USER MOD reduce.3.24.130724 H: found=0, std=0, add=633, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 627 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 78 HIS : no HE2:sc= 0.883 K(o=1.6,f=-5!) USER MOD Set 1.2: A 79 HIS : no HD1:sc= 0.762 K(o=1.6,f=-0.91) USER MOD Set 2.1: A 62 SER OG : rot 180:sc= 0.498 USER MOD Set 2.2: A 66 LYS NZ :NH3+ -158:sc= 0.556 (180deg=0) USER MOD Set 3.1: A 26 GLN : amide:sc= 1.27 K(o=1.5,f=-3) USER MOD Set 3.2: A 50 LYS NZ :NH3+ -167:sc= 0.227 (180deg=-0.197) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -148:sc= 0.848 (180deg=0.169) USER MOD Single : A 3 THR OG1 : rot 180:sc= 0.0262 USER MOD Single : A 6 SER OG : rot -39:sc= 0.137 USER MOD Single : A 8 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 ASN : amide:sc= 0 X(o=0,f=-0.23) USER MOD Single : A 24 GLN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 THR OG1 : rot 89:sc= 1.23 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=-0.32) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 52 SER OG : rot 77:sc= 0.375 USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 57 TYR OH : rot 180:sc=-0.00821 USER MOD Single : A 59 ASN : amide:sc= 0 X(o=0,f=-0.014) USER MOD Single : A 61 GLN : amide:sc= 0 X(o=0,f=-0.4) USER MOD Single : A 63 ASN : amide:sc= 0 K(o=0,f=-0.57) USER MOD Single : A 64 THR OG1 : rot -69:sc= 0.261 USER MOD Single : A 69 LYS NZ :NH3+ -177:sc= 1.12 (180deg=1.11) USER MOD Single : A 80 HIS : no HE2:sc= 1.1 K(o=1.1,f=-3.3!) USER MOD Single : A 81 HIS : no HE2:sc= 0.421 K(o=0.42,f=-2.3!) USER MOD Single : A 82 HIS : no HD1:sc= -0.025 X(o=-0.025,f=-0.025) USER MOD Single : A 83 HIS : no HD1:sc= 0 X(o=0,f=-0.008) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -1.675 -4.004 -9.973 1.00 10.00 N ATOM 2 CA MET A 1 -0.760 -3.631 -8.862 1.00 10.00 C ATOM 3 C MET A 1 -0.660 -2.110 -8.707 1.00 10.00 C ATOM 4 O MET A 1 -0.978 -1.366 -9.636 1.00 10.00 O ATOM 5 CB MET A 1 0.633 -4.291 -8.995 1.00 10.00 C ATOM 6 CG MET A 1 1.542 -3.743 -10.110 1.00 10.00 C ATOM 7 SD MET A 1 0.985 -4.029 -11.816 1.00 10.00 S ATOM 8 CE MET A 1 2.330 -3.205 -12.714 1.00 10.00 C ATOM 0 H1 MET A 1 -2.146 -4.903 -9.748 1.00 10.00 H new ATOM 0 H2 MET A 1 -2.391 -3.260 -10.098 1.00 10.00 H new ATOM 0 H3 MET A 1 -1.129 -4.110 -10.852 1.00 10.00 H new ATOM 0 HA MET A 1 -1.198 -4.026 -7.945 1.00 10.00 H new ATOM 0 HB2 MET A 1 1.155 -4.184 -8.044 1.00 10.00 H new ATOM 0 HB3 MET A 1 0.491 -5.359 -9.162 1.00 10.00 H new ATOM 0 HG2 MET A 1 1.655 -2.669 -9.962 1.00 10.00 H new ATOM 0 HG3 MET A 1 2.531 -4.186 -9.994 1.00 10.00 H new ATOM 0 HE1 MET A 1 2.152 -3.282 -13.787 1.00 10.00 H new ATOM 0 HE2 MET A 1 2.369 -2.154 -12.427 1.00 10.00 H new ATOM 0 HE3 MET A 1 3.278 -3.683 -12.468 1.00 10.00 H new ATOM 20 N ALA A 2 -0.213 -1.636 -7.538 1.00 10.00 N ATOM 21 CA ALA A 2 -0.038 -0.213 -7.223 1.00 10.00 C ATOM 22 C ALA A 2 1.049 0.042 -6.195 1.00 10.00 C ATOM 23 O ALA A 2 1.422 -0.812 -5.384 1.00 10.00 O ATOM 24 CB ALA A 2 -1.347 0.345 -6.628 1.00 10.00 C ATOM 0 H ALA A 2 0.044 -2.248 -6.764 1.00 10.00 H new ATOM 0 HA ALA A 2 0.240 0.272 -8.159 1.00 10.00 H new ATOM 0 HB1 ALA A 2 -1.219 1.402 -6.394 1.00 10.00 H new ATOM 0 HB2 ALA A 2 -2.154 0.229 -7.352 1.00 10.00 H new ATOM 0 HB3 ALA A 2 -1.595 -0.201 -5.718 1.00 10.00 H new ATOM 30 N THR A 3 1.501 1.287 -6.227 1.00 10.00 N ATOM 31 CA THR A 3 2.361 1.871 -5.218 1.00 10.00 C ATOM 32 C THR A 3 1.531 2.329 -4.034 1.00 10.00 C ATOM 33 O THR A 3 0.385 2.767 -4.206 1.00 10.00 O ATOM 34 CB THR A 3 3.096 3.077 -5.771 1.00 10.00 C ATOM 35 OG1 THR A 3 2.268 3.935 -6.533 1.00 10.00 O ATOM 36 CG2 THR A 3 4.186 2.539 -6.690 1.00 10.00 C ATOM 0 H THR A 3 1.270 1.935 -6.980 1.00 10.00 H new ATOM 0 HA THR A 3 3.080 1.111 -4.911 1.00 10.00 H new ATOM 0 HB THR A 3 3.478 3.661 -4.934 1.00 10.00 H new ATOM 0 HG1 THR A 3 2.796 4.693 -6.860 1.00 10.00 H new ATOM 0 HG21 THR A 3 4.747 3.371 -7.116 1.00 10.00 H new ATOM 0 HG22 THR A 3 4.861 1.901 -6.119 1.00 10.00 H new ATOM 0 HG23 THR A 3 3.731 1.959 -7.493 1.00 10.00 H new ATOM 44 N PRO A 4 2.088 2.228 -2.822 1.00 10.00 N ATOM 45 CA PRO A 4 1.324 2.516 -1.628 1.00 10.00 C ATOM 46 C PRO A 4 0.889 3.985 -1.536 1.00 10.00 C ATOM 47 O PRO A 4 1.679 4.900 -1.786 1.00 10.00 O ATOM 48 CB PRO A 4 2.182 2.059 -0.453 1.00 10.00 C ATOM 49 CG PRO A 4 3.318 1.243 -1.079 1.00 10.00 C ATOM 50 CD PRO A 4 3.414 1.727 -2.505 1.00 10.00 C ATOM 0 HA PRO A 4 0.376 1.978 -1.634 1.00 10.00 H new ATOM 0 HB2 PRO A 4 2.570 2.911 0.106 1.00 10.00 H new ATOM 0 HB3 PRO A 4 1.603 1.456 0.246 1.00 10.00 H new ATOM 0 HG2 PRO A 4 4.256 1.400 -0.546 1.00 10.00 H new ATOM 0 HG3 PRO A 4 3.104 0.175 -1.039 1.00 10.00 H new ATOM 0 HD2 PRO A 4 4.166 2.509 -2.606 1.00 10.00 H new ATOM 0 HD3 PRO A 4 3.702 0.919 -3.178 1.00 10.00 H new ATOM 58 N TRP A 5 -0.378 4.207 -1.169 1.00 10.00 N ATOM 59 CA TRP A 5 -1.030 5.523 -1.226 1.00 10.00 C ATOM 60 C TRP A 5 -0.273 6.615 -0.459 1.00 10.00 C ATOM 61 O TRP A 5 -0.102 7.717 -0.970 1.00 10.00 O ATOM 62 CB TRP A 5 -2.486 5.406 -0.748 1.00 10.00 C ATOM 63 CG TRP A 5 -2.677 5.095 0.709 1.00 10.00 C ATOM 64 CD1 TRP A 5 -2.781 3.858 1.246 1.00 10.00 C ATOM 65 CD2 TRP A 5 -2.769 6.026 1.833 1.00 10.00 C ATOM 66 NE1 TRP A 5 -2.913 3.956 2.618 1.00 10.00 N ATOM 67 CE2 TRP A 5 -2.903 5.270 3.036 1.00 10.00 C ATOM 68 CE3 TRP A 5 -2.734 7.433 1.960 1.00 10.00 C ATOM 69 CZ2 TRP A 5 -2.992 5.874 4.299 1.00 10.00 C ATOM 70 CZ3 TRP A 5 -2.822 8.051 3.224 1.00 10.00 C ATOM 71 CH2 TRP A 5 -2.949 7.276 4.391 1.00 10.00 C ATOM 0 H TRP A 5 -0.989 3.469 -0.819 1.00 10.00 H new ATOM 0 HA TRP A 5 -1.017 5.842 -2.268 1.00 10.00 H new ATOM 0 HB2 TRP A 5 -2.997 6.343 -0.969 1.00 10.00 H new ATOM 0 HB3 TRP A 5 -2.978 4.629 -1.333 1.00 10.00 H new ATOM 0 HD1 TRP A 5 -2.764 2.934 0.687 1.00 10.00 H new ATOM 0 HE1 TRP A 5 -3.006 3.156 3.244 1.00 10.00 H new ATOM 0 HE3 TRP A 5 -2.638 8.044 1.075 1.00 10.00 H new ATOM 0 HZ2 TRP A 5 -3.092 5.270 5.189 1.00 10.00 H new ATOM 0 HZ3 TRP A 5 -2.792 9.128 3.297 1.00 10.00 H new ATOM 0 HH2 TRP A 5 -3.013 7.757 5.356 1.00 10.00 H new ATOM 82 N SER A 6 0.266 6.304 0.721 1.00 10.00 N ATOM 83 CA SER A 6 0.973 7.263 1.591 1.00 10.00 C ATOM 84 C SER A 6 2.306 7.798 1.008 1.00 10.00 C ATOM 85 O SER A 6 2.952 8.648 1.627 1.00 10.00 O ATOM 86 CB SER A 6 1.188 6.622 2.970 1.00 10.00 C ATOM 87 OG SER A 6 1.485 7.590 3.965 1.00 10.00 O ATOM 0 H SER A 6 0.226 5.363 1.112 1.00 10.00 H new ATOM 0 HA SER A 6 0.337 8.145 1.674 1.00 10.00 H new ATOM 0 HB2 SER A 6 0.293 6.070 3.257 1.00 10.00 H new ATOM 0 HB3 SER A 6 2.003 5.900 2.911 1.00 10.00 H new ATOM 0 HG SER A 6 2.077 8.275 3.589 1.00 10.00 H new ATOM 93 N GLY A 7 2.714 7.335 -0.182 1.00 10.00 N ATOM 94 CA GLY A 7 3.863 7.829 -0.955 1.00 10.00 C ATOM 95 C GLY A 7 3.532 8.138 -2.424 1.00 10.00 C ATOM 96 O GLY A 7 4.427 8.100 -3.274 1.00 10.00 O ATOM 0 H GLY A 7 2.230 6.571 -0.654 1.00 10.00 H new ATOM 0 HA2 GLY A 7 4.248 8.732 -0.481 1.00 10.00 H new ATOM 0 HA3 GLY A 7 4.660 7.086 -0.920 1.00 10.00 H new ATOM 100 N TYR A 8 2.258 8.409 -2.740 1.00 10.00 N ATOM 101 CA TYR A 8 1.757 8.718 -4.082 1.00 10.00 C ATOM 102 C TYR A 8 0.531 9.653 -4.082 1.00 10.00 C ATOM 103 O TYR A 8 0.473 10.622 -4.843 1.00 10.00 O ATOM 104 CB TYR A 8 1.427 7.392 -4.790 1.00 10.00 C ATOM 105 CG TYR A 8 0.774 7.544 -6.151 1.00 10.00 C ATOM 106 CD1 TYR A 8 1.536 7.979 -7.252 1.00 10.00 C ATOM 107 CD2 TYR A 8 -0.596 7.256 -6.314 1.00 10.00 C ATOM 108 CE1 TYR A 8 0.932 8.129 -8.515 1.00 10.00 C ATOM 109 CE2 TYR A 8 -1.205 7.400 -7.577 1.00 10.00 C ATOM 110 CZ TYR A 8 -0.441 7.839 -8.682 1.00 10.00 C ATOM 111 OH TYR A 8 -1.018 7.985 -9.907 1.00 10.00 O ATOM 0 H TYR A 8 1.519 8.419 -2.036 1.00 10.00 H new ATOM 0 HA TYR A 8 2.537 9.262 -4.614 1.00 10.00 H new ATOM 0 HB2 TYR A 8 2.347 6.819 -4.906 1.00 10.00 H new ATOM 0 HB3 TYR A 8 0.767 6.808 -4.149 1.00 10.00 H new ATOM 0 HD1 TYR A 8 2.586 8.198 -7.128 1.00 10.00 H new ATOM 0 HD2 TYR A 8 -1.181 6.924 -5.469 1.00 10.00 H new ATOM 0 HE1 TYR A 8 1.519 8.466 -9.357 1.00 10.00 H new ATOM 0 HE2 TYR A 8 -2.254 7.175 -7.700 1.00 10.00 H new ATOM 0 HH TYR A 8 -1.966 7.744 -9.853 1.00 10.00 H new ATOM 121 N LEU A 9 -0.430 9.394 -3.191 1.00 10.00 N ATOM 122 CA LEU A 9 -1.674 10.151 -3.009 1.00 10.00 C ATOM 123 C LEU A 9 -1.420 11.638 -2.741 1.00 10.00 C ATOM 124 O LEU A 9 -2.160 12.488 -3.228 1.00 10.00 O ATOM 125 CB LEU A 9 -2.448 9.486 -1.849 1.00 10.00 C ATOM 126 CG LEU A 9 -3.837 10.019 -1.456 1.00 10.00 C ATOM 127 CD1 LEU A 9 -3.786 11.299 -0.613 1.00 10.00 C ATOM 128 CD2 LEU A 9 -4.757 10.165 -2.666 1.00 10.00 C ATOM 0 H LEU A 9 -0.359 8.610 -2.543 1.00 10.00 H new ATOM 0 HA LEU A 9 -2.261 10.123 -3.927 1.00 10.00 H new ATOM 0 HB2 LEU A 9 -2.562 8.431 -2.096 1.00 10.00 H new ATOM 0 HB3 LEU A 9 -1.816 9.539 -0.963 1.00 10.00 H new ATOM 0 HG LEU A 9 -4.271 9.258 -0.807 1.00 10.00 H new ATOM 0 HD11 LEU A 9 -4.800 11.617 -0.373 1.00 10.00 H new ATOM 0 HD12 LEU A 9 -3.238 11.106 0.309 1.00 10.00 H new ATOM 0 HD13 LEU A 9 -3.283 12.085 -1.176 1.00 10.00 H new ATOM 0 HD21 LEU A 9 -5.726 10.544 -2.342 1.00 10.00 H new ATOM 0 HD22 LEU A 9 -4.314 10.862 -3.378 1.00 10.00 H new ATOM 0 HD23 LEU A 9 -4.888 9.194 -3.143 1.00 10.00 H new ATOM 140 N ASP A 10 -0.367 11.954 -1.991 1.00 10.00 N ATOM 141 CA ASP A 10 -0.039 13.305 -1.525 1.00 10.00 C ATOM 142 C ASP A 10 0.219 14.344 -2.641 1.00 10.00 C ATOM 143 O ASP A 10 0.149 15.545 -2.379 1.00 10.00 O ATOM 144 CB ASP A 10 1.147 13.227 -0.551 1.00 10.00 C ATOM 145 CG ASP A 10 2.448 12.761 -1.230 1.00 10.00 C ATOM 146 OD1 ASP A 10 2.608 11.536 -1.447 1.00 10.00 O ATOM 147 OD2 ASP A 10 3.316 13.615 -1.531 1.00 10.00 O ATOM 0 H ASP A 10 0.306 11.255 -1.679 1.00 10.00 H new ATOM 0 HA ASP A 10 -0.929 13.679 -1.020 1.00 10.00 H new ATOM 0 HB2 ASP A 10 1.308 14.207 -0.102 1.00 10.00 H new ATOM 0 HB3 ASP A 10 0.900 12.542 0.260 1.00 10.00 H new ATOM 152 N ASP A 11 0.459 13.911 -3.884 1.00 10.00 N ATOM 153 CA ASP A 11 0.508 14.782 -5.072 1.00 10.00 C ATOM 154 C ASP A 11 -0.813 14.797 -5.857 1.00 10.00 C ATOM 155 O ASP A 11 -1.234 15.829 -6.382 1.00 10.00 O ATOM 156 CB ASP A 11 1.676 14.337 -5.964 1.00 10.00 C ATOM 157 CG ASP A 11 1.855 15.257 -7.185 1.00 10.00 C ATOM 158 OD1 ASP A 11 2.323 16.408 -7.012 1.00 10.00 O ATOM 159 OD2 ASP A 11 1.554 14.823 -8.323 1.00 10.00 O ATOM 0 H ASP A 11 0.628 12.929 -4.100 1.00 10.00 H new ATOM 0 HA ASP A 11 0.664 15.807 -4.736 1.00 10.00 H new ATOM 0 HB2 ASP A 11 2.596 14.329 -5.379 1.00 10.00 H new ATOM 0 HB3 ASP A 11 1.504 13.315 -6.303 1.00 10.00 H new ATOM 164 N VAL A 12 -1.495 13.654 -5.891 1.00 10.00 N ATOM 165 CA VAL A 12 -2.737 13.410 -6.618 1.00 10.00 C ATOM 166 C VAL A 12 -3.915 14.130 -5.973 1.00 10.00 C ATOM 167 O VAL A 12 -4.579 14.945 -6.609 1.00 10.00 O ATOM 168 CB VAL A 12 -2.969 11.888 -6.678 1.00 10.00 C ATOM 169 CG1 VAL A 12 -4.340 11.515 -7.246 1.00 10.00 C ATOM 170 CG2 VAL A 12 -1.854 11.250 -7.515 1.00 10.00 C ATOM 0 H VAL A 12 -1.177 12.828 -5.384 1.00 10.00 H new ATOM 0 HA VAL A 12 -2.654 13.809 -7.629 1.00 10.00 H new ATOM 0 HB VAL A 12 -2.948 11.507 -5.657 1.00 10.00 H new ATOM 0 HG11 VAL A 12 -4.444 10.430 -7.263 1.00 10.00 H new ATOM 0 HG12 VAL A 12 -5.122 11.945 -6.620 1.00 10.00 H new ATOM 0 HG13 VAL A 12 -4.432 11.904 -8.260 1.00 10.00 H new ATOM 0 HG21 VAL A 12 -2.008 10.172 -7.565 1.00 10.00 H new ATOM 0 HG22 VAL A 12 -1.872 11.666 -8.522 1.00 10.00 H new ATOM 0 HG23 VAL A 12 -0.889 11.458 -7.054 1.00 10.00 H new ATOM 180 N SER A 13 -4.141 13.870 -4.687 1.00 10.00 N ATOM 181 CA SER A 13 -5.182 14.503 -3.885 1.00 10.00 C ATOM 182 C SER A 13 -4.938 15.996 -3.698 1.00 10.00 C ATOM 183 O SER A 13 -5.882 16.780 -3.628 1.00 10.00 O ATOM 184 CB SER A 13 -5.285 13.805 -2.535 1.00 10.00 C ATOM 185 OG SER A 13 -6.394 14.277 -1.789 1.00 10.00 O ATOM 0 H SER A 13 -3.588 13.193 -4.160 1.00 10.00 H new ATOM 0 HA SER A 13 -6.125 14.401 -4.422 1.00 10.00 H new ATOM 0 HB2 SER A 13 -5.378 12.730 -2.687 1.00 10.00 H new ATOM 0 HB3 SER A 13 -4.368 13.969 -1.969 1.00 10.00 H new ATOM 0 HG SER A 13 -6.433 13.809 -0.929 1.00 10.00 H new ATOM 191 N ALA A 14 -3.677 16.438 -3.703 1.00 10.00 N ATOM 192 CA ALA A 14 -3.384 17.857 -3.592 1.00 10.00 C ATOM 193 C ALA A 14 -3.910 18.689 -4.789 1.00 10.00 C ATOM 194 O ALA A 14 -4.203 19.878 -4.636 1.00 10.00 O ATOM 195 CB ALA A 14 -1.902 18.094 -3.342 1.00 10.00 C ATOM 0 H ALA A 14 -2.857 15.837 -3.782 1.00 10.00 H new ATOM 0 HA ALA A 14 -3.934 18.218 -2.723 1.00 10.00 H new ATOM 0 HB1 ALA A 14 -1.713 19.165 -3.263 1.00 10.00 H new ATOM 0 HB2 ALA A 14 -1.607 17.604 -2.414 1.00 10.00 H new ATOM 0 HB3 ALA A 14 -1.323 17.683 -4.169 1.00 10.00 H new ATOM 201 N LYS A 15 -4.098 18.067 -5.969 1.00 10.00 N ATOM 202 CA LYS A 15 -4.784 18.675 -7.121 1.00 10.00 C ATOM 203 C LYS A 15 -6.251 19.011 -6.817 1.00 10.00 C ATOM 204 O LYS A 15 -6.753 20.045 -7.258 1.00 10.00 O ATOM 205 CB LYS A 15 -4.569 17.832 -8.399 1.00 10.00 C ATOM 206 CG LYS A 15 -5.777 17.016 -8.899 1.00 10.00 C ATOM 207 CD LYS A 15 -5.387 16.056 -10.031 1.00 10.00 C ATOM 208 CE LYS A 15 -4.947 16.795 -11.304 1.00 10.00 C ATOM 209 NZ LYS A 15 -4.547 15.847 -12.377 1.00 10.00 N ATOM 0 H LYS A 15 -3.773 17.117 -6.149 1.00 10.00 H new ATOM 0 HA LYS A 15 -4.325 19.643 -7.322 1.00 10.00 H new ATOM 0 HB2 LYS A 15 -4.255 18.501 -9.200 1.00 10.00 H new ATOM 0 HB3 LYS A 15 -3.744 17.143 -8.218 1.00 10.00 H new ATOM 0 HG2 LYS A 15 -6.200 16.448 -8.070 1.00 10.00 H new ATOM 0 HG3 LYS A 15 -6.554 17.695 -9.250 1.00 10.00 H new ATOM 0 HD2 LYS A 15 -4.578 15.410 -9.692 1.00 10.00 H new ATOM 0 HD3 LYS A 15 -6.234 15.411 -10.264 1.00 10.00 H new ATOM 0 HE2 LYS A 15 -5.762 17.425 -11.660 1.00 10.00 H new ATOM 0 HE3 LYS A 15 -4.112 17.456 -11.072 1.00 10.00 H new ATOM 0 HZ1 LYS A 15 -4.256 16.381 -13.221 1.00 10.00 H new ATOM 0 HZ2 LYS A 15 -3.753 15.263 -12.046 1.00 10.00 H new ATOM 0 HZ3 LYS A 15 -5.352 15.233 -12.616 1.00 10.00 H new ATOM 223 N PHE A 16 -6.912 18.174 -6.011 1.00 10.00 N ATOM 224 CA PHE A 16 -8.227 18.440 -5.441 1.00 10.00 C ATOM 225 C PHE A 16 -8.095 19.585 -4.424 1.00 10.00 C ATOM 226 O PHE A 16 -8.820 20.570 -4.500 1.00 10.00 O ATOM 227 CB PHE A 16 -8.855 17.205 -4.745 1.00 10.00 C ATOM 228 CG PHE A 16 -9.065 15.908 -5.524 1.00 10.00 C ATOM 229 CD1 PHE A 16 -8.008 15.263 -6.199 1.00 10.00 C ATOM 230 CD2 PHE A 16 -10.321 15.271 -5.478 1.00 10.00 C ATOM 231 CE1 PHE A 16 -8.221 14.055 -6.886 1.00 10.00 C ATOM 232 CE2 PHE A 16 -10.537 14.056 -6.156 1.00 10.00 C ATOM 233 CZ PHE A 16 -9.491 13.455 -6.874 1.00 10.00 C ATOM 0 H PHE A 16 -6.532 17.269 -5.732 1.00 10.00 H new ATOM 0 HA PHE A 16 -8.892 18.707 -6.262 1.00 10.00 H new ATOM 0 HB2 PHE A 16 -8.231 16.967 -3.884 1.00 10.00 H new ATOM 0 HB3 PHE A 16 -9.827 17.511 -4.359 1.00 10.00 H new ATOM 0 HD1 PHE A 16 -7.022 15.703 -6.188 1.00 10.00 H new ATOM 0 HD2 PHE A 16 -11.127 15.720 -4.916 1.00 10.00 H new ATOM 0 HE1 PHE A 16 -7.408 13.588 -7.423 1.00 10.00 H new ATOM 0 HE2 PHE A 16 -11.509 13.586 -6.124 1.00 10.00 H new ATOM 0 HZ PHE A 16 -9.662 12.536 -7.415 1.00 10.00 H new ATOM 243 N ASP A 17 -7.122 19.489 -3.508 1.00 10.00 N ATOM 244 CA ASP A 17 -6.949 20.382 -2.352 1.00 10.00 C ATOM 245 C ASP A 17 -6.807 21.886 -2.672 1.00 10.00 C ATOM 246 O ASP A 17 -7.152 22.724 -1.838 1.00 10.00 O ATOM 247 CB ASP A 17 -5.767 19.893 -1.505 1.00 10.00 C ATOM 248 CG ASP A 17 -5.716 20.562 -0.121 1.00 10.00 C ATOM 249 OD1 ASP A 17 -6.611 20.290 0.716 1.00 10.00 O ATOM 250 OD2 ASP A 17 -4.758 21.326 0.151 1.00 10.00 O ATOM 0 H ASP A 17 -6.408 18.762 -3.552 1.00 10.00 H new ATOM 0 HA ASP A 17 -7.885 20.321 -1.797 1.00 10.00 H new ATOM 0 HB2 ASP A 17 -5.836 18.812 -1.380 1.00 10.00 H new ATOM 0 HB3 ASP A 17 -4.836 20.093 -2.036 1.00 10.00 H new ATOM 255 N THR A 18 -6.352 22.244 -3.877 1.00 10.00 N ATOM 256 CA THR A 18 -6.223 23.633 -4.334 1.00 10.00 C ATOM 257 C THR A 18 -7.394 24.116 -5.210 1.00 10.00 C ATOM 258 O THR A 18 -7.744 25.297 -5.185 1.00 10.00 O ATOM 259 CB THR A 18 -4.861 23.842 -5.011 1.00 10.00 C ATOM 260 OG1 THR A 18 -4.532 25.214 -5.058 1.00 10.00 O ATOM 261 CG2 THR A 18 -4.830 23.299 -6.436 1.00 10.00 C ATOM 0 H THR A 18 -6.057 21.563 -4.577 1.00 10.00 H new ATOM 0 HA THR A 18 -6.272 24.264 -3.447 1.00 10.00 H new ATOM 0 HB THR A 18 -4.136 23.294 -4.409 1.00 10.00 H new ATOM 0 HG1 THR A 18 -3.660 25.327 -5.491 1.00 10.00 H new ATOM 0 HG21 THR A 18 -3.845 23.472 -6.870 1.00 10.00 H new ATOM 0 HG22 THR A 18 -5.038 22.229 -6.422 1.00 10.00 H new ATOM 0 HG23 THR A 18 -5.585 23.808 -7.036 1.00 10.00 H new ATOM 269 N GLY A 19 -8.067 23.212 -5.937 1.00 10.00 N ATOM 270 CA GLY A 19 -9.273 23.539 -6.716 1.00 10.00 C ATOM 271 C GLY A 19 -10.518 23.611 -5.837 1.00 10.00 C ATOM 272 O GLY A 19 -11.321 24.535 -5.974 1.00 10.00 O ATOM 0 H GLY A 19 -7.791 22.232 -6.002 1.00 10.00 H new ATOM 0 HA2 GLY A 19 -9.130 24.494 -7.222 1.00 10.00 H new ATOM 0 HA3 GLY A 19 -9.419 22.787 -7.491 1.00 10.00 H new ATOM 276 N VAL A 20 -10.632 22.703 -4.863 1.00 10.00 N ATOM 277 CA VAL A 20 -11.634 22.750 -3.795 1.00 10.00 C ATOM 278 C VAL A 20 -11.573 24.053 -3.047 1.00 10.00 C ATOM 279 O VAL A 20 -12.606 24.599 -2.695 1.00 10.00 O ATOM 280 CB VAL A 20 -11.481 21.567 -2.817 1.00 10.00 C ATOM 281 CG1 VAL A 20 -10.574 21.777 -1.600 1.00 10.00 C ATOM 282 CG2 VAL A 20 -12.857 21.153 -2.294 1.00 10.00 C ATOM 0 H VAL A 20 -10.014 21.894 -4.794 1.00 10.00 H new ATOM 0 HA VAL A 20 -12.611 22.670 -4.272 1.00 10.00 H new ATOM 0 HB VAL A 20 -10.991 20.804 -3.422 1.00 10.00 H new ATOM 0 HG11 VAL A 20 -10.557 20.868 -0.998 1.00 10.00 H new ATOM 0 HG12 VAL A 20 -9.563 22.009 -1.935 1.00 10.00 H new ATOM 0 HG13 VAL A 20 -10.956 22.603 -1.000 1.00 10.00 H new ATOM 0 HG21 VAL A 20 -12.747 20.317 -1.603 1.00 10.00 H new ATOM 0 HG22 VAL A 20 -13.317 21.994 -1.776 1.00 10.00 H new ATOM 0 HG23 VAL A 20 -13.489 20.852 -3.130 1.00 10.00 H new ATOM 292 N ASP A 21 -10.368 24.570 -2.848 1.00 10.00 N ATOM 293 CA ASP A 21 -10.128 25.811 -2.148 1.00 10.00 C ATOM 294 C ASP A 21 -10.619 27.048 -2.901 1.00 10.00 C ATOM 295 O ASP A 21 -10.978 28.021 -2.252 1.00 10.00 O ATOM 296 CB ASP A 21 -8.667 25.849 -1.723 1.00 10.00 C ATOM 297 CG ASP A 21 -8.202 27.217 -1.195 1.00 10.00 C ATOM 298 OD1 ASP A 21 -8.449 27.517 -0.002 1.00 10.00 O ATOM 299 OD2 ASP A 21 -7.559 27.977 -1.957 1.00 10.00 O ATOM 0 H ASP A 21 -9.514 24.122 -3.180 1.00 10.00 H new ATOM 0 HA ASP A 21 -10.739 25.843 -1.246 1.00 10.00 H new ATOM 0 HB2 ASP A 21 -8.505 25.099 -0.949 1.00 10.00 H new ATOM 0 HB3 ASP A 21 -8.045 25.569 -2.573 1.00 10.00 H new ATOM 304 N ASN A 22 -10.763 27.010 -4.228 1.00 10.00 N ATOM 305 CA ASN A 22 -11.449 28.072 -4.955 1.00 10.00 C ATOM 306 C ASN A 22 -12.957 28.078 -4.671 1.00 10.00 C ATOM 307 O ASN A 22 -13.620 29.110 -4.800 1.00 10.00 O ATOM 308 CB ASN A 22 -11.277 27.880 -6.466 1.00 10.00 C ATOM 309 CG ASN A 22 -9.850 28.059 -6.960 1.00 10.00 C ATOM 310 OD1 ASN A 22 -9.089 28.891 -6.482 1.00 10.00 O ATOM 311 ND2 ASN A 22 -9.446 27.301 -7.955 1.00 10.00 N ATOM 0 H ASN A 22 -10.413 26.255 -4.817 1.00 10.00 H new ATOM 0 HA ASN A 22 -11.007 29.011 -4.621 1.00 10.00 H new ATOM 0 HB2 ASN A 22 -11.620 26.881 -6.735 1.00 10.00 H new ATOM 0 HB3 ASN A 22 -11.921 28.589 -6.986 1.00 10.00 H new ATOM 0 HD21 ASN A 22 -8.502 27.407 -8.326 1.00 10.00 H new ATOM 0 HD22 ASN A 22 -10.077 26.607 -8.356 1.00 10.00 H new ATOM 318 N LEU A 23 -13.510 26.914 -4.326 1.00 10.00 N ATOM 319 CA LEU A 23 -14.855 26.783 -3.819 1.00 10.00 C ATOM 320 C LEU A 23 -14.952 27.103 -2.320 1.00 10.00 C ATOM 321 O LEU A 23 -15.817 27.870 -1.915 1.00 10.00 O ATOM 322 CB LEU A 23 -15.455 25.439 -4.259 1.00 10.00 C ATOM 323 CG LEU A 23 -16.798 25.660 -4.988 1.00 10.00 C ATOM 324 CD1 LEU A 23 -17.790 26.391 -4.104 1.00 10.00 C ATOM 325 CD2 LEU A 23 -16.900 26.401 -6.319 1.00 10.00 C ATOM 0 H LEU A 23 -13.016 26.025 -4.397 1.00 10.00 H new ATOM 0 HA LEU A 23 -15.490 27.547 -4.268 1.00 10.00 H new ATOM 0 HB2 LEU A 23 -14.758 24.921 -4.917 1.00 10.00 H new ATOM 0 HB3 LEU A 23 -15.607 24.800 -3.389 1.00 10.00 H new ATOM 0 HG LEU A 23 -16.987 24.612 -5.221 1.00 10.00 H new ATOM 0 HD11 LEU A 23 -18.725 26.531 -4.646 1.00 10.00 H new ATOM 0 HD12 LEU A 23 -17.976 25.805 -3.204 1.00 10.00 H new ATOM 0 HD13 LEU A 23 -17.382 27.363 -3.826 1.00 10.00 H new ATOM 0 HD21 LEU A 23 -17.942 26.433 -6.639 1.00 10.00 H new ATOM 0 HD22 LEU A 23 -16.526 27.418 -6.199 1.00 10.00 H new ATOM 0 HD23 LEU A 23 -16.305 25.882 -7.071 1.00 10.00 H new ATOM 337 N GLN A 24 -14.012 26.611 -1.513 1.00 10.00 N ATOM 338 CA GLN A 24 -13.879 26.865 -0.081 1.00 10.00 C ATOM 339 C GLN A 24 -13.739 28.353 0.219 1.00 10.00 C ATOM 340 O GLN A 24 -14.426 28.858 1.093 1.00 10.00 O ATOM 341 CB GLN A 24 -12.638 26.147 0.465 1.00 10.00 C ATOM 342 CG GLN A 24 -12.632 25.929 1.973 1.00 10.00 C ATOM 343 CD GLN A 24 -13.571 24.804 2.412 1.00 10.00 C ATOM 344 OE1 GLN A 24 -14.749 25.004 2.674 1.00 10.00 O ATOM 345 NE2 GLN A 24 -13.095 23.580 2.508 1.00 10.00 N ATOM 0 H GLN A 24 -13.282 25.990 -1.862 1.00 10.00 H new ATOM 0 HA GLN A 24 -14.784 26.491 0.397 1.00 10.00 H new ATOM 0 HB2 GLN A 24 -12.551 25.178 -0.027 1.00 10.00 H new ATOM 0 HB3 GLN A 24 -11.754 26.724 0.193 1.00 10.00 H new ATOM 0 HG2 GLN A 24 -11.618 25.697 2.298 1.00 10.00 H new ATOM 0 HG3 GLN A 24 -12.923 26.854 2.471 1.00 10.00 H new ATOM 0 HE21 GLN A 24 -12.115 23.396 2.293 1.00 10.00 H new ATOM 0 HE22 GLN A 24 -13.706 22.816 2.797 1.00 10.00 H new ATOM 354 N THR A 25 -12.875 29.069 -0.504 1.00 10.00 N ATOM 355 CA THR A 25 -12.684 30.514 -0.377 1.00 10.00 C ATOM 356 C THR A 25 -14.008 31.229 -0.598 1.00 10.00 C ATOM 357 O THR A 25 -14.458 32.006 0.235 1.00 10.00 O ATOM 358 CB THR A 25 -11.548 30.986 -1.299 1.00 10.00 C ATOM 359 OG1 THR A 25 -11.079 32.248 -0.880 1.00 10.00 O ATOM 360 CG2 THR A 25 -11.868 31.059 -2.787 1.00 10.00 C ATOM 0 H THR A 25 -12.274 28.648 -1.212 1.00 10.00 H new ATOM 0 HA THR A 25 -12.366 30.770 0.634 1.00 10.00 H new ATOM 0 HB THR A 25 -10.792 30.206 -1.201 1.00 10.00 H new ATOM 0 HG1 THR A 25 -10.354 32.541 -1.471 1.00 10.00 H new ATOM 0 HG21 THR A 25 -10.989 31.404 -3.332 1.00 10.00 H new ATOM 0 HG22 THR A 25 -12.153 30.070 -3.147 1.00 10.00 H new ATOM 0 HG23 THR A 25 -12.691 31.755 -2.948 1.00 10.00 H new ATOM 368 N GLN A 26 -14.728 30.816 -1.636 1.00 10.00 N ATOM 369 CA GLN A 26 -16.084 31.251 -1.942 1.00 10.00 C ATOM 370 C GLN A 26 -17.107 30.981 -0.826 1.00 10.00 C ATOM 371 O GLN A 26 -17.803 31.909 -0.409 1.00 10.00 O ATOM 372 CB GLN A 26 -16.511 30.612 -3.275 1.00 10.00 C ATOM 373 CG GLN A 26 -16.622 31.656 -4.390 1.00 10.00 C ATOM 374 CD GLN A 26 -16.854 31.016 -5.755 1.00 10.00 C ATOM 375 OE1 GLN A 26 -17.911 31.157 -6.355 1.00 10.00 O ATOM 376 NE2 GLN A 26 -15.909 30.266 -6.282 1.00 10.00 N ATOM 0 H GLN A 26 -14.368 30.143 -2.313 1.00 10.00 H new ATOM 0 HA GLN A 26 -16.070 32.338 -2.027 1.00 10.00 H new ATOM 0 HB2 GLN A 26 -15.788 29.848 -3.561 1.00 10.00 H new ATOM 0 HB3 GLN A 26 -17.471 30.111 -3.148 1.00 10.00 H new ATOM 0 HG2 GLN A 26 -17.442 32.339 -4.166 1.00 10.00 H new ATOM 0 HG3 GLN A 26 -15.710 32.252 -4.420 1.00 10.00 H new ATOM 0 HE21 GLN A 26 -15.024 30.141 -5.791 1.00 10.00 H new ATOM 0 HE22 GLN A 26 -16.062 29.810 -7.181 1.00 10.00 H new ATOM 385 N VAL A 27 -17.207 29.751 -0.307 1.00 10.00 N ATOM 386 CA VAL A 27 -18.124 29.444 0.797 1.00 10.00 C ATOM 387 C VAL A 27 -17.729 30.194 2.059 1.00 10.00 C ATOM 388 O VAL A 27 -18.572 30.679 2.800 1.00 10.00 O ATOM 389 CB VAL A 27 -18.285 27.949 1.140 1.00 10.00 C ATOM 390 CG1 VAL A 27 -18.221 27.035 -0.083 1.00 10.00 C ATOM 391 CG2 VAL A 27 -17.354 27.336 2.188 1.00 10.00 C ATOM 0 H VAL A 27 -16.664 28.952 -0.634 1.00 10.00 H new ATOM 0 HA VAL A 27 -19.093 29.775 0.424 1.00 10.00 H new ATOM 0 HB VAL A 27 -19.279 27.988 1.585 1.00 10.00 H new ATOM 0 HG11 VAL A 27 -18.341 25.998 0.231 1.00 10.00 H new ATOM 0 HG12 VAL A 27 -19.019 27.299 -0.777 1.00 10.00 H new ATOM 0 HG13 VAL A 27 -17.257 27.155 -0.577 1.00 10.00 H new ATOM 0 HG21 VAL A 27 -17.594 26.280 2.315 1.00 10.00 H new ATOM 0 HG22 VAL A 27 -16.320 27.436 1.859 1.00 10.00 H new ATOM 0 HG23 VAL A 27 -17.484 27.855 3.138 1.00 10.00 H new ATOM 401 N THR A 28 -16.430 30.320 2.298 1.00 10.00 N ATOM 402 CA THR A 28 -15.890 31.041 3.434 1.00 10.00 C ATOM 403 C THR A 28 -16.157 32.525 3.321 1.00 10.00 C ATOM 404 O THR A 28 -16.248 33.205 4.329 1.00 10.00 O ATOM 405 CB THR A 28 -14.386 30.873 3.580 1.00 10.00 C ATOM 406 OG1 THR A 28 -14.001 29.517 3.628 1.00 10.00 O ATOM 407 CG2 THR A 28 -13.922 31.501 4.877 1.00 10.00 C ATOM 0 H THR A 28 -15.713 29.916 1.695 1.00 10.00 H new ATOM 0 HA THR A 28 -16.392 30.615 4.303 1.00 10.00 H new ATOM 0 HB THR A 28 -13.937 31.351 2.709 1.00 10.00 H new ATOM 0 HG1 THR A 28 -13.843 29.189 2.718 1.00 10.00 H new ATOM 0 HG21 THR A 28 -12.844 31.377 4.976 1.00 10.00 H new ATOM 0 HG22 THR A 28 -14.167 32.563 4.875 1.00 10.00 H new ATOM 0 HG23 THR A 28 -14.421 31.015 5.715 1.00 10.00 H new ATOM 415 N GLU A 29 -16.291 33.069 2.121 1.00 10.00 N ATOM 416 CA GLU A 29 -16.660 34.455 1.969 1.00 10.00 C ATOM 417 C GLU A 29 -18.180 34.657 2.149 1.00 10.00 C ATOM 418 O GLU A 29 -18.610 35.708 2.611 1.00 10.00 O ATOM 419 CB GLU A 29 -16.111 35.023 0.679 1.00 10.00 C ATOM 420 CG GLU A 29 -14.592 35.213 0.767 1.00 10.00 C ATOM 421 CD GLU A 29 -14.035 35.917 -0.487 1.00 10.00 C ATOM 422 OE1 GLU A 29 -14.095 35.341 -1.601 1.00 10.00 O ATOM 423 OE2 GLU A 29 -13.537 37.064 -0.368 1.00 10.00 O ATOM 0 H GLU A 29 -16.149 32.567 1.244 1.00 10.00 H new ATOM 0 HA GLU A 29 -16.196 35.032 2.769 1.00 10.00 H new ATOM 0 HB2 GLU A 29 -16.351 34.355 -0.148 1.00 10.00 H new ATOM 0 HB3 GLU A 29 -16.589 35.979 0.465 1.00 10.00 H new ATOM 0 HG2 GLU A 29 -14.349 35.800 1.653 1.00 10.00 H new ATOM 0 HG3 GLU A 29 -14.109 34.243 0.885 1.00 10.00 H new ATOM 430 N ALA A 30 -19.017 33.656 1.849 1.00 10.00 N ATOM 431 CA ALA A 30 -20.429 33.659 2.235 1.00 10.00 C ATOM 432 C ALA A 30 -20.532 33.599 3.765 1.00 10.00 C ATOM 433 O ALA A 30 -21.325 34.296 4.396 1.00 10.00 O ATOM 434 CB ALA A 30 -21.135 32.453 1.613 1.00 10.00 C ATOM 0 H ALA A 30 -18.733 32.824 1.333 1.00 10.00 H new ATOM 0 HA ALA A 30 -20.908 34.570 1.876 1.00 10.00 H new ATOM 0 HB1 ALA A 30 -22.186 32.458 1.902 1.00 10.00 H new ATOM 0 HB2 ALA A 30 -21.057 32.506 0.527 1.00 10.00 H new ATOM 0 HB3 ALA A 30 -20.666 31.535 1.966 1.00 10.00 H new ATOM 440 N LEU A 31 -19.654 32.804 4.367 1.00 10.00 N ATOM 441 CA LEU A 31 -19.419 32.742 5.788 1.00 10.00 C ATOM 442 C LEU A 31 -18.773 34.015 6.352 1.00 10.00 C ATOM 443 O LEU A 31 -19.049 34.354 7.485 1.00 10.00 O ATOM 444 CB LEU A 31 -18.534 31.535 6.050 1.00 10.00 C ATOM 445 CG LEU A 31 -18.375 31.235 7.535 1.00 10.00 C ATOM 446 CD1 LEU A 31 -19.570 30.436 8.036 1.00 10.00 C ATOM 447 CD2 LEU A 31 -17.061 30.495 7.696 1.00 10.00 C ATOM 0 H LEU A 31 -19.063 32.158 3.844 1.00 10.00 H new ATOM 0 HA LEU A 31 -20.379 32.653 6.297 1.00 10.00 H new ATOM 0 HB2 LEU A 31 -18.958 30.664 5.551 1.00 10.00 H new ATOM 0 HB3 LEU A 31 -17.551 31.708 5.611 1.00 10.00 H new ATOM 0 HG LEU A 31 -18.349 32.144 8.136 1.00 10.00 H new ATOM 0 HD11 LEU A 31 -19.448 30.226 9.099 1.00 10.00 H new ATOM 0 HD12 LEU A 31 -20.483 31.012 7.883 1.00 10.00 H new ATOM 0 HD13 LEU A 31 -19.636 29.497 7.486 1.00 10.00 H new ATOM 0 HD21 LEU A 31 -16.903 30.258 8.748 1.00 10.00 H new ATOM 0 HD22 LEU A 31 -17.090 29.572 7.117 1.00 10.00 H new ATOM 0 HD23 LEU A 31 -16.244 31.122 7.339 1.00 10.00 H new ATOM 459 N ASP A 32 -17.965 34.770 5.611 1.00 10.00 N ATOM 460 CA ASP A 32 -17.471 36.080 6.036 1.00 10.00 C ATOM 461 C ASP A 32 -18.663 37.010 6.317 1.00 10.00 C ATOM 462 O ASP A 32 -18.634 37.803 7.258 1.00 10.00 O ATOM 463 CB ASP A 32 -16.475 36.645 5.003 1.00 10.00 C ATOM 464 CG ASP A 32 -16.133 38.122 5.252 1.00 10.00 C ATOM 465 OD1 ASP A 32 -15.332 38.414 6.173 1.00 10.00 O ATOM 466 OD2 ASP A 32 -16.646 38.991 4.505 1.00 10.00 O ATOM 0 H ASP A 32 -17.631 34.488 4.689 1.00 10.00 H new ATOM 0 HA ASP A 32 -16.912 35.989 6.967 1.00 10.00 H new ATOM 0 HB2 ASP A 32 -15.559 36.055 5.028 1.00 10.00 H new ATOM 0 HB3 ASP A 32 -16.896 36.538 4.003 1.00 10.00 H new ATOM 471 N LYS A 33 -19.764 36.817 5.574 1.00 10.00 N ATOM 472 CA LYS A 33 -21.050 37.435 5.825 1.00 10.00 C ATOM 473 C LYS A 33 -21.760 36.782 7.015 1.00 10.00 C ATOM 474 O LYS A 33 -22.332 37.465 7.861 1.00 10.00 O ATOM 475 CB LYS A 33 -21.936 37.449 4.577 1.00 10.00 C ATOM 476 CG LYS A 33 -21.322 37.537 3.175 1.00 10.00 C ATOM 477 CD LYS A 33 -20.099 38.444 3.010 1.00 10.00 C ATOM 478 CE LYS A 33 -19.744 38.584 1.531 1.00 10.00 C ATOM 479 NZ LYS A 33 -18.551 39.452 1.356 1.00 10.00 N ATOM 0 H LYS A 33 -19.771 36.204 4.758 1.00 10.00 H new ATOM 0 HA LYS A 33 -20.859 38.476 6.086 1.00 10.00 H new ATOM 0 HB2 LYS A 33 -22.541 36.543 4.605 1.00 10.00 H new ATOM 0 HB3 LYS A 33 -22.620 38.292 4.680 1.00 10.00 H new ATOM 0 HG2 LYS A 33 -21.043 36.531 2.863 1.00 10.00 H new ATOM 0 HG3 LYS A 33 -22.095 37.881 2.487 1.00 10.00 H new ATOM 0 HD2 LYS A 33 -20.304 39.426 3.437 1.00 10.00 H new ATOM 0 HD3 LYS A 33 -19.253 38.029 3.557 1.00 10.00 H new ATOM 0 HE2 LYS A 33 -19.550 37.600 1.104 1.00 10.00 H new ATOM 0 HE3 LYS A 33 -20.589 39.006 0.988 1.00 10.00 H new ATOM 0 HZ1 LYS A 33 -18.327 39.534 0.344 1.00 10.00 H new ATOM 0 HZ2 LYS A 33 -18.749 40.396 1.744 1.00 10.00 H new ATOM 0 HZ3 LYS A 33 -17.741 39.034 1.857 1.00 10.00 H new ATOM 493 N LEU A 34 -21.762 35.450 7.087 1.00 10.00 N ATOM 494 CA LEU A 34 -22.486 34.692 8.116 1.00 10.00 C ATOM 495 C LEU A 34 -21.814 34.812 9.495 1.00 10.00 C ATOM 496 O LEU A 34 -22.407 34.565 10.530 1.00 10.00 O ATOM 497 CB LEU A 34 -22.701 33.252 7.646 1.00 10.00 C ATOM 498 CG LEU A 34 -24.128 32.711 7.863 1.00 10.00 C ATOM 499 CD1 LEU A 34 -24.294 31.464 7.052 1.00 10.00 C ATOM 500 CD2 LEU A 34 -24.591 32.263 9.232 1.00 10.00 C ATOM 0 H LEU A 34 -21.257 34.859 6.427 1.00 10.00 H new ATOM 0 HA LEU A 34 -23.475 35.127 8.256 1.00 10.00 H new ATOM 0 HB2 LEU A 34 -22.461 33.191 6.584 1.00 10.00 H new ATOM 0 HB3 LEU A 34 -21.998 32.604 8.169 1.00 10.00 H new ATOM 0 HG LEU A 34 -24.708 33.598 7.610 1.00 10.00 H new ATOM 0 HD11 LEU A 34 -25.300 31.068 7.195 1.00 10.00 H new ATOM 0 HD12 LEU A 34 -24.140 31.693 5.997 1.00 10.00 H new ATOM 0 HD13 LEU A 34 -23.563 30.722 7.372 1.00 10.00 H new ATOM 0 HD21 LEU A 34 -25.623 31.917 9.172 1.00 10.00 H new ATOM 0 HD22 LEU A 34 -23.956 31.450 9.583 1.00 10.00 H new ATOM 0 HD23 LEU A 34 -24.528 33.099 9.929 1.00 10.00 H new ATOM 512 N ALA A 35 -20.548 35.189 9.521 1.00 10.00 N ATOM 513 CA ALA A 35 -19.804 35.573 10.699 1.00 10.00 C ATOM 514 C ALA A 35 -20.098 37.065 11.069 1.00 10.00 C ATOM 515 O ALA A 35 -19.941 37.457 12.227 1.00 10.00 O ATOM 516 CB ALA A 35 -18.336 35.217 10.411 1.00 10.00 C ATOM 0 H ALA A 35 -19.984 35.237 8.672 1.00 10.00 H new ATOM 0 HA ALA A 35 -20.100 35.036 11.600 1.00 10.00 H new ATOM 0 HB1 ALA A 35 -17.721 35.486 11.270 1.00 10.00 H new ATOM 0 HB2 ALA A 35 -18.251 34.146 10.224 1.00 10.00 H new ATOM 0 HB3 ALA A 35 -17.994 35.766 9.534 1.00 10.00 H new ATOM 522 N ALA A 36 -20.543 37.893 10.098 1.00 10.00 N ATOM 523 CA ALA A 36 -20.929 39.314 10.226 1.00 10.00 C ATOM 524 C ALA A 36 -22.353 39.591 10.776 1.00 10.00 C ATOM 525 O ALA A 36 -22.512 40.356 11.732 1.00 10.00 O ATOM 526 CB ALA A 36 -20.724 40.016 8.865 1.00 10.00 C ATOM 0 H ALA A 36 -20.649 37.563 9.139 1.00 10.00 H new ATOM 0 HA ALA A 36 -20.273 39.725 10.993 1.00 10.00 H new ATOM 0 HB1 ALA A 36 -21.007 41.065 8.951 1.00 10.00 H new ATOM 0 HB2 ALA A 36 -19.676 39.945 8.573 1.00 10.00 H new ATOM 0 HB3 ALA A 36 -21.344 39.534 8.110 1.00 10.00 H new ATOM 532 N LYS A 37 -23.385 38.977 10.178 1.00 10.00 N ATOM 533 CA LYS A 37 -24.836 39.150 10.474 1.00 10.00 C ATOM 534 C LYS A 37 -25.550 37.778 10.399 1.00 10.00 C ATOM 535 O LYS A 37 -26.592 37.641 9.760 1.00 10.00 O ATOM 536 CB LYS A 37 -25.392 40.078 9.390 1.00 10.00 C ATOM 537 CG LYS A 37 -26.740 40.745 9.696 1.00 10.00 C ATOM 538 CD LYS A 37 -27.358 41.298 8.402 1.00 10.00 C ATOM 539 CE LYS A 37 -26.638 42.553 7.890 1.00 10.00 C ATOM 540 NZ LYS A 37 -27.297 43.091 6.670 1.00 10.00 N ATOM 0 H LYS A 37 -23.232 38.303 9.428 1.00 10.00 H new ATOM 0 HA LYS A 37 -24.992 39.563 11.470 1.00 10.00 H new ATOM 0 HB2 LYS A 37 -24.658 40.861 9.199 1.00 10.00 H new ATOM 0 HB3 LYS A 37 -25.494 39.505 8.468 1.00 10.00 H new ATOM 0 HG2 LYS A 37 -27.417 40.023 10.153 1.00 10.00 H new ATOM 0 HG3 LYS A 37 -26.601 41.551 10.416 1.00 10.00 H new ATOM 0 HD2 LYS A 37 -27.328 40.527 7.632 1.00 10.00 H new ATOM 0 HD3 LYS A 37 -28.408 41.533 8.577 1.00 10.00 H new ATOM 0 HE2 LYS A 37 -26.632 43.315 8.669 1.00 10.00 H new ATOM 0 HE3 LYS A 37 -25.598 42.314 7.669 1.00 10.00 H new ATOM 0 HZ1 LYS A 37 -26.789 43.939 6.346 1.00 10.00 H new ATOM 0 HZ2 LYS A 37 -27.281 42.370 5.920 1.00 10.00 H new ATOM 0 HZ3 LYS A 37 -28.283 43.340 6.889 1.00 10.00 H new ATOM 554 N PRO A 38 -25.007 36.748 11.052 1.00 10.00 N ATOM 555 CA PRO A 38 -25.353 35.354 10.863 1.00 10.00 C ATOM 556 C PRO A 38 -26.624 34.882 10.172 1.00 10.00 C ATOM 557 O PRO A 38 -26.602 34.654 8.965 1.00 10.00 O ATOM 558 CB PRO A 38 -24.939 34.580 12.108 1.00 10.00 C ATOM 559 CG PRO A 38 -24.130 35.573 12.948 1.00 10.00 C ATOM 560 CD PRO A 38 -24.029 36.854 12.118 1.00 10.00 C ATOM 0 HA PRO A 38 -24.771 35.096 9.978 1.00 10.00 H new ATOM 0 HB2 PRO A 38 -25.810 34.219 12.655 1.00 10.00 H new ATOM 0 HB3 PRO A 38 -24.342 33.706 11.848 1.00 10.00 H new ATOM 0 HG2 PRO A 38 -24.621 35.765 13.902 1.00 10.00 H new ATOM 0 HG3 PRO A 38 -23.140 35.176 13.173 1.00 10.00 H new ATOM 0 HD2 PRO A 38 -24.226 37.730 12.736 1.00 10.00 H new ATOM 0 HD3 PRO A 38 -23.025 36.971 11.710 1.00 10.00 H new ATOM 568 N SER A 39 -27.718 34.669 10.889 1.00 10.00 N ATOM 569 CA SER A 39 -28.885 34.012 10.325 1.00 10.00 C ATOM 570 C SER A 39 -29.712 34.908 9.395 1.00 10.00 C ATOM 571 O SER A 39 -30.822 34.522 9.028 1.00 10.00 O ATOM 572 CB SER A 39 -29.678 33.283 11.403 1.00 10.00 C ATOM 573 OG SER A 39 -30.175 34.182 12.386 1.00 10.00 O ATOM 0 H SER A 39 -27.820 34.943 11.866 1.00 10.00 H new ATOM 0 HA SER A 39 -28.529 33.237 9.646 1.00 10.00 H new ATOM 0 HB2 SER A 39 -30.510 32.748 10.944 1.00 10.00 H new ATOM 0 HB3 SER A 39 -29.043 32.536 11.880 1.00 10.00 H new ATOM 0 HG SER A 39 -30.680 33.682 13.061 1.00 10.00 H new ATOM 579 N ASP A 40 -29.188 36.091 9.023 1.00 10.00 N ATOM 580 CA ASP A 40 -29.709 36.944 7.946 1.00 10.00 C ATOM 581 C ASP A 40 -29.896 36.021 6.735 1.00 10.00 C ATOM 582 O ASP A 40 -28.915 35.590 6.135 1.00 10.00 O ATOM 583 CB ASP A 40 -28.787 38.133 7.648 1.00 10.00 C ATOM 584 CG ASP A 40 -29.300 38.920 6.430 1.00 10.00 C ATOM 585 OD1 ASP A 40 -30.152 39.819 6.619 1.00 10.00 O ATOM 586 OD2 ASP A 40 -28.875 38.629 5.288 1.00 10.00 O ATOM 0 H ASP A 40 -28.367 36.488 9.479 1.00 10.00 H new ATOM 0 HA ASP A 40 -30.655 37.406 8.230 1.00 10.00 H new ATOM 0 HB2 ASP A 40 -28.737 38.789 8.517 1.00 10.00 H new ATOM 0 HB3 ASP A 40 -27.774 37.777 7.458 1.00 10.00 H new ATOM 591 N PRO A 41 -31.128 35.660 6.361 1.00 10.00 N ATOM 592 CA PRO A 41 -31.323 34.577 5.413 1.00 10.00 C ATOM 593 C PRO A 41 -30.817 34.828 4.001 1.00 10.00 C ATOM 594 O PRO A 41 -30.505 33.870 3.300 1.00 10.00 O ATOM 595 CB PRO A 41 -32.820 34.303 5.447 1.00 10.00 C ATOM 596 CG PRO A 41 -33.422 35.657 5.834 1.00 10.00 C ATOM 597 CD PRO A 41 -32.391 36.226 6.798 1.00 10.00 C ATOM 0 HA PRO A 41 -30.718 33.721 5.710 1.00 10.00 H new ATOM 0 HB2 PRO A 41 -33.188 33.962 4.479 1.00 10.00 H new ATOM 0 HB3 PRO A 41 -33.070 33.530 6.174 1.00 10.00 H new ATOM 0 HG2 PRO A 41 -33.561 36.300 4.965 1.00 10.00 H new ATOM 0 HG3 PRO A 41 -34.398 35.545 6.306 1.00 10.00 H new ATOM 0 HD2 PRO A 41 -32.371 37.315 6.760 1.00 10.00 H new ATOM 0 HD3 PRO A 41 -32.615 35.947 7.828 1.00 10.00 H new ATOM 605 N ALA A 42 -30.691 36.081 3.578 1.00 10.00 N ATOM 606 CA ALA A 42 -30.165 36.407 2.269 1.00 10.00 C ATOM 607 C ALA A 42 -28.654 36.110 2.146 1.00 10.00 C ATOM 608 O ALA A 42 -28.230 35.543 1.137 1.00 10.00 O ATOM 609 CB ALA A 42 -30.538 37.862 1.999 1.00 10.00 C ATOM 0 H ALA A 42 -30.952 36.894 4.136 1.00 10.00 H new ATOM 0 HA ALA A 42 -30.605 35.771 1.501 1.00 10.00 H new ATOM 0 HB1 ALA A 42 -30.162 38.158 1.020 1.00 10.00 H new ATOM 0 HB2 ALA A 42 -31.622 37.969 2.020 1.00 10.00 H new ATOM 0 HB3 ALA A 42 -30.096 38.499 2.765 1.00 10.00 H new ATOM 615 N LEU A 43 -27.847 36.388 3.181 1.00 10.00 N ATOM 616 CA LEU A 43 -26.446 35.960 3.255 1.00 10.00 C ATOM 617 C LEU A 43 -26.289 34.492 3.695 1.00 10.00 C ATOM 618 O LEU A 43 -25.470 33.774 3.121 1.00 10.00 O ATOM 619 CB LEU A 43 -25.652 36.956 4.119 1.00 10.00 C ATOM 620 CG LEU A 43 -25.819 36.827 5.632 1.00 10.00 C ATOM 621 CD1 LEU A 43 -24.899 35.790 6.220 1.00 10.00 C ATOM 622 CD2 LEU A 43 -25.335 38.047 6.395 1.00 10.00 C ATOM 0 H LEU A 43 -28.153 36.920 3.995 1.00 10.00 H new ATOM 0 HA LEU A 43 -26.021 35.978 2.251 1.00 10.00 H new ATOM 0 HB2 LEU A 43 -24.594 36.846 3.882 1.00 10.00 H new ATOM 0 HB3 LEU A 43 -25.941 37.966 3.828 1.00 10.00 H new ATOM 0 HG LEU A 43 -26.885 36.622 5.732 1.00 10.00 H new ATOM 0 HD11 LEU A 43 -25.054 35.735 7.297 1.00 10.00 H new ATOM 0 HD12 LEU A 43 -25.112 34.819 5.772 1.00 10.00 H new ATOM 0 HD13 LEU A 43 -23.864 36.064 6.016 1.00 10.00 H new ATOM 0 HD21 LEU A 43 -25.482 37.890 7.464 1.00 10.00 H new ATOM 0 HD22 LEU A 43 -24.275 38.205 6.194 1.00 10.00 H new ATOM 0 HD23 LEU A 43 -25.899 38.923 6.076 1.00 10.00 H new ATOM 634 N LEU A 44 -27.057 34.021 4.688 1.00 10.00 N ATOM 635 CA LEU A 44 -26.978 32.641 5.183 1.00 10.00 C ATOM 636 C LEU A 44 -27.373 31.709 4.055 1.00 10.00 C ATOM 637 O LEU A 44 -26.626 30.786 3.797 1.00 10.00 O ATOM 638 CB LEU A 44 -27.733 32.481 6.529 1.00 10.00 C ATOM 639 CG LEU A 44 -28.597 31.250 6.866 1.00 10.00 C ATOM 640 CD1 LEU A 44 -29.693 30.873 5.871 1.00 10.00 C ATOM 641 CD2 LEU A 44 -27.767 30.001 7.068 1.00 10.00 C ATOM 0 H LEU A 44 -27.753 34.589 5.171 1.00 10.00 H new ATOM 0 HA LEU A 44 -25.961 32.359 5.455 1.00 10.00 H new ATOM 0 HB2 LEU A 44 -26.982 32.557 7.316 1.00 10.00 H new ATOM 0 HB3 LEU A 44 -28.383 33.351 6.624 1.00 10.00 H new ATOM 0 HG LEU A 44 -29.083 31.590 7.781 1.00 10.00 H new ATOM 0 HD11 LEU A 44 -30.223 29.991 6.230 1.00 10.00 H new ATOM 0 HD12 LEU A 44 -30.394 31.702 5.771 1.00 10.00 H new ATOM 0 HD13 LEU A 44 -29.245 30.657 4.901 1.00 10.00 H new ATOM 0 HD21 LEU A 44 -28.423 29.163 7.303 1.00 10.00 H new ATOM 0 HD22 LEU A 44 -27.211 29.782 6.156 1.00 10.00 H new ATOM 0 HD23 LEU A 44 -27.069 30.157 7.890 1.00 10.00 H new ATOM 653 N ALA A 45 -28.428 31.943 3.276 1.00 10.00 N ATOM 654 CA ALA A 45 -28.752 31.002 2.220 1.00 10.00 C ATOM 655 C ALA A 45 -27.785 31.099 1.032 1.00 10.00 C ATOM 656 O ALA A 45 -27.657 30.132 0.286 1.00 10.00 O ATOM 657 CB ALA A 45 -30.227 31.086 1.863 1.00 10.00 C ATOM 0 H ALA A 45 -29.050 32.748 3.355 1.00 10.00 H new ATOM 0 HA ALA A 45 -28.597 29.989 2.591 1.00 10.00 H new ATOM 0 HB1 ALA A 45 -30.450 30.373 1.069 1.00 10.00 H new ATOM 0 HB2 ALA A 45 -30.828 30.851 2.742 1.00 10.00 H new ATOM 0 HB3 ALA A 45 -30.462 32.094 1.522 1.00 10.00 H new ATOM 663 N ALA A 46 -27.055 32.210 0.867 1.00 10.00 N ATOM 664 CA ALA A 46 -25.946 32.272 -0.076 1.00 10.00 C ATOM 665 C ALA A 46 -24.796 31.369 0.414 1.00 10.00 C ATOM 666 O ALA A 46 -24.180 30.671 -0.390 1.00 10.00 O ATOM 667 CB ALA A 46 -25.495 33.714 -0.300 1.00 10.00 C ATOM 0 H ALA A 46 -27.218 33.077 1.379 1.00 10.00 H new ATOM 0 HA ALA A 46 -26.277 31.898 -1.045 1.00 10.00 H new ATOM 0 HB1 ALA A 46 -24.666 33.730 -1.008 1.00 10.00 H new ATOM 0 HB2 ALA A 46 -26.325 34.297 -0.699 1.00 10.00 H new ATOM 0 HB3 ALA A 46 -25.171 34.145 0.647 1.00 10.00 H new ATOM 673 N TYR A 47 -24.552 31.304 1.733 1.00 10.00 N ATOM 674 CA TYR A 47 -23.660 30.325 2.351 1.00 10.00 C ATOM 675 C TYR A 47 -24.166 28.927 2.084 1.00 10.00 C ATOM 676 O TYR A 47 -23.423 28.129 1.529 1.00 10.00 O ATOM 677 CB TYR A 47 -23.534 30.537 3.859 1.00 10.00 C ATOM 678 CG TYR A 47 -22.596 29.566 4.568 1.00 10.00 C ATOM 679 CD1 TYR A 47 -21.241 29.477 4.210 1.00 10.00 C ATOM 680 CD2 TYR A 47 -23.112 28.667 5.524 1.00 10.00 C ATOM 681 CE1 TYR A 47 -20.407 28.502 4.792 1.00 10.00 C ATOM 682 CE2 TYR A 47 -22.283 27.699 6.124 1.00 10.00 C ATOM 683 CZ TYR A 47 -20.924 27.611 5.754 1.00 10.00 C ATOM 684 OH TYR A 47 -20.112 26.672 6.312 1.00 10.00 O ATOM 0 H TYR A 47 -24.978 31.942 2.405 1.00 10.00 H new ATOM 0 HA TYR A 47 -22.673 30.459 1.908 1.00 10.00 H new ATOM 0 HB2 TYR A 47 -23.186 31.554 4.040 1.00 10.00 H new ATOM 0 HB3 TYR A 47 -24.524 30.455 4.307 1.00 10.00 H new ATOM 0 HD1 TYR A 47 -20.834 30.163 3.481 1.00 10.00 H new ATOM 0 HD2 TYR A 47 -24.155 28.721 5.799 1.00 10.00 H new ATOM 0 HE1 TYR A 47 -19.369 28.437 4.500 1.00 10.00 H new ATOM 0 HE2 TYR A 47 -22.687 27.026 6.866 1.00 10.00 H new ATOM 0 HH TYR A 47 -20.623 26.139 6.957 1.00 10.00 H new ATOM 694 N GLN A 48 -25.446 28.676 2.374 1.00 10.00 N ATOM 695 CA GLN A 48 -26.118 27.412 2.104 1.00 10.00 C ATOM 696 C GLN A 48 -26.005 27.000 0.622 1.00 10.00 C ATOM 697 O GLN A 48 -25.916 25.815 0.298 1.00 10.00 O ATOM 698 CB GLN A 48 -27.589 27.431 2.546 1.00 10.00 C ATOM 699 CG GLN A 48 -27.900 27.771 4.006 1.00 10.00 C ATOM 700 CD GLN A 48 -27.243 26.824 5.008 1.00 10.00 C ATOM 701 OE1 GLN A 48 -26.194 27.096 5.571 1.00 10.00 O ATOM 702 NE2 GLN A 48 -27.827 25.672 5.265 1.00 10.00 N ATOM 0 H GLN A 48 -26.054 29.367 2.814 1.00 10.00 H new ATOM 0 HA GLN A 48 -25.600 26.662 2.701 1.00 10.00 H new ATOM 0 HB2 GLN A 48 -28.117 28.148 1.917 1.00 10.00 H new ATOM 0 HB3 GLN A 48 -28.013 26.449 2.335 1.00 10.00 H new ATOM 0 HG2 GLN A 48 -27.570 28.789 4.211 1.00 10.00 H new ATOM 0 HG3 GLN A 48 -28.980 27.750 4.153 1.00 10.00 H new ATOM 0 HE21 GLN A 48 -28.704 25.430 4.803 1.00 10.00 H new ATOM 0 HE22 GLN A 48 -27.403 25.021 5.926 1.00 10.00 H new ATOM 711 N SER A 49 -25.945 27.983 -0.280 1.00 10.00 N ATOM 712 CA SER A 49 -25.739 27.774 -1.704 1.00 10.00 C ATOM 713 C SER A 49 -24.306 27.383 -2.022 1.00 10.00 C ATOM 714 O SER A 49 -24.070 26.393 -2.705 1.00 10.00 O ATOM 715 CB SER A 49 -26.071 29.054 -2.504 1.00 10.00 C ATOM 716 OG SER A 49 -26.451 28.728 -3.831 1.00 10.00 O ATOM 0 H SER A 49 -26.041 28.967 -0.028 1.00 10.00 H new ATOM 0 HA SER A 49 -26.406 26.961 -1.991 1.00 10.00 H new ATOM 0 HB2 SER A 49 -26.877 29.598 -2.012 1.00 10.00 H new ATOM 0 HB3 SER A 49 -25.204 29.715 -2.520 1.00 10.00 H new ATOM 0 HG SER A 49 -26.659 29.550 -4.323 1.00 10.00 H new ATOM 722 N LYS A 50 -23.331 28.139 -1.514 1.00 10.00 N ATOM 723 CA LYS A 50 -21.908 27.924 -1.765 1.00 10.00 C ATOM 724 C LYS A 50 -21.409 26.624 -1.149 1.00 10.00 C ATOM 725 O LYS A 50 -20.636 25.913 -1.771 1.00 10.00 O ATOM 726 CB LYS A 50 -21.139 29.166 -1.294 1.00 10.00 C ATOM 727 CG LYS A 50 -21.489 30.382 -2.172 1.00 10.00 C ATOM 728 CD LYS A 50 -20.351 30.759 -3.110 1.00 10.00 C ATOM 729 CE LYS A 50 -20.026 29.664 -4.131 1.00 10.00 C ATOM 730 NZ LYS A 50 -20.380 30.074 -5.518 1.00 10.00 N ATOM 0 H LYS A 50 -23.515 28.935 -0.903 1.00 10.00 H new ATOM 0 HA LYS A 50 -21.732 27.800 -2.834 1.00 10.00 H new ATOM 0 HB2 LYS A 50 -21.383 29.379 -0.253 1.00 10.00 H new ATOM 0 HB3 LYS A 50 -20.067 28.975 -1.337 1.00 10.00 H new ATOM 0 HG2 LYS A 50 -22.382 30.161 -2.757 1.00 10.00 H new ATOM 0 HG3 LYS A 50 -21.729 31.232 -1.534 1.00 10.00 H new ATOM 0 HD2 LYS A 50 -20.613 31.675 -3.640 1.00 10.00 H new ATOM 0 HD3 LYS A 50 -19.459 30.975 -2.521 1.00 10.00 H new ATOM 0 HE2 LYS A 50 -18.963 29.427 -4.083 1.00 10.00 H new ATOM 0 HE3 LYS A 50 -20.568 28.754 -3.872 1.00 10.00 H new ATOM 0 HZ1 LYS A 50 -20.355 29.243 -6.143 1.00 10.00 H new ATOM 0 HZ2 LYS A 50 -21.336 30.484 -5.526 1.00 10.00 H new ATOM 0 HZ3 LYS A 50 -19.697 30.782 -5.856 1.00 10.00 H new ATOM 744 N LEU A 51 -21.936 26.277 0.015 1.00 10.00 N ATOM 745 CA LEU A 51 -21.837 25.012 0.735 1.00 10.00 C ATOM 746 C LEU A 51 -22.227 23.842 -0.179 1.00 10.00 C ATOM 747 O LEU A 51 -21.555 22.810 -0.202 1.00 10.00 O ATOM 748 CB LEU A 51 -22.781 25.245 1.937 1.00 10.00 C ATOM 749 CG LEU A 51 -23.278 24.094 2.820 1.00 10.00 C ATOM 750 CD1 LEU A 51 -23.971 24.727 4.029 1.00 10.00 C ATOM 751 CD2 LEU A 51 -24.340 23.232 2.132 1.00 10.00 C ATOM 0 H LEU A 51 -22.505 26.945 0.536 1.00 10.00 H new ATOM 0 HA LEU A 51 -20.836 24.738 1.069 1.00 10.00 H new ATOM 0 HB2 LEU A 51 -22.279 25.952 2.597 1.00 10.00 H new ATOM 0 HB3 LEU A 51 -23.667 25.746 1.547 1.00 10.00 H new ATOM 0 HG LEU A 51 -22.421 23.467 3.065 1.00 10.00 H new ATOM 0 HD11 LEU A 51 -24.342 23.942 4.688 1.00 10.00 H new ATOM 0 HD12 LEU A 51 -23.260 25.350 4.571 1.00 10.00 H new ATOM 0 HD13 LEU A 51 -24.805 25.341 3.690 1.00 10.00 H new ATOM 0 HD21 LEU A 51 -24.653 22.434 2.805 1.00 10.00 H new ATOM 0 HD22 LEU A 51 -25.201 23.850 1.877 1.00 10.00 H new ATOM 0 HD23 LEU A 51 -23.923 22.797 1.224 1.00 10.00 H new ATOM 763 N SER A 52 -23.267 24.029 -0.991 1.00 10.00 N ATOM 764 CA SER A 52 -23.674 23.086 -2.022 1.00 10.00 C ATOM 765 C SER A 52 -22.814 23.166 -3.280 1.00 10.00 C ATOM 766 O SER A 52 -22.429 22.129 -3.812 1.00 10.00 O ATOM 767 CB SER A 52 -25.131 23.286 -2.423 1.00 10.00 C ATOM 768 OG SER A 52 -26.010 23.229 -1.307 1.00 10.00 O ATOM 0 H SER A 52 -23.859 24.858 -0.946 1.00 10.00 H new ATOM 0 HA SER A 52 -23.541 22.102 -1.573 1.00 10.00 H new ATOM 0 HB2 SER A 52 -25.240 24.250 -2.920 1.00 10.00 H new ATOM 0 HB3 SER A 52 -25.415 22.521 -3.146 1.00 10.00 H new ATOM 0 HG SER A 52 -25.960 24.071 -0.808 1.00 10.00 H new ATOM 774 N GLU A 53 -22.444 24.363 -3.745 1.00 10.00 N ATOM 775 CA GLU A 53 -21.552 24.543 -4.886 1.00 10.00 C ATOM 776 C GLU A 53 -20.188 23.879 -4.664 1.00 10.00 C ATOM 777 O GLU A 53 -19.557 23.398 -5.597 1.00 10.00 O ATOM 778 CB GLU A 53 -21.237 25.993 -5.198 1.00 10.00 C ATOM 779 CG GLU A 53 -22.224 26.981 -5.780 1.00 10.00 C ATOM 780 CD GLU A 53 -22.944 26.470 -7.042 1.00 10.00 C ATOM 781 OE1 GLU A 53 -22.274 26.269 -8.083 1.00 10.00 O ATOM 782 OE2 GLU A 53 -24.186 26.300 -7.009 1.00 10.00 O ATOM 0 H GLU A 53 -22.761 25.241 -3.333 1.00 10.00 H new ATOM 0 HA GLU A 53 -22.106 24.088 -5.707 1.00 10.00 H new ATOM 0 HB2 GLU A 53 -20.886 26.433 -4.264 1.00 10.00 H new ATOM 0 HB3 GLU A 53 -20.388 25.977 -5.882 1.00 10.00 H new ATOM 0 HG2 GLU A 53 -22.968 27.226 -5.022 1.00 10.00 H new ATOM 0 HG3 GLU A 53 -21.699 27.905 -6.022 1.00 10.00 H new ATOM 789 N TYR A 54 -19.704 23.880 -3.427 1.00 10.00 N ATOM 790 CA TYR A 54 -18.463 23.240 -3.033 1.00 10.00 C ATOM 791 C TYR A 54 -18.590 21.717 -3.143 1.00 10.00 C ATOM 792 O TYR A 54 -17.686 21.053 -3.655 1.00 10.00 O ATOM 793 CB TYR A 54 -18.029 23.776 -1.658 1.00 10.00 C ATOM 794 CG TYR A 54 -17.488 22.743 -0.727 1.00 10.00 C ATOM 795 CD1 TYR A 54 -16.235 22.187 -1.008 1.00 10.00 C ATOM 796 CD2 TYR A 54 -18.242 22.315 0.374 1.00 10.00 C ATOM 797 CE1 TYR A 54 -15.740 21.166 -0.195 1.00 10.00 C ATOM 798 CE2 TYR A 54 -17.749 21.292 1.195 1.00 10.00 C ATOM 799 CZ TYR A 54 -16.492 20.706 0.912 1.00 10.00 C ATOM 800 OH TYR A 54 -16.008 19.696 1.686 1.00 10.00 O ATOM 0 H TYR A 54 -20.181 24.340 -2.652 1.00 10.00 H new ATOM 0 HA TYR A 54 -17.651 23.493 -3.714 1.00 10.00 H new ATOM 0 HB2 TYR A 54 -17.270 24.545 -1.806 1.00 10.00 H new ATOM 0 HB3 TYR A 54 -18.884 24.259 -1.185 1.00 10.00 H new ATOM 0 HD1 TYR A 54 -15.656 22.545 -1.847 1.00 10.00 H new ATOM 0 HD2 TYR A 54 -19.197 22.771 0.588 1.00 10.00 H new ATOM 0 HE1 TYR A 54 -14.778 20.725 -0.412 1.00 10.00 H new ATOM 0 HE2 TYR A 54 -18.327 20.952 2.042 1.00 10.00 H new ATOM 0 HH TYR A 54 -16.645 19.500 2.405 1.00 10.00 H new ATOM 810 N ASN A 55 -19.752 21.163 -2.787 1.00 10.00 N ATOM 811 CA ASN A 55 -20.066 19.772 -3.054 1.00 10.00 C ATOM 812 C ASN A 55 -20.304 19.492 -4.562 1.00 10.00 C ATOM 813 O ASN A 55 -20.097 18.369 -5.000 1.00 10.00 O ATOM 814 CB ASN A 55 -21.257 19.322 -2.206 1.00 10.00 C ATOM 815 CG ASN A 55 -20.947 18.060 -1.421 1.00 10.00 C ATOM 816 OD1 ASN A 55 -21.239 16.947 -1.835 1.00 10.00 O ATOM 817 ND2 ASN A 55 -20.326 18.190 -0.270 1.00 10.00 N ATOM 0 H ASN A 55 -20.495 21.671 -2.307 1.00 10.00 H new ATOM 0 HA ASN A 55 -19.194 19.182 -2.770 1.00 10.00 H new ATOM 0 HB2 ASN A 55 -21.534 20.120 -1.517 1.00 10.00 H new ATOM 0 HB3 ASN A 55 -22.117 19.146 -2.852 1.00 10.00 H new ATOM 0 HD21 ASN A 55 -20.088 17.363 0.277 1.00 10.00 H new ATOM 0 HD22 ASN A 55 -20.082 19.118 0.076 1.00 10.00 H new ATOM 824 N LEU A 56 -20.712 20.478 -5.374 1.00 10.00 N ATOM 825 CA LEU A 56 -20.768 20.418 -6.844 1.00 10.00 C ATOM 826 C LEU A 56 -19.368 20.450 -7.459 1.00 10.00 C ATOM 827 O LEU A 56 -19.117 19.713 -8.409 1.00 10.00 O ATOM 828 CB LEU A 56 -21.605 21.584 -7.394 1.00 10.00 C ATOM 829 CG LEU A 56 -23.117 21.364 -7.579 1.00 10.00 C ATOM 830 CD1 LEU A 56 -23.797 20.445 -6.562 1.00 10.00 C ATOM 831 CD2 LEU A 56 -23.796 22.732 -7.509 1.00 10.00 C ATOM 0 H LEU A 56 -21.026 21.378 -5.010 1.00 10.00 H new ATOM 0 HA LEU A 56 -21.239 19.474 -7.119 1.00 10.00 H new ATOM 0 HB2 LEU A 56 -21.471 22.435 -6.727 1.00 10.00 H new ATOM 0 HB3 LEU A 56 -21.188 21.868 -8.360 1.00 10.00 H new ATOM 0 HG LEU A 56 -23.225 20.859 -8.539 1.00 10.00 H new ATOM 0 HD11 LEU A 56 -24.859 20.367 -6.795 1.00 10.00 H new ATOM 0 HD12 LEU A 56 -23.343 19.455 -6.605 1.00 10.00 H new ATOM 0 HD13 LEU A 56 -23.674 20.857 -5.560 1.00 10.00 H new ATOM 0 HD21 LEU A 56 -24.872 22.611 -7.637 1.00 10.00 H new ATOM 0 HD22 LEU A 56 -23.595 23.189 -6.540 1.00 10.00 H new ATOM 0 HD23 LEU A 56 -23.406 23.373 -8.300 1.00 10.00 H new ATOM 843 N TYR A 57 -18.444 21.242 -6.901 1.00 10.00 N ATOM 844 CA TYR A 57 -17.030 21.172 -7.243 1.00 10.00 C ATOM 845 C TYR A 57 -16.566 19.714 -7.031 1.00 10.00 C ATOM 846 O TYR A 57 -15.915 19.113 -7.884 1.00 10.00 O ATOM 847 CB TYR A 57 -16.189 22.215 -6.479 1.00 10.00 C ATOM 848 CG TYR A 57 -14.735 21.792 -6.461 1.00 10.00 C ATOM 849 CD1 TYR A 57 -14.338 20.835 -5.514 1.00 10.00 C ATOM 850 CD2 TYR A 57 -13.874 22.130 -7.523 1.00 10.00 C ATOM 851 CE1 TYR A 57 -13.128 20.141 -5.666 1.00 10.00 C ATOM 852 CE2 TYR A 57 -12.633 21.473 -7.654 1.00 10.00 C ATOM 853 CZ TYR A 57 -12.270 20.457 -6.740 1.00 10.00 C ATOM 854 OH TYR A 57 -11.109 19.769 -6.909 1.00 10.00 O ATOM 0 H TYR A 57 -18.663 21.949 -6.199 1.00 10.00 H new ATOM 0 HA TYR A 57 -16.879 21.437 -8.289 1.00 10.00 H new ATOM 0 HB2 TYR A 57 -16.287 23.192 -6.953 1.00 10.00 H new ATOM 0 HB3 TYR A 57 -16.560 22.317 -5.459 1.00 10.00 H new ATOM 0 HD1 TYR A 57 -14.969 20.631 -4.661 1.00 10.00 H new ATOM 0 HD2 TYR A 57 -14.163 22.889 -8.234 1.00 10.00 H new ATOM 0 HE1 TYR A 57 -12.855 19.368 -4.963 1.00 10.00 H new ATOM 0 HE2 TYR A 57 -11.959 21.746 -8.453 1.00 10.00 H new ATOM 0 HH TYR A 57 -10.637 20.112 -7.696 1.00 10.00 H new ATOM 864 N ARG A 58 -16.994 19.116 -5.911 1.00 10.00 N ATOM 865 CA ARG A 58 -16.775 17.723 -5.514 1.00 10.00 C ATOM 866 C ARG A 58 -17.482 16.712 -6.423 1.00 10.00 C ATOM 867 O ARG A 58 -16.936 15.648 -6.684 1.00 10.00 O ATOM 868 CB ARG A 58 -17.263 17.576 -4.051 1.00 10.00 C ATOM 869 CG ARG A 58 -16.278 16.959 -3.062 1.00 10.00 C ATOM 870 CD ARG A 58 -15.121 17.924 -2.764 1.00 10.00 C ATOM 871 NE ARG A 58 -13.967 17.223 -2.168 1.00 10.00 N ATOM 872 CZ ARG A 58 -13.647 17.124 -0.888 1.00 10.00 C ATOM 873 NH1 ARG A 58 -14.356 17.666 0.058 1.00 10.00 N ATOM 874 NH2 ARG A 58 -12.586 16.461 -0.529 1.00 10.00 N ATOM 0 H ARG A 58 -17.537 19.627 -5.215 1.00 10.00 H new ATOM 0 HA ARG A 58 -15.712 17.498 -5.606 1.00 10.00 H new ATOM 0 HB2 ARG A 58 -17.541 18.564 -3.684 1.00 10.00 H new ATOM 0 HB3 ARG A 58 -18.169 16.970 -4.053 1.00 10.00 H new ATOM 0 HG2 ARG A 58 -16.795 16.709 -2.136 1.00 10.00 H new ATOM 0 HG3 ARG A 58 -15.884 16.028 -3.469 1.00 10.00 H new ATOM 0 HD2 ARG A 58 -14.811 18.417 -3.686 1.00 10.00 H new ATOM 0 HD3 ARG A 58 -15.464 18.704 -2.085 1.00 10.00 H new ATOM 0 HE ARG A 58 -13.339 16.758 -2.823 1.00 10.00 H new ATOM 0 HH11 ARG A 58 -15.198 18.194 -0.174 1.00 10.00 H new ATOM 0 HH12 ARG A 58 -14.071 17.563 1.032 1.00 10.00 H new ATOM 0 HH21 ARG A 58 -11.999 16.016 -1.235 1.00 10.00 H new ATOM 0 HH22 ARG A 58 -12.341 16.386 0.458 1.00 10.00 H new ATOM 888 N ASN A 59 -18.670 17.045 -6.927 1.00 10.00 N ATOM 889 CA ASN A 59 -19.460 16.235 -7.854 1.00 10.00 C ATOM 890 C ASN A 59 -18.776 16.144 -9.225 1.00 10.00 C ATOM 891 O ASN A 59 -18.628 15.073 -9.809 1.00 10.00 O ATOM 892 CB ASN A 59 -20.881 16.818 -7.991 1.00 10.00 C ATOM 893 CG ASN A 59 -21.812 15.855 -8.714 1.00 10.00 C ATOM 894 OD1 ASN A 59 -21.996 14.713 -8.317 1.00 10.00 O ATOM 895 ND2 ASN A 59 -22.423 16.271 -9.801 1.00 10.00 N ATOM 0 H ASN A 59 -19.128 17.925 -6.690 1.00 10.00 H new ATOM 0 HA ASN A 59 -19.534 15.225 -7.451 1.00 10.00 H new ATOM 0 HB2 ASN A 59 -21.282 17.039 -7.002 1.00 10.00 H new ATOM 0 HB3 ASN A 59 -20.837 17.761 -8.535 1.00 10.00 H new ATOM 0 HD21 ASN A 59 -23.046 15.643 -10.308 1.00 10.00 H new ATOM 0 HD22 ASN A 59 -22.274 17.222 -10.137 1.00 10.00 H new ATOM 902 N ALA A 60 -18.288 17.284 -9.707 1.00 10.00 N ATOM 903 CA ALA A 60 -17.436 17.411 -10.873 1.00 10.00 C ATOM 904 C ALA A 60 -16.114 16.668 -10.680 1.00 10.00 C ATOM 905 O ALA A 60 -15.742 15.850 -11.520 1.00 10.00 O ATOM 906 CB ALA A 60 -17.255 18.912 -11.116 1.00 10.00 C ATOM 0 H ALA A 60 -18.489 18.184 -9.270 1.00 10.00 H new ATOM 0 HA ALA A 60 -17.886 16.948 -11.751 1.00 10.00 H new ATOM 0 HB1 ALA A 60 -16.618 19.065 -11.987 1.00 10.00 H new ATOM 0 HB2 ALA A 60 -18.227 19.372 -11.292 1.00 10.00 H new ATOM 0 HB3 ALA A 60 -16.790 19.369 -10.242 1.00 10.00 H new ATOM 912 N GLN A 61 -15.497 16.814 -9.506 1.00 10.00 N ATOM 913 CA GLN A 61 -14.349 16.043 -9.032 1.00 10.00 C ATOM 914 C GLN A 61 -14.715 14.670 -8.429 1.00 10.00 C ATOM 915 O GLN A 61 -14.105 14.150 -7.495 1.00 10.00 O ATOM 916 CB GLN A 61 -13.495 16.909 -8.134 1.00 10.00 C ATOM 917 CG GLN A 61 -12.033 16.418 -8.100 1.00 10.00 C ATOM 918 CD GLN A 61 -11.119 16.955 -9.202 1.00 10.00 C ATOM 919 OE1 GLN A 61 -11.510 17.653 -10.127 1.00 10.00 O ATOM 920 NE2 GLN A 61 -9.844 16.629 -9.141 1.00 10.00 N ATOM 0 H GLN A 61 -15.802 17.510 -8.826 1.00 10.00 H new ATOM 0 HA GLN A 61 -13.749 15.766 -9.899 1.00 10.00 H new ATOM 0 HB2 GLN A 61 -13.526 17.940 -8.485 1.00 10.00 H new ATOM 0 HB3 GLN A 61 -13.905 16.904 -7.124 1.00 10.00 H new ATOM 0 HG2 GLN A 61 -11.603 16.687 -7.135 1.00 10.00 H new ATOM 0 HG3 GLN A 61 -12.035 15.329 -8.156 1.00 10.00 H new ATOM 0 HE21 GLN A 61 -9.502 16.048 -8.376 1.00 10.00 H new ATOM 0 HE22 GLN A 61 -9.199 16.958 -9.859 1.00 10.00 H new ATOM 929 N SER A 62 -15.761 14.112 -9.016 1.00 10.00 N ATOM 930 CA SER A 62 -16.279 12.755 -8.904 1.00 10.00 C ATOM 931 C SER A 62 -16.690 12.235 -10.294 1.00 10.00 C ATOM 932 O SER A 62 -16.595 11.044 -10.566 1.00 10.00 O ATOM 933 CB SER A 62 -17.388 12.668 -7.856 1.00 10.00 C ATOM 934 OG SER A 62 -17.820 11.329 -7.690 1.00 10.00 O ATOM 0 H SER A 62 -16.334 14.661 -9.656 1.00 10.00 H new ATOM 0 HA SER A 62 -15.493 12.093 -8.541 1.00 10.00 H new ATOM 0 HB2 SER A 62 -17.027 13.059 -6.905 1.00 10.00 H new ATOM 0 HB3 SER A 62 -18.230 13.291 -8.158 1.00 10.00 H new ATOM 0 HG SER A 62 -18.529 11.295 -7.014 1.00 10.00 H new ATOM 940 N ASN A 63 -17.011 13.126 -11.237 1.00 10.00 N ATOM 941 CA ASN A 63 -17.258 12.837 -12.642 1.00 10.00 C ATOM 942 C ASN A 63 -15.990 12.558 -13.450 1.00 10.00 C ATOM 943 O ASN A 63 -15.855 11.522 -14.087 1.00 10.00 O ATOM 944 CB ASN A 63 -17.999 14.058 -13.219 1.00 10.00 C ATOM 945 CG ASN A 63 -18.756 13.757 -14.506 1.00 10.00 C ATOM 946 OD1 ASN A 63 -19.261 12.665 -14.729 1.00 10.00 O ATOM 947 ND2 ASN A 63 -18.851 14.712 -15.404 1.00 10.00 N ATOM 0 H ASN A 63 -17.109 14.119 -11.024 1.00 10.00 H new ATOM 0 HA ASN A 63 -17.845 11.921 -12.713 1.00 10.00 H new ATOM 0 HB2 ASN A 63 -18.700 14.433 -12.474 1.00 10.00 H new ATOM 0 HB3 ASN A 63 -17.279 14.854 -13.408 1.00 10.00 H new ATOM 0 HD21 ASN A 63 -19.344 14.541 -16.281 1.00 10.00 H new ATOM 0 HD22 ASN A 63 -18.432 15.625 -15.224 1.00 10.00 H new ATOM 954 N THR A 64 -15.028 13.470 -13.364 1.00 10.00 N ATOM 955 CA THR A 64 -13.676 13.383 -13.942 1.00 10.00 C ATOM 956 C THR A 64 -12.922 12.103 -13.586 1.00 10.00 C ATOM 957 O THR A 64 -12.320 11.411 -14.400 1.00 10.00 O ATOM 958 CB THR A 64 -12.902 14.616 -13.485 1.00 10.00 C ATOM 959 OG1 THR A 64 -11.619 14.678 -14.054 1.00 10.00 O ATOM 960 CG2 THR A 64 -12.809 14.718 -11.967 1.00 10.00 C ATOM 0 H THR A 64 -15.172 14.345 -12.860 1.00 10.00 H new ATOM 0 HA THR A 64 -13.773 13.349 -15.027 1.00 10.00 H new ATOM 0 HB THR A 64 -13.475 15.471 -13.843 1.00 10.00 H new ATOM 0 HG1 THR A 64 -11.060 13.965 -13.679 1.00 10.00 H new ATOM 0 HG21 THR A 64 -12.248 15.613 -11.696 1.00 10.00 H new ATOM 0 HG22 THR A 64 -13.812 14.776 -11.544 1.00 10.00 H new ATOM 0 HG23 THR A 64 -12.300 13.838 -11.574 1.00 10.00 H new ATOM 968 N VAL A 65 -13.088 11.725 -12.336 1.00 10.00 N ATOM 969 CA VAL A 65 -12.647 10.508 -11.664 1.00 10.00 C ATOM 970 C VAL A 65 -13.191 9.238 -12.345 1.00 10.00 C ATOM 971 O VAL A 65 -12.523 8.204 -12.396 1.00 10.00 O ATOM 972 CB VAL A 65 -13.147 10.614 -10.215 1.00 10.00 C ATOM 973 CG1 VAL A 65 -12.309 9.763 -9.266 1.00 10.00 C ATOM 974 CG2 VAL A 65 -13.120 12.047 -9.662 1.00 10.00 C ATOM 0 H VAL A 65 -13.593 12.329 -11.687 1.00 10.00 H new ATOM 0 HA VAL A 65 -11.561 10.421 -11.708 1.00 10.00 H new ATOM 0 HB VAL A 65 -14.177 10.261 -10.260 1.00 10.00 H new ATOM 0 HG11 VAL A 65 -12.693 9.864 -8.251 1.00 10.00 H new ATOM 0 HG12 VAL A 65 -12.362 8.718 -9.572 1.00 10.00 H new ATOM 0 HG13 VAL A 65 -11.272 10.098 -9.296 1.00 10.00 H new ATOM 0 HG21 VAL A 65 -13.486 12.048 -8.635 1.00 10.00 H new ATOM 0 HG22 VAL A 65 -12.098 12.426 -9.683 1.00 10.00 H new ATOM 0 HG23 VAL A 65 -13.757 12.685 -10.275 1.00 10.00 H new ATOM 984 N LYS A 66 -14.383 9.360 -12.943 1.00 10.00 N ATOM 985 CA LYS A 66 -15.125 8.402 -13.765 1.00 10.00 C ATOM 986 C LYS A 66 -15.012 8.659 -15.283 1.00 10.00 C ATOM 987 O LYS A 66 -15.696 8.024 -16.085 1.00 10.00 O ATOM 988 CB LYS A 66 -16.586 8.399 -13.277 1.00 10.00 C ATOM 989 CG LYS A 66 -16.849 7.331 -12.196 1.00 10.00 C ATOM 990 CD LYS A 66 -17.017 7.915 -10.789 1.00 10.00 C ATOM 991 CE LYS A 66 -18.382 8.605 -10.655 1.00 10.00 C ATOM 992 NZ LYS A 66 -18.625 9.071 -9.268 1.00 10.00 N ATOM 0 H LYS A 66 -14.907 10.230 -12.851 1.00 10.00 H new ATOM 0 HA LYS A 66 -14.681 7.415 -13.638 1.00 10.00 H new ATOM 0 HB2 LYS A 66 -16.834 9.383 -12.878 1.00 10.00 H new ATOM 0 HB3 LYS A 66 -17.248 8.223 -14.125 1.00 10.00 H new ATOM 0 HG2 LYS A 66 -17.747 6.773 -12.459 1.00 10.00 H new ATOM 0 HG3 LYS A 66 -16.023 6.620 -12.190 1.00 10.00 H new ATOM 0 HD2 LYS A 66 -16.929 7.122 -10.046 1.00 10.00 H new ATOM 0 HD3 LYS A 66 -16.220 8.630 -10.588 1.00 10.00 H new ATOM 0 HE2 LYS A 66 -18.430 9.453 -11.338 1.00 10.00 H new ATOM 0 HE3 LYS A 66 -19.171 7.913 -10.950 1.00 10.00 H new ATOM 0 HZ1 LYS A 66 -19.647 9.183 -9.114 1.00 10.00 H new ATOM 0 HZ2 LYS A 66 -18.248 8.372 -8.596 1.00 10.00 H new ATOM 0 HZ3 LYS A 66 -18.150 9.984 -9.120 1.00 10.00 H new ATOM 1006 N VAL A 67 -14.090 9.532 -15.684 1.00 10.00 N ATOM 1007 CA VAL A 67 -13.707 9.894 -17.049 1.00 10.00 C ATOM 1008 C VAL A 67 -12.278 9.477 -17.346 1.00 10.00 C ATOM 1009 O VAL A 67 -11.995 9.018 -18.447 1.00 10.00 O ATOM 1010 CB VAL A 67 -13.934 11.391 -17.232 1.00 10.00 C ATOM 1011 CG1 VAL A 67 -13.166 12.009 -18.378 1.00 10.00 C ATOM 1012 CG2 VAL A 67 -15.425 11.625 -17.367 1.00 10.00 C ATOM 0 H VAL A 67 -13.541 10.052 -14.999 1.00 10.00 H new ATOM 0 HA VAL A 67 -14.326 9.358 -17.769 1.00 10.00 H new ATOM 0 HB VAL A 67 -13.538 11.897 -16.352 1.00 10.00 H new ATOM 0 HG11 VAL A 67 -13.389 13.075 -18.432 1.00 10.00 H new ATOM 0 HG12 VAL A 67 -12.097 11.869 -18.217 1.00 10.00 H new ATOM 0 HG13 VAL A 67 -13.458 11.529 -19.312 1.00 10.00 H new ATOM 0 HG21 VAL A 67 -15.616 12.690 -17.499 1.00 10.00 H new ATOM 0 HG22 VAL A 67 -15.802 11.079 -18.231 1.00 10.00 H new ATOM 0 HG23 VAL A 67 -15.931 11.275 -16.467 1.00 10.00 H new ATOM 1022 N PHE A 68 -11.385 9.546 -16.361 1.00 10.00 N ATOM 1023 CA PHE A 68 -10.064 8.933 -16.441 1.00 10.00 C ATOM 1024 C PHE A 68 -10.244 7.410 -16.629 1.00 10.00 C ATOM 1025 O PHE A 68 -9.469 6.756 -17.324 1.00 10.00 O ATOM 1026 CB PHE A 68 -9.282 9.307 -15.181 1.00 10.00 C ATOM 1027 CG PHE A 68 -8.799 10.748 -15.158 1.00 10.00 C ATOM 1028 CD1 PHE A 68 -7.903 11.212 -16.143 1.00 10.00 C ATOM 1029 CD2 PHE A 68 -9.257 11.638 -14.168 1.00 10.00 C ATOM 1030 CE1 PHE A 68 -7.495 12.558 -16.153 1.00 10.00 C ATOM 1031 CE2 PHE A 68 -8.863 12.987 -14.186 1.00 10.00 C ATOM 1032 CZ PHE A 68 -7.982 13.449 -15.180 1.00 10.00 C ATOM 0 H PHE A 68 -11.560 10.032 -15.481 1.00 10.00 H new ATOM 0 HA PHE A 68 -9.489 9.294 -17.293 1.00 10.00 H new ATOM 0 HB2 PHE A 68 -9.912 9.132 -14.309 1.00 10.00 H new ATOM 0 HB3 PHE A 68 -8.421 8.645 -15.090 1.00 10.00 H new ATOM 0 HD1 PHE A 68 -7.528 10.531 -16.893 1.00 10.00 H new ATOM 0 HD2 PHE A 68 -9.915 11.282 -13.390 1.00 10.00 H new ATOM 0 HE1 PHE A 68 -6.807 12.908 -16.909 1.00 10.00 H new ATOM 0 HE2 PHE A 68 -9.237 13.669 -13.436 1.00 10.00 H new ATOM 0 HZ PHE A 68 -7.680 14.486 -15.196 1.00 10.00 H new ATOM 1042 N LYS A 69 -11.355 6.877 -16.093 1.00 10.00 N ATOM 1043 CA LYS A 69 -11.910 5.538 -16.321 1.00 10.00 C ATOM 1044 C LYS A 69 -12.097 5.255 -17.818 1.00 10.00 C ATOM 1045 O LYS A 69 -11.953 4.123 -18.260 1.00 10.00 O ATOM 1046 CB LYS A 69 -13.265 5.479 -15.571 1.00 10.00 C ATOM 1047 CG LYS A 69 -14.244 4.366 -16.005 1.00 10.00 C ATOM 1048 CD LYS A 69 -15.245 4.849 -17.080 1.00 10.00 C ATOM 1049 CE LYS A 69 -15.748 3.693 -17.953 1.00 10.00 C ATOM 1050 NZ LYS A 69 -16.618 4.179 -19.059 1.00 10.00 N ATOM 0 H LYS A 69 -11.929 7.413 -15.442 1.00 10.00 H new ATOM 0 HA LYS A 69 -11.227 4.775 -15.949 1.00 10.00 H new ATOM 0 HB2 LYS A 69 -13.061 5.359 -14.507 1.00 10.00 H new ATOM 0 HB3 LYS A 69 -13.765 6.440 -15.693 1.00 10.00 H new ATOM 0 HG2 LYS A 69 -13.678 3.519 -16.393 1.00 10.00 H new ATOM 0 HG3 LYS A 69 -14.794 4.009 -15.134 1.00 10.00 H new ATOM 0 HD2 LYS A 69 -16.093 5.333 -16.595 1.00 10.00 H new ATOM 0 HD3 LYS A 69 -14.767 5.599 -17.710 1.00 10.00 H new ATOM 0 HE2 LYS A 69 -14.897 3.154 -18.369 1.00 10.00 H new ATOM 0 HE3 LYS A 69 -16.303 2.986 -17.337 1.00 10.00 H new ATOM 0 HZ1 LYS A 69 -16.981 3.367 -19.598 1.00 10.00 H new ATOM 0 HZ2 LYS A 69 -17.416 4.716 -18.663 1.00 10.00 H new ATOM 0 HZ3 LYS A 69 -16.066 4.794 -19.690 1.00 10.00 H new ATOM 1064 N ASP A 70 -12.434 6.279 -18.599 1.00 10.00 N ATOM 1065 CA ASP A 70 -12.691 6.202 -20.032 1.00 10.00 C ATOM 1066 C ASP A 70 -11.410 6.170 -20.869 1.00 10.00 C ATOM 1067 O ASP A 70 -11.363 5.528 -21.920 1.00 10.00 O ATOM 1068 CB ASP A 70 -13.694 7.281 -20.457 1.00 10.00 C ATOM 1069 CG ASP A 70 -14.707 6.720 -21.464 1.00 10.00 C ATOM 1070 OD1 ASP A 70 -15.515 5.849 -21.053 1.00 10.00 O ATOM 1071 OD2 ASP A 70 -14.712 7.150 -22.642 1.00 10.00 O ATOM 0 H ASP A 70 -12.539 7.225 -18.233 1.00 10.00 H new ATOM 0 HA ASP A 70 -13.160 5.240 -20.240 1.00 10.00 H new ATOM 0 HB2 ASP A 70 -14.219 7.661 -19.580 1.00 10.00 H new ATOM 0 HB3 ASP A 70 -13.162 8.123 -20.900 1.00 10.00 H new ATOM 1076 N ILE A 71 -10.341 6.786 -20.361 1.00 10.00 N ATOM 1077 CA ILE A 71 -8.994 6.650 -20.910 1.00 10.00 C ATOM 1078 C ILE A 71 -8.501 5.239 -20.608 1.00 10.00 C ATOM 1079 O ILE A 71 -7.955 4.546 -21.455 1.00 10.00 O ATOM 1080 CB ILE A 71 -8.026 7.711 -20.315 1.00 10.00 C ATOM 1081 CG1 ILE A 71 -8.194 9.097 -20.964 1.00 10.00 C ATOM 1082 CG2 ILE A 71 -6.548 7.296 -20.429 1.00 10.00 C ATOM 1083 CD1 ILE A 71 -9.562 9.700 -20.651 1.00 10.00 C ATOM 0 H ILE A 71 -10.389 7.400 -19.548 1.00 10.00 H new ATOM 0 HA ILE A 71 -9.021 6.819 -21.987 1.00 10.00 H new ATOM 0 HB ILE A 71 -8.300 7.773 -19.262 1.00 10.00 H new ATOM 0 HG12 ILE A 71 -7.410 9.765 -20.606 1.00 10.00 H new ATOM 0 HG13 ILE A 71 -8.071 9.012 -22.044 1.00 10.00 H new ATOM 0 HG21 ILE A 71 -5.917 8.074 -19.998 1.00 10.00 H new ATOM 0 HG22 ILE A 71 -6.390 6.361 -19.891 1.00 10.00 H new ATOM 0 HG23 ILE A 71 -6.289 7.159 -21.479 1.00 10.00 H new ATOM 0 HD11 ILE A 71 -9.646 10.678 -21.125 1.00 10.00 H new ATOM 0 HD12 ILE A 71 -10.345 9.044 -21.032 1.00 10.00 H new ATOM 0 HD13 ILE A 71 -9.673 9.809 -19.572 1.00 10.00 H new ATOM 1095 N ASP A 72 -8.730 4.784 -19.388 1.00 10.00 N ATOM 1096 CA ASP A 72 -8.382 3.455 -18.933 1.00 10.00 C ATOM 1097 C ASP A 72 -9.168 2.342 -19.645 1.00 10.00 C ATOM 1098 O ASP A 72 -8.618 1.284 -19.926 1.00 10.00 O ATOM 1099 CB ASP A 72 -8.544 3.496 -17.426 1.00 10.00 C ATOM 1100 CG ASP A 72 -8.252 2.149 -16.748 1.00 10.00 C ATOM 1101 OD1 ASP A 72 -7.060 1.783 -16.620 1.00 10.00 O ATOM 1102 OD2 ASP A 72 -9.213 1.472 -16.310 1.00 10.00 O ATOM 0 H ASP A 72 -9.177 5.350 -18.667 1.00 10.00 H new ATOM 0 HA ASP A 72 -7.357 3.191 -19.191 1.00 10.00 H new ATOM 0 HB2 ASP A 72 -7.876 4.254 -17.016 1.00 10.00 H new ATOM 0 HB3 ASP A 72 -9.562 3.804 -17.185 1.00 10.00 H new ATOM 1107 N ALA A 73 -10.411 2.600 -20.047 1.00 10.00 N ATOM 1108 CA ALA A 73 -11.185 1.733 -20.930 1.00 10.00 C ATOM 1109 C ALA A 73 -10.523 1.620 -22.327 1.00 10.00 C ATOM 1110 O ALA A 73 -10.564 0.561 -22.955 1.00 10.00 O ATOM 1111 CB ALA A 73 -12.615 2.287 -21.020 1.00 10.00 C ATOM 0 H ALA A 73 -10.919 3.437 -19.761 1.00 10.00 H new ATOM 0 HA ALA A 73 -11.215 0.722 -20.523 1.00 10.00 H new ATOM 0 HB1 ALA A 73 -13.210 1.652 -21.676 1.00 10.00 H new ATOM 0 HB2 ALA A 73 -13.062 2.302 -20.026 1.00 10.00 H new ATOM 0 HB3 ALA A 73 -12.588 3.300 -21.422 1.00 10.00 H new ATOM 1117 N ALA A 74 -9.856 2.682 -22.799 1.00 10.00 N ATOM 1118 CA ALA A 74 -9.008 2.664 -23.985 1.00 10.00 C ATOM 1119 C ALA A 74 -7.678 1.912 -23.752 1.00 10.00 C ATOM 1120 O ALA A 74 -7.200 1.235 -24.659 1.00 10.00 O ATOM 1121 CB ALA A 74 -8.784 4.106 -24.464 1.00 10.00 C ATOM 0 H ALA A 74 -9.896 3.597 -22.351 1.00 10.00 H new ATOM 0 HA ALA A 74 -9.519 2.105 -24.769 1.00 10.00 H new ATOM 0 HB1 ALA A 74 -8.150 4.100 -25.351 1.00 10.00 H new ATOM 0 HB2 ALA A 74 -9.744 4.562 -24.706 1.00 10.00 H new ATOM 0 HB3 ALA A 74 -8.299 4.680 -23.675 1.00 10.00 H new ATOM 1127 N ILE A 75 -7.105 1.959 -22.542 1.00 10.00 N ATOM 1128 CA ILE A 75 -5.957 1.128 -22.120 1.00 10.00 C ATOM 1129 C ILE A 75 -6.341 -0.368 -22.106 1.00 10.00 C ATOM 1130 O ILE A 75 -5.588 -1.217 -22.579 1.00 10.00 O ATOM 1131 CB ILE A 75 -5.369 1.569 -20.752 1.00 10.00 C ATOM 1132 CG1 ILE A 75 -4.874 3.029 -20.824 1.00 10.00 C ATOM 1133 CG2 ILE A 75 -4.208 0.654 -20.318 1.00 10.00 C ATOM 1134 CD1 ILE A 75 -4.483 3.670 -19.485 1.00 10.00 C ATOM 0 H ILE A 75 -7.430 2.589 -21.808 1.00 10.00 H new ATOM 0 HA ILE A 75 -5.168 1.278 -22.858 1.00 10.00 H new ATOM 0 HB ILE A 75 -6.166 1.491 -20.012 1.00 10.00 H new ATOM 0 HG12 ILE A 75 -4.011 3.068 -21.489 1.00 10.00 H new ATOM 0 HG13 ILE A 75 -5.656 3.636 -21.281 1.00 10.00 H new ATOM 0 HG21 ILE A 75 -3.819 0.990 -19.357 1.00 10.00 H new ATOM 0 HG22 ILE A 75 -4.567 -0.371 -20.225 1.00 10.00 H new ATOM 0 HG23 ILE A 75 -3.415 0.694 -21.064 1.00 10.00 H new ATOM 0 HD11 ILE A 75 -4.151 4.694 -19.655 1.00 10.00 H new ATOM 0 HD12 ILE A 75 -5.345 3.674 -18.818 1.00 10.00 H new ATOM 0 HD13 ILE A 75 -3.675 3.097 -19.030 1.00 10.00 H new ATOM 1146 N LEU A 76 -7.541 -0.694 -21.618 1.00 10.00 N ATOM 1147 CA LEU A 76 -8.172 -2.017 -21.708 1.00 10.00 C ATOM 1148 C LEU A 76 -8.276 -2.474 -23.175 1.00 10.00 C ATOM 1149 O LEU A 76 -7.812 -3.557 -23.534 1.00 10.00 O ATOM 1150 CB LEU A 76 -9.566 -1.928 -21.041 1.00 10.00 C ATOM 1151 CG LEU A 76 -9.674 -2.479 -19.610 1.00 10.00 C ATOM 1152 CD1 LEU A 76 -8.642 -1.923 -18.628 1.00 10.00 C ATOM 1153 CD2 LEU A 76 -11.069 -2.199 -19.049 1.00 10.00 C ATOM 0 H LEU A 76 -8.125 -0.016 -21.129 1.00 10.00 H new ATOM 0 HA LEU A 76 -7.567 -2.761 -21.190 1.00 10.00 H new ATOM 0 HB2 LEU A 76 -9.873 -0.882 -21.029 1.00 10.00 H new ATOM 0 HB3 LEU A 76 -10.280 -2.462 -21.668 1.00 10.00 H new ATOM 0 HG LEU A 76 -9.477 -3.547 -19.702 1.00 10.00 H new ATOM 0 HD11 LEU A 76 -8.797 -2.369 -17.646 1.00 10.00 H new ATOM 0 HD12 LEU A 76 -7.639 -2.162 -18.981 1.00 10.00 H new ATOM 0 HD13 LEU A 76 -8.754 -0.841 -18.556 1.00 10.00 H new ATOM 0 HD21 LEU A 76 -11.139 -2.592 -18.035 1.00 10.00 H new ATOM 0 HD22 LEU A 76 -11.246 -1.124 -19.034 1.00 10.00 H new ATOM 0 HD23 LEU A 76 -11.818 -2.682 -19.677 1.00 10.00 H new ATOM 1165 N GLU A 77 -8.831 -1.619 -24.037 1.00 10.00 N ATOM 1166 CA GLU A 77 -8.959 -1.847 -25.477 1.00 10.00 C ATOM 1167 C GLU A 77 -7.598 -1.982 -26.197 1.00 10.00 C ATOM 1168 O GLU A 77 -7.469 -2.785 -27.120 1.00 10.00 O ATOM 1169 CB GLU A 77 -9.823 -0.717 -26.064 1.00 10.00 C ATOM 1170 CG GLU A 77 -10.247 -0.912 -27.522 1.00 10.00 C ATOM 1171 CD GLU A 77 -11.147 -2.152 -27.709 1.00 10.00 C ATOM 1172 OE1 GLU A 77 -12.391 -2.024 -27.596 1.00 10.00 O ATOM 1173 OE2 GLU A 77 -10.621 -3.260 -27.973 1.00 10.00 O ATOM 0 H GLU A 77 -9.215 -0.721 -23.742 1.00 10.00 H new ATOM 0 HA GLU A 77 -9.446 -2.808 -25.641 1.00 10.00 H new ATOM 0 HB2 GLU A 77 -10.719 -0.611 -25.453 1.00 10.00 H new ATOM 0 HB3 GLU A 77 -9.271 0.220 -25.985 1.00 10.00 H new ATOM 0 HG2 GLU A 77 -10.779 -0.025 -27.865 1.00 10.00 H new ATOM 0 HG3 GLU A 77 -9.359 -1.013 -28.146 1.00 10.00 H new ATOM 1180 N HIS A 78 -6.552 -1.280 -25.744 1.00 10.00 N ATOM 1181 CA HIS A 78 -5.182 -1.345 -26.284 1.00 10.00 C ATOM 1182 C HIS A 78 -4.563 -2.763 -26.253 1.00 10.00 C ATOM 1183 O HIS A 78 -3.659 -3.062 -27.037 1.00 10.00 O ATOM 1184 CB HIS A 78 -4.296 -0.335 -25.528 1.00 10.00 C ATOM 1185 CG HIS A 78 -2.917 -0.160 -26.112 1.00 10.00 C ATOM 1186 ND1 HIS A 78 -1.747 -0.676 -25.601 1.00 10.00 N ATOM 1187 CD2 HIS A 78 -2.588 0.544 -27.239 1.00 10.00 C ATOM 1188 CE1 HIS A 78 -0.736 -0.299 -26.400 1.00 10.00 C ATOM 1189 NE2 HIS A 78 -1.200 0.452 -27.418 1.00 10.00 N ATOM 0 H HIS A 78 -6.636 -0.628 -24.964 1.00 10.00 H new ATOM 0 HA HIS A 78 -5.237 -1.083 -27.341 1.00 10.00 H new ATOM 0 HB2 HIS A 78 -4.798 0.633 -25.515 1.00 10.00 H new ATOM 0 HB3 HIS A 78 -4.200 -0.658 -24.491 1.00 10.00 H new ATOM 0 HD1 HIS A 78 -1.663 -1.247 -24.760 1.00 10.00 H new ATOM 0 HD2 HIS A 78 -3.276 1.077 -27.878 1.00 10.00 H new ATOM 0 HE1 HIS A 78 0.301 -0.560 -26.248 1.00 10.00 H new ATOM 1197 N HIS A 79 -5.084 -3.652 -25.398 1.00 10.00 N ATOM 1198 CA HIS A 79 -4.653 -5.051 -25.254 1.00 10.00 C ATOM 1199 C HIS A 79 -5.805 -6.066 -25.445 1.00 10.00 C ATOM 1200 O HIS A 79 -5.597 -7.265 -25.263 1.00 10.00 O ATOM 1201 CB HIS A 79 -3.949 -5.209 -23.894 1.00 10.00 C ATOM 1202 CG HIS A 79 -2.726 -4.331 -23.755 1.00 10.00 C ATOM 1203 ND1 HIS A 79 -1.475 -4.588 -24.275 1.00 10.00 N ATOM 1204 CD2 HIS A 79 -2.658 -3.115 -23.131 1.00 10.00 C ATOM 1205 CE1 HIS A 79 -0.672 -3.555 -23.972 1.00 10.00 C ATOM 1206 NE2 HIS A 79 -1.352 -2.621 -23.281 1.00 10.00 N ATOM 0 H HIS A 79 -5.845 -3.409 -24.764 1.00 10.00 H new ATOM 0 HA HIS A 79 -3.951 -5.284 -26.055 1.00 10.00 H new ATOM 0 HB2 HIS A 79 -4.653 -4.970 -23.097 1.00 10.00 H new ATOM 0 HB3 HIS A 79 -3.658 -6.251 -23.761 1.00 10.00 H new ATOM 0 HD2 HIS A 79 -3.467 -2.621 -22.614 1.00 10.00 H new ATOM 0 HE1 HIS A 79 0.371 -3.484 -24.244 1.00 10.00 H new ATOM 0 HE2 HIS A 79 -0.991 -1.732 -22.935 1.00 10.00 H new ATOM 1214 N HIS A 80 -6.983 -5.590 -25.872 1.00 10.00 N ATOM 1215 CA HIS A 80 -8.320 -6.212 -25.997 1.00 10.00 C ATOM 1216 C HIS A 80 -8.856 -7.170 -24.899 1.00 10.00 C ATOM 1217 O HIS A 80 -10.072 -7.197 -24.688 1.00 10.00 O ATOM 1218 CB HIS A 80 -8.408 -6.926 -27.358 1.00 10.00 C ATOM 1219 CG HIS A 80 -8.001 -6.095 -28.552 1.00 10.00 C ATOM 1220 ND1 HIS A 80 -8.593 -4.930 -28.990 1.00 10.00 N ATOM 1221 CD2 HIS A 80 -6.970 -6.367 -29.413 1.00 10.00 C ATOM 1222 CE1 HIS A 80 -7.927 -4.501 -30.074 1.00 10.00 C ATOM 1223 NE2 HIS A 80 -6.928 -5.352 -30.380 1.00 10.00 N ATOM 0 H HIS A 80 -7.031 -4.620 -26.184 1.00 10.00 H new ATOM 0 HA HIS A 80 -8.975 -5.349 -25.876 1.00 10.00 H new ATOM 0 HB2 HIS A 80 -7.779 -7.815 -27.324 1.00 10.00 H new ATOM 0 HB3 HIS A 80 -9.433 -7.266 -27.505 1.00 10.00 H new ATOM 0 HD1 HIS A 80 -9.399 -4.472 -28.564 1.00 10.00 H new ATOM 0 HD2 HIS A 80 -6.305 -7.216 -29.357 1.00 10.00 H new ATOM 0 HE1 HIS A 80 -8.159 -3.601 -30.623 1.00 10.00 H new ATOM 1231 N HIS A 81 -8.028 -7.963 -24.212 1.00 10.00 N ATOM 1232 CA HIS A 81 -8.449 -9.045 -23.309 1.00 10.00 C ATOM 1233 C HIS A 81 -7.375 -9.382 -22.250 1.00 10.00 C ATOM 1234 O HIS A 81 -6.207 -9.002 -22.376 1.00 10.00 O ATOM 1235 CB HIS A 81 -8.762 -10.283 -24.177 1.00 10.00 C ATOM 1236 CG HIS A 81 -9.483 -11.397 -23.457 1.00 10.00 C ATOM 1237 ND1 HIS A 81 -8.903 -12.489 -22.848 1.00 10.00 N ATOM 1238 CD2 HIS A 81 -10.837 -11.517 -23.290 1.00 10.00 C ATOM 1239 CE1 HIS A 81 -9.878 -13.244 -22.318 1.00 10.00 C ATOM 1240 NE2 HIS A 81 -11.082 -12.691 -22.562 1.00 10.00 N ATOM 0 H HIS A 81 -7.014 -7.869 -24.269 1.00 10.00 H new ATOM 0 HA HIS A 81 -9.330 -8.723 -22.753 1.00 10.00 H new ATOM 0 HB2 HIS A 81 -9.366 -9.969 -25.028 1.00 10.00 H new ATOM 0 HB3 HIS A 81 -7.827 -10.674 -24.577 1.00 10.00 H new ATOM 0 HD1 HIS A 81 -7.904 -12.689 -22.807 1.00 10.00 H new ATOM 0 HD2 HIS A 81 -11.585 -10.829 -23.655 1.00 10.00 H new ATOM 0 HE1 HIS A 81 -9.720 -14.163 -21.774 1.00 10.00 H new ATOM 1248 N HIS A 82 -7.767 -10.123 -21.209 1.00 10.00 N ATOM 1249 CA HIS A 82 -6.869 -10.727 -20.216 1.00 10.00 C ATOM 1250 C HIS A 82 -5.879 -11.733 -20.853 1.00 10.00 C ATOM 1251 O HIS A 82 -6.195 -12.374 -21.863 1.00 10.00 O ATOM 1252 CB HIS A 82 -7.742 -11.406 -19.148 1.00 10.00 C ATOM 1253 CG HIS A 82 -6.967 -12.026 -18.012 1.00 10.00 C ATOM 1254 ND1 HIS A 82 -6.331 -11.353 -16.992 1.00 10.00 N ATOM 1255 CD2 HIS A 82 -6.772 -13.365 -17.794 1.00 10.00 C ATOM 1256 CE1 HIS A 82 -5.766 -12.262 -16.178 1.00 10.00 C ATOM 1257 NE2 HIS A 82 -6.010 -13.507 -16.626 1.00 10.00 N ATOM 0 H HIS A 82 -8.750 -10.326 -21.027 1.00 10.00 H new ATOM 0 HA HIS A 82 -6.252 -9.949 -19.767 1.00 10.00 H new ATOM 0 HB2 HIS A 82 -8.434 -10.670 -18.740 1.00 10.00 H new ATOM 0 HB3 HIS A 82 -8.344 -12.179 -19.626 1.00 10.00 H new ATOM 0 HD2 HIS A 82 -7.141 -14.169 -18.413 1.00 10.00 H new ATOM 0 HE1 HIS A 82 -5.197 -12.026 -15.291 1.00 10.00 H new ATOM 0 HE2 HIS A 82 -5.702 -14.381 -16.200 1.00 10.00 H new ATOM 1265 N HIS A 83 -4.701 -11.900 -20.237 1.00 10.00 N ATOM 1266 CA HIS A 83 -3.628 -12.812 -20.668 1.00 10.00 C ATOM 1267 C HIS A 83 -2.826 -13.349 -19.463 1.00 10.00 C ATOM 1268 O HIS A 83 -2.279 -12.533 -18.684 1.00 10.00 O ATOM 1269 CB HIS A 83 -2.723 -12.079 -21.675 1.00 10.00 C ATOM 1270 CG HIS A 83 -1.623 -12.944 -22.238 1.00 10.00 C ATOM 1271 ND1 HIS A 83 -0.352 -13.081 -21.726 1.00 10.00 N ATOM 1272 CD2 HIS A 83 -1.696 -13.739 -23.350 1.00 10.00 C ATOM 1273 CE1 HIS A 83 0.327 -13.939 -22.508 1.00 10.00 C ATOM 1274 NE2 HIS A 83 -0.453 -14.369 -23.519 1.00 10.00 N ATOM 1275 OXT HIS A 83 -2.761 -14.589 -19.297 1.00 10.00 O ATOM 0 H HIS A 83 -4.458 -11.384 -19.391 1.00 10.00 H new ATOM 0 HA HIS A 83 -4.069 -13.682 -21.156 1.00 10.00 H new ATOM 0 HB2 HIS A 83 -3.335 -11.704 -22.495 1.00 10.00 H new ATOM 0 HB3 HIS A 83 -2.278 -11.212 -21.187 1.00 10.00 H new ATOM 0 HD2 HIS A 83 -2.560 -13.860 -23.987 1.00 10.00 H new ATOM 0 HE1 HIS A 83 1.352 -14.240 -22.348 1.00 10.00 H new ATOM 0 HE2 HIS A 83 -0.193 -15.021 -24.259 1.00 10.00 H new TER 1283 HIS A 83