 0.00 H new ATOM 0 HA ALA A 4 -18.447 8.465 0.890 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -19.030 6.407 2.030 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -19.593 7.844 2.916 1.00 0.00 H new ATOM 0 HB3 ALA A 4 -20.750 6.861 1.988 1.00 0.00 H new ATOM 43 N LEU A 5 -19.167 8.009 -1.647 1.00 0.00 N ATOM 44 CA LEU A 5 -19.081 7.392 -2.959 1.00 0.00 C ATOM 45 C LEU A 5 -18.030 6.278 -2.862 1.00 0.00 C ATOM 46 O LEU A 5 -17.109 6.382 -2.047 1.00 0.00 O ATOM 47 CB LEU A 5 -18.631 8.399 -4.023 1.00 0.00 C ATOM 48 CG LEU A 5 -19.577 9.447 -4.507 1.00 0.00 C ATOM 49 CD1 LEU A 5 -18.857 10.660 -5.097 1.00 0.00 C ATOM 50 CD2 LEU A 5 -20.728 8.997 -5.402 1.00 0.00 C ATOM 0 H LEU A 5 -18.918 8.998 -1.641 1.00 0.00 H new ATOM 0 HA LEU A 5 -20.061 7.013 -3.249 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -17.752 8.912 -3.633 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -18.307 7.828 -4.893 1.00 0.00 H new ATOM 0 HG LEU A 5 -20.077 9.738 -3.583 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -19.592 11.391 -5.433 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -18.219 11.110 -4.336 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -18.246 10.345 -5.943 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -21.334 9.860 -5.678 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -20.328 8.532 -6.303 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -21.346 8.277 -4.866 1.00 0.00 H new ATOM 62 N PRO A 6 -18.143 5.223 -3.668 1.00 0.00 N ATOM 63 CA PRO A 6 -17.328 4.035 -3.554 1.00 0.00 C ATOM 64 C PRO A 6 -15.928 4.286 -4.133 1.00 0.00 C ATOM 65 O PRO A 6 -15.661 5.333 -4.715 1.00 0.00 O ATOM 66 CB PRO A 6 -18.130 2.982 -4.314 1.00 0.00 C ATOM 67 CG PRO A 6 -18.799 3.776 -5.439 1.00 0.00 C ATOM 68 CD PRO A 6 -18.925 5.201 -4.881 1.00 0.00 C ATOM 0 HA PRO A 6 -17.137 3.717 -2.529 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -17.486 2.195 -4.707 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -18.867 2.499 -3.672 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -18.199 3.758 -6.349 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -19.775 3.361 -5.692 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -18.555 5.935 -5.597 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -19.967 5.450 -4.678 1.00 0.00 H new ATOM 76 N LEU A 7 -15.008 3.339 -3.945 1.00 0.00 N ATOM 77 CA LEU A 7 -13.619 3.464 -4.391 1.00 0.00 C ATOM 78 C LEU A 7 -13.522 3.696 -5.893 1.00 0.00 C ATOM 79 O LEU A 7 -14.171 3.017 -6.694 1.00 0.00 O ATOM 80 CB LEU A 7 -12.824 2.227 -4.001 1.00 0.00 C ATOM 81 CG LEU A 7 -11.296 2.320 -4.205 1.00 0.00 C ATOM 82 CD1 LEU A 7 -10.726 1.977 -5.589 1.00 0.00 C ATOM 83 CD2 LEU A 7 -10.622 3.554 -3.618 1.00 0.00 C ATOM 0 H LEU A 7 -15.207 2.456 -3.475 1.00 0.00 H new ATOM 0 HA LEU A 7 -13.195 4.336 -3.894 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -13.019 2.009 -2.951 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -13.198 1.381 -4.577 1.00 0.00 H new ATOM 0 HG LEU A 7 -11.012 1.470 -3.585 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -9.642 2.089 -5.574 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -10.981 0.948 -5.843 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -11.150 2.650 -6.334 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -9.552 3.515 -3.820 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -11.044 4.450 -4.072 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -10.787 3.581 -2.541 1.00 0.00 H new ATOM 95 N TYR A 8 -12.626 4.599 -6.269 1.00 0.00 N ATOM 96 CA TYR A 8 -12.403 4.990 -7.655 1.00 0.00 C ATOM 97 C TYR A 8 -10.927 5.229 -8.003 1.00 0.00 C ATOM 98 O TYR A 8 -10.632 5.570 -9.149 1.00 0.00 O ATOM 99 CB TYR A 8 -13.320 6.175 -8.005 1.00 0.00 C ATOM 100 CG TYR A 8 -13.369 7.343 -7.030 1.00 0.00 C ATOM 101 CD1 TYR A 8 -12.234 8.141 -6.811 1.00 0.00 C ATOM 102 CD2 TYR A 8 -14.584 7.690 -6.412 1.00 0.00 C ATOM 103 CE1 TYR A 8 -12.324 9.310 -6.029 1.00 0.00 C ATOM 104 CE2 TYR A 8 -14.680 8.838 -5.606 1.00 0.00 C ATOM 105 CZ TYR A 8 -13.550 9.661 -5.417 1.00 0.00 C ATOM 106 OH TYR A 8 -13.625 10.780 -4.641 1.00 0.00 O ATOM 0 H TYR A 8 -12.023 5.089 -5.608 1.00 0.00 H new ATOM 0 HA TYR A 8 -12.675 4.148 -8.291 1.00 0.00 H new ATOM 0 HB2 TYR A 8 -13.012 6.562 -8.977 1.00 0.00 H new ATOM 0 HB3 TYR A 8 -14.334 5.792 -8.121 1.00 0.00 H new ATOM 0 HD1 TYR A 8 -11.286 7.857 -7.245 1.00 0.00 H new ATOM 0 HD2 TYR A 8 -15.454 7.067 -6.558 1.00 0.00 H new ATOM 0 HE1 TYR A 8 -11.456 9.939 -5.897 1.00 0.00 H new ATOM 0 HE2 TYR A 8 -15.617 9.089 -5.132 1.00 0.00 H new ATOM 0 HH TYR A 8 -14.537 10.879 -4.296 1.00 0.00 H new ATOM 116 N TYR A 9 -9.991 5.028 -7.069 1.00 0.00 N ATOM 117 CA TYR A 9 -8.549 5.106 -7.299 1.00 0.00 C ATOM 118 C TYR A 9 -7.854 4.254 -6.241 1.00 0.00 C ATOM 119 O TYR A 9 -8.044 4.506 -5.047 1.00 0.00 O ATOM 120 CB TYR A 9 -8.094 6.553 -7.213 1.00 0.00 C ATOM 121 CG TYR A 9 -6.597 6.790 -7.152 1.00 0.00 C ATOM 122 CD1 TYR A 9 -5.967 6.849 -5.895 1.00 0.00 C ATOM 123 CD2 TYR A 9 -5.846 7.010 -8.324 1.00 0.00 C ATOM 124 CE1 TYR A 9 -4.645 7.297 -5.793 1.00 0.00 C ATOM 125 CE2 TYR A 9 -4.487 7.370 -8.231 1.00 0.00 C ATOM 126 CZ TYR A 9 -3.916 7.603 -6.958 1.00 0.00 C ATOM 127 OH TYR A 9 -2.646 8.058 -6.810 1.00 0.00 O ATOM 0 H TYR A 9 -10.226 4.800 -6.103 1.00 0.00 H new ATOM 0 HA TYR A 9 -8.296 4.733 -8.292 1.00 0.00 H new ATOM 0 HB2 TYR A 9 -8.489 7.087 -8.078 1.00 0.00 H new ATOM 0 HB3 TYR A 9 -8.547 7.001 -6.328 1.00 0.00 H new ATOM 0 HD1 TYR A 9 -6.504 6.548 -5.008 1.00 0.00 H new ATOM 0 HD2 TYR A 9 -6.312 6.903 -9.293 1.00 0.00 H new ATOM 0 HE1 TYR A 9 -4.185 7.408 -4.822 1.00 0.00 H new ATOM 0 HE2 TYR A 9 -3.887 7.467 -9.124 1.00 0.00 H new ATOM 0 HH TYR A 9 -2.255 8.230 -7.692 1.00 0.00 H new ATOM 137 N LEU A 10 -7.058 3.268 -6.666 1.00 0.00 N ATOM 138 CA LEU A 10 -6.155 2.514 -5.809 1.00 0.00 C ATOM 139 C LEU A 10 -4.746 2.911 -6.234 1.00 0.00 C ATOM 140 O LEU A 10 -4.409 2.784 -7.414 1.00 0.00 O ATOM 141 CB LEU A 10 -6.375 1.001 -6.015 1.00 0.00 C ATOM 142 CG LEU A 10 -5.797 0.087 -4.913 1.00 0.00 C ATOM 143 CD1 LEU A 10 -4.405 0.442 -4.405 1.00 0.00 C ATOM 144 CD2 LEU A 10 -6.766 -0.011 -3.736 1.00 0.00 C ATOM 0 H LEU A 10 -7.027 2.969 -7.641 1.00 0.00 H new ATOM 0 HA LEU A 10 -6.325 2.727 -4.754 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -7.446 0.815 -6.092 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -5.933 0.714 -6.969 1.00 0.00 H new ATOM 0 HG LEU A 10 -5.677 -0.877 -5.407 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -4.106 -0.269 -3.635 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -3.695 0.402 -5.231 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -4.416 1.448 -3.985 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -6.342 -0.659 -2.969 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -6.934 0.982 -3.320 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -7.714 -0.426 -4.079 1.00 0.00 H new ATOM 156 N GLN A 11 -3.900 3.343 -5.304 1.00 0.00 N ATOM 157 CA GLN A 11 -2.470 3.462 -5.548 1.00 0.00 C ATOM 158 C GLN A 11 -1.722 3.174 -4.252 1.00 0.00 C ATOM 159 O GLN A 11 -2.200 3.511 -3.172 1.00 0.00 O ATOM 160 CB GLN A 11 -2.173 4.874 -6.061 1.00 0.00 C ATOM 161 CG GLN A 11 -1.026 4.944 -7.078 1.00 0.00 C ATOM 162 CD GLN A 11 -1.492 4.954 -8.537 1.00 0.00 C ATOM 163 OE1 GLN A 11 -1.069 5.802 -9.320 1.00 0.00 O ATOM 164 NE2 GLN A 11 -2.367 4.046 -8.938 1.00 0.00 N ATOM 0 H GLN A 11 -4.186 3.619 -4.365 1.00 0.00 H new ATOM 0 HA GLN A 11 -2.142 2.745 -6.300 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -3.075 5.280 -6.519 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -1.931 5.514 -5.212 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -0.439 5.842 -6.888 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -0.364 4.092 -6.924 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -2.713 3.346 -8.282 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -2.696 4.046 -9.904 1.00 0.00 H new ATOM 173 N ILE A 12 -0.548 2.555 -4.361 1.00 0.00 N ATOM 174 CA ILE A 12 0.314 2.266 -3.220 1.00 0.00 C ATOM 175 C ILE A 12 0.882 3.540 -2.585 1.00 0.00 C ATOM 176 O ILE A 12 1.126 3.493 -1.393 1.00 0.00 O ATOM 177 CB ILE A 12 1.418 1.256 -3.616 1.00 0.00 C ATOM 178 CG1 ILE A 12 0.818 -0.081 -4.129 1.00 0.00 C ATOM 179 CG2 ILE A 12 2.328 0.888 -2.420 1.00 0.00 C ATOM 180 CD1 ILE A 12 -0.367 -0.659 -3.344 1.00 0.00 C ATOM 0 H ILE A 12 -0.166 2.238 -5.252 1.00 0.00 H new ATOM 0 HA ILE A 12 -0.297 1.799 -2.447 1.00 0.00 H new ATOM 0 HB ILE A 12 1.990 1.756 -4.398 1.00 0.00 H new ATOM 0 HG12 ILE A 12 0.502 0.064 -5.162 1.00 0.00 H new ATOM 0 HG13 ILE A 12 1.613 -0.827 -4.141 1.00 0.00 H new ATOM 0 HG21 ILE A 12 3.087 0.177 -2.746 1.00 0.00 H new ATOM 0 HG22 ILE A 12 2.812 1.788 -2.041 1.00 0.00 H new ATOM 0 HG23 ILE A 12 1.726 0.439 -1.630 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -0.690 -1.592 -3.806 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -0.063 -0.850 -2.315 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -1.191 0.054 -3.352 1.00 0.00 H new ATOM 192 N THR A 13 1.029 4.653 -3.316 1.00 0.00 N ATOM 193 CA THR A 13 1.332 6.003 -2.811 1.00 0.00 C ATOM 194 C THR A 13 2.642 6.152 -2.005 1.00 0.00 C ATOM 195 O THR A 13 3.517 6.898 -2.452 1.00 0.00 O ATOM 196 CB THR A 13 0.074 6.574 -2.124 1.00 0.00 C ATOM 197 OG1 THR A 13 -0.976 6.604 -3.075 1.00 0.00 O ATOM 198 CG2 THR A 13 0.252 7.988 -1.565 1.00 0.00 C ATOM 0 H THR A 13 0.935 4.637 -4.332 1.00 0.00 H new ATOM 0 HA THR A 13 1.572 6.625 -3.673 1.00 0.00 H new ATOM 0 HB THR A 13 -0.141 5.925 -1.275 1.00 0.00 H new ATOM 0 HG1 THR A 13 -1.387 5.716 -3.137 1.00 0.00 H new ATOM 0 HG21 THR A 13 -0.678 8.315 -1.099 1.00 0.00 H new ATOM 0 HG22 THR A 13 1.050 7.988 -0.822 1.00 0.00 H new ATOM 0 HG23 THR A 13 0.511 8.670 -2.375 1.00 0.00 H new ATOM 206 N GLY A 14 2.826 5.494 -0.862 1.00 0.00 N ATOM 207 CA GLY A 14 4.063 5.493 -0.100 1.00 0.00 C ATOM 208 C GLY A 14 4.359 4.099 0.431 1.00 0.00 C ATOM 209 O GLY A 14 3.444 3.299 0.655 1.00 0.00 O ATOM 0 H GLY A 14 2.093 4.931 -0.431 1.00 0.00 H new ATOM 0 HA2 GLY A 14 4.886 5.831 -0.730 1.00 0.00 H new ATOM 0 HA3 GLY A 14 3.987 6.196 0.729 1.00 0.00 H new ATOM 213 N ILE A 15 5.638 3.799 0.645 1.00 0.00 N ATOM 214 CA ILE A 15 6.068 2.477 1.084 1.00 0.00 C ATOM 215 C ILE A 15 7.334 2.616 1.910 1.00 0.00 C ATOM 216 O ILE A 15 8.155 3.495 1.643 1.00 0.00 O ATOM 217 CB ILE A 15 6.263 1.567 -0.149 1.00 0.00 C ATOM 218 CG1 ILE A 15 6.256 0.078 0.224 1.00 0.00 C ATOM 219 CG2 ILE A 15 7.526 1.903 -0.964 1.00 0.00 C ATOM 220 CD1 ILE A 15 6.105 -0.791 -1.030 1.00 0.00 C ATOM 0 H ILE A 15 6.401 4.464 0.519 1.00 0.00 H new ATOM 0 HA ILE A 15 5.311 2.011 1.715 1.00 0.00 H new ATOM 0 HB ILE A 15 5.403 1.770 -0.788 1.00 0.00 H new ATOM 0 HG12 ILE A 15 7.181 -0.177 0.741 1.00 0.00 H new ATOM 0 HG13 ILE A 15 5.438 -0.126 0.915 1.00 0.00 H new ATOM 0 HG21 ILE A 15 7.601 1.226 -1.815 1.00 0.00 H new ATOM 0 HG22 ILE A 15 7.465 2.931 -1.322 1.00 0.00 H new ATOM 0 HG23 ILE A 15 8.407 1.791 -0.332 1.00 0.00 H new ATOM 0 HD11 ILE A 15 6.102 -1.843 -0.745 1.00 0.00 H new ATOM 0 HD12 ILE A 15 5.168 -0.548 -1.530 1.00 0.00 H new ATOM 0 HD13 ILE A 15 6.938 -0.601 -1.707 1.00 0.00 H new ATOM 232 N THR A 16 7.515 1.720 2.868 1.00 0.00 N ATOM 233 CA THR A 16 8.761 1.555 3.580 1.00 0.00 C ATOM 234 C THR A 16 8.765 0.163 4.223 1.00 0.00 C ATOM 235 O THR A 16 7.839 -0.624 4.010 1.00 0.00 O ATOM 236 CB THR A 16 8.956 2.719 4.565 1.00 0.00 C ATOM 237 OG1 THR A 16 10.263 2.670 5.077 1.00 0.00 O ATOM 238 CG2 THR A 16 7.956 2.751 5.726 1.00 0.00 C ATOM 0 H THR A 16 6.783 1.078 3.174 1.00 0.00 H new ATOM 0 HA THR A 16 9.622 1.598 2.914 1.00 0.00 H new ATOM 0 HB THR A 16 8.777 3.631 3.996 1.00 0.00 H new ATOM 0 HG1 THR A 16 10.859 3.194 4.503 1.00 0.00 H new ATOM 0 HG21 THR A 16 8.171 3.605 6.368 1.00 0.00 H new ATOM 0 HG22 THR A 16 6.944 2.839 5.332 1.00 0.00 H new ATOM 0 HG23 THR A 16 8.041 1.832 6.305 1.00 0.00 H new ATOM 246 N SER A 17 9.775 -0.150 5.027 1.00 0.00 N ATOM 247 CA SER A 17 9.768 -1.326 5.869 1.00 0.00 C ATOM 248 C SER A 17 10.360 -1.016 7.232 1.00 0.00 C ATOM 249 O SER A 17 10.846 0.089 7.498 1.00 0.00 O ATOM 250 CB SER A 17 10.488 -2.484 5.175 1.00 0.00 C ATOM 251 OG SER A 17 11.840 -2.172 4.911 1.00 0.00 O ATOM 0 H SER A 17 10.622 0.412 5.109 1.00 0.00 H new ATOM 0 HA SER A 17 8.736 -1.637 6.033 1.00 0.00 H new ATOM 0 HB2 SER A 17 10.435 -3.374 5.802 1.00 0.00 H new ATOM 0 HB3 SER A 17 9.980 -2.722 4.241 1.00 0.00 H new ATOM 0 HG SER A 17 12.420 -2.770 5.426 1.00 0.00 H new ATOM 257 N ASP A 18 10.287 -2.016 8.102 1.00 0.00 N ATOM 258 CA ASP A 18 10.918 -2.015 9.406 1.00 0.00 C ATOM 259 C ASP A 18 12.442 -2.012 9.278 1.00 0.00 C ATOM 260 O ASP A 18 13.118 -1.324 10.045 1.00 0.00 O ATOM 261 CB ASP A 18 10.334 -3.161 10.252 1.00 0.00 C ATOM 262 CG ASP A 18 10.641 -4.602 9.812 1.00 0.00 C ATOM 263 OD1 ASP A 18 10.626 -4.893 8.595 1.00 0.00 O ATOM 264 OD2 ASP A 18 10.696 -5.480 10.704 1.00 0.00 O ATOM 0 H ASP A 18 9.770 -2.874 7.909 1.00 0.00 H new ATOM 0 HA ASP A 18 10.693 -1.094 9.944 1.00 0.00 H new ATOM 0 HB2 ASP A 18 10.692 -3.039 11.274 1.00 0.00 H new ATOM 0 HB3 ASP A 18 9.251 -3.041 10.277 1.00 0.00 H new ATOM 269 N GLY A 19 12.985 -2.623 8.222 1.00 0.00 N ATOM 270 CA GLY A 19 14.360 -2.426 7.790 1.00 0.00 C ATOM 271 C GLY A 19 14.503 -1.322 6.734 1.00 0.00 C ATOM 272 O GLY A 19 15.160 -1.542 5.716 1.00 0.00 O ATOM 0 H GLY A 19 12.468 -3.279 7.637 1.00 0.00 H new ATOM 0 HA2 GLY A 19 14.975 -2.176 8.655 1.00 0.00 H new ATOM 0 HA3 GLY A 19 14.745 -3.361 7.385 1.00 0.00 H new ATOM 276 N ASN A 20 13.906 -0.139 6.929 1.00 0.00 N ATOM 277 CA ASN A 20 14.259 1.024 6.102 1.00 0.00 C ATOM 278 C ASN A 20 14.202 2.392 6.787 1.00 0.00 C ATOM 279 O ASN A 20 13.930 3.402 6.139 1.00 0.00 O ATOM 280 CB ASN A 20 13.464 1.071 4.787 1.00 0.00 C ATOM 281 CG ASN A 20 14.438 1.432 3.670 1.00 0.00 C ATOM 282 OD1 ASN A 20 15.290 2.303 3.828 1.00 0.00 O ATOM 283 ND2 ASN A 20 14.437 0.682 2.582 1.00 0.00 N ATOM 0 H ASN A 20 13.192 0.038 7.636 1.00 0.00 H new ATOM 0 HA ASN A 20 15.315 0.847 5.897 1.00 0.00 H new ATOM 0 HB2 ASN A 20 12.995 0.107 4.589 1.00 0.00 H new ATOM 0 HB3 ASN A 20 12.664 1.808 4.850 1.00 0.00 H new ATOM 0 HD21 ASN A 20 15.148 0.824 1.864 1.00 0.00 H new ATOM 0 HD22 ASN A 20 13.725 -0.039 2.460 1.00 0.00 H new ATOM 290 N ASP A 21 14.400 2.471 8.102 1.00 0.00 N ATOM 291 CA ASP A 21 14.330 3.727 8.861 1.00 0.00 C ATOM 292 C ASP A 21 12.918 4.332 8.791 1.00 0.00 C ATOM 293 O ASP A 21 12.727 5.517 9.084 1.00 0.00 O ATOM 294 CB ASP A 21 15.386 4.762 8.412 1.00 0.00 C ATOM 295 CG ASP A 21 16.828 4.268 8.334 1.00 0.00 C ATOM 296 OD1 ASP A 21 17.218 3.683 7.292 1.00 0.00 O ATOM 297 OD2 ASP A 21 17.594 4.514 9.292 1.00 0.00 O ATOM 0 H ASP A 21 14.616 1.659 8.680 1.00 0.00 H new ATOM 0 HA ASP A 21 14.557 3.474 9.897 1.00 0.00 H new ATOM 0 HB2 ASP A 21 15.100 5.138 7.430 1.00 0.00 H new ATOM 0 HB3 ASP A 21 15.351 5.607 9.100 1.00 0.00 H new ATOM 302 N PHE A 22 11.937 3.517 8.383 1.00 0.00 N ATOM 303 CA PHE A 22 10.556 3.862 8.102 1.00 0.00 C ATOM 304 C PHE A 22 10.470 5.028 7.086 1.00 0.00 C ATOM 305 O PHE A 22 9.576 5.875 7.187 1.00 0.00 O ATOM 306 CB PHE A 22 9.771 4.070 9.418 1.00 0.00 C ATOM 307 CG PHE A 22 9.547 2.867 10.343 1.00 0.00 C ATOM 308 CD1 PHE A 22 10.584 1.986 10.720 1.00 0.00 C ATOM 309 CD2 PHE A 22 8.265 2.658 10.893 1.00 0.00 C ATOM 310 CE1 PHE A 22 10.334 0.894 11.570 1.00 0.00 C ATOM 311 CE2 PHE A 22 8.006 1.560 11.731 1.00 0.00 C ATOM 312 CZ PHE A 22 9.038 0.662 12.056 1.00 0.00 C ATOM 0 H PHE A 22 12.112 2.524 8.232 1.00 0.00 H new ATOM 0 HA PHE A 22 10.058 3.030 7.604 1.00 0.00 H new ATOM 0 HB2 PHE A 22 10.289 4.837 9.994 1.00 0.00 H new ATOM 0 HB3 PHE A 22 8.792 4.473 9.158 1.00 0.00 H new ATOM 0 HD1 PHE A 22 11.585 2.153 10.350 1.00 0.00 H new ATOM 0 HD2 PHE A 22 7.470 3.353 10.666 1.00 0.00 H new ATOM 0 HE1 PHE A 22 11.141 0.233 11.849 1.00 0.00 H new ATOM 0 HE2 PHE A 22 7.013 1.406 12.126 1.00 0.00 H new ATOM 0 HZ PHE A 22 8.835 -0.200 12.675 1.00 0.00 H new ATOM 322 N ALA A 23 11.419 5.097 6.141 1.00 0.00 N ATOM 323 CA ALA A 23 11.544 6.087 5.077 1.00 0.00 C ATOM 324 C ALA A 23 10.476 5.926 3.978 1.00 0.00 C ATOM 325 O ALA A 23 10.627 5.107 3.075 1.00 0.00 O ATOM 326 CB ALA A 23 12.966 6.012 4.519 1.00 0.00 C ATOM 0 H ALA A 23 12.171 4.409 6.103 1.00 0.00 H new ATOM 0 HA ALA A 23 11.364 7.079 5.492 1.00 0.00 H new ATOM 0 HB1 ALA A 23 13.083 6.745 3.721 1.00 0.00 H new ATOM 0 HB2 ALA A 23 13.681 6.225 5.314 1.00 0.00 H new ATOM 0 HB3 ALA A 23 13.150 5.013 4.124 1.00 0.00 H new ATOM 332 N TRP A 24 9.385 6.689 4.065 1.00 0.00 N ATOM 333 CA TRP A 24 8.104 6.469 3.394 1.00 0.00 C ATOM 334 C TRP A 24 7.997 6.684 1.882 1.00 0.00 C ATOM 335 O TRP A 24 6.896 6.443 1.377 1.00 0.00 O ATOM 336 CB TRP A 24 7.073 7.369 4.100 1.00 0.00 C ATOM 337 CG TRP A 24 6.402 6.718 5.250 1.00 0.00 C ATOM 338 CD1 TRP A 24 6.489 7.079 6.545 1.00 0.00 C ATOM 339 CD2 TRP A 24 5.545 5.551 5.204 1.00 0.00 C ATOM 340 NE1 TRP A 24 5.713 6.227 7.300 1.00 0.00 N ATOM 341 CE2 TRP A 24 5.102 5.264 6.524 1.00 0.00 C ATOM 342 CE3 TRP A 24 5.113 4.704 4.167 1.00 0.00 C ATOM 343 CZ2 TRP A 24 4.245 4.193 6.797 1.00 0.00 C ATOM 344 CZ3 TRP A 24 4.284 3.607 4.436 1.00 0.00 C ATOM 345 CH2 TRP A 24 3.837 3.358 5.744 1.00 0.00 C ATOM 0 H TRP A 24 9.372 7.530 4.642 1.00 0.00 H new ATOM 0 HA TRP A 24 7.937 5.395 3.480 1.00 0.00 H new ATOM 0 HB2 TRP A 24 7.571 8.274 4.446 1.00 0.00 H new ATOM 0 HB3 TRP A 24 6.318 7.677 3.377 1.00 0.00 H new ATOM 0 HD1 TRP A 24 7.072 7.903 6.929 1.00 0.00 H new ATOM 0 HE1 TRP A 24 5.603 6.300 8.311 1.00 0.00 H new ATOM 0 HE3 TRP A 24 5.424 4.902 3.152 1.00 0.00 H new ATOM 0 HZ2 TRP A 24 3.901 4.010 7.804 1.00 0.00 H new ATOM 0 HZ3 TRP A 24 3.987 2.949 3.633 1.00 0.00 H new ATOM 0 HH2 TRP A 24 3.179 2.524 5.940 1.00 0.00 H new ATOM 356 N ASP A 25 9.029 7.172 1.185 1.00 0.00 N ATOM 357 CA ASP A 25 9.183 7.167 -0.281 1.00 0.00 C ATOM 358 C ASP A 25 7.913 7.562 -1.056 1.00 0.00 C ATOM 359 O ASP A 25 7.076 6.702 -1.334 1.00 0.00 O ATOM 360 CB ASP A 25 9.729 5.819 -0.788 1.00 0.00 C ATOM 361 CG ASP A 25 11.232 5.817 -1.037 1.00 0.00 C ATOM 362 OD1 ASP A 25 11.714 6.700 -1.780 1.00 0.00 O ATOM 363 OD2 ASP A 25 11.915 4.869 -0.583 1.00 0.00 O ATOM 0 H ASP A 25 9.826 7.606 1.651 1.00 0.00 H new ATOM 0 HA ASP A 25 9.914 7.949 -0.487 1.00 0.00 H new ATOM 0 HB2 ASP A 25 9.490 5.044 -0.060 1.00 0.00 H new ATOM 0 HB3 ASP A 25 9.217 5.555 -1.713 1.00 0.00 H new ATOM 368 N ASN A 26 7.717 8.833 -1.416 1.00 0.00 N ATOM 369 CA ASN A 26 6.568 9.215 -2.245 1.00 0.00 C ATOM 370 C ASN A 26 6.698 8.648 -3.657 1.00 0.00 C ATOM 371 O ASN A 26 7.430 9.189 -4.491 1.00 0.00 O ATOM 372 CB ASN A 26 6.383 10.733 -2.325 1.00 0.00 C ATOM 373 CG ASN A 26 5.553 11.226 -1.158 1.00 0.00 C ATOM 374 OD1 ASN A 26 6.047 11.883 -0.249 1.00 0.00 O ATOM 375 ND2 ASN A 26 4.285 10.865 -1.115 1.00 0.00 N ATOM 0 H ASN A 26 8.328 9.606 -1.152 1.00 0.00 H new ATOM 0 HA ASN A 26 5.688 8.792 -1.760 1.00 0.00 H new ATOM 0 HB2 ASN A 26 7.356 11.225 -2.321 1.00 0.00 H new ATOM 0 HB3 ASN A 26 5.896 10.997 -3.263 1.00 0.00 H new ATOM 0 HD21 ASN A 26 3.705 11.133 -0.320 1.00 0.00 H new ATOM 0 HD22 ASN A 26 3.884 10.318 -1.877 1.00 0.00 H new ATOM 382 N LEU A 27 5.971 7.575 -3.927 1.00 0.00 N ATOM 383 CA LEU A 27 6.051 6.774 -5.134 1.00 0.00 C ATOM 384 C LEU A 27 5.474 7.562 -6.291 1.00 0.00 C ATOM 385 O LEU A 27 4.396 8.161 -6.179 1.00 0.00 O ATOM 386 CB LEU A 27 5.296 5.455 -4.926 1.00 0.00 C ATOM 387 CG LEU A 27 5.775 4.706 -3.666 1.00 0.00 C ATOM 388 CD1 LEU A 27 4.843 3.556 -3.303 1.00 0.00 C ATOM 389 CD2 LEU A 27 7.234 4.245 -3.802 1.00 0.00 C ATOM 0 H LEU A 27 5.272 7.222 -3.273 1.00 0.00 H new ATOM 0 HA LEU A 27 7.090 6.536 -5.362 1.00 0.00 H new ATOM 0 HB2 LEU A 27 4.228 5.658 -4.843 1.00 0.00 H new ATOM 0 HB3 LEU A 27 5.432 4.818 -5.800 1.00 0.00 H new ATOM 0 HG LEU A 27 5.741 5.413 -2.837 1.00 0.00 H new ATOM 0 HD11 LEU A 27 5.215 3.054 -2.410 1.00 0.00 H new ATOM 0 HD12 LEU A 27 3.843 3.945 -3.110 1.00 0.00 H new ATOM 0 HD13 LEU A 27 4.803 2.846 -4.129 1.00 0.00 H new ATOM 0 HD21 LEU A 27 7.536 3.721 -2.895 1.00 0.00 H new ATOM 0 HD22 LEU A 27 7.325 3.574 -4.656 1.00 0.00 H new ATOM 0 HD23 LEU A 27 7.877 5.112 -3.951 1.00 0.00 H new ATOM 401 N THR A 28 6.179 7.535 -7.415 1.00 0.00 N ATOM 402 CA THR A 28 5.725 8.164 -8.639 1.00 0.00 C ATOM 403 C THR A 28 4.381 7.541 -9.028 1.00 0.00 C ATOM 404 O THR A 28 4.113 6.371 -8.735 1.00 0.00 O ATOM 405 CB THR A 28 6.808 8.025 -9.726 1.00 0.00 C ATOM 406 OG1 THR A 28 7.611 6.880 -9.565 1.00 0.00 O ATOM 407 CG2 THR A 28 7.768 9.214 -9.692 1.00 0.00 C ATOM 0 H THR A 28 7.085 7.073 -7.499 1.00 0.00 H new ATOM 0 HA THR A 28 5.566 9.234 -8.507 1.00 0.00 H new ATOM 0 HB THR A 28 6.256 7.964 -10.664 1.00 0.00 H new ATOM 0 HG1 THR A 28 8.277 6.844 -10.283 1.00 0.00 H new ATOM 0 HG21 THR A 28 8.524 9.094 -10.468 1.00 0.00 H new ATOM 0 HG22 THR A 28 7.212 10.135 -9.866 1.00 0.00 H new ATOM 0 HG23 THR A 28 8.253 9.262 -8.717 1.00 0.00 H new ATOM 415 N SER A 29 3.510 8.334 -9.652 1.00 0.00 N ATOM 416 CA SER A 29 2.168 7.883 -9.981 1.00 0.00 C ATOM 417 C SER A 29 2.231 6.652 -10.879 1.00 0.00 C ATOM 418 O SER A 29 1.744 5.581 -10.527 1.00 0.00 O ATOM 419 CB SER A 29 1.367 9.039 -10.600 1.00 0.00 C ATOM 420 OG SER A 29 1.217 10.072 -9.639 1.00 0.00 O ATOM 0 H SER A 29 3.715 9.291 -9.938 1.00 0.00 H new ATOM 0 HA SER A 29 1.643 7.581 -9.075 1.00 0.00 H new ATOM 0 HB2 SER A 29 1.880 9.420 -11.483 1.00 0.00 H new ATOM 0 HB3 SER A 29 0.389 8.685 -10.927 1.00 0.00 H new ATOM 0 HG SER A 29 0.708 10.812 -10.031 1.00 0.00 H new ATOM 426 N SER A 30 2.937 6.794 -11.988 1.00 0.00 N ATOM 427 CA SER A 30 3.196 5.779 -12.988 1.00 0.00 C ATOM 428 C SER A 30 4.241 4.731 -12.570 1.00 0.00 C ATOM 429 O SER A 30 4.694 3.978 -13.430 1.00 0.00 O ATOM 430 CB SER A 30 3.593 6.524 -14.273 1.00 0.00 C ATOM 431 OG SER A 30 4.157 7.812 -14.026 1.00 0.00 O ATOM 0 H SER A 30 3.373 7.684 -12.227 1.00 0.00 H new ATOM 0 HA SER A 30 2.297 5.182 -13.138 1.00 0.00 H new ATOM 0 HB2 SER A 30 4.311 5.920 -14.828 1.00 0.00 H new ATOM 0 HB3 SER A 30 2.713 6.635 -14.907 1.00 0.00 H new ATOM 0 HG SER A 30 4.391 8.236 -14.878 1.00 0.00 H new ATOM 437 N GLN A 31 4.661 4.684 -11.297 1.00 0.00 N ATOM 438 CA GLN A 31 5.707 3.761 -10.860 1.00 0.00 C ATOM 439 C GLN A 31 5.328 2.310 -11.194 1.00 0.00 C ATOM 440 O GLN A 31 4.162 1.909 -11.144 1.00 0.00 O ATOM 441 CB GLN A 31 6.043 3.918 -9.358 1.00 0.00 C ATOM 442 CG GLN A 31 7.392 3.304 -8.961 1.00 0.00 C ATOM 443 CD GLN A 31 8.379 4.279 -8.333 1.00 0.00 C ATOM 444 OE1 GLN A 31 9.351 4.680 -8.968 1.00 0.00 O ATOM 445 NE2 GLN A 31 8.207 4.671 -7.086 1.00 0.00 N ATOM 0 H GLN A 31 4.289 5.277 -10.555 1.00 0.00 H new ATOM 0 HA GLN A 31 6.611 4.018 -11.412 1.00 0.00 H new ATOM 0 HB2 GLN A 31 6.048 4.978 -9.105 1.00 0.00 H new ATOM 0 HB3 GLN A 31 5.254 3.452 -8.767 1.00 0.00 H new ATOM 0 HG2 GLN A 31 7.212 2.489 -8.260 1.00 0.00 H new ATOM 0 HG3 GLN A 31 7.850 2.866 -9.847 1.00 0.00 H new ATOM 0 HE21 GLN A 31 7.402 4.341 -6.554 1.00 0.00 H new ATOM 0 HE22 GLN A 31 8.879 5.304 -6.653 1.00 0.00 H new ATOM 454 N THR A 32 6.353 1.506 -11.466 1.00 0.00 N ATOM 455 CA THR A 32 6.242 0.087 -11.770 1.00 0.00 C ATOM 456 C THR A 32 7.236 -0.747 -10.940 1.00 0.00 C ATOM 457 O THR A 32 7.270 -1.974 -11.060 1.00 0.00 O ATOM 458 CB THR A 32 6.412 -0.108 -13.282 1.00 0.00 C ATOM 459 OG1 THR A 32 7.690 0.322 -13.724 1.00 0.00 O ATOM 460 CG2 THR A 32 5.375 0.657 -14.100 1.00 0.00 C ATOM 0 H THR A 32 7.317 1.839 -11.481 1.00 0.00 H new ATOM 0 HA THR A 32 5.254 -0.277 -11.488 1.00 0.00 H new ATOM 0 HB THR A 32 6.285 -1.179 -13.441 1.00 0.00 H new ATOM 0 HG1 THR A 32 7.766 0.182 -14.691 1.00 0.00 H new ATOM 0 HG21 THR A 32 5.546 0.480 -15.162 1.00 0.00 H new ATOM 0 HG22 THR A 32 4.375 0.315 -13.832 1.00 0.00 H new ATOM 0 HG23 THR A 32 5.462 1.723 -13.891 1.00 0.00 H new ATOM 468 N LYS A 33 8.084 -0.123 -10.110 1.00 0.00 N ATOM 469 CA LYS A 33 9.206 -0.786 -9.450 1.00 0.00 C ATOM 470 C LYS A 33 9.580 -0.025 -8.177 1.00 0.00 C ATOM 471 O LYS A 33 9.303 1.173 -8.097 1.00 0.00 O ATOM 472 CB LYS A 33 10.380 -0.775 -10.447 1.00 0.00 C ATOM 473 CG LYS A 33 11.215 -2.031 -10.245 1.00 0.00 C ATOM 474 CD LYS A 33 11.779 -2.566 -11.562 1.00 0.00 C ATOM 475 CE LYS A 33 12.404 -3.942 -11.342 1.00 0.00 C ATOM 476 NZ LYS A 33 13.794 -3.867 -10.859 1.00 0.00 N ATOM 0 H LYS A 33 8.005 0.867 -9.879 1.00 0.00 H new ATOM 0 HA LYS A 33 8.952 -1.807 -9.166 1.00 0.00 H new ATOM 0 HB2 LYS A 33 10.005 -0.733 -11.470 1.00 0.00 H new ATOM 0 HB3 LYS A 33 10.994 0.113 -10.296 1.00 0.00 H new ATOM 0 HG2 LYS A 33 12.036 -1.814 -9.561 1.00 0.00 H new ATOM 0 HG3 LYS A 33 10.603 -2.800 -9.774 1.00 0.00 H new ATOM 0 HD2 LYS A 33 10.986 -2.633 -12.306 1.00 0.00 H new ATOM 0 HD3 LYS A 33 12.527 -1.876 -11.954 1.00 0.00 H new ATOM 0 HE2 LYS A 33 11.803 -4.498 -10.622 1.00 0.00 H new ATOM 0 HE3 LYS A 33 12.379 -4.501 -12.277 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 14.168 -4.828 -10.727 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 14.377 -3.361 -11.556 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 13.819 -3.358 -9.952 1.00 0.00 H new ATOM 490 N ALA A 34 10.106 -0.705 -7.163 1.00 0.00 N ATOM 491 CA ALA A 34 10.340 -0.093 -5.864 1.00 0.00 C ATOM 492 C ALA A 34 11.546 0.842 -5.902 1.00 0.00 C ATOM 493 O ALA A 34 12.405 0.715 -6.780 1.00 0.00 O ATOM 494 CB ALA A 34 10.559 -1.177 -4.805 1.00 0.00 C ATOM 0 H ALA A 34 10.379 -1.686 -7.219 1.00 0.00 H new ATOM 0 HA ALA A 34 9.459 0.495 -5.606 1.00 0.00 H new ATOM 0 HB1 ALA A 34 10.733 -0.709 -3.836 1.00 0.00 H new ATOM 0 HB2 ALA A 34 9.676 -1.813 -4.747 1.00 0.00 H new ATOM 0 HB3 ALA A 34 11.424 -1.782 -5.077 1.00 0.00 H new ATOM 500 N PRO A 35 11.637 1.752 -4.919 1.00 0.00 N ATOM 501 CA PRO A 35 12.744 2.680 -4.822 1.00 0.00 C ATOM 502 C PRO A 35 14.059 1.999 -4.417 1.00 0.00 C ATOM 503 O PRO A 35 15.085 2.315 -5.016 1.00 0.00 O ATOM 504 CB PRO A 35 12.284 3.756 -3.839 1.00 0.00 C ATOM 505 CG PRO A 35 11.262 3.039 -2.965 1.00 0.00 C ATOM 506 CD PRO A 35 10.605 2.086 -3.944 1.00 0.00 C ATOM 0 HA PRO A 35 12.985 3.119 -5.790 1.00 0.00 H new ATOM 0 HB2 PRO A 35 13.116 4.140 -3.248 1.00 0.00 H new ATOM 0 HB3 PRO A 35 11.841 4.607 -4.356 1.00 0.00 H new ATOM 0 HG2 PRO A 35 11.735 2.509 -2.138 1.00 0.00 H new ATOM 0 HG3 PRO A 35 10.543 3.733 -2.529 1.00 0.00 H new ATOM 0 HD2 PRO A 35 10.241 1.192 -3.437 1.00 0.00 H new ATOM 0 HD3 PRO A 35 9.745 2.551 -4.427 1.00 0.00 H new ATOM 514 N ASN A 36 14.074 1.085 -3.436 1.00 0.00 N ATOM 515 CA ASN A 36 15.275 0.382 -2.988 1.00 0.00 C ATOM 516 C ASN A 36 14.850 -0.974 -2.444 1.00 0.00 C ATOM 517 O ASN A 36 13.673 -1.161 -2.120 1.00 0.00 O ATOM 518 CB ASN A 36 16.000 1.165 -1.878 1.00 0.00 C ATOM 519 CG ASN A 36 17.080 2.053 -2.465 1.00 0.00 C ATOM 520 OD1 ASN A 36 18.148 1.572 -2.825 1.00 0.00 O ATOM 521 ND2 ASN A 36 16.826 3.348 -2.566 1.00 0.00 N ATOM 0 H ASN A 36 13.234 0.812 -2.925 1.00 0.00 H new ATOM 0 HA ASN A 36 15.961 0.275 -3.828 1.00 0.00 H new ATOM 0 HB2 ASN A 36 15.282 1.773 -1.327 1.00 0.00 H new ATOM 0 HB3 ASN A 36 16.442 0.469 -1.165 1.00 0.00 H new ATOM 0 HD21 ASN A 36 17.530 3.977 -2.953 1.00 0.00 H new ATOM 0 HD22 ASN A 36 15.927 3.717 -2.257 1.00 0.00 H new ATOM 528 N VAL A 37 15.807 -1.883 -2.257 1.00 0.00 N ATOM 529 CA VAL A 37 15.634 -3.006 -1.350 1.00 0.00 C ATOM 530 C VAL A 37 15.278 -2.547 0.062 1.00 0.00 C ATOM 531 O VAL A 37 16.037 -1.864 0.747 1.00 0.00 O ATOM 532 CB VAL A 37 16.704 -4.097 -1.505 1.00 0.00 C ATOM 533 CG1 VAL A 37 18.107 -3.579 -1.670 1.00 0.00 C ATOM 534 CG2 VAL A 37 16.712 -5.160 -0.392 1.00 0.00 C ATOM 0 H VAL A 37 16.712 -1.859 -2.726 1.00 0.00 H new ATOM 0 HA VAL A 37 14.746 -3.559 -1.655 1.00 0.00 H new ATOM 0 HB VAL A 37 16.390 -4.571 -2.435 1.00 0.00 H new ATOM 0 HG11 VAL A 37 18.795 -4.418 -1.772 1.00 0.00 H new ATOM 0 HG12 VAL A 37 18.162 -2.954 -2.561 1.00 0.00 H new ATOM 0 HG13 VAL A 37 18.382 -2.989 -0.796 1.00 0.00 H new ATOM 0 HG21 VAL A 37 17.501 -5.886 -0.588 1.00 0.00 H new ATOM 0 HG22 VAL A 37 16.893 -4.679 0.569 1.00 0.00 H new ATOM 0 HG23 VAL A 37 15.748 -5.669 -0.368 1.00 0.00 H new ATOM 544 N LEU A 38 14.057 -2.896 0.444 1.00 0.00 N ATOM 545 CA LEU A 38 13.447 -2.809 1.757 1.00 0.00 C ATOM 546 C LEU A 38 13.967 -3.960 2.626 1.00 0.00 C ATOM 547 O LEU A 38 13.624 -5.109 2.369 1.00 0.00 O ATOM 548 CB LEU A 38 11.921 -2.934 1.559 1.00 0.00 C ATOM 549 CG LEU A 38 11.276 -1.908 0.610 1.00 0.00 C ATOM 550 CD1 LEU A 38 9.757 -2.081 0.623 1.00 0.00 C ATOM 551 CD2 LEU A 38 11.633 -0.465 0.974 1.00 0.00 C ATOM 0 H LEU A 38 13.403 -3.288 -0.233 1.00 0.00 H new ATOM 0 HA LEU A 38 13.688 -1.867 2.250 1.00 0.00 H new ATOM 0 HB2 LEU A 38 11.704 -3.934 1.182 1.00 0.00 H new ATOM 0 HB3 LEU A 38 11.440 -2.850 2.534 1.00 0.00 H new ATOM 0 HG LEU A 38 11.671 -2.097 -0.388 1.00 0.00 H new ATOM 0 HD11 LEU A 38 9.302 -1.354 -0.049 1.00 0.00 H new ATOM 0 HD12 LEU A 38 9.503 -3.088 0.294 1.00 0.00 H new ATOM 0 HD13 LEU A 38 9.382 -1.924 1.634 1.00 0.00 H new ATOM 0 HD21 LEU A 38 11.152 0.217 0.273 1.00 0.00 H new ATOM 0 HD22 LEU A 38 11.288 -0.249 1.985 1.00 0.00 H new ATOM 0 HD23 LEU A 38 12.714 -0.334 0.924 1.00 0.00 H new ATOM 563 N LYS A 39 14.808 -3.707 3.638 1.00 0.00 N ATOM 564 CA LYS A 39 15.232 -4.795 4.534 1.00 0.00 C ATOM 565 C LYS A 39 14.060 -5.155 5.453 1.00 0.00 C ATOM 566 O LYS A 39 13.093 -4.391 5.549 1.00 0.00 O ATOM 567 CB LYS A 39 16.504 -4.452 5.344 1.00 0.00 C ATOM 568 CG LYS A 39 17.790 -4.291 4.513 1.00 0.00 C ATOM 569 CD LYS A 39 18.277 -2.847 4.298 1.00 0.00 C ATOM 570 CE LYS A 39 17.353 -2.120 3.328 1.00 0.00 C ATOM 571 NZ LYS A 39 17.912 -0.870 2.786 1.00 0.00 N ATOM 0 H LYS A 39 15.199 -2.790 3.854 1.00 0.00 H new ATOM 0 HA LYS A 39 15.505 -5.656 3.924 1.00 0.00 H new ATOM 0 HB2 LYS A 39 16.327 -3.527 5.892 1.00 0.00 H new ATOM 0 HB3 LYS A 39 16.665 -5.235 6.085 1.00 0.00 H new ATOM 0 HG2 LYS A 39 18.587 -4.853 5.000 1.00 0.00 H new ATOM 0 HG3 LYS A 39 17.628 -4.748 3.537 1.00 0.00 H new ATOM 0 HD2 LYS A 39 18.304 -2.319 5.251 1.00 0.00 H new ATOM 0 HD3 LYS A 39 19.295 -2.853 3.907 1.00 0.00 H new ATOM 0 HE2 LYS A 39 17.115 -2.788 2.500 1.00 0.00 H new ATOM 0 HE3 LYS A 39 16.415 -1.896 3.836 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 17.518 -0.695 1.839 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 17.666 -0.079 3.415 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 18.947 -0.952 2.721 1.00 0.00 H new ATOM 585 N GLY A 40 14.158 -6.257 6.195 1.00 0.00 N ATOM 586 CA GLY A 40 13.133 -6.632 7.158 1.00 0.00 C ATOM 587 C GLY A 40 12.079 -7.522 6.517 1.00 0.00 C ATOM 588 O GLY A 40 12.340 -8.187 5.508 1.00 0.00 O ATOM 0 H GLY A 40 14.943 -6.907 6.144 1.00 0.00 H new ATOM 0 HA2 GLY A 40 13.592 -7.154 7.998 1.00 0.00 H new ATOM 0 HA3 GLY A 40 12.661 -5.735 7.559 1.00 0.00 H new ATOM 592 N ASN A 41 10.889 -7.555 7.117 1.00 0.00 N ATOM 593 CA ASN A 41 9.726 -8.268 6.577 1.00 0.00 C ATOM 594 C ASN A 41 8.462 -7.416 6.614 1.00 0.00 C ATOM 595 O ASN A 41 7.588 -7.608 5.766 1.00 0.00 O ATOM 596 CB ASN A 41 9.470 -9.595 7.318 1.00 0.00 C ATOM 597 CG ASN A 41 8.165 -10.252 6.847 1.00 0.00 C ATOM 598 OD1 ASN A 41 7.988 -10.584 5.676 1.00 0.00 O ATOM 599 ND2 ASN A 41 7.193 -10.438 7.726 1.00 0.00 N ATOM 0 H ASN A 41 10.701 -7.083 8.001 1.00 0.00 H new ATOM 0 HA ASN A 41 9.967 -8.487 5.537 1.00 0.00 H new ATOM 0 HB2 ASN A 41 10.304 -10.276 7.149 1.00 0.00 H new ATOM 0 HB3 ASN A 41 9.421 -9.411 8.391 1.00 0.00 H new ATOM 0 HD21 ASN A 41 6.310 -10.852 7.429 1.00 0.00 H new ATOM 0 HD22 ASN A 41 7.327 -10.167 8.700 1.00 0.00 H new ATOM 606 N LYS A 42 8.322 -6.500 7.577 1.00 0.00 N ATOM 607 CA LYS A 42 7.089 -5.739 7.685 1.00 0.00 C ATOM 608 C LYS A 42 7.102 -4.667 6.612 1.00 0.00 C ATOM 609 O LYS A 42 7.851 -3.696 6.687 1.00 0.00 O ATOM 610 CB LYS A 42 6.882 -5.158 9.080 1.00 0.00 C ATOM 611 CG LYS A 42 6.737 -6.198 10.199 1.00 0.00 C ATOM 612 CD LYS A 42 5.695 -7.276 9.883 1.00 0.00 C ATOM 613 CE LYS A 42 5.348 -8.111 11.114 1.00 0.00 C ATOM 614 NZ LYS A 42 4.214 -7.563 11.881 1.00 0.00 N ATOM 0 H LYS A 42 9.032 -6.276 8.274 1.00 0.00 H new ATOM 0 HA LYS A 42 6.239 -6.403 7.528 1.00 0.00 H new ATOM 0 HB2 LYS A 42 7.725 -4.508 9.315 1.00 0.00 H new ATOM 0 HB3 LYS A 42 5.990 -4.532 9.068 1.00 0.00 H new ATOM 0 HG2 LYS A 42 7.702 -6.673 10.373 1.00 0.00 H new ATOM 0 HG3 LYS A 42 6.460 -5.692 11.124 1.00 0.00 H new ATOM 0 HD2 LYS A 42 4.791 -6.805 9.497 1.00 0.00 H new ATOM 0 HD3 LYS A 42 6.075 -7.929 9.097 1.00 0.00 H new ATOM 0 HE2 LYS A 42 5.110 -9.128 10.801 1.00 0.00 H new ATOM 0 HE3 LYS A 42 6.222 -8.173 11.762 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 4.334 -7.790 12.889 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 4.180 -6.531 11.761 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 3.327 -7.981 11.535 1.00 0.00 H new ATOM 628 N LEU A 43 6.282 -4.882 5.596 1.00 0.00 N ATOM 629 CA LEU A 43 6.130 -4.032 4.438 1.00 0.00 C ATOM 630 C LEU A 43 5.065 -3.010 4.800 1.00 0.00 C ATOM 631 O LEU A 43 3.856 -3.276 4.741 1.00 0.00 O ATOM 632 CB LEU A 43 5.757 -4.867 3.198 1.00 0.00 C ATOM 633 CG LEU A 43 6.548 -4.461 1.948 1.00 0.00 C ATOM 634 CD1 LEU A 43 6.016 -5.210 0.725 1.00 0.00 C ATOM 635 CD2 LEU A 43 6.517 -2.975 1.643 1.00 0.00 C ATOM 0 H LEU A 43 5.674 -5.700 5.560 1.00 0.00 H new ATOM 0 HA LEU A 43 7.059 -3.524 4.177 1.00 0.00 H new ATOM 0 HB2 LEU A 43 5.935 -5.921 3.409 1.00 0.00 H new ATOM 0 HB3 LEU A 43 4.691 -4.758 2.999 1.00 0.00 H new ATOM 0 HG LEU A 43 7.583 -4.725 2.165 1.00 0.00 H new ATOM 0 HD11 LEU A 43 6.584 -4.915 -0.158 1.00 0.00 H new ATOM 0 HD12 LEU A 43 6.121 -6.284 0.882 1.00 0.00 H new ATOM 0 HD13 LEU A 43 4.964 -4.966 0.578 1.00 0.00 H new ATOM 0 HD21 LEU A 43 7.101 -2.776 0.744 1.00 0.00 H new ATOM 0 HD22 LEU A 43 5.486 -2.658 1.484 1.00 0.00 H new ATOM 0 HD23 LEU A 43 6.942 -2.423 2.481 1.00 0.00 H new ATOM 647 N TYR A 44 5.512 -1.853 5.270 1.00 0.00 N ATOM 648 CA TYR A 44 4.622 -0.789 5.670 1.00 0.00 C ATOM 649 C TYR A 44 4.221 -0.037 4.414 1.00 0.00 C ATOM 650 O TYR A 44 5.032 0.651 3.803 1.00 0.00 O ATOM 651 CB TYR A 44 5.288 0.100 6.721 1.00 0.00 C ATOM 652 CG TYR A 44 5.683 -0.641 7.985 1.00 0.00 C ATOM 653 CD1 TYR A 44 4.754 -1.476 8.641 1.00 0.00 C ATOM 654 CD2 TYR A 44 6.996 -0.532 8.478 1.00 0.00 C ATOM 655 CE1 TYR A 44 5.146 -2.205 9.771 1.00 0.00 C ATOM 656 CE2 TYR A 44 7.380 -1.238 9.634 1.00 0.00 C ATOM 657 CZ TYR A 44 6.453 -2.077 10.287 1.00 0.00 C ATOM 658 OH TYR A 44 6.809 -2.794 11.387 1.00 0.00 O ATOM 0 H TYR A 44 6.502 -1.633 5.382 1.00 0.00 H new ATOM 0 HA TYR A 44 3.722 -1.177 6.147 1.00 0.00 H new ATOM 0 HB2 TYR A 44 6.176 0.558 6.286 1.00 0.00 H new ATOM 0 HB3 TYR A 44 4.607 0.910 6.983 1.00 0.00 H new ATOM 0 HD1 TYR A 44 3.742 -1.553 8.272 1.00 0.00 H new ATOM 0 HD2 TYR A 44 7.712 0.095 7.968 1.00 0.00 H new ATOM 0 HE1 TYR A 44 4.443 -2.870 10.251 1.00 0.00 H new ATOM 0 HE2 TYR A 44 8.383 -1.137 10.020 1.00 0.00 H new ATOM 0 HH TYR A 44 6.150 -3.502 11.543 1.00 0.00 H new ATOM 668 N VAL A 45 2.966 -0.198 4.007 1.00 0.00 N ATOM 669 CA VAL A 45 2.392 0.522 2.883 1.00 0.00 C ATOM 670 C VAL A 45 1.494 1.630 3.429 1.00 0.00 C ATOM 671 O VAL A 45 0.798 1.429 4.433 1.00 0.00 O ATOM 672 CB VAL A 45 1.646 -0.462 1.974 1.00 0.00 C ATOM 673 CG1 VAL A 45 1.055 0.280 0.791 1.00 0.00 C ATOM 674 CG2 VAL A 45 2.565 -1.582 1.491 1.00 0.00 C ATOM 0 H VAL A 45 2.314 -0.841 4.456 1.00 0.00 H new ATOM 0 HA VAL A 45 3.164 0.990 2.272 1.00 0.00 H new ATOM 0 HB VAL A 45 0.843 -0.919 2.553 1.00 0.00 H new ATOM 0 HG11 VAL A 45 0.526 -0.423 0.148 1.00 0.00 H new ATOM 0 HG12 VAL A 45 0.359 1.039 1.148 1.00 0.00 H new ATOM 0 HG13 VAL A 45 1.855 0.758 0.225 1.00 0.00 H new ATOM 0 HG21 VAL A 45 2.004 -2.261 0.849 1.00 0.00 H new ATOM 0 HG22 VAL A 45 3.395 -1.154 0.929 1.00 0.00 H new ATOM 0 HG23 VAL A 45 2.952 -2.131 2.350 1.00 0.00 H new ATOM 684 N LYS A 46 1.485 2.766 2.729 1.00 0.00 N ATOM 685 CA LYS A 46 0.600 3.904 2.912 1.00 0.00 C ATOM 686 C LYS A 46 -0.121 4.078 1.571 1.00 0.00 C ATOM 687 O LYS A 46 0.210 4.980 0.809 1.00 0.00 O ATOM 688 CB LYS A 46 1.437 5.135 3.323 1.00 0.00 C ATOM 689 CG LYS A 46 0.592 6.401 3.538 1.00 0.00 C ATOM 690 CD LYS A 46 1.287 7.693 3.096 1.00 0.00 C ATOM 691 CE LYS A 46 2.425 8.083 4.045 1.00 0.00 C ATOM 692 NZ LYS A 46 3.073 9.344 3.630 1.00 0.00 N ATOM 0 H LYS A 46 2.145 2.920 1.967 1.00 0.00 H new ATOM 0 HA LYS A 46 -0.135 3.766 3.705 1.00 0.00 H new ATOM 0 HB2 LYS A 46 1.978 4.907 4.241 1.00 0.00 H new ATOM 0 HB3 LYS A 46 2.184 5.331 2.554 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -0.345 6.298 2.990 1.00 0.00 H new ATOM 0 HG3 LYS A 46 0.336 6.480 4.595 1.00 0.00 H new ATOM 0 HD2 LYS A 46 1.682 7.566 2.088 1.00 0.00 H new ATOM 0 HD3 LYS A 46 0.557 8.501 3.053 1.00 0.00 H new ATOM 0 HE2 LYS A 46 2.035 8.190 5.057 1.00 0.00 H new ATOM 0 HE3 LYS A 46 3.166 7.284 4.072 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 3.838 9.577 4.295 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 3.467 9.233 2.674 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 2.371 10.111 3.628 1.00 0.00 H new ATOM 706 N ALA A 47 -1.036 3.152 1.262 1.00 0.00 N ATOM 707 CA ALA A 47 -1.810 3.114 0.027 1.00 0.00 C ATOM 708 C ALA A 47 -2.999 4.067 0.117 1.00 0.00 C ATOM 709 O ALA A 47 -3.796 3.963 1.056 1.00 0.00 O ATOM 710 CB ALA A 47 -2.251 1.676 -0.264 1.00 0.00 C ATOM 0 H ALA A 47 -1.262 2.382 1.892 1.00 0.00 H new ATOM 0 HA ALA A 47 -1.188 3.448 -0.804 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -2.829 1.653 -1.188 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -1.372 1.040 -0.370 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -2.866 1.311 0.558 1.00 0.00 H new ATOM 716 N ARG A 48 -3.149 4.977 -0.847 1.00 0.00 N ATOM 717 CA ARG A 48 -4.244 5.940 -0.846 1.00 0.00 C ATOM 718 C ARG A 48 -5.468 5.292 -1.466 1.00 0.00 C ATOM 719 O ARG A 48 -5.368 4.646 -2.511 1.00 0.00 O ATOM 720 CB ARG A 48 -3.828 7.191 -1.618 1.00 0.00 C ATOM 721 CG ARG A 48 -4.949 8.238 -1.668 1.00 0.00 C ATOM 722 CD ARG A 48 -4.390 9.627 -1.987 1.00 0.00 C ATOM 723 NE ARG A 48 -3.610 9.678 -3.237 1.00 0.00 N ATOM 724 CZ ARG A 48 -3.635 10.654 -4.156 1.00 0.00 C ATOM 725 NH1 ARG A 48 -4.602 11.559 -4.171 1.00 0.00 N ATOM 726 NH2 ARG A 48 -2.670 10.735 -5.059 1.00 0.00 N ATOM 0 H ARG A 48 -2.518 5.065 -1.644 1.00 0.00 H new ATOM 0 HA ARG A 48 -4.485 6.240 0.174 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -2.945 7.628 -1.151 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -3.547 6.913 -2.634 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -5.682 7.955 -2.423 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -5.471 8.263 -0.711 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -5.216 10.335 -2.055 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -3.758 9.953 -1.161 1.00 0.00 H new ATOM 0 HE ARG A 48 -2.988 8.891 -3.421 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -5.346 11.522 -3.475 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -4.602 12.293 -4.879 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -1.909 10.056 -5.055 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -2.687 11.477 -5.759 1.00 0.00 H new ATOM 740 N PHE A 49 -6.632 5.498 -0.864 1.00 0.00 N ATOM 741 CA PHE A 49 -7.905 4.996 -1.366 1.00 0.00 C ATOM 742 C PHE A 49 -8.769 6.232 -1.577 1.00 0.00 C ATOM 743 O PHE A 49 -9.093 6.907 -0.595 1.00 0.00 O ATOM 744 CB PHE A 49 -8.539 4.009 -0.367 1.00 0.00 C ATOM 745 CG PHE A 49 -7.738 2.747 -0.073 1.00 0.00 C ATOM 746 CD1 PHE A 49 -6.677 2.804 0.854 1.00 0.00 C ATOM 747 CD2 PHE A 49 -8.022 1.521 -0.716 1.00 0.00 C ATOM 748 CE1 PHE A 49 -5.894 1.665 1.119 1.00 0.00 C ATOM 749 CE2 PHE A 49 -7.286 0.365 -0.387 1.00 0.00 C ATOM 750 CZ PHE A 49 -6.219 0.436 0.523 1.00 0.00 C ATOM 0 H PHE A 49 -6.720 6.028 0.003 1.00 0.00 H new ATOM 0 HA PHE A 49 -7.790 4.436 -2.294 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -8.710 4.534 0.573 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -9.516 3.714 -0.749 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -6.463 3.731 1.366 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -8.803 1.470 -1.460 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -5.043 1.736 1.781 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -7.544 -0.582 -0.838 1.00 0.00 H new ATOM 0 HZ PHE A 49 -5.651 -0.451 0.763 1.00 0.00 H new ATOM 760 N MET A 50 -9.059 6.592 -2.832 1.00 0.00 N ATOM 761 CA MET A 50 -9.945 7.720 -3.116 1.00 0.00 C ATOM 762 C MET A 50 -11.324 7.122 -3.341 1.00 0.00 C ATOM 763 O MET A 50 -11.537 6.443 -4.343 1.00 0.00 O ATOM 764 CB MET A 50 -9.551 8.571 -4.334 1.00 0.00 C ATOM 765 CG MET A 50 -8.064 8.865 -4.489 1.00 0.00 C ATOM 766 SD MET A 50 -7.529 10.512 -3.980 1.00 0.00 S ATOM 767 CE MET A 50 -8.006 10.438 -2.247 1.00 0.00 C ATOM 0 H MET A 50 -8.695 6.121 -3.660 1.00 0.00 H new ATOM 0 HA MET A 50 -9.894 8.410 -2.274 1.00 0.00 H new ATOM 0 HB2 MET A 50 -9.897 8.063 -5.234 1.00 0.00 H new ATOM 0 HB3 MET A 50 -10.085 9.520 -4.278 1.00 0.00 H new ATOM 0 HG2 MET A 50 -7.506 8.128 -3.912 1.00 0.00 H new ATOM 0 HG3 MET A 50 -7.792 8.723 -5.535 1.00 0.00 H new ATOM 0 HE1 MET A 50 -7.566 11.280 -1.712 1.00 0.00 H new ATOM 0 HE2 MET A 50 -9.092 10.484 -2.166 1.00 0.00 H new ATOM 0 HE3 MET A 50 -7.649 9.505 -1.811 1.00 0.00 H new ATOM 777 N GLY A 51 -12.232 7.328 -2.401 1.00 0.00 N ATOM 778 CA GLY A 51 -13.543 6.689 -2.403 1.00 0.00 C ATOM 779 C GLY A 51 -13.595 5.616 -1.325 1.00 0.00 C ATOM 780 O GLY A 51 -12.563 5.149 -0.826 1.00 0.00 O ATOM 0 H GLY A 51 -12.081 7.949 -1.606 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -14.320 7.432 -2.227 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -13.741 6.246 -3.379 1.00 0.00 H new ATOM 784 N TYR A 52 -14.809 5.261 -0.924 1.00 0.00 N ATOM 785 CA TYR A 52 -15.105 4.422 0.220 1.00 0.00 C ATOM 786 C TYR A 52 -15.014 2.949 -0.178 1.00 0.00 C ATOM 787 O TYR A 52 -15.733 2.481 -1.064 1.00 0.00 O ATOM 788 CB TYR A 52 -16.499 4.797 0.753 1.00 0.00 C ATOM 789 CG TYR A 52 -16.622 4.789 2.261 1.00 0.00 C ATOM 790 CD1 TYR A 52 -16.552 3.583 2.978 1.00 0.00 C ATOM 791 CD2 TYR A 52 -16.863 5.994 2.947 1.00 0.00 C ATOM 792 CE1 TYR A 52 -16.749 3.586 4.368 1.00 0.00 C ATOM 793 CE2 TYR A 52 -17.117 5.998 4.327 1.00 0.00 C ATOM 794 CZ TYR A 52 -17.075 4.783 5.045 1.00 0.00 C ATOM 795 OH TYR A 52 -17.356 4.752 6.376 1.00 0.00 O ATOM 0 H TYR A 52 -15.650 5.567 -1.413 1.00 0.00 H new ATOM 0 HA TYR A 52 -14.378 4.582 1.016 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -16.758 5.790 0.386 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -17.230 4.103 0.339 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -16.347 2.657 2.462 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -16.852 6.928 2.404 1.00 0.00 H new ATOM 0 HE1 TYR A 52 -16.651 2.666 4.925 1.00 0.00 H new ATOM 0 HE2 TYR A 52 -17.343 6.923 4.836 1.00 0.00 H new ATOM 0 HH TYR A 52 -17.559 5.658 6.689 1.00 0.00 H new ATOM 805 N THR A 53 -14.165 2.194 0.503 1.00 0.00 N ATOM 806 CA THR A 53 -14.236 0.746 0.563 1.00 0.00 C ATOM 807 C THR A 53 -13.777 0.335 1.951 1.00 0.00 C ATOM 808 O THR A 53 -12.998 1.044 2.595 1.00 0.00 O ATOM 809 CB THR A 53 -13.417 0.103 -0.579 1.00 0.00 C ATOM 810 OG1 THR A 53 -13.464 -1.308 -0.492 1.00 0.00 O ATOM 811 CG2 THR A 53 -11.942 0.528 -0.608 1.00 0.00 C ATOM 0 H THR A 53 -13.390 2.583 1.041 1.00 0.00 H new ATOM 0 HA THR A 53 -15.253 0.387 0.409 1.00 0.00 H new ATOM 0 HB THR A 53 -13.884 0.461 -1.497 1.00 0.00 H new ATOM 0 HG1 THR A 53 -14.015 -1.663 -1.221 1.00 0.00 H new ATOM 0 HG21 THR A 53 -11.437 0.033 -1.438 1.00 0.00 H new ATOM 0 HG22 THR A 53 -11.877 1.609 -0.736 1.00 0.00 H new ATOM 0 HG23 THR A 53 -11.463 0.244 0.329 1.00 0.00 H new ATOM 819 N LYS A 54 -14.237 -0.827 2.407 1.00 0.00 N ATOM 820 CA LYS A 54 -13.641 -1.514 3.541 1.00 0.00 C ATOM 821 C LYS A 54 -13.608 -3.019 3.291 1.00 0.00 C ATOM 822 O LYS A 54 -13.836 -3.821 4.202 1.00 0.00 O ATOM 823 CB LYS A 54 -14.286 -1.070 4.860 1.00 0.00 C ATOM 824 CG LYS A 54 -15.762 -1.448 5.064 1.00 0.00 C ATOM 825 CD LYS A 54 -15.973 -1.911 6.513 1.00 0.00 C ATOM 826 CE LYS A 54 -17.408 -2.360 6.792 1.00 0.00 C ATOM 827 NZ LYS A 54 -17.620 -2.658 8.224 1.00 0.00 N ATOM 0 H LYS A 54 -15.033 -1.316 1.998 1.00 0.00 H new ATOM 0 HA LYS A 54 -12.596 -1.224 3.650 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -13.709 -1.494 5.682 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -14.198 0.014 4.935 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -16.402 -0.592 4.847 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -16.045 -2.241 4.372 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -15.292 -2.734 6.729 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -15.714 -1.097 7.190 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -18.101 -1.580 6.476 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -17.634 -3.246 6.199 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -18.604 -2.959 8.374 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -16.976 -3.420 8.519 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -17.429 -1.805 8.788 1.00 0.00 H new ATOM 841 N LEU A 55 -13.357 -3.404 2.038 1.00 0.00 N ATOM 842 CA LEU A 55 -13.093 -4.782 1.662 1.00 0.00 C ATOM 843 C LEU A 55 -11.872 -4.773 0.747 1.00 0.00 C ATOM 844 O LEU A 55 -11.946 -5.035 -0.458 1.00 0.00 O ATOM 845 CB LEU A 55 -14.361 -5.437 1.074 1.00 0.00 C ATOM 846 CG LEU A 55 -14.470 -6.961 1.276 1.00 0.00 C ATOM 847 CD1 LEU A 55 -13.280 -7.751 0.726 1.00 0.00 C ATOM 848 CD2 LEU A 55 -14.691 -7.310 2.754 1.00 0.00 C ATOM 0 H LEU A 55 -13.333 -2.755 1.251 1.00 0.00 H new ATOM 0 HA LEU A 55 -12.852 -5.411 2.519 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -15.235 -4.964 1.522 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -14.397 -5.225 0.005 1.00 0.00 H new ATOM 0 HG LEU A 55 -15.339 -7.264 0.692 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -13.434 -8.815 0.908 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -13.191 -7.575 -0.346 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -12.366 -7.426 1.224 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -14.764 -8.392 2.865 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -13.853 -6.940 3.344 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -15.613 -6.846 3.103 1.00 0.00 H new ATOM 860 N THR A 56 -10.740 -4.399 1.335 1.00 0.00 N ATOM 861 CA THR A 56 -9.426 -4.592 0.751 1.00 0.00 C ATOM 862 C THR A 56 -9.106 -6.092 0.819 1.00 0.00 C ATOM 863 O THR A 56 -9.507 -6.776 1.766 1.00 0.00 O ATOM 864 CB THR A 56 -8.400 -3.726 1.510 1.00 0.00 C ATOM 865 OG1 THR A 56 -8.890 -2.410 1.711 1.00 0.00 O ATOM 866 CG2 THR A 56 -7.087 -3.606 0.741 1.00 0.00 C ATOM 0 H THR A 56 -10.715 -3.945 2.248 1.00 0.00 H new ATOM 0 HA THR A 56 -9.390 -4.278 -0.292 1.00 0.00 H new ATOM 0 HB THR A 56 -8.232 -4.223 2.465 1.00 0.00 H new ATOM 0 HG1 THR A 56 -8.168 -1.840 2.050 1.00 0.00 H new ATOM 0 HG21 THR A 56 -6.389 -2.989 1.307 1.00 0.00 H new ATOM 0 HG22 THR A 56 -6.659 -4.598 0.595 1.00 0.00 H new ATOM 0 HG23 THR A 56 -7.274 -3.146 -0.229 1.00 0.00 H new ATOM 874 N VAL A 57 -8.367 -6.601 -0.167 1.00 0.00 N ATOM 875 CA VAL A 57 -7.967 -7.990 -0.333 1.00 0.00 C ATOM 876 C VAL A 57 -6.511 -7.991 -0.796 1.00 0.00 C ATOM 877 O VAL A 57 -6.038 -7.074 -1.475 1.00 0.00 O ATOM 878 CB VAL A 57 -8.916 -8.682 -1.339 1.00 0.00 C ATOM 879 CG1 VAL A 57 -8.438 -10.087 -1.757 1.00 0.00 C ATOM 880 CG2 VAL A 57 -10.330 -8.743 -0.749 1.00 0.00 C ATOM 0 H VAL A 57 -8.011 -6.011 -0.919 1.00 0.00 H new ATOM 0 HA VAL A 57 -8.038 -8.552 0.598 1.00 0.00 H new ATOM 0 HB VAL A 57 -8.918 -8.082 -2.249 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -9.148 -10.518 -2.463 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -7.458 -10.013 -2.227 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -8.370 -10.725 -0.876 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -10.999 -9.231 -1.458 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -10.312 -9.310 0.182 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -10.686 -7.732 -0.551 1.00 0.00 H new ATOM 890 N ILE A 58 -5.779 -9.039 -0.429 1.00 0.00 N ATOM 891 CA ILE A 58 -4.396 -9.249 -0.807 1.00 0.00 C ATOM 892 C ILE A 58 -4.308 -10.757 -1.027 1.00 0.00 C ATOM 893 O ILE A 58 -4.322 -11.503 -0.058 1.00 0.00 O ATOM 894 CB ILE A 58 -3.436 -8.717 0.287 1.00 0.00 C ATOM 895 CG1 ILE A 58 -3.761 -7.274 0.750 1.00 0.00 C ATOM 896 CG2 ILE A 58 -2.003 -8.772 -0.257 1.00 0.00 C ATOM 897 CD1 ILE A 58 -2.910 -6.814 1.933 1.00 0.00 C ATOM 0 H ILE A 58 -6.149 -9.786 0.158 1.00 0.00 H new ATOM 0 HA ILE A 58 -4.094 -8.705 -1.702 1.00 0.00 H new ATOM 0 HB ILE A 58 -3.557 -9.352 1.164 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -3.611 -6.589 -0.085 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -4.814 -7.216 1.024 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -1.312 -8.401 0.500 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -1.748 -9.802 -0.507 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -1.929 -8.152 -1.151 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -3.188 -5.796 2.207 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -3.078 -7.477 2.782 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -1.856 -6.840 1.655 1.00 0.00 H new ATOM 909 N THR A 59 -4.358 -11.208 -2.277 1.00 0.00 N ATOM 910 CA THR A 59 -4.499 -12.611 -2.665 1.00 0.00 C ATOM 911 C THR A 59 -3.350 -13.465 -2.121 1.00 0.00 C ATOM 912 O THR A 59 -3.607 -14.504 -1.527 1.00 0.00 O ATOM 913 CB THR A 59 -4.602 -12.658 -4.198 1.00 0.00 C ATOM 914 OG1 THR A 59 -5.602 -11.738 -4.602 1.00 0.00 O ATOM 915 CG2 THR A 59 -4.929 -14.026 -4.783 1.00 0.00 C ATOM 0 H THR A 59 -4.299 -10.582 -3.081 1.00 0.00 H new ATOM 0 HA THR A 59 -5.401 -13.040 -2.229 1.00 0.00 H new ATOM 0 HB THR A 59 -3.613 -12.405 -4.579 1.00 0.00 H new ATOM 0 HG1 THR A 59 -5.773 -11.841 -5.561 1.00 0.00 H new ATOM 0 HG21 THR A 59 -4.980 -13.954 -5.869 1.00 0.00 H new ATOM 0 HG22 THR A 59 -4.152 -14.737 -4.502 1.00 0.00 H new ATOM 0 HG23 THR A 59 -5.890 -14.367 -4.397 1.00 0.00 H new ATOM 923 N GLY A 60 -2.118 -12.982 -2.284 1.00 0.00 N ATOM 924 CA GLY A 60 -0.854 -13.538 -1.815 1.00 0.00 C ATOM 925 C GLY A 60 -0.453 -14.828 -2.525 1.00 0.00 C ATOM 926 O GLY A 60 -1.148 -15.300 -3.428 1.00 0.00 O ATOM 0 H GLY A 60 -1.969 -12.112 -2.795 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -0.067 -12.797 -1.954 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -0.926 -13.730 -0.744 1.00 0.00 H new ATOM 930 N LYS A 61 0.700 -15.373 -2.127 1.00 0.00 N ATOM 931 CA LYS A 61 1.239 -16.661 -2.560 1.00 0.00 C ATOM 932 C LYS A 61 0.259 -17.754 -2.160 1.00 0.00 C ATOM 933 O LYS A 61 -0.125 -18.587 -2.984 1.00 0.00 O ATOM 934 CB LYS A 61 2.620 -16.893 -1.896 1.00 0.00 C ATOM 935 CG LYS A 61 3.743 -17.210 -2.887 1.00 0.00 C ATOM 936 CD LYS A 61 5.138 -17.085 -2.247 1.00 0.00 C ATOM 937 CE LYS A 61 6.158 -16.671 -3.323 1.00 0.00 C ATOM 938 NZ LYS A 61 7.536 -16.463 -2.824 1.00 0.00 N ATOM 0 H LYS A 61 1.312 -14.902 -1.460 1.00 0.00 H new ATOM 0 HA LYS A 61 1.372 -16.675 -3.642 1.00 0.00 H new ATOM 0 HB2 LYS A 61 2.892 -16.004 -1.327 1.00 0.00 H new ATOM 0 HB3 LYS A 61 2.536 -17.714 -1.184 1.00 0.00 H new ATOM 0 HG2 LYS A 61 3.611 -18.221 -3.271 1.00 0.00 H new ATOM 0 HG3 LYS A 61 3.674 -16.534 -3.739 1.00 0.00 H new ATOM 0 HD2 LYS A 61 5.118 -16.346 -1.446 1.00 0.00 H new ATOM 0 HD3 LYS A 61 5.431 -18.034 -1.798 1.00 0.00 H new ATOM 0 HE2 LYS A 61 6.179 -17.437 -4.098 1.00 0.00 H new ATOM 0 HE3 LYS A 61 5.814 -15.750 -3.794 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 8.153 -16.187 -3.614 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 7.535 -15.710 -2.106 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 7.889 -17.345 -2.400 1.00 0.00 H new ATOM 952 N ASP A 62 -0.191 -17.680 -0.907 1.00 0.00 N ATOM 953 CA ASP A 62 -1.269 -18.492 -0.348 1.00 0.00 C ATOM 954 C ASP A 62 -2.512 -18.509 -1.246 1.00 0.00 C ATOM 955 O ASP A 62 -3.159 -19.547 -1.366 1.00 0.00 O ATOM 956 CB ASP A 62 -1.564 -18.099 1.115 1.00 0.00 C ATOM 957 CG ASP A 62 -2.889 -17.380 1.397 1.00 0.00 C ATOM 958 OD1 ASP A 62 -3.239 -16.410 0.688 1.00 0.00 O ATOM 959 OD2 ASP A 62 -3.545 -17.781 2.382 1.00 0.00 O ATOM 0 H ASP A 62 0.201 -17.027 -0.229 1.00 0.00 H new ATOM 0 HA ASP A 62 -0.928 -19.527 -0.322 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -1.537 -19.005 1.720 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -0.753 -17.459 1.463 1.00 0.00 H new ATOM 964 N GLY A 63 -2.798 -17.423 -1.969 1.00 0.00 N ATOM 965 CA GLY A 63 -3.874 -17.383 -2.943 1.00 0.00 C ATOM 966 C GLY A 63 -5.252 -17.495 -2.293 1.00 0.00 C ATOM 967 O GLY A 63 -6.182 -17.994 -2.940 1.00 0.00 O ATOM 0 H GLY A 63 -2.283 -16.546 -1.889 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -3.816 -16.452 -3.507 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -3.745 -18.196 -3.657 1.00 0.00 H new ATOM 971 N LYS A 64 -5.393 -17.073 -1.032 1.00 0.00 N ATOM 972 CA LYS A 64 -6.591 -17.293 -0.214 1.00 0.00 C ATOM 973 C LYS A 64 -6.963 -16.074 0.635 1.00 0.00 C ATOM 974 O LYS A 64 -7.840 -16.193 1.494 1.00 0.00 O ATOM 975 CB LYS A 64 -6.453 -18.562 0.652 1.00 0.00 C ATOM 976 CG LYS A 64 -6.443 -19.860 -0.165 1.00 0.00 C ATOM 977 CD LYS A 64 -7.156 -21.010 0.558 1.00 0.00 C ATOM 978 CE LYS A 64 -7.111 -22.264 -0.320 1.00 0.00 C ATOM 979 NZ LYS A 64 -8.029 -23.322 0.147 1.00 0.00 N ATOM 0 H LYS A 64 -4.662 -16.558 -0.541 1.00 0.00 H new ATOM 0 HA LYS A 64 -7.416 -17.446 -0.909 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -5.532 -18.499 1.231 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -7.276 -18.597 1.366 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -6.925 -19.685 -1.127 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -5.412 -20.148 -0.372 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -6.676 -21.206 1.517 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -8.190 -20.737 0.769 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -7.366 -21.994 -1.345 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -6.093 -22.654 -0.337 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -7.958 -24.146 -0.483 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -7.772 -23.603 1.115 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -9.005 -22.963 0.138 1.00 0.00 H new ATOM 993 N ASN A 65 -6.425 -14.893 0.310 1.00 0.00 N ATOM 994 CA ASN A 65 -6.623 -13.617 0.999 1.00 0.00 C ATOM 995 C ASN A 65 -5.803 -13.582 2.288 1.00 0.00 C ATOM 996 O ASN A 65 -6.312 -13.842 3.371 1.00 0.00 O ATOM 997 CB ASN A 65 -8.115 -13.312 1.288 1.00 0.00 C ATOM 998 CG ASN A 65 -8.442 -11.855 1.550 1.00 0.00 C ATOM 999 OD1 ASN A 65 -9.429 -11.340 1.063 1.00 0.00 O ATOM 1000 ND2 ASN A 65 -7.664 -11.137 2.331 1.00 0.00 N ATOM 0 H ASN A 65 -5.801 -14.799 -0.491 1.00 0.00 H new ATOM 0 HA ASN A 65 -6.274 -12.833 0.327 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -8.709 -13.653 0.440 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -8.427 -13.898 2.152 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -7.893 -10.161 2.521 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -6.832 -11.556 2.747 1.00 0.00 H new ATOM 1007 N LEU A 66 -4.568 -13.099 2.190 1.00 0.00 N ATOM 1008 CA LEU A 66 -3.621 -12.884 3.281 1.00 0.00 C ATOM 1009 C LEU A 66 -4.225 -12.201 4.506 1.00 0.00 C ATOM 1010 O LEU A 66 -3.911 -12.577 5.634 1.00 0.00 O ATOM 1011 CB LEU A 66 -2.464 -12.011 2.774 1.00 0.00 C ATOM 1012 CG LEU A 66 -1.531 -12.670 1.745 1.00 0.00 C ATOM 1013 CD1 LEU A 66 -0.337 -11.741 1.489 1.00 0.00 C ATOM 1014 CD2 LEU A 66 -1.036 -14.051 2.185 1.00 0.00 C ATOM 0 H LEU A 66 -4.176 -12.830 1.288 1.00 0.00 H new ATOM 0 HA LEU A 66 -3.290 -13.874 3.594 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -2.883 -11.107 2.331 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -1.867 -11.699 3.631 1.00 0.00 H new ATOM 0 HG LEU A 66 -2.104 -12.823 0.830 1.00 0.00 H new ATOM 0 HD11 LEU A 66 0.331 -12.200 0.760 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -0.695 -10.787 1.103 1.00 0.00 H new ATOM 0 HD13 LEU A 66 0.202 -11.576 2.422 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -0.382 -14.465 1.417 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -0.484 -13.959 3.121 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -1.889 -14.714 2.331 1.00 0.00 H new ATOM 1026 N LEU A 67 -5.083 -11.194 4.305 1.00 0.00 N ATOM 1027 CA LEU A 67 -5.715 -10.488 5.405 1.00 0.00 C ATOM 1028 C LEU A 67 -6.643 -11.401 6.216 1.00 0.00 C ATOM 1029 O LEU A 67 -6.915 -11.077 7.366 1.00 0.00 O ATOM 1030 CB LEU A 67 -6.528 -9.283 4.905 1.00 0.00 C ATOM 1031 CG LEU A 67 -5.798 -8.202 4.085 1.00 0.00 C ATOM 1032 CD1 LEU A 67 -6.823 -7.332 3.359 1.00 0.00 C ATOM 1033 CD2 LEU A 67 -4.945 -7.286 4.962 1.00 0.00 C ATOM 0 H LEU A 67 -5.351 -10.855 3.381 1.00 0.00 H new ATOM 0 HA LEU A 67 -4.905 -10.143 6.048 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -7.349 -9.664 4.297 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -6.973 -8.798 5.774 1.00 0.00 H new ATOM 0 HG LEU A 67 -5.146 -8.722 3.383 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -6.306 -6.568 2.779 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -7.419 -7.953 2.690 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -7.476 -6.854 4.089 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -4.451 -6.541 4.338 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -5.581 -6.784 5.691 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -4.193 -7.878 5.484 1.00 0.00 H new ATOM 1045 N TYR A 68 -7.164 -12.492 5.641 1.00 0.00 N ATOM 1046 CA TYR A 68 -7.964 -13.519 6.305 1.00 0.00 C ATOM 1047 C TYR A 68 -7.069 -14.705 6.730 1.00 0.00 C ATOM 1048 O TYR A 68 -7.571 -15.783 7.046 1.00 0.00 O ATOM 1049 CB TYR A 68 -9.095 -13.923 5.337 1.00 0.00 C ATOM 1050 CG TYR A 68 -10.283 -14.650 5.950 1.00 0.00 C ATOM 1051 CD1 TYR A 68 -11.317 -13.943 6.597 1.00 0.00 C ATOM 1052 CD2 TYR A 68 -10.377 -16.046 5.829 1.00 0.00 C ATOM 1053 CE1 TYR A 68 -12.440 -14.635 7.091 1.00 0.00 C ATOM 1054 CE2 TYR A 68 -11.485 -16.748 6.336 1.00 0.00 C ATOM 1055 CZ TYR A 68 -12.538 -16.036 6.948 1.00 0.00 C ATOM 1056 OH TYR A 68 -13.660 -16.678 7.380 1.00 0.00 O ATOM 0 H TYR A 68 -7.030 -12.689 4.649 1.00 0.00 H new ATOM 0 HA TYR A 68 -8.413 -13.146 7.226 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -9.462 -13.022 4.846 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -8.669 -14.558 4.560 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -11.248 -12.872 6.714 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -9.584 -16.590 5.338 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -13.232 -14.090 7.583 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -11.530 -17.824 6.257 1.00 0.00 H new ATOM 0 HH TYR A 68 -13.573 -17.639 7.209 1.00 0.00 H new ATOM 1066 N ASN A 69 -5.739 -14.531 6.716 1.00 0.00 N ATOM 1067 CA ASN A 69 -4.761 -15.454 7.281 1.00 0.00 C ATOM 1068 C ASN A 69 -4.374 -14.848 8.631 1.00 0.00 C ATOM 1069 O ASN A 69 -4.958 -15.224 9.650 1.00 0.00 O ATOM 1070 CB ASN A 69 -3.588 -15.669 6.294 1.00 0.00 C ATOM 1071 CG ASN A 69 -3.238 -17.137 6.115 1.00 0.00 C ATOM 1072 OD1 ASN A 69 -2.150 -17.593 6.460 1.00 0.00 O ATOM 1073 ND2 ASN A 69 -4.138 -17.906 5.539 1.00 0.00 N ATOM 0 H ASN A 69 -5.305 -13.710 6.293 1.00 0.00 H new ATOM 0 HA ASN A 69 -5.146 -16.461 7.442 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -3.849 -15.241 5.326 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -2.711 -15.131 6.655 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -3.936 -18.892 5.374 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -5.037 -17.516 5.257 1.00 0.00 H new ATOM 1080 N GLY A 70 -3.540 -13.798 8.642 1.00 0.00 N ATOM 1081 CA GLY A 70 -3.296 -13.017 9.852 1.00 0.00 C ATOM 1082 C GLY A 70 -2.005 -12.207 9.884 1.00 0.00 C ATOM 1083 O GLY A 70 -1.890 -11.343 10.751 1.00 0.00 O ATOM 0 H GLY A 70 -3.025 -13.474 7.823 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -4.133 -12.333 9.992 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -3.294 -13.697 10.704 1.00 0.00 H new ATOM 1087 N THR A 71 -1.041 -12.442 8.991 1.00 0.00 N ATOM 1088 CA THR A 71 0.171 -11.622 8.958 1.00 0.00 C ATOM 1089 C THR A 71 -0.176 -10.209 8.465 1.00 0.00 C ATOM 1090 O THR A 71 0.015 -9.239 9.200 1.00 0.00 O ATOM 1091 CB THR A 71 1.236 -12.312 8.097 1.00 0.00 C ATOM 1092 OG1 THR A 71 1.536 -13.579 8.627 1.00 0.00 O ATOM 1093 CG2 THR A 71 2.533 -11.521 7.951 1.00 0.00 C ATOM 0 H THR A 71 -1.074 -13.183 8.290 1.00 0.00 H new ATOM 0 HA THR A 71 0.589 -11.517 9.959 1.00 0.00 H new ATOM 0 HB THR A 71 0.800 -12.391 7.101 1.00 0.00 H new ATOM 0 HG1 THR A 71 2.216 -14.014 8.071 1.00 0.00 H new ATOM 0 HG21 THR A 71 3.232 -12.079 7.328 1.00 0.00 H new ATOM 0 HG22 THR A 71 2.322 -10.558 7.486 1.00 0.00 H new ATOM 0 HG23 THR A 71 2.974 -11.360 8.935 1.00 0.00 H new ATOM 1101 N ALA A 72 -0.689 -10.076 7.234 1.00 0.00 N ATOM 1102 CA ALA A 72 -1.111 -8.788 6.714 1.00 0.00 C ATOM 1103 C ALA A 72 -2.385 -8.360 7.422 1.00 0.00 C ATOM 1104 O ALA A 72 -3.362 -9.107 7.448 1.00 0.00 O ATOM 1105 CB ALA A 72 -1.342 -8.880 5.199 1.00 0.00 C ATOM 0 H ALA A 72 -0.818 -10.853 6.586 1.00 0.00 H new ATOM 0 HA ALA A 72 -0.333 -8.047 6.895 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -1.658 -7.908 4.820 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -0.416 -9.178 4.707 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -2.116 -9.619 4.993 1.00 0.00 H new ATOM 1111 N LYS A 73 -2.402 -7.133 7.934 1.00 0.00 N ATOM 1112 CA LYS A 73 -3.589 -6.532 8.519 1.00 0.00 C ATOM 1113 C LYS A 73 -3.418 -5.018 8.559 1.00 0.00 C ATOM 1114 O LYS A 73 -2.285 -4.535 8.640 1.00 0.00 O ATOM 1115 CB LYS A 73 -3.762 -7.156 9.910 1.00 0.00 C ATOM 1116 CG LYS A 73 -4.859 -6.467 10.712 1.00 0.00 C ATOM 1117 CD LYS A 73 -5.431 -7.387 11.804 1.00 0.00 C ATOM 1118 CE LYS A 73 -6.914 -7.099 12.045 1.00 0.00 C ATOM 1119 NZ LYS A 73 -7.595 -8.136 12.853 1.00 0.00 N ATOM 0 H LYS A 73 -1.583 -6.525 7.953 1.00 0.00 H new ATOM 0 HA LYS A 73 -4.489 -6.723 7.934 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -4.000 -8.215 9.805 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -2.820 -7.093 10.455 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -4.460 -5.562 11.171 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -5.660 -6.157 10.041 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -5.303 -8.429 11.510 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -4.875 -7.246 12.731 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -7.012 -6.137 12.547 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -7.419 -7.010 11.083 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -8.595 -7.878 12.977 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -7.532 -9.053 12.366 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -7.137 -8.207 13.784 1.00 0.00 H new ATOM 1133 N MET A 74 -4.512 -4.258 8.483 1.00 0.00 N ATOM 1134 CA MET A 74 -4.474 -2.820 8.695 1.00 0.00 C ATOM 1135 C MET A 74 -4.426 -2.499 10.193 1.00 0.00 C ATOM 1136 O MET A 74 -5.070 -3.173 11.001 1.00 0.00 O ATOM 1137 CB MET A 74 -5.665 -2.169 7.996 1.00 0.00 C ATOM 1138 CG MET A 74 -6.986 -2.332 8.756 1.00 0.00 C ATOM 1139 SD MET A 74 -8.486 -1.694 7.964 1.00 0.00 S ATOM 1140 CE MET A 74 -7.794 -0.478 6.815 1.00 0.00 C ATOM 0 H MET A 74 -5.441 -4.624 8.274 1.00 0.00 H new ATOM 0 HA MET A 74 -3.566 -2.406 8.257 1.00 0.00 H new ATOM 0 HB2 MET A 74 -5.461 -1.107 7.862 1.00 0.00 H new ATOM 0 HB3 MET A 74 -5.772 -2.601 7.001 1.00 0.00 H new ATOM 0 HG2 MET A 74 -7.134 -3.394 8.951 1.00 0.00 H new ATOM 0 HG3 MET A 74 -6.881 -1.841 9.724 1.00 0.00 H new ATOM 0 HE1 MET A 74 -8.598 -0.029 6.232 1.00 0.00 H new ATOM 0 HE2 MET A 74 -7.275 0.299 7.376 1.00 0.00 H new ATOM 0 HE3 MET A 74 -7.091 -0.971 6.143 1.00 0.00 H new ATOM 1150 N PHE A 75 -3.699 -1.447 10.557 1.00 0.00 N ATOM 1151 CA PHE A 75 -3.438 -1.082 11.950 1.00 0.00 C ATOM 1152 C PHE A 75 -3.383 0.438 12.153 1.00 0.00 C ATOM 1153 O PHE A 75 -3.096 0.906 13.257 1.00 0.00 O ATOM 1154 CB PHE A 75 -2.139 -1.766 12.411 1.00 0.00 C ATOM 1155 CG PHE A 75 -0.873 -1.280 11.724 1.00 0.00 C ATOM 1156 CD1 PHE A 75 -0.600 -1.625 10.386 1.00 0.00 C ATOM 1157 CD2 PHE A 75 0.040 -0.474 12.429 1.00 0.00 C ATOM 1158 CE1 PHE A 75 0.566 -1.159 9.756 1.00 0.00 C ATOM 1159 CE2 PHE A 75 1.209 -0.015 11.797 1.00 0.00 C ATOM 1160 CZ PHE A 75 1.476 -0.362 10.463 1.00 0.00 C ATOM 0 H PHE A 75 -3.267 -0.813 9.884 1.00 0.00 H new ATOM 0 HA PHE A 75 -4.267 -1.433 12.564 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -2.030 -1.617 13.485 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -2.234 -2.839 12.246 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -1.291 -2.251 9.841 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -0.158 -0.208 13.457 1.00 0.00 H new ATOM 0 HE1 PHE A 75 0.761 -1.415 8.725 1.00 0.00 H new ATOM 0 HE2 PHE A 75 1.905 0.607 12.340 1.00 0.00 H new ATOM 0 HZ PHE A 75 2.380 -0.016 9.983 1.00 0.00 H new ATOM 1170 N LYS A 76 -3.640 1.227 11.103 1.00 0.00 N ATOM 1171 CA LYS A 76 -3.659 2.681 11.176 1.00 0.00 C ATOM 1172 C LYS A 76 -4.482 3.193 10.003 1.00 0.00 C ATOM 1173 O LYS A 76 -4.499 2.568 8.935 1.00 0.00 O ATOM 1174 CB LYS A 76 -2.211 3.199 11.187 1.00 0.00 C ATOM 1175 CG LYS A 76 -2.117 4.709 11.402 1.00 0.00 C ATOM 1176 CD LYS A 76 -0.689 5.108 11.790 1.00 0.00 C ATOM 1177 CE LYS A 76 -0.399 6.537 11.323 1.00 0.00 C ATOM 1178 NZ LYS A 76 0.872 7.034 11.874 1.00 0.00 N ATOM 0 H LYS A 76 -3.842 0.864 10.172 1.00 0.00 H new ATOM 0 HA LYS A 76 -4.124 3.047 12.091 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -1.655 2.690 11.975 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -1.732 2.942 10.242 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -2.412 5.231 10.492 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -2.812 5.015 12.184 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -0.564 5.037 12.870 1.00 0.00 H new ATOM 0 HD3 LYS A 76 0.025 4.418 11.341 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -0.361 6.565 10.234 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -1.212 7.194 11.631 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 1.040 8.004 11.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 0.825 7.029 12.913 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 1.650 6.420 11.560 1.00 0.00 H new ATOM 1192 N SER A 77 -5.205 4.285 10.186 1.00 0.00 N ATOM 1193 CA SER A 77 -6.109 4.856 9.206 1.00 0.00 C ATOM 1194 C SER A 77 -6.177 6.343 9.518 1.00 0.00 C ATOM 1195 O SER A 77 -6.738 6.712 10.545 1.00 0.00 O ATOM 1196 CB SER A 77 -7.477 4.153 9.284 1.00 0.00 C ATOM 1197 OG SER A 77 -7.993 4.048 10.600 1.00 0.00 O ATOM 0 H SER A 77 -5.176 4.817 11.055 1.00 0.00 H new ATOM 0 HA SER A 77 -5.768 4.716 8.180 1.00 0.00 H new ATOM 0 HB2 SER A 77 -8.191 4.698 8.667 1.00 0.00 H new ATOM 0 HB3 SER A 77 -7.386 3.153 8.859 1.00 0.00 H new ATOM 0 HG SER A 77 -7.788 4.867 11.098 1.00 0.00 H new ATOM 1203 N ASP A 78 -5.555 7.178 8.691 1.00 0.00 N ATOM 1204 CA ASP A 78 -5.594 8.635 8.848 1.00 0.00 C ATOM 1205 C ASP A 78 -6.766 9.192 8.031 1.00 0.00 C ATOM 1206 O ASP A 78 -7.658 8.421 7.652 1.00 0.00 O ATOM 1207 CB ASP A 78 -4.213 9.218 8.526 1.00 0.00 C ATOM 1208 CG ASP A 78 -3.934 10.434 9.401 1.00 0.00 C ATOM 1209 OD1 ASP A 78 -4.517 11.505 9.136 1.00 0.00 O ATOM 1210 OD2 ASP A 78 -3.125 10.304 10.350 1.00 0.00 O ATOM 0 H ASP A 78 -5.007 6.866 7.889 1.00 0.00 H new ATOM 0 HA ASP A 78 -5.791 8.938 9.876 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -3.445 8.462 8.688 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -4.166 9.500 7.474 1.00 0.00 H new ATOM 1215 N ALA A 79 -6.843 10.504 7.808 1.00 0.00 N ATOM 1216 CA ALA A 79 -7.837 11.100 6.909 1.00 0.00 C ATOM 1217 C ALA A 79 -7.212 12.178 6.007 1.00 0.00 C ATOM 1218 O ALA A 79 -6.592 13.119 6.514 1.00 0.00 O ATOM 1219 CB ALA A 79 -9.036 11.591 7.740 1.00 0.00 C ATOM 0 H ALA A 79 -6.220 11.184 8.244 1.00 0.00 H new ATOM 0 HA ALA A 79 -8.211 10.348 6.214 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -9.780 12.036 7.078 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -9.480 10.749 8.271 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -8.699 12.337 8.460 1.00 0.00 H new ATOM 1225 N ILE A 80 -7.358 12.039 4.677 1.00 0.00 N ATOM 1226 CA ILE A 80 -6.822 12.974 3.683 1.00 0.00 C ATOM 1227 C ILE A 80 -7.907 14.019 3.448 1.00 0.00 C ATOM 1228 O ILE A 80 -8.953 13.693 2.871 1.00 0.00 O ATOM 1229 CB ILE A 80 -6.447 12.280 2.342 1.00 0.00 C ATOM 1230 CG1 ILE A 80 -5.531 11.061 2.543 1.00 0.00 C ATOM 1231 CG2 ILE A 80 -5.784 13.295 1.392 1.00 0.00 C ATOM 1232 CD1 ILE A 80 -5.143 10.345 1.249 1.00 0.00 C ATOM 0 H ILE A 80 -7.862 11.257 4.259 1.00 0.00 H new ATOM 0 HA ILE A 80 -5.898 13.414 4.057 1.00 0.00 H new ATOM 0 HB ILE A 80 -7.372 11.912 1.899 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -4.623 11.384 3.052 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -6.031 10.351 3.202 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -5.525 12.801 0.456 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -6.477 14.112 1.191 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -4.881 13.691 1.856 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -4.497 9.498 1.481 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -6.042 9.988 0.747 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -4.613 11.037 0.595 1.00 0.00 H new ATOM 1244 N LEU A 81 -7.705 15.254 3.905 1.00 0.00 N ATOM 1245 CA LEU A 81 -8.527 16.356 3.416 1.00 0.00 C ATOM 1246 C LEU A 81 -7.943 16.843 2.090 1.00 0.00 C ATOM 1247 O LEU A 81 -6.759 16.657 1.825 1.00 0.00 O ATOM 1248 CB LEU A 81 -8.630 17.501 4.427 1.00 0.00 C ATOM 1249 CG LEU A 81 -9.307 17.130 5.756 1.00 0.00 C ATOM 1250 CD1 LEU A 81 -9.408 18.383 6.622 1.00 0.00 C ATOM 1251 CD2 LEU A 81 -10.706 16.527 5.567 1.00 0.00 C ATOM 0 H LEU A 81 -6.999 15.512 4.594 1.00 0.00 H new ATOM 0 HA LEU A 81 -9.545 15.995 3.268 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -7.627 17.872 4.638 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -9.184 18.321 3.970 1.00 0.00 H new ATOM 0 HG LEU A 81 -8.695 16.367 6.236 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -9.887 18.133 7.569 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -8.409 18.775 6.813 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -10.000 19.137 6.103 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -11.133 16.286 6.541 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -11.347 17.247 5.058 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -10.633 15.619 4.968 1.00 0.00 H new ATOM 1263 N GLY A 82 -8.752 17.477 1.242 1.00 0.00 N ATOM 1264 CA GLY A 82 -8.412 17.829 -0.128 1.00 0.00 C ATOM 1265 C GLY A 82 -8.487 19.329 -0.359 1.00 0.00 C ATOM 1266 O GLY A 82 -9.215 19.760 -1.251 1.00 0.00 O ATOM 0 H GLY A 82 -9.694 17.768 1.503 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -7.406 17.476 -0.355 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -9.091 17.321 -0.813 1.00 0.00 H new ATOM 1270 N GLN A 83 -7.734 20.105 0.423 1.00 0.00 N ATOM 1271 CA GLN A 83 -7.595 21.561 0.389 1.00 0.00 C ATOM 1272 C GLN A 83 -8.877 22.275 0.827 1.00 0.00 C ATOM 1273 O GLN A 83 -8.854 23.022 1.800 1.00 0.00 O ATOM 1274 CB GLN A 83 -7.040 22.014 -0.973 1.00 0.00 C ATOM 1275 CG GLN A 83 -6.765 23.515 -1.050 1.00 0.00 C ATOM 1276 CD GLN A 83 -5.683 24.008 -0.090 1.00 0.00 C ATOM 1277 OE1 GLN A 83 -5.971 24.667 0.899 1.00 0.00 O ATOM 1278 NE2 GLN A 83 -4.426 23.706 -0.371 1.00 0.00 N ATOM 0 H GLN A 83 -7.157 19.696 1.158 1.00 0.00 H new ATOM 0 HA GLN A 83 -6.857 21.864 1.132 1.00 0.00 H new ATOM 0 HB2 GLN A 83 -6.117 21.472 -1.179 1.00 0.00 H new ATOM 0 HB3 GLN A 83 -7.750 21.742 -1.754 1.00 0.00 H new ATOM 0 HG2 GLN A 83 -6.472 23.767 -2.069 1.00 0.00 H new ATOM 0 HG3 GLN A 83 -7.690 24.053 -0.843 1.00 0.00 H new ATOM 0 HE21 GLN A 83 -4.207 23.155 -1.201 1.00 0.00 H new ATOM 0 HE22 GLN A 83 -3.676 24.024 0.242 1.00 0.00 H new ATOM 1287 N ASN A 84 -10.004 22.064 0.143 1.00 0.00 N ATOM 1288 CA ASN A 84 -11.277 22.680 0.518 1.00 0.00 C ATOM 1289 C ASN A 84 -11.968 21.852 1.607 1.00 0.00 C ATOM 1290 O ASN A 84 -13.152 21.522 1.476 1.00 0.00 O ATOM 1291 CB ASN A 84 -12.231 22.817 -0.668 1.00 0.00 C ATOM 1292 CG ASN A 84 -11.654 23.560 -1.863 1.00 0.00 C ATOM 1293 OD1 ASN A 84 -11.450 24.767 -1.825 1.00 0.00 O ATOM 1294 ND2 ASN A 84 -11.393 22.869 -2.963 1.00 0.00 N ATOM 0 H ASN A 84 -10.059 21.465 -0.681 1.00 0.00 H new ATOM 0 HA ASN A 84 -11.042 23.679 0.887 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -12.536 21.821 -0.989 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -13.131 23.334 -0.335 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -11.019 23.342 -3.786 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -11.566 21.864 -2.987 1.00 0.00 H new ATOM 1301 N LYS A 85 -11.239 21.468 2.656 1.00 0.00 N ATOM 1302 CA LYS A 85 -11.659 20.692 3.814 1.00 0.00 C ATOM 1303 C LYS A 85 -12.396 19.376 3.525 1.00 0.00 C ATOM 1304 O LYS A 85 -13.039 18.820 4.420 1.00 0.00 O ATOM 1305 CB LYS A 85 -12.356 21.644 4.774 1.00 0.00 C ATOM 1306 CG LYS A 85 -13.795 21.923 4.363 1.00 0.00 C ATOM 1307 CD LYS A 85 -14.687 22.240 5.554 1.00 0.00 C ATOM 1308 CE LYS A 85 -14.984 23.726 5.748 1.00 0.00 C ATOM 1309 NZ LYS A 85 -16.105 24.196 4.918 1.00 0.00 N ATOM 0 H LYS A 85 -10.252 21.717 2.718 1.00 0.00 H new ATOM 0 HA LYS A 85 -10.772 20.280 4.295 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -12.342 21.220 5.778 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -11.804 22.583 4.817 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -13.815 22.760 3.665 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -14.193 21.057 3.834 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -15.630 21.707 5.437 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -14.214 21.856 6.458 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -15.212 23.912 6.798 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -14.092 24.305 5.508 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -16.263 25.210 5.089 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -15.880 24.045 3.914 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -16.965 23.666 5.164 1.00 0.00 H new ATOM 1323 N VAL A 86 -12.344 18.900 2.285 1.00 0.00 N ATOM 1324 CA VAL A 86 -13.099 17.770 1.761 1.00 0.00 C ATOM 1325 C VAL A 86 -12.364 16.468 2.043 1.00 0.00 C ATOM 1326 O VAL A 86 -11.210 16.336 1.652 1.00 0.00 O ATOM 1327 CB VAL A 86 -13.488 17.982 0.289 1.00 0.00 C ATOM 1328 CG1 VAL A 86 -12.311 18.524 -0.491 1.00 0.00 C ATOM 1329 CG2 VAL A 86 -14.017 16.702 -0.381 1.00 0.00 C ATOM 0 H VAL A 86 -11.738 19.318 1.579 1.00 0.00 H new ATOM 0 HA VAL A 86 -14.051 17.696 2.286 1.00 0.00 H new ATOM 0 HB VAL A 86 -14.302 18.706 0.281 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -12.600 18.669 -1.532 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -12.000 19.477 -0.064 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -11.484 17.816 -0.440 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -14.275 16.914 -1.418 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -13.248 15.930 -0.349 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -14.903 16.353 0.149 1.00 0.00 H new ATOM 1339 N VAL A 87 -13.016 15.487 2.666 1.00 0.00 N ATOM 1340 CA VAL A 87 -12.530 14.112 2.682 1.00 0.00 C ATOM 1341 C VAL A 87 -12.542 13.564 1.250 1.00 0.00 C ATOM 1342 O VAL A 87 -13.571 13.110 0.736 1.00 0.00 O ATOM 1343 CB VAL A 87 -13.299 13.276 3.724 1.00 0.00 C ATOM 1344 CG1 VAL A 87 -14.825 13.453 3.671 1.00 0.00 C ATOM 1345 CG2 VAL A 87 -12.908 11.793 3.683 1.00 0.00 C ATOM 0 H VAL A 87 -13.892 15.624 3.171 1.00 0.00 H new ATOM 0 HA VAL A 87 -11.493 14.059 3.014 1.00 0.00 H new ATOM 0 HB VAL A 87 -12.987 13.680 4.687 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -15.290 12.831 4.436 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -15.077 14.498 3.851 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -15.192 13.156 2.689 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -13.476 11.246 4.435 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -13.127 11.386 2.696 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -11.842 11.692 3.889 1.00 0.00 H new ATOM 1355 N ILE A 88 -11.398 13.667 0.574 1.00 0.00 N ATOM 1356 CA ILE A 88 -11.198 13.082 -0.746 1.00 0.00 C ATOM 1357 C ILE A 88 -10.959 11.576 -0.630 1.00 0.00 C ATOM 1358 O ILE A 88 -11.327 10.824 -1.532 1.00 0.00 O ATOM 1359 CB ILE A 88 -10.066 13.809 -1.509 1.00 0.00 C ATOM 1360 CG1 ILE A 88 -8.724 13.895 -0.748 1.00 0.00 C ATOM 1361 CG2 ILE A 88 -10.574 15.213 -1.878 1.00 0.00 C ATOM 1362 CD1 ILE A 88 -7.573 14.350 -1.660 1.00 0.00 C ATOM 0 H ILE A 88 -10.581 14.162 0.931 1.00 0.00 H new ATOM 0 HA ILE A 88 -12.105 13.219 -1.335 1.00 0.00 H new ATOM 0 HB ILE A 88 -9.836 13.217 -2.395 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -8.823 14.591 0.085 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -8.486 12.920 -0.322 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -9.795 15.751 -2.418 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -11.459 15.126 -2.508 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -10.828 15.758 -0.969 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -6.649 14.397 -1.084 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -7.455 13.640 -2.479 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -7.798 15.337 -2.065 1.00 0.00 H new ATOM 1374 N GLY A 89 -10.400 11.113 0.485 1.00 0.00 N ATOM 1375 CA GLY A 89 -10.084 9.718 0.724 1.00 0.00 C ATOM 1376 C GLY A 89 -9.332 9.592 2.038 1.00 0.00 C ATOM 1377 O GLY A 89 -9.340 10.521 2.853 1.00 0.00 O ATOM 0 H GLY A 89 -10.149 11.720 1.266 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -10.999 9.126 0.757 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -9.480 9.325 -0.093 1.00 0.00 H new ATOM 1381 N TRP A 90 -8.688 8.445 2.252 1.00 0.00 N ATOM 1382 CA TRP A 90 -7.949 8.180 3.470 1.00 0.00 C ATOM 1383 C TRP A 90 -6.705 7.389 3.114 1.00 0.00 C ATOM 1384 O TRP A 90 -6.709 6.612 2.152 1.00 0.00 O ATOM 1385 CB TRP A 90 -8.815 7.371 4.435 1.00 0.00 C ATOM 1386 CG TRP A 90 -10.154 7.948 4.752 1.00 0.00 C ATOM 1387 CD1 TRP A 90 -10.471 8.702 5.824 1.00 0.00 C ATOM 1388 CD2 TRP A 90 -11.382 7.807 3.984 1.00 0.00 C ATOM 1389 NE1 TRP A 90 -11.787 9.100 5.727 1.00 0.00 N ATOM 1390 CE2 TRP A 90 -12.408 8.556 4.624 1.00 0.00 C ATOM 1391 CE3 TRP A 90 -11.728 7.103 2.816 1.00 0.00 C ATOM 1392 CZ2 TRP A 90 -13.712 8.622 4.112 1.00 0.00 C ATOM 1393 CZ3 TRP A 90 -13.025 7.184 2.278 1.00 0.00 C ATOM 1394 CH2 TRP A 90 -14.013 7.953 2.915 1.00 0.00 C ATOM 0 H TRP A 90 -8.668 7.677 1.581 1.00 0.00 H new ATOM 0 HA TRP A 90 -7.672 9.119 3.950 1.00 0.00 H new ATOM 0 HB2 TRP A 90 -8.960 6.376 4.015 1.00 0.00 H new ATOM 0 HB3 TRP A 90 -8.265 7.246 5.368 1.00 0.00 H new ATOM 0 HD1 TRP A 90 -9.800 8.954 6.631 1.00 0.00 H new ATOM 0 HE1 TRP A 90 -12.246 9.723 6.392 1.00 0.00 H new ATOM 0 HE3 TRP A 90 -10.986 6.491 2.325 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 -14.476 9.181 4.632 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 -13.263 6.651 1.369 1.00 0.00 H new ATOM 0 HH2 TRP A 90 -15.001 8.029 2.485 1.00 0.00 H new ATOM 1405 N ASP A 91 -5.686 7.537 3.948 1.00 0.00 N ATOM 1406 CA ASP A 91 -4.524 6.681 3.972 1.00 0.00 C ATOM 1407 C ASP A 91 -4.807 5.617 5.028 1.00 0.00 C ATOM 1408 O ASP A 91 -4.611 5.818 6.231 1.00 0.00 O ATOM 1409 CB ASP A 91 -3.220 7.482 4.195 1.00 0.00 C ATOM 1410 CG ASP A 91 -2.595 7.906 2.860 1.00 0.00 C ATOM 1411 OD1 ASP A 91 -2.472 7.013 1.992 1.00 0.00 O ATOM 1412 OD2 ASP A 91 -2.219 9.094 2.708 1.00 0.00 O ATOM 0 H ASP A 91 -5.651 8.281 4.645 1.00 0.00 H new ATOM 0 HA ASP A 91 -4.351 6.196 3.011 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -3.431 8.365 4.798 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -2.509 6.876 4.756 1.00 0.00 H new ATOM 1417 N LYS A 92 -5.406 4.508 4.579 1.00 0.00 N ATOM 1418 CA LYS A 92 -5.482 3.262 5.340 1.00 0.00 C ATOM 1419 C LYS A 92 -4.166 2.504 5.142 1.00 0.00 C ATOM 1420 O LYS A 92 -3.922 1.969 4.059 1.00 0.00 O ATOM 1421 CB LYS A 92 -6.678 2.410 4.884 1.00 0.00 C ATOM 1422 CG LYS A 92 -7.983 2.681 5.649 1.00 0.00 C ATOM 1423 CD LYS A 92 -8.585 4.078 5.470 1.00 0.00 C ATOM 1424 CE LYS A 92 -10.100 4.031 5.756 1.00 0.00 C ATOM 1425 NZ LYS A 92 -10.690 5.318 6.184 1.00 0.00 N ATOM 0 H LYS A 92 -5.856 4.453 3.665 1.00 0.00 H new ATOM 0 HA LYS A 92 -5.631 3.482 6.397 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -6.851 2.588 3.823 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -6.420 1.357 4.993 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -8.724 1.945 5.338 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -7.799 2.519 6.711 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -8.099 4.783 6.145 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -8.407 4.434 4.455 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -10.615 3.692 4.857 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -10.287 3.286 6.530 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -11.680 5.169 6.467 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -10.152 5.696 6.990 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -10.654 5.996 5.396 1.00 0.00 H new ATOM 1439 N TYR A 93 -3.338 2.459 6.181 1.00 0.00 N ATOM 1440 CA TYR A 93 -2.053 1.774 6.185 1.00 0.00 C ATOM 1441 C TYR A 93 -2.258 0.265 6.377 1.00 0.00 C ATOM 1442 O TYR A 93 -3.206 -0.156 7.049 1.00 0.00 O ATOM 1443 CB TYR A 93 -1.213 2.314 7.347 1.00 0.00 C ATOM 1444 CG TYR A 93 -0.890 3.800 7.329 1.00 0.00 C ATOM 1445 CD1 TYR A 93 -1.824 4.735 7.814 1.00 0.00 C ATOM 1446 CD2 TYR A 93 0.372 4.248 6.895 1.00 0.00 C ATOM 1447 CE1 TYR A 93 -1.482 6.093 7.907 1.00 0.00 C ATOM 1448 CE2 TYR A 93 0.725 5.607 6.995 1.00 0.00 C ATOM 1449 CZ TYR A 93 -0.202 6.536 7.518 1.00 0.00 C ATOM 1450 OH TYR A 93 0.120 7.848 7.682 1.00 0.00 O ATOM 0 H TYR A 93 -3.551 2.912 7.070 1.00 0.00 H new ATOM 0 HA TYR A 93 -1.548 1.947 5.235 1.00 0.00 H new ATOM 0 HB2 TYR A 93 -1.737 2.092 8.277 1.00 0.00 H new ATOM 0 HB3 TYR A 93 -0.273 1.763 7.371 1.00 0.00 H new ATOM 0 HD1 TYR A 93 -2.807 4.406 8.116 1.00 0.00 H new ATOM 0 HD2 TYR A 93 1.077 3.542 6.481 1.00 0.00 H new ATOM 0 HE1 TYR A 93 -2.205 6.804 8.279 1.00 0.00 H new ATOM 0 HE2 TYR A 93 1.701 5.938 6.673 1.00 0.00 H new ATOM 0 HH TYR A 93 1.036 8.002 7.369 1.00 0.00 H new ATOM 1460 N PHE A 94 -1.327 -0.555 5.873 1.00 0.00 N ATOM 1461 CA PHE A 94 -1.370 -2.019 5.947 1.00 0.00 C ATOM 1462 C PHE A 94 -0.012 -2.590 6.354 1.00 0.00 C ATOM 1463 O PHE A 94 1.014 -2.006 5.996 1.00 0.00 O ATOM 1464 CB PHE A 94 -1.778 -2.582 4.579 1.00 0.00 C ATOM 1465 CG PHE A 94 -3.265 -2.469 4.302 1.00 0.00 C ATOM 1466 CD1 PHE A 94 -3.804 -1.284 3.767 1.00 0.00 C ATOM 1467 CD2 PHE A 94 -4.123 -3.535 4.634 1.00 0.00 C ATOM 1468 CE1 PHE A 94 -5.192 -1.160 3.589 1.00 0.00 C ATOM 1469 CE2 PHE A 94 -5.510 -3.420 4.429 1.00 0.00 C ATOM 1470 CZ PHE A 94 -6.045 -2.227 3.918 1.00 0.00 C ATOM 0 H PHE A 94 -0.500 -0.207 5.389 1.00 0.00 H new ATOM 0 HA PHE A 94 -2.100 -2.308 6.703 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -1.229 -2.055 3.799 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -1.484 -3.630 4.523 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -3.150 -0.469 3.493 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -3.714 -4.445 5.048 1.00 0.00 H new ATOM 0 HE1 PHE A 94 -5.605 -0.242 3.198 1.00 0.00 H new ATOM 0 HE2 PHE A 94 -6.162 -4.248 4.664 1.00 0.00 H new ATOM 0 HZ PHE A 94 -7.111 -2.129 3.778 1.00 0.00 H new ATOM 1480 N GLU A 95 -0.005 -3.734 7.053 1.00 0.00 N ATOM 1481 CA GLU A 95 1.214 -4.413 7.515 1.00 0.00 C ATOM 1482 C GLU A 95 1.508 -5.678 6.700 1.00 0.00 C ATOM 1483 O GLU A 95 1.461 -6.782 7.234 1.00 0.00 O ATOM 1484 CB GLU A 95 1.033 -4.744 9.005 1.00 0.00 C ATOM 1485 CG GLU A 95 2.351 -5.128 9.692 1.00 0.00 C ATOM 1486 CD GLU A 95 2.310 -5.001 11.216 1.00 0.00 C ATOM 1487 OE1 GLU A 95 1.215 -4.994 11.827 1.00 0.00 O ATOM 1488 OE2 GLU A 95 3.400 -4.909 11.820 1.00 0.00 O ATOM 0 H GLU A 95 -0.861 -4.222 7.318 1.00 0.00 H new ATOM 0 HA GLU A 95 2.072 -3.756 7.375 1.00 0.00 H new ATOM 0 HB2 GLU A 95 0.600 -3.883 9.514 1.00 0.00 H new ATOM 0 HB3 GLU A 95 0.323 -5.564 9.107 1.00 0.00 H new ATOM 0 HG2 GLU A 95 2.602 -6.156 9.429 1.00 0.00 H new ATOM 0 HG3 GLU A 95 3.150 -4.496 9.305 1.00 0.00 H new ATOM 1495 N ILE A 96 1.744 -5.564 5.396 1.00 0.00 N ATOM 1496 CA ILE A 96 1.923 -6.751 4.556 1.00 0.00 C ATOM 1497 C ILE A 96 3.282 -7.411 4.898 1.00 0.00 C ATOM 1498 O ILE A 96 4.181 -6.721 5.380 1.00 0.00 O ATOM 1499 CB ILE A 96 1.769 -6.341 3.072 1.00 0.00 C ATOM 1500 CG1 ILE A 96 0.456 -5.554 2.819 1.00 0.00 C ATOM 1501 CG2 ILE A 96 1.721 -7.527 2.099 1.00 0.00 C ATOM 1502 CD1 ILE A 96 0.695 -4.063 2.649 1.00 0.00 C ATOM 0 H ILE A 96 1.816 -4.675 4.900 1.00 0.00 H new ATOM 0 HA ILE A 96 1.160 -7.506 4.748 1.00 0.00 H new ATOM 0 HB ILE A 96 2.657 -5.736 2.887 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -0.032 -5.945 1.926 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -0.228 -5.716 3.652 1.00 0.00 H new ATOM 0 HG21 ILE A 96 1.612 -7.157 1.080 1.00 0.00 H new ATOM 0 HG22 ILE A 96 2.644 -8.101 2.180 1.00 0.00 H new ATOM 0 HG23 ILE A 96 0.873 -8.166 2.346 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -0.256 -3.560 2.475 1.00 0.00 H new ATOM 0 HD12 ILE A 96 1.157 -3.663 3.552 1.00 0.00 H new ATOM 0 HD13 ILE A 96 1.356 -3.895 1.799 1.00 0.00 H new ATOM 1514 N PRO A 97 3.468 -8.730 4.706 1.00 0.00 N ATOM 1515 CA PRO A 97 4.791 -9.350 4.669 1.00 0.00 C ATOM 1516 C PRO A 97 5.575 -8.883 3.440 1.00 0.00 C ATOM 1517 O PRO A 97 5.050 -8.186 2.574 1.00 0.00 O ATOM 1518 CB PRO A 97 4.544 -10.866 4.600 1.00 0.00 C ATOM 1519 CG PRO A 97 3.116 -10.997 4.102 1.00 0.00 C ATOM 1520 CD PRO A 97 2.429 -9.734 4.587 1.00 0.00 C ATOM 0 HA PRO A 97 5.380 -9.077 5.544 1.00 0.00 H new ATOM 0 HB2 PRO A 97 5.246 -11.352 3.923 1.00 0.00 H new ATOM 0 HB3 PRO A 97 4.668 -11.333 5.577 1.00 0.00 H new ATOM 0 HG2 PRO A 97 3.080 -11.077 3.016 1.00 0.00 H new ATOM 0 HG3 PRO A 97 2.636 -11.890 4.503 1.00 0.00 H new ATOM 0 HD2 PRO A 97 1.658 -9.416 3.885 1.00 0.00 H new ATOM 0 HD3 PRO A 97 1.938 -9.901 5.545 1.00 0.00 H new ATOM 1528 N MET A 98 6.803 -9.376 3.309 1.00 0.00 N ATOM 1529 CA MET A 98 7.614 -9.329 2.093 1.00 0.00 C ATOM 1530 C MET A 98 7.937 -10.724 1.570 1.00 0.00 C ATOM 1531 O MET A 98 8.819 -10.899 0.734 1.00 0.00 O ATOM 1532 CB MET A 98 8.896 -8.540 2.375 1.00 0.00 C ATOM 1533 CG MET A 98 8.610 -7.058 2.230 1.00 0.00 C ATOM 1534 SD MET A 98 10.061 -6.003 2.070 1.00 0.00 S ATOM 1535 CE MET A 98 10.333 -5.660 3.810 1.00 0.00 C ATOM 0 H MET A 98 7.283 -9.840 4.081 1.00 0.00 H new ATOM 0 HA MET A 98 7.041 -8.828 1.313 1.00 0.00 H new ATOM 0 HB2 MET A 98 9.257 -8.756 3.380 1.00 0.00 H new ATOM 0 HB3 MET A 98 9.682 -8.841 1.682 1.00 0.00 H new ATOM 0 HG2 MET A 98 7.977 -6.911 1.355 1.00 0.00 H new ATOM 0 HG3 MET A 98 8.037 -6.729 3.097 1.00 0.00 H new ATOM 0 HE1 MET A 98 11.191 -4.997 3.920 1.00 0.00 H new ATOM 0 HE2 MET A 98 9.448 -5.181 4.229 1.00 0.00 H new ATOM 0 HE3 MET A 98 10.525 -6.593 4.339 1.00 0.00 H new ATOM 1545 N ASP A 99 7.226 -11.721 2.082 1.00 0.00 N ATOM 1546 CA ASP A 99 7.533 -13.131 1.905 1.00 0.00 C ATOM 1547 C ASP A 99 6.260 -13.949 1.648 1.00 0.00 C ATOM 1548 O ASP A 99 6.325 -15.182 1.654 1.00 0.00 O ATOM 1549 CB ASP A 99 8.264 -13.614 3.172 1.00 0.00 C ATOM 1550 CG ASP A 99 9.502 -14.463 2.898 1.00 0.00 C ATOM 1551 OD1 ASP A 99 9.506 -15.342 2.009 1.00 0.00 O ATOM 1552 OD2 ASP A 99 10.475 -14.298 3.670 1.00 0.00 O ATOM 0 H ASP A 99 6.393 -11.563 2.650 1.00 0.00 H new ATOM 0 HA ASP A 99 8.170 -13.270 1.031 1.00 0.00 H new ATOM 0 HB2 ASP A 99 8.557 -12.745 3.762 1.00 0.00 H new ATOM 0 HB3 ASP A 99 7.569 -14.192 3.780 1.00 0.00 H new ATOM 1557 N ALA A 100 5.085 -13.306 1.467 1.00 0.00 N ATOM 1558 CA ALA A 100 3.845 -14.086 1.309 1.00 0.00 C ATOM 1559 C ALA A 100 3.034 -13.603 0.123 1.00 0.00 C ATOM 1560 O ALA A 100 1.854 -13.924 -0.024 1.00 0.00 O ATOM 1561 CB ALA A 100 3.023 -14.110 2.599 1.00 0.00 C ATOM 0 H ALA A 100 4.972 -12.293 1.428 1.00 0.00 H new ATOM 0 HA ALA A 100 4.131 -15.117 1.101 1.00 0.00 H new ATOM 0 HB1 ALA A 100 2.117 -14.695 2.442 1.00 0.00 H new ATOM 0 HB2 ALA A 100 3.612 -14.561 3.397 1.00 0.00 H new ATOM 0 HB3 ALA A 100 2.754 -13.091 2.878 1.00 0.00 H new ATOM 1567 N LEU A 101 3.640 -12.766 -0.700 1.00 0.00 N ATOM 1568 CA LEU A 101 3.095 -12.292 -1.935 1.00 0.00 C ATOM 1569 C LEU A 101 3.356 -13.327 -3.001 1.00 0.00 C ATOM 1570 O LEU A 101 4.273 -14.130 -2.875 1.00 0.00 O ATOM 1571 CB LEU A 101 3.816 -10.997 -2.264 1.00 0.00 C ATOM 1572 CG LEU A 101 3.758 -9.993 -1.120 1.00 0.00 C ATOM 1573 CD1 LEU A 101 2.331 -9.761 -0.601 1.00 0.00 C ATOM 1574 CD2 LEU A 101 4.794 -10.113 -0.026 1.00 0.00 C ATOM 0 H LEU A 101 4.567 -12.388 -0.506 1.00 0.00 H new ATOM 0 HA LEU A 101 2.020 -12.120 -1.872 1.00 0.00 H new ATOM 0 HB2 LEU A 101 4.858 -11.214 -2.501 1.00 0.00 H new ATOM 0 HB3 LEU A 101 3.372 -10.554 -3.156 1.00 0.00 H new ATOM 0 HG LEU A 101 4.080 -9.072 -1.607 1.00 0.00 H new ATOM 0 HD11 LEU A 101 2.353 -9.036 0.213 1.00 0.00 H new ATOM 0 HD12 LEU A 101 1.707 -9.379 -1.409 1.00 0.00 H new ATOM 0 HD13 LEU A 101 1.918 -10.702 -0.238 1.00 0.00 H new ATOM 0 HD21 LEU A 101 4.629 -9.334 0.718 1.00 0.00 H new ATOM 0 HD22 LEU A 101 4.711 -11.091 0.448 1.00 0.00 H new ATOM 0 HD23 LEU A 101 5.790 -10.001 -0.454 1.00 0.00 H new ATOM 1586 N GLN A 102 2.567 -13.275 -4.067 1.00 0.00 N ATOM 1587 CA GLN A 102 2.658 -14.189 -5.179 1.00 0.00 C ATOM 1588 C GLN A 102 4.020 -14.124 -5.890 1.00 0.00 C ATOM 1589 O GLN A 102 4.345 -15.038 -6.645 1.00 0.00 O ATOM 1590 CB GLN A 102 1.471 -13.842 -6.076 1.00 0.00 C ATOM 1591 CG GLN A 102 1.320 -14.812 -7.228 1.00 0.00 C ATOM 1592 CD GLN A 102 0.089 -14.484 -8.057 1.00 0.00 C ATOM 1593 OE1 GLN A 102 0.076 -13.508 -8.811 1.00 0.00 O ATOM 1594 NE2 GLN A 102 -0.980 -15.248 -7.926 1.00 0.00 N ATOM 0 H GLN A 102 1.832 -12.577 -4.177 1.00 0.00 H new ATOM 0 HA GLN A 102 2.605 -15.229 -4.858 1.00 0.00 H new ATOM 0 HB2 GLN A 102 0.557 -13.842 -5.482 1.00 0.00 H new ATOM 0 HB3 GLN A 102 1.597 -12.833 -6.468 1.00 0.00 H new ATOM 0 HG2 GLN A 102 2.208 -14.775 -7.859 1.00 0.00 H new ATOM 0 HG3 GLN A 102 1.244 -15.829 -6.844 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -0.958 -16.053 -7.300 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -1.828 -15.033 -8.451 1.00 0.00 H new ATOM 1603 N ASP A 103 4.813 -13.084 -5.649 1.00 0.00 N ATOM 1604 CA ASP A 103 6.128 -12.873 -6.236 1.00 0.00 C ATOM 1605 C ASP A 103 6.888 -11.873 -5.363 1.00 0.00 C ATOM 1606 O ASP A 103 6.327 -11.386 -4.379 1.00 0.00 O ATOM 1607 CB ASP A 103 5.925 -12.288 -7.628 1.00 0.00 C ATOM 1608 CG ASP A 103 7.195 -12.149 -8.438 1.00 0.00 C ATOM 1609 OD1 ASP A 103 8.154 -12.916 -8.222 1.00 0.00 O ATOM 1610 OD2 ASP A 103 7.164 -11.236 -9.295 1.00 0.00 O ATOM 0 H ASP A 103 4.543 -12.335 -5.012 1.00 0.00 H new ATOM 0 HA ASP A 103 6.691 -13.804 -6.299 1.00 0.00 H new ATOM 0 HB2 ASP A 103 5.226 -12.920 -8.176 1.00 0.00 H new ATOM 0 HB3 ASP A 103 5.460 -11.307 -7.532 1.00 0.00 H new ATOM 1615 N ASN A 104 8.100 -11.477 -5.753 1.00 0.00 N ATOM 1616 CA ASN A 104 8.866 -10.374 -5.164 1.00 0.00 C ATOM 1617 C ASN A 104 8.275 -9.029 -5.599 1.00 0.00 C ATOM 1618 O ASN A 104 8.986 -8.095 -5.967 1.00 0.00 O ATOM 1619 CB ASN A 104 10.362 -10.488 -5.519 1.00 0.00 C ATOM 1620 CG ASN A 104 11.067 -11.608 -4.769 1.00 0.00 C ATOM 1621 OD1 ASN A 104 10.450 -12.583 -4.347 1.00 0.00 O ATOM 1622 ND2 ASN A 104 12.357 -11.468 -4.537 1.00 0.00 N ATOM 0 H ASN A 104 8.596 -11.933 -6.519 1.00 0.00 H new ATOM 0 HA ASN A 104 8.792 -10.435 -4.078 1.00 0.00 H new ATOM 0 HB2 ASN A 104 10.464 -10.656 -6.591 1.00 0.00 H new ATOM 0 HB3 ASN A 104 10.856 -9.542 -5.296 1.00 0.00 H new ATOM 0 HD21 ASN A 104 12.858 -12.175 -4.000 1.00 0.00 H new ATOM 0 HD22 ASN A 104 12.854 -10.652 -4.895 1.00 0.00 H new ATOM 1629 N SER A 105 6.950 -8.916 -5.602 1.00 0.00 N ATOM 1630 CA SER A 105 6.254 -7.673 -5.825 1.00 0.00 C ATOM 1631 C SER A 105 5.035 -7.648 -4.914 1.00 0.00 C ATOM 1632 O SER A 105 4.334 -8.652 -4.758 1.00 0.00 O ATOM 1633 CB SER A 105 5.930 -7.513 -7.321 1.00 0.00 C ATOM 1634 OG SER A 105 5.204 -8.600 -7.876 1.00 0.00 O ATOM 0 H SER A 105 6.326 -9.708 -5.445 1.00 0.00 H new ATOM 0 HA SER A 105 6.869 -6.810 -5.570 1.00 0.00 H new ATOM 0 HB2 SER A 105 5.356 -6.597 -7.462 1.00 0.00 H new ATOM 0 HB3 SER A 105 6.862 -7.393 -7.873 1.00 0.00 H new ATOM 0 HG SER A 105 5.643 -8.900 -8.699 1.00 0.00 H new ATOM 1640 N ILE A 106 4.763 -6.498 -4.307 1.00 0.00 N ATOM 1641 CA ILE A 106 3.547 -6.295 -3.541 1.00 0.00 C ATOM 1642 C ILE A 106 2.499 -5.745 -4.522 1.00 0.00 C ATOM 1643 O ILE A 106 2.830 -4.992 -5.444 1.00 0.00 O ATOM 1644 CB ILE A 106 3.859 -5.421 -2.304 1.00 0.00 C ATOM 1645 CG1 ILE A 106 2.668 -5.382 -1.315 1.00 0.00 C ATOM 1646 CG2 ILE A 106 4.447 -4.035 -2.634 1.00 0.00 C ATOM 1647 CD1 ILE A 106 1.693 -4.216 -1.500 1.00 0.00 C ATOM 0 H ILE A 106 5.379 -5.685 -4.334 1.00 0.00 H new ATOM 0 HA ILE A 106 3.130 -7.207 -3.115 1.00 0.00 H new ATOM 0 HB ILE A 106 4.677 -5.919 -1.783 1.00 0.00 H new ATOM 0 HG12 ILE A 106 2.112 -6.315 -1.407 1.00 0.00 H new ATOM 0 HG13 ILE A 106 3.063 -5.344 -0.300 1.00 0.00 H new ATOM 0 HG21 ILE A 106 4.635 -3.490 -1.709 1.00 0.00 H new ATOM 0 HG22 ILE A 106 5.382 -4.157 -3.180 1.00 0.00 H new ATOM 0 HG23 ILE A 106 3.740 -3.476 -3.247 1.00 0.00 H new ATOM 0 HD11 ILE A 106 0.898 -4.285 -0.757 1.00 0.00 H new ATOM 0 HD12 ILE A 106 2.226 -3.273 -1.376 1.00 0.00 H new ATOM 0 HD13 ILE A 106 1.260 -4.259 -2.499 1.00 0.00 H new ATOM 1659 N GLN A 107 1.225 -6.069 -4.315 1.00 0.00 N ATOM 1660 CA GLN A 107 0.107 -5.244 -4.762 1.00 0.00 C ATOM 1661 C GLN A 107 -1.016 -5.324 -3.718 1.00 0.00 C ATOM 1662 O GLN A 107 -0.925 -6.094 -2.759 1.00 0.00 O ATOM 1663 CB GLN A 107 -0.332 -5.629 -6.188 1.00 0.00 C ATOM 1664 CG GLN A 107 -0.963 -7.022 -6.346 1.00 0.00 C ATOM 1665 CD GLN A 107 -1.489 -7.281 -7.763 1.00 0.00 C ATOM 1666 OE1 GLN A 107 -1.394 -8.401 -8.257 1.00 0.00 O ATOM 1667 NE2 GLN A 107 -2.124 -6.316 -8.411 1.00 0.00 N ATOM 0 H GLN A 107 0.938 -6.918 -3.828 1.00 0.00 H new ATOM 0 HA GLN A 107 0.409 -4.199 -4.835 1.00 0.00 H new ATOM 0 HB2 GLN A 107 -1.048 -4.886 -6.540 1.00 0.00 H new ATOM 0 HB3 GLN A 107 0.537 -5.569 -6.843 1.00 0.00 H new ATOM 0 HG2 GLN A 107 -0.223 -7.781 -6.094 1.00 0.00 H new ATOM 0 HG3 GLN A 107 -1.782 -7.127 -5.635 1.00 0.00 H new ATOM 0 HE21 GLN A 107 -2.200 -5.387 -7.996 1.00 0.00 H new ATOM 0 HE22 GLN A 107 -2.537 -6.502 -9.325 1.00 0.00 H new ATOM 1676 N ILE A 108 -2.085 -4.558 -3.901 1.00 0.00 N ATOM 1677 CA ILE A 108 -3.310 -4.582 -3.106 1.00 0.00 C ATOM 1678 C ILE A 108 -4.462 -4.707 -4.120 1.00 0.00 C ATOM 1679 O ILE A 108 -4.248 -4.508 -5.318 1.00 0.00 O ATOM 1680 CB ILE A 108 -3.353 -3.308 -2.211 1.00 0.00 C ATOM 1681 CG1 ILE A 108 -2.174 -3.306 -1.202 1.00 0.00 C ATOM 1682 CG2 ILE A 108 -4.681 -3.177 -1.448 1.00 0.00 C ATOM 1683 CD1 ILE A 108 -2.114 -2.090 -0.265 1.00 0.00 C ATOM 0 H ILE A 108 -2.124 -3.865 -4.649 1.00 0.00 H new ATOM 0 HA ILE A 108 -3.380 -5.417 -2.409 1.00 0.00 H new ATOM 0 HB ILE A 108 -3.263 -2.452 -2.880 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -2.235 -4.209 -0.595 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -1.239 -3.360 -1.760 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -4.663 -2.274 -0.838 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -5.505 -3.118 -2.159 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -4.818 -4.046 -0.805 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -1.255 -2.185 0.400 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -2.016 -1.180 -0.856 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -3.028 -2.042 0.327 1.00 0.00 H new ATOM 1695 N LYS A 109 -5.675 -5.053 -3.694 1.00 0.00 N ATOM 1696 CA LYS A 109 -6.895 -4.827 -4.470 1.00 0.00 C ATOM 1697 C LYS A 109 -8.054 -4.553 -3.505 1.00 0.00 C ATOM 1698 O LYS A 109 -7.912 -4.865 -2.323 1.00 0.00 O ATOM 1699 CB LYS A 109 -7.142 -6.014 -5.427 1.00 0.00 C ATOM 1700 CG LYS A 109 -7.326 -7.383 -4.748 1.00 0.00 C ATOM 1701 CD LYS A 109 -6.397 -8.487 -5.265 1.00 0.00 C ATOM 1702 CE LYS A 109 -4.909 -8.271 -4.964 1.00 0.00 C ATOM 1703 NZ LYS A 109 -4.123 -9.450 -5.394 1.00 0.00 N ATOM 0 H LYS A 109 -5.841 -5.502 -2.793 1.00 0.00 H new ATOM 0 HA LYS A 109 -6.798 -3.948 -5.108 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -8.030 -5.800 -6.022 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -6.303 -6.081 -6.120 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -7.166 -7.266 -3.676 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -8.359 -7.704 -4.883 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -6.707 -9.437 -4.829 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -6.526 -8.575 -6.344 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -4.552 -7.379 -5.480 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -4.768 -8.100 -3.897 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -3.201 -9.446 -4.913 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -4.638 -10.319 -5.148 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -3.977 -9.413 -6.423 1.00 0.00 H new ATOM 1717 N ALA A 110 -9.181 -3.989 -3.946 1.00 0.00 N ATOM 1718 CA ALA A 110 -10.366 -3.807 -3.099 1.00 0.00 C ATOM 1719 C ALA A 110 -11.664 -3.831 -3.913 1.00 0.00 C ATOM 1720 O ALA A 110 -11.652 -3.499 -5.103 1.00 0.00 O ATOM 1721 CB ALA A 110 -10.255 -2.474 -2.341 1.00 0.00 C ATOM 0 H ALA A 110 -9.299 -3.645 -4.899 1.00 0.00 H new ATOM 0 HA ALA A 110 -10.403 -4.639 -2.395 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -11.135 -2.339 -1.712 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -9.361 -2.483 -1.717 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -10.190 -1.653 -3.056 1.00 0.00 H new ATOM 1727 N LEU A 111 -12.792 -4.143 -3.264 1.00 0.00 N ATOM 1728 CA LEU A 111 -14.142 -4.102 -3.839 1.00 0.00 C ATOM 1729 C LEU A 111 -14.674 -2.670 -3.809 1.00 0.00 C ATOM 1730 O LEU A 111 -14.737 -2.069 -2.736 1.00 0.00 O ATOM 1731 CB LEU A 111 -15.081 -5.029 -3.035 1.00 0.00 C ATOM 1732 CG LEU A 111 -16.419 -5.261 -3.760 1.00 0.00 C ATOM 1733 CD1 LEU A 111 -16.268 -6.235 -4.936 1.00 0.00 C ATOM 1734 CD2 LEU A 111 -17.499 -5.843 -2.855 1.00 0.00 C ATOM 0 H LEU A 111 -12.790 -4.442 -2.289 1.00 0.00 H new ATOM 0 HA LEU A 111 -14.102 -4.445 -4.873 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -14.589 -5.987 -2.867 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -15.271 -4.592 -2.055 1.00 0.00 H new ATOM 0 HG LEU A 111 -16.716 -4.269 -4.102 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -17.234 -6.372 -5.421 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -15.555 -5.830 -5.655 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -15.907 -7.196 -4.569 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -18.417 -5.982 -3.427 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -17.166 -6.804 -2.463 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -17.688 -5.159 -2.027 1.00 0.00 H new ATOM 1746 N SER A 112 -15.047 -2.110 -4.966 1.00 0.00 N ATOM 1747 CA SER A 112 -15.737 -0.823 -5.043 1.00 0.00 C ATOM 1748 C SER A 112 -17.144 -0.985 -4.456 1.00 0.00 C ATOM 1749 O SER A 112 -17.365 -0.602 -3.307 1.00 0.00 O ATOM 1750 CB SER A 112 -15.745 -0.306 -6.490 1.00 0.00 C ATOM 1751 OG SER A 112 -16.453 0.908 -6.568 1.00 0.00 O ATOM 0 H SER A 112 -14.877 -2.540 -5.875 1.00 0.00 H new ATOM 0 HA SER A 112 -15.213 -0.069 -4.455 1.00 0.00 H new ATOM 0 HB2 SER A 112 -14.722 -0.162 -6.838 1.00 0.00 H new ATOM 0 HB3 SER A 112 -16.204 -1.046 -7.146 1.00 0.00 H new ATOM 0 HG SER A 112 -15.819 1.654 -6.611 1.00 0.00 H new ATOM 1757 N SER A 113 -18.070 -1.582 -5.211 1.00 0.00 N ATOM 1758 CA SER A 113 -19.425 -1.989 -4.806 1.00 0.00 C ATOM 1759 C SER A 113 -20.155 -2.642 -5.982 1.00 0.00 C ATOM 1760 O SER A 113 -20.620 -3.782 -5.857 1.00 0.00 O ATOM 1761 CB SER A 113 -20.268 -0.810 -4.285 1.00 0.00 C ATOM 1762 OG SER A 113 -19.957 -0.533 -2.930 1.00 0.00 O ATOM 0 H SER A 113 -17.884 -1.811 -6.187 1.00 0.00 H new ATOM 0 HA SER A 113 -19.305 -2.701 -3.990 1.00 0.00 H new ATOM 0 HB2 SER A 113 -20.082 0.074 -4.894 1.00 0.00 H new ATOM 0 HB3 SER A 113 -21.328 -1.045 -4.380 1.00 0.00 H new ATOM 0 HG SER A 113 -18.995 -0.367 -2.843 1.00 0.00 H new ATOM 1768 N GLY A 114 -20.238 -1.953 -7.125 1.00 0.00 N ATOM 1769 CA GLY A 114 -21.014 -2.400 -8.269 1.00 0.00 C ATOM 1770 C GLY A 114 -20.220 -3.394 -9.100 1.00 0.00 C ATOM 1771 O GLY A 114 -19.800 -3.071 -10.212 1.00 0.00 O ATOM 0 H GLY A 114 -19.762 -1.064 -7.276 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -21.941 -2.861 -7.928 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -21.291 -1.544 -8.884 1.00 0.00 H new ATOM 1775 N THR A 115 -20.009 -4.589 -8.546 1.00 0.00 N ATOM 1776 CA THR A 115 -19.256 -5.745 -9.050 1.00 0.00 C ATOM 1777 C THR A 115 -17.748 -5.515 -9.308 1.00 0.00 C ATOM 1778 O THR A 115 -16.975 -6.470 -9.368 1.00 0.00 O ATOM 1779 CB THR A 115 -20.021 -6.431 -10.217 1.00 0.00 C ATOM 1780 OG1 THR A 115 -20.853 -5.549 -10.965 1.00 0.00 O ATOM 1781 CG2 THR A 115 -20.965 -7.491 -9.649 1.00 0.00 C ATOM 0 H THR A 115 -20.406 -4.796 -7.629 1.00 0.00 H new ATOM 0 HA THR A 115 -19.213 -6.456 -8.225 1.00 0.00 H new ATOM 0 HB THR A 115 -19.246 -6.832 -10.870 1.00 0.00 H new ATOM 0 HG1 THR A 115 -21.299 -6.048 -11.680 1.00 0.00 H new ATOM 0 HG21 THR A 115 -21.503 -7.974 -10.465 1.00 0.00 H new ATOM 0 HG22 THR A 115 -20.388 -8.237 -9.103 1.00 0.00 H new ATOM 0 HG23 THR A 115 -21.678 -7.019 -8.974 1.00 0.00 H new ATOM 1789 N THR A 116 -17.314 -4.261 -9.321 1.00 0.00 N ATOM 1790 CA THR A 116 -16.013 -3.697 -9.618 1.00 0.00 C ATOM 1791 C THR A 116 -15.004 -4.058 -8.536 1.00 0.00 C ATOM 1792 O THR A 116 -15.241 -3.802 -7.347 1.00 0.00 O ATOM 1793 CB THR A 116 -16.157 -2.155 -9.659 1.00 0.00 C ATOM 1794 OG1 THR A 116 -17.430 -1.691 -9.231 1.00 0.00 O ATOM 1795 CG2 THR A 116 -15.895 -1.591 -11.051 1.00 0.00 C ATOM 0 H THR A 116 -17.967 -3.513 -9.089 1.00 0.00 H new ATOM 0 HA THR A 116 -15.661 -4.092 -10.571 1.00 0.00 H new ATOM 0 HB THR A 116 -15.402 -1.798 -8.959 1.00 0.00 H new ATOM 0 HG1 THR A 116 -17.455 -0.712 -9.279 1.00 0.00 H new ATOM 0 HG21 THR A 116 -16.007 -0.507 -11.031 1.00 0.00 H new ATOM 0 HG22 THR A 116 -14.882 -1.845 -11.362 1.00 0.00 H new ATOM 0 HG23 THR A 116 -16.608 -2.017 -11.756 1.00 0.00 H new ATOM 1803 N PHE A 117 -13.846 -4.561 -8.934 1.00 0.00 N ATOM 1804 CA PHE A 117 -12.711 -4.800 -8.072 1.00 0.00 C ATOM 1805 C PHE A 117 -11.514 -4.082 -8.685 1.00 0.00 C ATOM 1806 O PHE A 117 -11.228 -4.243 -9.871 1.00 0.00 O ATOM 1807 CB PHE A 117 -12.531 -6.314 -7.943 1.00 0.00 C ATOM 1808 CG PHE A 117 -12.294 -6.782 -6.525 1.00 0.00 C ATOM 1809 CD1 PHE A 117 -11.085 -6.513 -5.861 1.00 0.00 C ATOM 1810 CD2 PHE A 117 -13.323 -7.462 -5.856 1.00 0.00 C ATOM 1811 CE1 PHE A 117 -10.927 -6.901 -4.517 1.00 0.00 C ATOM 1812 CE2 PHE A 117 -13.157 -7.867 -4.522 1.00 0.00 C ATOM 1813 CZ PHE A 117 -11.966 -7.569 -3.848 1.00 0.00 C ATOM 0 H PHE A 117 -13.670 -4.822 -9.904 1.00 0.00 H new ATOM 0 HA PHE A 117 -12.841 -4.410 -7.062 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -13.418 -6.811 -8.336 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -11.690 -6.625 -8.563 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -10.281 -6.011 -6.379 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -14.248 -7.675 -6.370 1.00 0.00 H new ATOM 0 HE1 PHE A 117 -10.004 -6.684 -3.999 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -13.945 -8.406 -4.017 1.00 0.00 H new ATOM 0 HZ PHE A 117 -11.846 -7.853 -2.813 1.00 0.00 H new ATOM 1823 N VAL A 118 -10.841 -3.248 -7.897 1.00 0.00 N ATOM 1824 CA VAL A 118 -9.771 -2.376 -8.362 1.00 0.00 C ATOM 1825 C VAL A 118 -8.484 -2.898 -7.744 1.00 0.00 C ATOM 1826 O VAL A 118 -8.357 -2.954 -6.519 1.00 0.00 O ATOM 1827 CB VAL A 118 -10.049 -0.908 -7.989 1.00 0.00 C ATOM 1828 CG1 VAL A 118 -9.039 0.041 -8.654 1.00 0.00 C ATOM 1829 CG2 VAL A 118 -11.467 -0.476 -8.390 1.00 0.00 C ATOM 0 H VAL A 118 -11.029 -3.159 -6.898 1.00 0.00 H new ATOM 0 HA VAL A 118 -9.694 -2.389 -9.449 1.00 0.00 H new ATOM 0 HB VAL A 118 -9.950 -0.845 -6.905 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -9.264 1.069 -8.370 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -8.031 -0.214 -8.327 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -9.105 -0.059 -9.737 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -11.623 0.566 -8.110 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -11.589 -0.584 -9.468 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -12.197 -1.103 -7.878 1.00 0.00 H new ATOM 1839 N TYR A 119 -7.561 -3.329 -8.593 1.00 0.00 N ATOM 1840 CA TYR A 119 -6.224 -3.749 -8.207 1.00 0.00 C ATOM 1841 C TYR A 119 -5.345 -2.505 -8.113 1.00 0.00 C ATOM 1842 O TYR A 119 -5.595 -1.509 -8.799 1.00 0.00 O ATOM 1843 CB TYR A 119 -5.672 -4.766 -9.224 1.00 0.00 C ATOM 1844 CG TYR A 119 -6.574 -5.974 -9.436 1.00 0.00 C ATOM 1845 CD1 TYR A 119 -7.706 -5.851 -10.261 1.00 0.00 C ATOM 1846 CD2 TYR A 119 -6.312 -7.206 -8.808 1.00 0.00 C ATOM 1847 CE1 TYR A 119 -8.615 -6.906 -10.413 1.00 0.00 C ATOM 1848 CE2 TYR A 119 -7.206 -8.283 -8.971 1.00 0.00 C ATOM 1849 CZ TYR A 119 -8.370 -8.130 -9.760 1.00 0.00 C ATOM 1850 OH TYR A 119 -9.235 -9.167 -9.919 1.00 0.00 O ATOM 0 H TYR A 119 -7.728 -3.397 -9.597 1.00 0.00 H new ATOM 0 HA TYR A 119 -6.240 -4.247 -7.238 1.00 0.00 H new ATOM 0 HB2 TYR A 119 -5.521 -4.265 -10.180 1.00 0.00 H new ATOM 0 HB3 TYR A 119 -4.694 -5.109 -8.886 1.00 0.00 H new ATOM 0 HD1 TYR A 119 -7.878 -4.924 -10.788 1.00 0.00 H new ATOM 0 HD2 TYR A 119 -5.426 -7.326 -8.202 1.00 0.00 H new ATOM 0 HE1 TYR A 119 -9.496 -6.782 -11.025 1.00 0.00 H new ATOM 0 HE2 TYR A 119 -7.002 -9.229 -8.492 1.00 0.00 H new ATOM 0 HH TYR A 119 -8.920 -9.938 -9.402 1.00 0.00 H new ATOM 1860 N SER A 120 -4.301 -2.547 -7.290 1.00 0.00 N ATOM 1861 CA SER A 120 -3.204 -1.612 -7.418 1.00 0.00 C ATOM 1862 C SER A 120 -2.310 -2.090 -8.557 1.00 0.00 C ATOM 1863 O SER A 120 -2.310 -3.275 -8.900 1.00 0.00 O ATOM 1864 CB SER A 120 -2.422 -1.528 -6.101 1.00 0.00 C ATOM 1865 OG SER A 120 -1.447 -2.536 -5.922 1.00 0.00 O ATOM 0 H SER A 120 -4.198 -3.220 -6.531 1.00 0.00 H new ATOM 0 HA SER A 120 -3.578 -0.612 -7.639 1.00 0.00 H new ATOM 0 HB2 SER A 120 -1.932 -0.556 -6.048 1.00 0.00 H new ATOM 0 HB3 SER A 120 -3.128 -1.575 -5.272 1.00 0.00 H new ATOM 0 HG SER A 120 -0.711 -2.395 -6.553 1.00 0.00 H new ATOM 1871 N GLN A 121 -1.434 -1.203 -9.015 1.00 0.00 N ATOM 1872 CA GLN A 121 -0.323 -1.576 -9.877 1.00 0.00 C ATOM 1873 C GLN A 121 0.626 -2.535 -9.146 1.00 0.00 C ATOM 1874 O GLN A 121 0.670 -2.562 -7.907 1.00 0.00 O ATOM 1875 CB GLN A 121 0.384 -0.310 -10.387 1.00 0.00 C ATOM 1876 CG GLN A 121 0.768 0.738 -9.329 1.00 0.00 C ATOM 1877 CD GLN A 121 1.062 2.125 -9.907 1.00 0.00 C ATOM 1878 OE1 GLN A 121 0.729 2.424 -11.050 1.00 0.00 O ATOM 1879 NE2 GLN A 121 1.588 3.014 -9.084 1.00 0.00 N ATOM 0 H GLN A 121 -1.475 -0.207 -8.799 1.00 0.00 H new ATOM 0 HA GLN A 121 -0.695 -2.114 -10.749 1.00 0.00 H new ATOM 0 HB2 GLN A 121 1.291 -0.614 -10.910 1.00 0.00 H new ATOM 0 HB3 GLN A 121 -0.263 0.169 -11.122 1.00 0.00 H new ATOM 0 HG2 GLN A 121 -0.042 0.822 -8.604 1.00 0.00 H new ATOM 0 HG3 GLN A 121 1.646 0.388 -8.787 1.00 0.00 H new ATOM 0 HE21 GLN A 121 1.856 2.738 -8.139 1.00 0.00 H new ATOM 0 HE22 GLN A 121 1.726 3.976 -9.393 1.00 0.00 H new ATOM 1888 N LYS A 122 1.383 -3.319 -9.918 1.00 0.00 N ATOM 1889 CA LYS A 122 2.421 -4.231 -9.440 1.00 0.00 C ATOM 1890 C LYS A 122 3.702 -3.426 -9.289 1.00 0.00 C ATOM 1891 O LYS A 122 4.071 -2.699 -10.207 1.00 0.00 O ATOM 1892 CB LYS A 122 2.562 -5.389 -10.448 1.00 0.00 C ATOM 1893 CG LYS A 122 3.704 -6.391 -10.171 1.00 0.00 C ATOM 1894 CD LYS A 122 4.900 -6.209 -11.125 1.00 0.00 C ATOM 1895 CE LYS A 122 5.953 -7.323 -10.980 1.00 0.00 C ATOM 1896 NZ LYS A 122 7.007 -7.250 -12.020 1.00 0.00 N ATOM 0 H LYS A 122 1.284 -3.335 -10.933 1.00 0.00 H new ATOM 0 HA LYS A 122 2.175 -4.672 -8.474 1.00 0.00 H new ATOM 0 HB2 LYS A 122 1.621 -5.939 -10.474 1.00 0.00 H new ATOM 0 HB3 LYS A 122 2.711 -4.964 -11.441 1.00 0.00 H new ATOM 0 HG2 LYS A 122 4.044 -6.273 -9.142 1.00 0.00 H new ATOM 0 HG3 LYS A 122 3.321 -7.407 -10.265 1.00 0.00 H new ATOM 0 HD2 LYS A 122 4.539 -6.188 -12.153 1.00 0.00 H new ATOM 0 HD3 LYS A 122 5.369 -5.244 -10.932 1.00 0.00 H new ATOM 0 HE2 LYS A 122 6.415 -7.256 -9.995 1.00 0.00 H new ATOM 0 HE3 LYS A 122 5.460 -8.293 -11.035 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 7.690 -8.021 -11.877 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 6.573 -7.341 -12.961 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 7.498 -6.336 -11.953 1.00 0.00 H new ATOM 1910 N ILE A 123 4.367 -3.559 -8.146 1.00 0.00 N ATOM 1911 CA ILE A 123 5.636 -2.922 -7.840 1.00 0.00 C ATOM 1912 C ILE A 123 6.474 -4.025 -7.216 1.00 0.00 C ATOM 1913 O ILE A 123 6.207 -4.507 -6.112 1.00 0.00 O ATOM 1914 CB ILE A 123 5.435 -1.696 -6.913 1.00 0.00 C ATOM 1915 CG1 ILE A 123 4.410 -0.630 -7.394 1.00 0.00 C ATOM 1916 CG2 ILE A 123 6.798 -1.050 -6.653 1.00 0.00 C ATOM 1917 CD1 ILE A 123 4.823 0.286 -8.550 1.00 0.00 C ATOM 0 H ILE A 123 4.020 -4.137 -7.380 1.00 0.00 H new ATOM 0 HA ILE A 123 6.133 -2.511 -8.718 1.00 0.00 H new ATOM 0 HB ILE A 123 4.988 -2.088 -6.000 1.00 0.00 H new ATOM 0 HG12 ILE A 123 3.498 -1.150 -7.688 1.00 0.00 H new ATOM 0 HG13 ILE A 123 4.157 -0.000 -6.541 1.00 0.00 H new ATOM 0 HG21 ILE A 123 6.672 -0.185 -6.002 1.00 0.00 H new ATOM 0 HG22 ILE A 123 7.458 -1.773 -6.173 1.00 0.00 H new ATOM 0 HG23 ILE A 123 7.236 -0.731 -7.599 1.00 0.00 H new ATOM 0 HD11 ILE A 123 4.010 0.976 -8.776 1.00 0.00 H new ATOM 0 HD12 ILE A 123 5.711 0.851 -8.267 1.00 0.00 H new ATOM 0 HD13 ILE A 123 5.042 -0.317 -9.431 1.00 0.00 H new ATOM 1929 N ASP A 124 7.429 -4.459 -8.024 1.00 0.00 N ATOM 1930 CA ASP A 124 8.599 -5.253 -7.674 1.00 0.00 C ATOM 1931 C ASP A 124 9.400 -4.583 -6.575 1.00 0.00 C ATOM 1932 O ASP A 124 9.397 -3.356 -6.503 1.00 0.00 O ATOM 1933 CB ASP A 124 9.439 -5.319 -8.934 1.00 0.00 C ATOM 1934 CG ASP A 124 10.829 -5.894 -8.707 1.00 0.00 C ATOM 1935 OD1 ASP A 124 10.973 -7.131 -8.753 1.00 0.00 O ATOM 1936 OD2 ASP A 124 11.770 -5.095 -8.507 1.00 0.00 O ATOM 0 H ASP A 124 7.405 -4.249 -9.022 1.00 0.00 H new ATOM 0 HA ASP A 124 8.307 -6.239 -7.312 1.00 0.00 H new ATOM 0 HB2 ASP A 124 8.920 -5.926 -9.676 1.00 0.00 H new ATOM 0 HB3 ASP A 124 9.533 -4.317 -9.352 1.00 0.00 H new ATOM 1941 N PHE A 125 10.088 -5.368 -5.752 1.00 0.00 N ATOM 1942 CA PHE A 125 11.032 -4.896 -4.745 1.00 0.00 C ATOM 1943 C PHE A 125 12.129 -5.949 -4.534 1.00 0.00 C ATOM 1944 O PHE A 125 12.073 -7.035 -5.118 1.00 0.00 O ATOM 1945 CB PHE A 125 10.286 -4.529 -3.444 1.00 0.00 C ATOM 1946 CG PHE A 125 9.595 -5.673 -2.724 1.00 0.00 C ATOM 1947 CD1 PHE A 125 10.304 -6.440 -1.784 1.00 0.00 C ATOM 1948 CD2 PHE A 125 8.228 -5.938 -2.943 1.00 0.00 C ATOM 1949 CE1 PHE A 125 9.679 -7.495 -1.107 1.00 0.00 C ATOM 1950 CE2 PHE A 125 7.592 -6.980 -2.241 1.00 0.00 C ATOM 1951 CZ PHE A 125 8.324 -7.777 -1.345 1.00 0.00 C ATOM 0 H PHE A 125 10.001 -6.384 -5.768 1.00 0.00 H new ATOM 0 HA PHE A 125 11.523 -3.985 -5.087 1.00 0.00 H new ATOM 0 HB2 PHE A 125 10.999 -4.072 -2.757 1.00 0.00 H new ATOM 0 HB3 PHE A 125 9.539 -3.771 -3.679 1.00 0.00 H new ATOM 0 HD1 PHE A 125 11.341 -6.214 -1.582 1.00 0.00 H new ATOM 0 HD2 PHE A 125 7.669 -5.342 -3.649 1.00 0.00 H new ATOM 0 HE1 PHE A 125 10.239 -8.091 -0.402 1.00 0.00 H new ATOM 0 HE2 PHE A 125 6.539 -7.167 -2.392 1.00 0.00 H new ATOM 0 HZ PHE A 125 7.846 -8.604 -0.841 1.00 0.00 H new ATOM 1961 N GLU A 126 13.124 -5.644 -3.696 1.00 0.00 N ATOM 1962 CA GLU A 126 14.061 -6.618 -3.153 1.00 0.00 C ATOM 1963 C GLU A 126 14.033 -6.497 -1.641 1.00 0.00 C ATOM 1964 O GLU A 126 13.621 -5.460 -1.107 1.00 0.00 O ATOM 1965 CB GLU A 126 15.430 -6.484 -3.833 1.00 0.00 C ATOM 1966 CG GLU A 126 15.488 -7.136 -5.218 1.00 0.00 C ATOM 1967 CD GLU A 126 15.426 -8.668 -5.255 1.00 0.00 C ATOM 1968 OE1 GLU A 126 14.782 -9.333 -4.412 1.00 0.00 O ATOM 1969 OE2 GLU A 126 16.030 -9.237 -6.192 1.00 0.00 O ATOM 0 H GLU A 126 13.300 -4.693 -3.373 1.00 0.00 H new ATOM 0 HA GLU A 126 13.777 -7.647 -3.375 1.00 0.00 H new ATOM 0 HB2 GLU A 126 15.679 -5.427 -3.927 1.00 0.00 H new ATOM 0 HB3 GLU A 126 16.190 -6.935 -3.195 1.00 0.00 H new ATOM 0 HG2 GLU A 126 14.662 -6.746 -5.814 1.00 0.00 H new ATOM 0 HG3 GLU A 126 16.410 -6.820 -5.706 1.00 0.00 H new ATOM 1976 N ARG A 127 14.385 -7.589 -0.955 1.00 0.00 N ATOM 1977 CA ARG A 127 14.294 -7.707 0.487 1.00 0.00 C ATOM 1978 C ARG A 127 15.561 -8.304 1.075 1.00 0.00 C ATOM 1979 O ARG A 127 15.776 -9.508 1.014 1.00 0.00 O ATOM 1980 CB ARG A 127 12.997 -8.353 0.979 1.00 0.00 C ATOM 1981 CG ARG A 127 12.314 -9.410 0.110 1.00 0.00 C ATOM 1982 CD ARG A 127 13.060 -10.699 -0.151 1.00 0.00 C ATOM 1983 NE ARG A 127 13.493 -11.356 1.096 1.00 0.00 N ATOM 1984 CZ ARG A 127 14.385 -12.349 1.180 1.00 0.00 C ATOM 1985 NH1 ARG A 127 14.794 -12.975 0.079 1.00 0.00 N ATOM 1986 NH2 ARG A 127 14.844 -12.733 2.366 1.00 0.00 N ATOM 0 H ARG A 127 14.748 -8.429 -1.405 1.00 0.00 H new ATOM 0 HA ARG A 127 14.226 -6.693 0.882 1.00 0.00 H new ATOM 0 HB2 ARG A 127 13.204 -8.808 1.948 1.00 0.00 H new ATOM 0 HB3 ARG A 127 12.276 -7.553 1.150 1.00 0.00 H new ATOM 0 HG2 ARG A 127 11.362 -9.663 0.577 1.00 0.00 H new ATOM 0 HG3 ARG A 127 12.086 -8.954 -0.854 1.00 0.00 H new ATOM 0 HD2 ARG A 127 12.421 -11.379 -0.714 1.00 0.00 H new ATOM 0 HD3 ARG A 127 13.932 -10.493 -0.772 1.00 0.00 H new ATOM 0 HE ARG A 127 13.078 -11.026 1.967 1.00 0.00 H new ATOM 0 HH11 ARG A 127 14.427 -12.698 -0.831 1.00 0.00 H new ATOM 0 HH12 ARG A 127 15.474 -13.732 0.146 1.00 0.00 H new ATOM 0 HH21 ARG A 127 14.516 -12.270 3.214 1.00 0.00 H new ATOM 0 HH22 ARG A 127 15.524 -13.490 2.429 1.00 0.00 H new ATOM 2000 N GLU A 128 16.356 -7.399 1.639 1.00 0.00 N ATOM 2001 CA GLU A 128 17.671 -7.589 2.247 1.00 0.00 C ATOM 2002 C GLU A 128 18.546 -8.479 1.378 1.00 0.00 C ATOM 2003 O GLU A 128 19.188 -9.431 1.878 1.00 0.00 O ATOM 2004 CB GLU A 128 17.597 -7.958 3.744 1.00 0.00 C ATOM 2005 CG GLU A 128 16.727 -9.174 4.092 1.00 0.00 C ATOM 2006 CD GLU A 128 16.935 -9.652 5.544 1.00 0.00 C ATOM 2007 OE1 GLU A 128 17.200 -8.809 6.446 1.00 0.00 O ATOM 2008 OE2 GLU A 128 16.785 -10.865 5.824 1.00 0.00 O ATOM 0 H GLU A 128 16.069 -6.421 1.687 1.00 0.00 H new ATOM 0 HA GLU A 128 18.186 -6.629 2.271 1.00 0.00 H new ATOM 0 HB2 GLU A 128 18.609 -8.145 4.103 1.00 0.00 H new ATOM 0 HB3 GLU A 128 17.218 -7.096 4.293 1.00 0.00 H new ATOM 0 HG2 GLU A 128 15.677 -8.921 3.943 1.00 0.00 H new ATOM 0 HG3 GLU A 128 16.958 -9.990 3.407 1.00 0.00 H new TER 2015 GLU A 128