USER MOD reduce.3.24.130724 H: found=0, std=0, add=862, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 858 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 62 TYR OH : rot -49:sc= 0.104 USER MOD Set 1.2: A 87 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 57 ASN : amide:sc= -1.89! C(o=-2.8!,f=-6.6!) USER MOD Set 2.2: A 60 MET CE :methyl 132:sc= -0.899 (180deg=-5.29!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot -43:sc= 0.851 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc=-0.00102 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 7:sc= 0.556 USER MOD Single : A 10 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 25 ASN : amide:sc= -2.71 K(o=-2.7,f=-7.8!) USER MOD Single : A 26 CYS SG : rot 180:sc= 0 USER MOD Single : A 36 GLN : amide:sc= -0.173 X(o=-0.17,f=-0.0028) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 MET CE :methyl -145:sc= -0.18 (180deg=-0.759) USER MOD Single : A 53 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 LYS NZ :NH3+ 161:sc= 0 (180deg=-0.295) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 THR OG1 : rot 180:sc= -0.023 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 SER OG : rot -70:sc= 0.39 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 TYR OH : rot 130:sc= 0 USER MOD Single : A 73 TYR OH : rot 103:sc= 0.448 USER MOD Single : A 74 LYS NZ :NH3+ -158:sc= 0.515 (180deg=0.328) USER MOD Single : A 75 THR OG1 : rot -38:sc= -0.451 USER MOD Single : A 88 LYS NZ :NH3+ 159:sc= 0.126 (180deg=0.0387) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 ASN : amide:sc= -1.82 X(o=-1.8,f=-2.3) USER MOD Single : A 94 HIS : no HE2:sc= -1.15 K(o=-1.2,f=-2.6!) USER MOD Single : A 97 GLN : amide:sc= -0.441 X(o=-0.44,f=-0.099) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 180:sc=-0.00258 USER MOD Single : A 106 SER OG : rot 44:sc= 0.725 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 6.704 -11.534 0.625 1.00 0.00 N ATOM 2 CA GLY A 1 5.818 -11.370 -0.512 1.00 0.00 C ATOM 3 C GLY A 1 6.564 -11.007 -1.781 1.00 0.00 C ATOM 4 O GLY A 1 7.316 -11.819 -2.321 1.00 0.00 O ATOM 0 H1 GLY A 1 6.146 -11.781 1.467 1.00 0.00 H new ATOM 0 H2 GLY A 1 7.387 -12.293 0.427 1.00 0.00 H new ATOM 0 H3 GLY A 1 7.215 -10.645 0.798 1.00 0.00 H new ATOM 0 HA2 GLY A 1 5.263 -12.294 -0.672 1.00 0.00 H new ATOM 0 HA3 GLY A 1 5.086 -10.593 -0.290 1.00 0.00 H new ATOM 8 N SER A 2 6.356 -9.784 -2.259 1.00 0.00 N ATOM 9 CA SER A 2 7.011 -9.317 -3.475 1.00 0.00 C ATOM 10 C SER A 2 7.374 -7.839 -3.363 1.00 0.00 C ATOM 11 O SER A 2 7.193 -7.071 -4.308 1.00 0.00 O ATOM 12 CB SER A 2 6.103 -9.541 -4.686 1.00 0.00 C ATOM 13 OG SER A 2 6.739 -9.128 -5.883 1.00 0.00 O ATOM 0 H SER A 2 5.739 -9.099 -1.823 1.00 0.00 H new ATOM 0 HA SER A 2 7.929 -9.889 -3.607 1.00 0.00 H new ATOM 0 HB2 SER A 2 5.839 -10.596 -4.756 1.00 0.00 H new ATOM 0 HB3 SER A 2 5.173 -8.988 -4.555 1.00 0.00 H new ATOM 0 HG SER A 2 7.187 -8.269 -5.736 1.00 0.00 H new ATOM 19 N SER A 3 7.887 -7.449 -2.201 1.00 0.00 N ATOM 20 CA SER A 3 8.272 -6.063 -1.963 1.00 0.00 C ATOM 21 C SER A 3 9.790 -5.925 -1.895 1.00 0.00 C ATOM 22 O SER A 3 10.425 -6.392 -0.951 1.00 0.00 O ATOM 23 CB SER A 3 7.644 -5.552 -0.665 1.00 0.00 C ATOM 24 OG SER A 3 6.747 -4.484 -0.919 1.00 0.00 O ATOM 0 H SER A 3 8.046 -8.073 -1.410 1.00 0.00 H new ATOM 0 HA SER A 3 7.906 -5.463 -2.796 1.00 0.00 H new ATOM 0 HB2 SER A 3 7.115 -6.365 -0.168 1.00 0.00 H new ATOM 0 HB3 SER A 3 8.428 -5.219 0.016 1.00 0.00 H new ATOM 0 HG SER A 3 6.357 -4.176 -0.074 1.00 0.00 H new ATOM 30 N GLY A 4 10.365 -5.278 -2.905 1.00 0.00 N ATOM 31 CA GLY A 4 11.804 -5.090 -2.941 1.00 0.00 C ATOM 32 C GLY A 4 12.248 -3.867 -2.163 1.00 0.00 C ATOM 33 O GLY A 4 11.439 -3.214 -1.504 1.00 0.00 O ATOM 0 H GLY A 4 9.861 -4.881 -3.698 1.00 0.00 H new ATOM 0 HA2 GLY A 4 12.293 -5.974 -2.532 1.00 0.00 H new ATOM 0 HA3 GLY A 4 12.129 -4.996 -3.977 1.00 0.00 H new ATOM 37 N SER A 5 13.539 -3.556 -2.238 1.00 0.00 N ATOM 38 CA SER A 5 14.091 -2.407 -1.531 1.00 0.00 C ATOM 39 C SER A 5 15.435 -1.998 -2.125 1.00 0.00 C ATOM 40 O SER A 5 16.321 -2.830 -2.315 1.00 0.00 O ATOM 41 CB SER A 5 14.254 -2.727 -0.044 1.00 0.00 C ATOM 42 OG SER A 5 15.395 -3.535 0.182 1.00 0.00 O ATOM 0 H SER A 5 14.222 -4.084 -2.782 1.00 0.00 H new ATOM 0 HA SER A 5 13.396 -1.575 -1.642 1.00 0.00 H new ATOM 0 HB2 SER A 5 14.343 -1.800 0.523 1.00 0.00 H new ATOM 0 HB3 SER A 5 13.364 -3.240 0.321 1.00 0.00 H new ATOM 0 HG SER A 5 15.478 -3.724 1.140 1.00 0.00 H new ATOM 48 N SER A 6 15.578 -0.709 -2.417 1.00 0.00 N ATOM 49 CA SER A 6 16.812 -0.188 -2.993 1.00 0.00 C ATOM 50 C SER A 6 17.664 0.493 -1.927 1.00 0.00 C ATOM 51 O SER A 6 17.286 1.529 -1.382 1.00 0.00 O ATOM 52 CB SER A 6 16.497 0.800 -4.118 1.00 0.00 C ATOM 53 OG SER A 6 17.322 0.568 -5.247 1.00 0.00 O ATOM 0 H SER A 6 14.854 -0.006 -2.264 1.00 0.00 H new ATOM 0 HA SER A 6 17.375 -1.027 -3.402 1.00 0.00 H new ATOM 0 HB2 SER A 6 15.449 0.708 -4.404 1.00 0.00 H new ATOM 0 HB3 SER A 6 16.642 1.820 -3.762 1.00 0.00 H new ATOM 0 HG SER A 6 17.100 1.211 -5.952 1.00 0.00 H new ATOM 59 N GLY A 7 18.819 -0.098 -1.634 1.00 0.00 N ATOM 60 CA GLY A 7 19.708 0.464 -0.634 1.00 0.00 C ATOM 61 C GLY A 7 20.830 -0.483 -0.258 1.00 0.00 C ATOM 62 O GLY A 7 22.006 -0.136 -0.362 1.00 0.00 O ATOM 0 H GLY A 7 19.155 -0.956 -2.072 1.00 0.00 H new ATOM 0 HA2 GLY A 7 20.133 1.394 -1.012 1.00 0.00 H new ATOM 0 HA3 GLY A 7 19.134 0.715 0.258 1.00 0.00 H new ATOM 66 N SER A 8 20.466 -1.683 0.183 1.00 0.00 N ATOM 67 CA SER A 8 21.451 -2.682 0.582 1.00 0.00 C ATOM 68 C SER A 8 21.510 -3.821 -0.431 1.00 0.00 C ATOM 69 O SER A 8 20.630 -3.958 -1.280 1.00 0.00 O ATOM 70 CB SER A 8 21.114 -3.234 1.969 1.00 0.00 C ATOM 71 OG SER A 8 19.982 -4.085 1.918 1.00 0.00 O ATOM 0 H SER A 8 19.497 -1.987 0.273 1.00 0.00 H new ATOM 0 HA SER A 8 22.428 -2.200 0.618 1.00 0.00 H new ATOM 0 HB2 SER A 8 21.969 -3.784 2.363 1.00 0.00 H new ATOM 0 HB3 SER A 8 20.922 -2.409 2.655 1.00 0.00 H new ATOM 0 HG SER A 8 19.788 -4.426 2.816 1.00 0.00 H new ATOM 77 N SER A 9 22.556 -4.637 -0.333 1.00 0.00 N ATOM 78 CA SER A 9 22.734 -5.762 -1.243 1.00 0.00 C ATOM 79 C SER A 9 23.655 -6.814 -0.632 1.00 0.00 C ATOM 80 O SER A 9 24.817 -6.538 -0.331 1.00 0.00 O ATOM 81 CB SER A 9 23.305 -5.281 -2.578 1.00 0.00 C ATOM 82 OG SER A 9 22.363 -4.490 -3.281 1.00 0.00 O ATOM 0 H SER A 9 23.292 -4.540 0.367 1.00 0.00 H new ATOM 0 HA SER A 9 21.758 -6.215 -1.416 1.00 0.00 H new ATOM 0 HB2 SER A 9 24.211 -4.702 -2.402 1.00 0.00 H new ATOM 0 HB3 SER A 9 23.589 -6.140 -3.186 1.00 0.00 H new ATOM 0 HG SER A 9 21.580 -4.333 -2.714 1.00 0.00 H new ATOM 88 N HIS A 10 23.128 -8.021 -0.452 1.00 0.00 N ATOM 89 CA HIS A 10 23.902 -9.115 0.123 1.00 0.00 C ATOM 90 C HIS A 10 24.190 -10.186 -0.925 1.00 0.00 C ATOM 91 O HIS A 10 23.287 -10.641 -1.628 1.00 0.00 O ATOM 92 CB HIS A 10 23.154 -9.731 1.306 1.00 0.00 C ATOM 93 CG HIS A 10 22.560 -8.716 2.233 1.00 0.00 C ATOM 94 ND1 HIS A 10 23.293 -8.056 3.196 1.00 0.00 N ATOM 95 CD2 HIS A 10 21.294 -8.248 2.339 1.00 0.00 C ATOM 96 CE1 HIS A 10 22.505 -7.227 3.856 1.00 0.00 C ATOM 97 NE2 HIS A 10 21.286 -7.324 3.355 1.00 0.00 N ATOM 0 H HIS A 10 22.168 -8.266 -0.696 1.00 0.00 H new ATOM 0 HA HIS A 10 24.851 -8.710 0.474 1.00 0.00 H new ATOM 0 HB2 HIS A 10 22.360 -10.374 0.928 1.00 0.00 H new ATOM 0 HB3 HIS A 10 23.839 -10.367 1.867 1.00 0.00 H new ATOM 0 HD2 HIS A 10 20.448 -8.546 1.737 1.00 0.00 H new ATOM 0 HE1 HIS A 10 22.806 -6.580 4.667 1.00 0.00 H new ATOM 0 HE2 HIS A 10 20.471 -6.798 3.672 1.00 0.00 H new ATOM 105 N LEU A 11 25.454 -10.583 -1.026 1.00 0.00 N ATOM 106 CA LEU A 11 25.862 -11.600 -1.989 1.00 0.00 C ATOM 107 C LEU A 11 25.012 -12.858 -1.845 1.00 0.00 C ATOM 108 O LEU A 11 24.384 -13.308 -2.804 1.00 0.00 O ATOM 109 CB LEU A 11 27.340 -11.944 -1.802 1.00 0.00 C ATOM 110 CG LEU A 11 27.784 -13.309 -2.330 1.00 0.00 C ATOM 111 CD1 LEU A 11 27.340 -13.492 -3.773 1.00 0.00 C ATOM 112 CD2 LEU A 11 29.293 -13.462 -2.211 1.00 0.00 C ATOM 0 H LEU A 11 26.214 -10.216 -0.453 1.00 0.00 H new ATOM 0 HA LEU A 11 25.714 -11.197 -2.991 1.00 0.00 H new ATOM 0 HB2 LEU A 11 27.936 -11.175 -2.294 1.00 0.00 H new ATOM 0 HB3 LEU A 11 27.572 -11.895 -0.738 1.00 0.00 H new ATOM 0 HG LEU A 11 27.312 -14.083 -1.725 1.00 0.00 H new ATOM 0 HD11 LEU A 11 27.664 -14.469 -4.132 1.00 0.00 H new ATOM 0 HD12 LEU A 11 26.253 -13.427 -3.830 1.00 0.00 H new ATOM 0 HD13 LEU A 11 27.783 -12.712 -4.392 1.00 0.00 H new ATOM 0 HD21 LEU A 11 29.591 -14.439 -2.591 1.00 0.00 H new ATOM 0 HD22 LEU A 11 29.785 -12.681 -2.791 1.00 0.00 H new ATOM 0 HD23 LEU A 11 29.586 -13.375 -1.165 1.00 0.00 H new ATOM 124 N TRP A 12 24.996 -13.421 -0.642 1.00 0.00 N ATOM 125 CA TRP A 12 24.222 -14.626 -0.372 1.00 0.00 C ATOM 126 C TRP A 12 22.853 -14.555 -1.040 1.00 0.00 C ATOM 127 O TRP A 12 22.337 -15.560 -1.526 1.00 0.00 O ATOM 128 CB TRP A 12 24.058 -14.826 1.135 1.00 0.00 C ATOM 129 CG TRP A 12 22.949 -14.009 1.725 1.00 0.00 C ATOM 130 CD1 TRP A 12 23.060 -12.788 2.328 1.00 0.00 C ATOM 131 CD2 TRP A 12 21.560 -14.356 1.771 1.00 0.00 C ATOM 132 NE1 TRP A 12 21.825 -12.356 2.745 1.00 0.00 N ATOM 133 CE2 TRP A 12 20.888 -13.298 2.415 1.00 0.00 C ATOM 134 CE3 TRP A 12 20.819 -15.455 1.329 1.00 0.00 C ATOM 135 CZ2 TRP A 12 19.512 -13.311 2.627 1.00 0.00 C ATOM 136 CZ3 TRP A 12 19.454 -15.467 1.540 1.00 0.00 C ATOM 137 CH2 TRP A 12 18.811 -14.400 2.184 1.00 0.00 C ATOM 0 H TRP A 12 25.511 -13.062 0.162 1.00 0.00 H new ATOM 0 HA TRP A 12 24.764 -15.476 -0.787 1.00 0.00 H new ATOM 0 HB2 TRP A 12 23.869 -15.881 1.336 1.00 0.00 H new ATOM 0 HB3 TRP A 12 24.993 -14.569 1.632 1.00 0.00 H new ATOM 0 HD1 TRP A 12 23.983 -12.243 2.458 1.00 0.00 H new ATOM 0 HE1 TRP A 12 21.636 -11.475 3.224 1.00 0.00 H new ATOM 0 HE3 TRP A 12 21.305 -16.281 0.831 1.00 0.00 H new ATOM 0 HZ2 TRP A 12 19.015 -12.491 3.124 1.00 0.00 H new ATOM 0 HZ3 TRP A 12 18.872 -16.312 1.203 1.00 0.00 H new ATOM 0 HH2 TRP A 12 17.742 -14.438 2.333 1.00 0.00 H new ATOM 148 N GLU A 13 22.270 -13.360 -1.059 1.00 0.00 N ATOM 149 CA GLU A 13 20.960 -13.159 -1.666 1.00 0.00 C ATOM 150 C GLU A 13 21.065 -13.128 -3.188 1.00 0.00 C ATOM 151 O GLU A 13 20.227 -13.692 -3.892 1.00 0.00 O ATOM 152 CB GLU A 13 20.332 -11.858 -1.161 1.00 0.00 C ATOM 153 CG GLU A 13 19.262 -12.070 -0.103 1.00 0.00 C ATOM 154 CD GLU A 13 17.962 -11.367 -0.440 1.00 0.00 C ATOM 155 OE1 GLU A 13 17.681 -11.183 -1.642 1.00 0.00 O ATOM 156 OE2 GLU A 13 17.225 -11.002 0.500 1.00 0.00 O ATOM 0 H GLU A 13 22.684 -12.517 -0.661 1.00 0.00 H new ATOM 0 HA GLU A 13 20.323 -13.996 -1.379 1.00 0.00 H new ATOM 0 HB2 GLU A 13 21.116 -11.221 -0.751 1.00 0.00 H new ATOM 0 HB3 GLU A 13 19.896 -11.323 -2.005 1.00 0.00 H new ATOM 0 HG2 GLU A 13 19.075 -13.138 0.010 1.00 0.00 H new ATOM 0 HG3 GLU A 13 19.629 -11.707 0.857 1.00 0.00 H new ATOM 163 N PHE A 14 22.101 -12.463 -3.690 1.00 0.00 N ATOM 164 CA PHE A 14 22.316 -12.356 -5.129 1.00 0.00 C ATOM 165 C PHE A 14 22.511 -13.734 -5.754 1.00 0.00 C ATOM 166 O PHE A 14 21.771 -14.130 -6.654 1.00 0.00 O ATOM 167 CB PHE A 14 23.533 -11.475 -5.419 1.00 0.00 C ATOM 168 CG PHE A 14 24.225 -11.815 -6.709 1.00 0.00 C ATOM 169 CD1 PHE A 14 23.801 -11.259 -7.905 1.00 0.00 C ATOM 170 CD2 PHE A 14 25.299 -12.690 -6.724 1.00 0.00 C ATOM 171 CE1 PHE A 14 24.435 -11.569 -9.093 1.00 0.00 C ATOM 172 CE2 PHE A 14 25.937 -13.004 -7.909 1.00 0.00 C ATOM 173 CZ PHE A 14 25.504 -12.444 -9.095 1.00 0.00 C ATOM 0 H PHE A 14 22.804 -11.990 -3.122 1.00 0.00 H new ATOM 0 HA PHE A 14 21.431 -11.899 -5.571 1.00 0.00 H new ATOM 0 HB2 PHE A 14 23.218 -10.432 -5.449 1.00 0.00 H new ATOM 0 HB3 PHE A 14 24.244 -11.570 -4.598 1.00 0.00 H new ATOM 0 HD1 PHE A 14 22.965 -10.575 -7.909 1.00 0.00 H new ATOM 0 HD2 PHE A 14 25.641 -13.131 -5.800 1.00 0.00 H new ATOM 0 HE1 PHE A 14 24.095 -11.128 -10.018 1.00 0.00 H new ATOM 0 HE2 PHE A 14 26.774 -13.687 -7.908 1.00 0.00 H new ATOM 0 HZ PHE A 14 26.000 -12.690 -10.022 1.00 0.00 H new ATOM 183 N VAL A 15 23.513 -14.461 -5.269 1.00 0.00 N ATOM 184 CA VAL A 15 23.806 -15.795 -5.779 1.00 0.00 C ATOM 185 C VAL A 15 22.604 -16.719 -5.623 1.00 0.00 C ATOM 186 O VAL A 15 22.301 -17.515 -6.512 1.00 0.00 O ATOM 187 CB VAL A 15 25.016 -16.418 -5.058 1.00 0.00 C ATOM 188 CG1 VAL A 15 24.767 -16.485 -3.559 1.00 0.00 C ATOM 189 CG2 VAL A 15 25.316 -17.800 -5.619 1.00 0.00 C ATOM 0 H VAL A 15 24.135 -14.148 -4.524 1.00 0.00 H new ATOM 0 HA VAL A 15 24.041 -15.685 -6.838 1.00 0.00 H new ATOM 0 HB VAL A 15 25.886 -15.784 -5.230 1.00 0.00 H new ATOM 0 HG11 VAL A 15 25.632 -16.928 -3.066 1.00 0.00 H new ATOM 0 HG12 VAL A 15 24.604 -15.479 -3.172 1.00 0.00 H new ATOM 0 HG13 VAL A 15 23.886 -17.096 -3.363 1.00 0.00 H new ATOM 0 HG21 VAL A 15 26.174 -18.226 -5.098 1.00 0.00 H new ATOM 0 HG22 VAL A 15 24.449 -18.446 -5.479 1.00 0.00 H new ATOM 0 HG23 VAL A 15 25.540 -17.720 -6.683 1.00 0.00 H new ATOM 199 N ARG A 16 21.922 -16.608 -4.488 1.00 0.00 N ATOM 200 CA ARG A 16 20.752 -17.434 -4.215 1.00 0.00 C ATOM 201 C ARG A 16 19.647 -17.165 -5.232 1.00 0.00 C ATOM 202 O ARG A 16 19.011 -18.092 -5.733 1.00 0.00 O ATOM 203 CB ARG A 16 20.234 -17.170 -2.801 1.00 0.00 C ATOM 204 CG ARG A 16 19.022 -18.009 -2.429 1.00 0.00 C ATOM 205 CD ARG A 16 17.887 -17.145 -1.901 1.00 0.00 C ATOM 206 NE ARG A 16 17.409 -16.196 -2.903 1.00 0.00 N ATOM 207 CZ ARG A 16 16.753 -15.080 -2.604 1.00 0.00 C ATOM 208 NH1 ARG A 16 16.499 -14.775 -1.339 1.00 0.00 N ATOM 209 NH2 ARG A 16 16.350 -14.267 -3.571 1.00 0.00 N ATOM 0 H ARG A 16 22.160 -15.954 -3.742 1.00 0.00 H new ATOM 0 HA ARG A 16 21.050 -18.479 -4.296 1.00 0.00 H new ATOM 0 HB2 ARG A 16 21.034 -17.367 -2.088 1.00 0.00 H new ATOM 0 HB3 ARG A 16 19.977 -16.115 -2.709 1.00 0.00 H new ATOM 0 HG2 ARG A 16 18.681 -18.565 -3.302 1.00 0.00 H new ATOM 0 HG3 ARG A 16 19.304 -18.743 -1.674 1.00 0.00 H new ATOM 0 HD2 ARG A 16 17.062 -17.784 -1.584 1.00 0.00 H new ATOM 0 HD3 ARG A 16 18.226 -16.601 -1.019 1.00 0.00 H new ATOM 0 HE ARG A 16 17.589 -16.401 -3.886 1.00 0.00 H new ATOM 0 HH11 ARG A 16 16.807 -15.398 -0.592 1.00 0.00 H new ATOM 0 HH12 ARG A 16 15.995 -13.918 -1.112 1.00 0.00 H new ATOM 0 HH21 ARG A 16 16.544 -14.498 -4.545 1.00 0.00 H new ATOM 0 HH22 ARG A 16 15.846 -13.410 -3.340 1.00 0.00 H new ATOM 223 N ASP A 17 19.424 -15.890 -5.532 1.00 0.00 N ATOM 224 CA ASP A 17 18.396 -15.498 -6.490 1.00 0.00 C ATOM 225 C ASP A 17 18.565 -16.250 -7.806 1.00 0.00 C ATOM 226 O ASP A 17 17.617 -16.844 -8.321 1.00 0.00 O ATOM 227 CB ASP A 17 18.449 -13.990 -6.739 1.00 0.00 C ATOM 228 CG ASP A 17 17.078 -13.347 -6.692 1.00 0.00 C ATOM 229 OD1 ASP A 17 16.144 -13.895 -7.315 1.00 0.00 O ATOM 230 OD2 ASP A 17 16.937 -12.295 -6.033 1.00 0.00 O ATOM 0 H ASP A 17 19.941 -15.110 -5.126 1.00 0.00 H new ATOM 0 HA ASP A 17 17.424 -15.754 -6.068 1.00 0.00 H new ATOM 0 HB2 ASP A 17 19.091 -13.524 -5.992 1.00 0.00 H new ATOM 0 HB3 ASP A 17 18.902 -13.801 -7.712 1.00 0.00 H new ATOM 235 N LEU A 18 19.778 -16.220 -8.347 1.00 0.00 N ATOM 236 CA LEU A 18 20.072 -16.899 -9.605 1.00 0.00 C ATOM 237 C LEU A 18 19.470 -18.300 -9.622 1.00 0.00 C ATOM 238 O LEU A 18 18.870 -18.717 -10.613 1.00 0.00 O ATOM 239 CB LEU A 18 21.584 -16.979 -9.823 1.00 0.00 C ATOM 240 CG LEU A 18 22.198 -15.873 -10.682 1.00 0.00 C ATOM 241 CD1 LEU A 18 22.151 -14.540 -9.951 1.00 0.00 C ATOM 242 CD2 LEU A 18 23.629 -16.225 -11.062 1.00 0.00 C ATOM 0 H LEU A 18 20.574 -15.733 -7.935 1.00 0.00 H new ATOM 0 HA LEU A 18 19.624 -16.322 -10.414 1.00 0.00 H new ATOM 0 HB2 LEU A 18 22.072 -16.968 -8.849 1.00 0.00 H new ATOM 0 HB3 LEU A 18 21.814 -17.940 -10.284 1.00 0.00 H new ATOM 0 HG LEU A 18 21.612 -15.783 -11.597 1.00 0.00 H new ATOM 0 HD11 LEU A 18 22.592 -13.765 -10.578 1.00 0.00 H new ATOM 0 HD12 LEU A 18 21.115 -14.282 -9.731 1.00 0.00 H new ATOM 0 HD13 LEU A 18 22.712 -14.616 -9.019 1.00 0.00 H new ATOM 0 HD21 LEU A 18 24.050 -15.427 -11.673 1.00 0.00 H new ATOM 0 HD22 LEU A 18 24.227 -16.344 -10.158 1.00 0.00 H new ATOM 0 HD23 LEU A 18 23.637 -17.157 -11.627 1.00 0.00 H new ATOM 254 N LEU A 19 19.632 -19.021 -8.518 1.00 0.00 N ATOM 255 CA LEU A 19 19.102 -20.375 -8.404 1.00 0.00 C ATOM 256 C LEU A 19 17.594 -20.391 -8.632 1.00 0.00 C ATOM 257 O LEU A 19 17.054 -21.327 -9.224 1.00 0.00 O ATOM 258 CB LEU A 19 19.427 -20.958 -7.028 1.00 0.00 C ATOM 259 CG LEU A 19 20.911 -21.166 -6.721 1.00 0.00 C ATOM 260 CD1 LEU A 19 21.128 -21.333 -5.225 1.00 0.00 C ATOM 261 CD2 LEU A 19 21.447 -22.373 -7.477 1.00 0.00 C ATOM 0 H LEU A 19 20.126 -18.691 -7.689 1.00 0.00 H new ATOM 0 HA LEU A 19 19.574 -20.988 -9.172 1.00 0.00 H new ATOM 0 HB2 LEU A 19 19.008 -20.299 -6.268 1.00 0.00 H new ATOM 0 HB3 LEU A 19 18.919 -21.918 -6.933 1.00 0.00 H new ATOM 0 HG LEU A 19 21.458 -20.283 -7.051 1.00 0.00 H new ATOM 0 HD11 LEU A 19 22.189 -21.480 -5.025 1.00 0.00 H new ATOM 0 HD12 LEU A 19 20.781 -20.440 -4.705 1.00 0.00 H new ATOM 0 HD13 LEU A 19 20.569 -22.199 -4.871 1.00 0.00 H new ATOM 0 HD21 LEU A 19 22.504 -22.506 -7.247 1.00 0.00 H new ATOM 0 HD22 LEU A 19 20.895 -23.264 -7.178 1.00 0.00 H new ATOM 0 HD23 LEU A 19 21.326 -22.214 -8.549 1.00 0.00 H new ATOM 273 N LEU A 20 16.919 -19.348 -8.160 1.00 0.00 N ATOM 274 CA LEU A 20 15.472 -19.240 -8.314 1.00 0.00 C ATOM 275 C LEU A 20 15.115 -18.423 -9.551 1.00 0.00 C ATOM 276 O LEU A 20 13.946 -18.312 -9.918 1.00 0.00 O ATOM 277 CB LEU A 20 14.854 -18.600 -7.070 1.00 0.00 C ATOM 278 CG LEU A 20 15.523 -18.939 -5.737 1.00 0.00 C ATOM 279 CD1 LEU A 20 14.819 -18.229 -4.591 1.00 0.00 C ATOM 280 CD2 LEU A 20 15.529 -20.444 -5.511 1.00 0.00 C ATOM 0 H LEU A 20 17.350 -18.566 -7.668 1.00 0.00 H new ATOM 0 HA LEU A 20 15.068 -20.245 -8.437 1.00 0.00 H new ATOM 0 HB2 LEU A 20 14.870 -17.518 -7.197 1.00 0.00 H new ATOM 0 HB3 LEU A 20 13.807 -18.899 -7.014 1.00 0.00 H new ATOM 0 HG LEU A 20 16.556 -18.593 -5.772 1.00 0.00 H new ATOM 0 HD11 LEU A 20 15.309 -18.482 -3.651 1.00 0.00 H new ATOM 0 HD12 LEU A 20 14.867 -17.151 -4.747 1.00 0.00 H new ATOM 0 HD13 LEU A 20 13.776 -18.544 -4.553 1.00 0.00 H new ATOM 0 HD21 LEU A 20 16.009 -20.667 -4.558 1.00 0.00 H new ATOM 0 HD22 LEU A 20 14.504 -20.814 -5.496 1.00 0.00 H new ATOM 0 HD23 LEU A 20 16.079 -20.931 -6.317 1.00 0.00 H new ATOM 292 N SER A 21 16.132 -17.853 -10.191 1.00 0.00 N ATOM 293 CA SER A 21 15.926 -17.044 -11.386 1.00 0.00 C ATOM 294 C SER A 21 16.682 -17.629 -12.575 1.00 0.00 C ATOM 295 O SER A 21 17.784 -17.198 -12.915 1.00 0.00 O ATOM 296 CB SER A 21 16.378 -15.604 -11.138 1.00 0.00 C ATOM 297 OG SER A 21 15.358 -14.850 -10.507 1.00 0.00 O ATOM 0 H SER A 21 17.106 -17.937 -9.901 1.00 0.00 H new ATOM 0 HA SER A 21 14.861 -17.047 -11.617 1.00 0.00 H new ATOM 0 HB2 SER A 21 17.273 -15.603 -10.516 1.00 0.00 H new ATOM 0 HB3 SER A 21 16.647 -15.136 -12.085 1.00 0.00 H new ATOM 0 HG SER A 21 15.673 -13.934 -10.358 1.00 0.00 H new ATOM 303 N PRO A 22 16.077 -18.636 -13.223 1.00 0.00 N ATOM 304 CA PRO A 22 16.674 -19.302 -14.384 1.00 0.00 C ATOM 305 C PRO A 22 16.710 -18.402 -15.614 1.00 0.00 C ATOM 306 O PRO A 22 17.349 -18.727 -16.614 1.00 0.00 O ATOM 307 CB PRO A 22 15.748 -20.497 -14.622 1.00 0.00 C ATOM 308 CG PRO A 22 14.438 -20.082 -14.046 1.00 0.00 C ATOM 309 CD PRO A 22 14.763 -19.201 -12.872 1.00 0.00 C ATOM 0 HA PRO A 22 17.713 -19.579 -14.205 1.00 0.00 H new ATOM 0 HB2 PRO A 22 15.659 -20.724 -15.684 1.00 0.00 H new ATOM 0 HB3 PRO A 22 16.128 -21.395 -14.135 1.00 0.00 H new ATOM 0 HG2 PRO A 22 13.840 -19.546 -14.783 1.00 0.00 H new ATOM 0 HG3 PRO A 22 13.856 -20.949 -13.734 1.00 0.00 H new ATOM 0 HD2 PRO A 22 14.014 -18.421 -12.735 1.00 0.00 H new ATOM 0 HD3 PRO A 22 14.805 -19.769 -11.943 1.00 0.00 H new ATOM 317 N GLU A 23 16.019 -17.269 -15.533 1.00 0.00 N ATOM 318 CA GLU A 23 15.972 -16.322 -16.641 1.00 0.00 C ATOM 319 C GLU A 23 17.235 -15.466 -16.679 1.00 0.00 C ATOM 320 O GLU A 23 17.615 -14.949 -17.729 1.00 0.00 O ATOM 321 CB GLU A 23 14.739 -15.425 -16.523 1.00 0.00 C ATOM 322 CG GLU A 23 13.653 -15.746 -17.537 1.00 0.00 C ATOM 323 CD GLU A 23 12.348 -15.034 -17.240 1.00 0.00 C ATOM 324 OE1 GLU A 23 12.210 -13.858 -17.636 1.00 0.00 O ATOM 325 OE2 GLU A 23 11.464 -15.653 -16.611 1.00 0.00 O ATOM 0 H GLU A 23 15.484 -16.985 -14.712 1.00 0.00 H new ATOM 0 HA GLU A 23 15.911 -16.891 -17.569 1.00 0.00 H new ATOM 0 HB2 GLU A 23 14.326 -15.520 -15.519 1.00 0.00 H new ATOM 0 HB3 GLU A 23 15.043 -14.386 -16.646 1.00 0.00 H new ATOM 0 HG2 GLU A 23 13.997 -15.466 -18.533 1.00 0.00 H new ATOM 0 HG3 GLU A 23 13.480 -16.822 -17.550 1.00 0.00 H new ATOM 332 N GLU A 24 17.881 -15.322 -15.526 1.00 0.00 N ATOM 333 CA GLU A 24 19.100 -14.528 -15.428 1.00 0.00 C ATOM 334 C GLU A 24 20.324 -15.427 -15.278 1.00 0.00 C ATOM 335 O GLU A 24 21.343 -15.220 -15.935 1.00 0.00 O ATOM 336 CB GLU A 24 19.013 -13.564 -14.242 1.00 0.00 C ATOM 337 CG GLU A 24 18.556 -12.167 -14.627 1.00 0.00 C ATOM 338 CD GLU A 24 19.628 -11.120 -14.400 1.00 0.00 C ATOM 339 OE1 GLU A 24 19.858 -10.748 -13.231 1.00 0.00 O ATOM 340 OE2 GLU A 24 20.239 -10.672 -15.394 1.00 0.00 O ATOM 0 H GLU A 24 17.581 -15.745 -14.648 1.00 0.00 H new ATOM 0 HA GLU A 24 19.204 -13.953 -16.348 1.00 0.00 H new ATOM 0 HB2 GLU A 24 18.324 -13.972 -13.503 1.00 0.00 H new ATOM 0 HB3 GLU A 24 19.991 -13.499 -13.765 1.00 0.00 H new ATOM 0 HG2 GLU A 24 18.264 -12.161 -15.677 1.00 0.00 H new ATOM 0 HG3 GLU A 24 17.670 -11.906 -14.048 1.00 0.00 H new ATOM 347 N ASN A 25 20.214 -16.425 -14.407 1.00 0.00 N ATOM 348 CA ASN A 25 21.312 -17.355 -14.169 1.00 0.00 C ATOM 349 C ASN A 25 21.607 -18.180 -15.419 1.00 0.00 C ATOM 350 O ASN A 25 20.745 -18.906 -15.913 1.00 0.00 O ATOM 351 CB ASN A 25 20.977 -18.284 -13.000 1.00 0.00 C ATOM 352 CG ASN A 25 22.113 -19.233 -12.671 1.00 0.00 C ATOM 353 OD1 ASN A 25 23.284 -18.911 -12.874 1.00 0.00 O ATOM 354 ND2 ASN A 25 21.772 -20.410 -12.160 1.00 0.00 N ATOM 0 H ASN A 25 19.377 -16.610 -13.855 1.00 0.00 H new ATOM 0 HA ASN A 25 22.200 -16.774 -13.920 1.00 0.00 H new ATOM 0 HB2 ASN A 25 20.741 -17.685 -12.120 1.00 0.00 H new ATOM 0 HB3 ASN A 25 20.084 -18.861 -13.242 1.00 0.00 H new ATOM 0 HD21 ASN A 25 22.493 -21.090 -11.919 1.00 0.00 H new ATOM 0 HD22 ASN A 25 20.789 -20.635 -12.009 1.00 0.00 H new ATOM 361 N CYS A 26 22.831 -18.062 -15.923 1.00 0.00 N ATOM 362 CA CYS A 26 23.240 -18.795 -17.115 1.00 0.00 C ATOM 363 C CYS A 26 24.306 -19.832 -16.776 1.00 0.00 C ATOM 364 O CYS A 26 25.502 -19.570 -16.897 1.00 0.00 O ATOM 365 CB CYS A 26 23.770 -17.830 -18.176 1.00 0.00 C ATOM 366 SG CYS A 26 22.877 -17.898 -19.747 1.00 0.00 S ATOM 0 H CYS A 26 23.556 -17.466 -15.525 1.00 0.00 H new ATOM 0 HA CYS A 26 22.366 -19.314 -17.510 1.00 0.00 H new ATOM 0 HB2 CYS A 26 23.719 -16.814 -17.785 1.00 0.00 H new ATOM 0 HB3 CYS A 26 24.822 -18.049 -18.358 1.00 0.00 H new ATOM 0 HG CYS A 26 23.397 -17.045 -20.579 1.00 0.00 H new ATOM 372 N GLY A 27 23.864 -21.011 -16.348 1.00 0.00 N ATOM 373 CA GLY A 27 24.793 -22.069 -15.996 1.00 0.00 C ATOM 374 C GLY A 27 25.886 -21.592 -15.060 1.00 0.00 C ATOM 375 O GLY A 27 27.036 -22.020 -15.169 1.00 0.00 O ATOM 0 H GLY A 27 22.879 -21.252 -16.239 1.00 0.00 H new ATOM 0 HA2 GLY A 27 24.247 -22.886 -15.525 1.00 0.00 H new ATOM 0 HA3 GLY A 27 25.245 -22.469 -16.904 1.00 0.00 H new ATOM 379 N ILE A 28 25.528 -20.704 -14.139 1.00 0.00 N ATOM 380 CA ILE A 28 26.488 -20.169 -13.181 1.00 0.00 C ATOM 381 C ILE A 28 26.412 -20.913 -11.852 1.00 0.00 C ATOM 382 O ILE A 28 27.372 -20.929 -11.081 1.00 0.00 O ATOM 383 CB ILE A 28 26.255 -18.667 -12.930 1.00 0.00 C ATOM 384 CG1 ILE A 28 26.015 -17.938 -14.253 1.00 0.00 C ATOM 385 CG2 ILE A 28 27.442 -18.064 -12.194 1.00 0.00 C ATOM 386 CD1 ILE A 28 25.648 -16.480 -14.081 1.00 0.00 C ATOM 0 H ILE A 28 24.581 -20.340 -14.036 1.00 0.00 H new ATOM 0 HA ILE A 28 27.478 -20.307 -13.616 1.00 0.00 H new ATOM 0 HB ILE A 28 25.368 -18.550 -12.307 1.00 0.00 H new ATOM 0 HG12 ILE A 28 26.914 -18.008 -14.866 1.00 0.00 H new ATOM 0 HG13 ILE A 28 25.218 -18.443 -14.798 1.00 0.00 H new ATOM 0 HG21 ILE A 28 27.263 -17.002 -12.024 1.00 0.00 H new ATOM 0 HG22 ILE A 28 27.571 -18.569 -11.236 1.00 0.00 H new ATOM 0 HG23 ILE A 28 28.344 -18.188 -12.794 1.00 0.00 H new ATOM 0 HD11 ILE A 28 25.492 -16.026 -15.060 1.00 0.00 H new ATOM 0 HD12 ILE A 28 24.732 -16.402 -13.495 1.00 0.00 H new ATOM 0 HD13 ILE A 28 26.455 -15.960 -13.564 1.00 0.00 H new ATOM 398 N LEU A 29 25.265 -21.531 -11.592 1.00 0.00 N ATOM 399 CA LEU A 29 25.062 -22.280 -10.356 1.00 0.00 C ATOM 400 C LEU A 29 24.241 -23.539 -10.612 1.00 0.00 C ATOM 401 O LEU A 29 23.653 -23.702 -11.680 1.00 0.00 O ATOM 402 CB LEU A 29 24.364 -21.404 -9.314 1.00 0.00 C ATOM 403 CG LEU A 29 25.028 -20.060 -9.013 1.00 0.00 C ATOM 404 CD1 LEU A 29 24.002 -19.059 -8.507 1.00 0.00 C ATOM 405 CD2 LEU A 29 26.150 -20.235 -8.000 1.00 0.00 C ATOM 0 H LEU A 29 24.461 -21.528 -12.220 1.00 0.00 H new ATOM 0 HA LEU A 29 26.039 -22.577 -9.975 1.00 0.00 H new ATOM 0 HB2 LEU A 29 23.345 -21.215 -9.651 1.00 0.00 H new ATOM 0 HB3 LEU A 29 24.293 -21.968 -8.384 1.00 0.00 H new ATOM 0 HG LEU A 29 25.457 -19.673 -9.937 1.00 0.00 H new ATOM 0 HD11 LEU A 29 24.493 -18.109 -8.298 1.00 0.00 H new ATOM 0 HD12 LEU A 29 23.233 -18.911 -9.265 1.00 0.00 H new ATOM 0 HD13 LEU A 29 23.543 -19.438 -7.594 1.00 0.00 H new ATOM 0 HD21 LEU A 29 26.611 -19.268 -7.798 1.00 0.00 H new ATOM 0 HD22 LEU A 29 25.744 -20.644 -7.075 1.00 0.00 H new ATOM 0 HD23 LEU A 29 26.899 -20.918 -8.401 1.00 0.00 H new ATOM 417 N GLU A 30 24.204 -24.426 -9.622 1.00 0.00 N ATOM 418 CA GLU A 30 23.453 -25.671 -9.740 1.00 0.00 C ATOM 419 C GLU A 30 22.879 -26.090 -8.390 1.00 0.00 C ATOM 420 O GLU A 30 23.481 -25.845 -7.345 1.00 0.00 O ATOM 421 CB GLU A 30 24.348 -26.782 -10.293 1.00 0.00 C ATOM 422 CG GLU A 30 24.171 -27.021 -11.783 1.00 0.00 C ATOM 423 CD GLU A 30 24.418 -28.465 -12.176 1.00 0.00 C ATOM 424 OE1 GLU A 30 25.344 -29.083 -11.612 1.00 0.00 O ATOM 425 OE2 GLU A 30 23.683 -28.976 -13.047 1.00 0.00 O ATOM 0 H GLU A 30 24.685 -24.306 -8.730 1.00 0.00 H new ATOM 0 HA GLU A 30 22.626 -25.503 -10.430 1.00 0.00 H new ATOM 0 HB2 GLU A 30 25.390 -26.530 -10.095 1.00 0.00 H new ATOM 0 HB3 GLU A 30 24.137 -27.708 -9.757 1.00 0.00 H new ATOM 0 HG2 GLU A 30 23.160 -26.737 -12.075 1.00 0.00 H new ATOM 0 HG3 GLU A 30 24.855 -26.376 -12.334 1.00 0.00 H new ATOM 432 N TRP A 31 21.711 -26.721 -8.421 1.00 0.00 N ATOM 433 CA TRP A 31 21.054 -27.173 -7.200 1.00 0.00 C ATOM 434 C TRP A 31 21.478 -28.595 -6.848 1.00 0.00 C ATOM 435 O TRP A 31 20.956 -29.562 -7.401 1.00 0.00 O ATOM 436 CB TRP A 31 19.534 -27.106 -7.358 1.00 0.00 C ATOM 437 CG TRP A 31 18.943 -25.819 -6.870 1.00 0.00 C ATOM 438 CD1 TRP A 31 18.135 -24.970 -7.571 1.00 0.00 C ATOM 439 CD2 TRP A 31 19.114 -25.234 -5.574 1.00 0.00 C ATOM 440 NE1 TRP A 31 17.794 -23.892 -6.789 1.00 0.00 N ATOM 441 CE2 TRP A 31 18.382 -24.031 -5.560 1.00 0.00 C ATOM 442 CE3 TRP A 31 19.814 -25.610 -4.424 1.00 0.00 C ATOM 443 CZ2 TRP A 31 18.331 -23.204 -4.441 1.00 0.00 C ATOM 444 CZ3 TRP A 31 19.763 -24.788 -3.315 1.00 0.00 C ATOM 445 CH2 TRP A 31 19.026 -23.596 -3.329 1.00 0.00 C ATOM 0 H TRP A 31 21.199 -26.931 -9.278 1.00 0.00 H new ATOM 0 HA TRP A 31 21.357 -26.511 -6.389 1.00 0.00 H new ATOM 0 HB2 TRP A 31 19.279 -27.239 -8.409 1.00 0.00 H new ATOM 0 HB3 TRP A 31 19.082 -27.935 -6.813 1.00 0.00 H new ATOM 0 HD1 TRP A 31 17.811 -25.123 -8.590 1.00 0.00 H new ATOM 0 HE1 TRP A 31 17.200 -23.115 -7.077 1.00 0.00 H new ATOM 0 HE3 TRP A 31 20.385 -26.527 -4.403 1.00 0.00 H new ATOM 0 HZ2 TRP A 31 17.763 -22.285 -4.450 1.00 0.00 H new ATOM 0 HZ3 TRP A 31 20.301 -25.069 -2.421 1.00 0.00 H new ATOM 0 HH2 TRP A 31 19.006 -22.975 -2.446 1.00 0.00 H new ATOM 456 N GLU A 32 22.428 -28.714 -5.926 1.00 0.00 N ATOM 457 CA GLU A 32 22.922 -30.019 -5.502 1.00 0.00 C ATOM 458 C GLU A 32 21.942 -30.686 -4.541 1.00 0.00 C ATOM 459 O GLU A 32 21.836 -31.912 -4.497 1.00 0.00 O ATOM 460 CB GLU A 32 24.292 -29.879 -4.835 1.00 0.00 C ATOM 461 CG GLU A 32 25.438 -29.735 -5.822 1.00 0.00 C ATOM 462 CD GLU A 32 26.293 -30.985 -5.909 1.00 0.00 C ATOM 463 OE1 GLU A 32 26.521 -31.622 -4.860 1.00 0.00 O ATOM 464 OE2 GLU A 32 26.734 -31.325 -7.027 1.00 0.00 O ATOM 0 H GLU A 32 22.871 -27.923 -5.458 1.00 0.00 H new ATOM 0 HA GLU A 32 23.020 -30.647 -6.388 1.00 0.00 H new ATOM 0 HB2 GLU A 32 24.279 -29.010 -4.177 1.00 0.00 H new ATOM 0 HB3 GLU A 32 24.472 -30.752 -4.207 1.00 0.00 H new ATOM 0 HG2 GLU A 32 25.036 -29.505 -6.809 1.00 0.00 H new ATOM 0 HG3 GLU A 32 26.063 -28.892 -5.527 1.00 0.00 H new ATOM 471 N ASP A 33 21.228 -29.870 -3.773 1.00 0.00 N ATOM 472 CA ASP A 33 20.256 -30.380 -2.813 1.00 0.00 C ATOM 473 C ASP A 33 19.279 -29.285 -2.396 1.00 0.00 C ATOM 474 O ASP A 33 19.626 -28.388 -1.628 1.00 0.00 O ATOM 475 CB ASP A 33 20.969 -30.939 -1.581 1.00 0.00 C ATOM 476 CG ASP A 33 20.901 -32.452 -1.510 1.00 0.00 C ATOM 477 OD1 ASP A 33 21.618 -33.116 -2.288 1.00 0.00 O ATOM 478 OD2 ASP A 33 20.132 -32.972 -0.676 1.00 0.00 O ATOM 0 H ASP A 33 21.304 -28.853 -3.797 1.00 0.00 H new ATOM 0 HA ASP A 33 19.694 -31.181 -3.293 1.00 0.00 H new ATOM 0 HB2 ASP A 33 22.013 -30.625 -1.595 1.00 0.00 H new ATOM 0 HB3 ASP A 33 20.521 -30.515 -0.682 1.00 0.00 H new ATOM 483 N ARG A 34 18.055 -29.365 -2.909 1.00 0.00 N ATOM 484 CA ARG A 34 17.028 -28.380 -2.592 1.00 0.00 C ATOM 485 C ARG A 34 16.608 -28.484 -1.129 1.00 0.00 C ATOM 486 O ARG A 34 16.396 -27.473 -0.461 1.00 0.00 O ATOM 487 CB ARG A 34 15.810 -28.572 -3.498 1.00 0.00 C ATOM 488 CG ARG A 34 15.184 -27.267 -3.961 1.00 0.00 C ATOM 489 CD ARG A 34 16.029 -26.590 -5.028 1.00 0.00 C ATOM 490 NE ARG A 34 15.384 -26.619 -6.338 1.00 0.00 N ATOM 491 CZ ARG A 34 14.222 -26.029 -6.598 1.00 0.00 C ATOM 492 NH1 ARG A 34 13.583 -25.368 -5.644 1.00 0.00 N ATOM 493 NH2 ARG A 34 13.698 -26.101 -7.815 1.00 0.00 N ATOM 0 H ARG A 34 17.751 -30.102 -3.546 1.00 0.00 H new ATOM 0 HA ARG A 34 17.447 -27.388 -2.762 1.00 0.00 H new ATOM 0 HB2 ARG A 34 16.105 -29.153 -4.371 1.00 0.00 H new ATOM 0 HB3 ARG A 34 15.060 -29.156 -2.965 1.00 0.00 H new ATOM 0 HG2 ARG A 34 14.186 -27.461 -4.355 1.00 0.00 H new ATOM 0 HG3 ARG A 34 15.066 -26.597 -3.110 1.00 0.00 H new ATOM 0 HD2 ARG A 34 16.217 -25.556 -4.739 1.00 0.00 H new ATOM 0 HD3 ARG A 34 16.998 -27.085 -5.090 1.00 0.00 H new ATOM 0 HE ARG A 34 15.851 -27.119 -7.094 1.00 0.00 H new ATOM 0 HH11 ARG A 34 13.983 -25.311 -4.707 1.00 0.00 H new ATOM 0 HH12 ARG A 34 12.691 -24.916 -5.846 1.00 0.00 H new ATOM 0 HH21 ARG A 34 14.187 -26.609 -8.552 1.00 0.00 H new ATOM 0 HH22 ARG A 34 12.806 -25.648 -8.014 1.00 0.00 H new ATOM 507 N GLU A 35 16.488 -29.714 -0.639 1.00 0.00 N ATOM 508 CA GLU A 35 16.092 -29.950 0.744 1.00 0.00 C ATOM 509 C GLU A 35 17.099 -29.334 1.711 1.00 0.00 C ATOM 510 O GLU A 35 16.734 -28.553 2.589 1.00 0.00 O ATOM 511 CB GLU A 35 15.962 -31.450 1.013 1.00 0.00 C ATOM 512 CG GLU A 35 14.526 -31.914 1.193 1.00 0.00 C ATOM 513 CD GLU A 35 14.211 -32.290 2.628 1.00 0.00 C ATOM 514 OE1 GLU A 35 13.779 -31.401 3.392 1.00 0.00 O ATOM 515 OE2 GLU A 35 14.395 -33.471 2.987 1.00 0.00 O ATOM 0 H GLU A 35 16.659 -30.562 -1.179 1.00 0.00 H new ATOM 0 HA GLU A 35 15.124 -29.475 0.903 1.00 0.00 H new ATOM 0 HB2 GLU A 35 16.411 -31.999 0.186 1.00 0.00 H new ATOM 0 HB3 GLU A 35 16.531 -31.701 1.908 1.00 0.00 H new ATOM 0 HG2 GLU A 35 13.849 -31.122 0.872 1.00 0.00 H new ATOM 0 HG3 GLU A 35 14.342 -32.773 0.547 1.00 0.00 H new ATOM 522 N GLN A 36 18.368 -29.693 1.543 1.00 0.00 N ATOM 523 CA GLN A 36 19.428 -29.178 2.401 1.00 0.00 C ATOM 524 C GLN A 36 19.780 -27.741 2.028 1.00 0.00 C ATOM 525 O GLN A 36 20.194 -26.953 2.877 1.00 0.00 O ATOM 526 CB GLN A 36 20.671 -30.063 2.300 1.00 0.00 C ATOM 527 CG GLN A 36 20.372 -31.548 2.423 1.00 0.00 C ATOM 528 CD GLN A 36 21.431 -32.294 3.211 1.00 0.00 C ATOM 529 OE1 GLN A 36 22.041 -33.240 2.712 1.00 0.00 O ATOM 530 NE2 GLN A 36 21.656 -31.870 4.449 1.00 0.00 N ATOM 0 H GLN A 36 18.687 -30.339 0.820 1.00 0.00 H new ATOM 0 HA GLN A 36 19.066 -29.189 3.429 1.00 0.00 H new ATOM 0 HB2 GLN A 36 21.162 -29.878 1.345 1.00 0.00 H new ATOM 0 HB3 GLN A 36 21.375 -29.777 3.081 1.00 0.00 H new ATOM 0 HG2 GLN A 36 19.404 -31.681 2.906 1.00 0.00 H new ATOM 0 HG3 GLN A 36 20.293 -31.982 1.426 1.00 0.00 H new ATOM 0 HE21 GLN A 36 21.127 -31.082 4.822 1.00 0.00 H new ATOM 0 HE22 GLN A 36 22.358 -32.332 5.027 1.00 0.00 H new ATOM 539 N GLY A 37 19.613 -27.409 0.752 1.00 0.00 N ATOM 540 CA GLY A 37 19.918 -26.067 0.289 1.00 0.00 C ATOM 541 C GLY A 37 21.347 -25.934 -0.199 1.00 0.00 C ATOM 542 O GLY A 37 21.927 -24.849 -0.153 1.00 0.00 O ATOM 0 H GLY A 37 19.272 -28.044 0.031 1.00 0.00 H new ATOM 0 HA2 GLY A 37 19.235 -25.800 -0.518 1.00 0.00 H new ATOM 0 HA3 GLY A 37 19.746 -25.358 1.099 1.00 0.00 H new ATOM 546 N ILE A 38 21.917 -27.040 -0.667 1.00 0.00 N ATOM 547 CA ILE A 38 23.287 -27.041 -1.165 1.00 0.00 C ATOM 548 C ILE A 38 23.331 -26.709 -2.652 1.00 0.00 C ATOM 549 O ILE A 38 22.571 -27.263 -3.446 1.00 0.00 O ATOM 550 CB ILE A 38 23.968 -28.402 -0.934 1.00 0.00 C ATOM 551 CG1 ILE A 38 23.998 -28.736 0.559 1.00 0.00 C ATOM 552 CG2 ILE A 38 25.377 -28.394 -1.508 1.00 0.00 C ATOM 553 CD1 ILE A 38 24.036 -30.220 0.847 1.00 0.00 C ATOM 0 H ILE A 38 21.451 -27.946 -0.712 1.00 0.00 H new ATOM 0 HA ILE A 38 23.826 -26.275 -0.608 1.00 0.00 H new ATOM 0 HB ILE A 38 23.391 -29.171 -1.448 1.00 0.00 H new ATOM 0 HG12 ILE A 38 24.871 -28.264 1.011 1.00 0.00 H new ATOM 0 HG13 ILE A 38 23.119 -28.304 1.037 1.00 0.00 H new ATOM 0 HG21 ILE A 38 25.845 -29.363 -1.337 1.00 0.00 H new ATOM 0 HG22 ILE A 38 25.332 -28.197 -2.579 1.00 0.00 H new ATOM 0 HG23 ILE A 38 25.964 -27.616 -1.020 1.00 0.00 H new ATOM 0 HD11 ILE A 38 24.056 -30.381 1.925 1.00 0.00 H new ATOM 0 HD12 ILE A 38 23.150 -30.695 0.425 1.00 0.00 H new ATOM 0 HD13 ILE A 38 24.929 -30.655 0.399 1.00 0.00 H new ATOM 565 N PHE A 39 24.228 -25.801 -3.024 1.00 0.00 N ATOM 566 CA PHE A 39 24.373 -25.395 -4.417 1.00 0.00 C ATOM 567 C PHE A 39 25.839 -25.417 -4.840 1.00 0.00 C ATOM 568 O PHE A 39 26.739 -25.357 -4.002 1.00 0.00 O ATOM 569 CB PHE A 39 23.792 -23.995 -4.625 1.00 0.00 C ATOM 570 CG PHE A 39 24.534 -22.921 -3.882 1.00 0.00 C ATOM 571 CD1 PHE A 39 24.325 -22.727 -2.526 1.00 0.00 C ATOM 572 CD2 PHE A 39 25.440 -22.105 -4.540 1.00 0.00 C ATOM 573 CE1 PHE A 39 25.006 -21.739 -1.841 1.00 0.00 C ATOM 574 CE2 PHE A 39 26.125 -21.115 -3.859 1.00 0.00 C ATOM 575 CZ PHE A 39 25.908 -20.933 -2.508 1.00 0.00 C ATOM 0 H PHE A 39 24.865 -25.333 -2.380 1.00 0.00 H new ATOM 0 HA PHE A 39 23.824 -26.105 -5.035 1.00 0.00 H new ATOM 0 HB2 PHE A 39 23.801 -23.761 -5.690 1.00 0.00 H new ATOM 0 HB3 PHE A 39 22.750 -23.992 -4.307 1.00 0.00 H new ATOM 0 HD1 PHE A 39 23.622 -23.355 -1.999 1.00 0.00 H new ATOM 0 HD2 PHE A 39 25.613 -22.244 -5.597 1.00 0.00 H new ATOM 0 HE1 PHE A 39 24.833 -21.597 -0.784 1.00 0.00 H new ATOM 0 HE2 PHE A 39 26.829 -20.485 -4.383 1.00 0.00 H new ATOM 0 HZ PHE A 39 26.443 -20.162 -1.973 1.00 0.00 H new ATOM 585 N ARG A 40 26.071 -25.504 -6.145 1.00 0.00 N ATOM 586 CA ARG A 40 27.427 -25.536 -6.680 1.00 0.00 C ATOM 587 C ARG A 40 27.676 -24.345 -7.601 1.00 0.00 C ATOM 588 O ARG A 40 26.756 -23.843 -8.247 1.00 0.00 O ATOM 589 CB ARG A 40 27.667 -26.842 -7.441 1.00 0.00 C ATOM 590 CG ARG A 40 28.966 -26.857 -8.230 1.00 0.00 C ATOM 591 CD ARG A 40 28.982 -27.979 -9.255 1.00 0.00 C ATOM 592 NE ARG A 40 30.025 -27.789 -10.259 1.00 0.00 N ATOM 593 CZ ARG A 40 30.345 -28.702 -11.170 1.00 0.00 C ATOM 594 NH1 ARG A 40 29.705 -29.862 -11.202 1.00 0.00 N ATOM 595 NH2 ARG A 40 31.306 -28.454 -12.050 1.00 0.00 N ATOM 0 H ARG A 40 25.337 -25.554 -6.852 1.00 0.00 H new ATOM 0 HA ARG A 40 28.123 -25.478 -5.843 1.00 0.00 H new ATOM 0 HB2 ARG A 40 27.673 -27.670 -6.732 1.00 0.00 H new ATOM 0 HB3 ARG A 40 26.835 -27.013 -8.124 1.00 0.00 H new ATOM 0 HG2 ARG A 40 29.097 -25.900 -8.735 1.00 0.00 H new ATOM 0 HG3 ARG A 40 29.807 -26.975 -7.546 1.00 0.00 H new ATOM 0 HD2 ARG A 40 29.137 -28.931 -8.748 1.00 0.00 H new ATOM 0 HD3 ARG A 40 28.011 -28.034 -9.747 1.00 0.00 H new ATOM 0 HE ARG A 40 30.536 -26.906 -10.261 1.00 0.00 H new ATOM 0 HH11 ARG A 40 28.965 -30.055 -10.527 1.00 0.00 H new ATOM 0 HH12 ARG A 40 29.952 -30.562 -11.902 1.00 0.00 H new ATOM 0 HH21 ARG A 40 31.800 -27.562 -12.028 1.00 0.00 H new ATOM 0 HH22 ARG A 40 31.551 -29.155 -12.749 1.00 0.00 H new ATOM 609 N VAL A 41 28.927 -23.898 -7.657 1.00 0.00 N ATOM 610 CA VAL A 41 29.297 -22.767 -8.499 1.00 0.00 C ATOM 611 C VAL A 41 29.928 -23.238 -9.805 1.00 0.00 C ATOM 612 O VAL A 41 31.151 -23.305 -9.928 1.00 0.00 O ATOM 613 CB VAL A 41 30.281 -21.828 -7.776 1.00 0.00 C ATOM 614 CG1 VAL A 41 30.721 -20.702 -8.699 1.00 0.00 C ATOM 615 CG2 VAL A 41 29.652 -21.273 -6.507 1.00 0.00 C ATOM 0 H VAL A 41 29.701 -24.302 -7.129 1.00 0.00 H new ATOM 0 HA VAL A 41 28.379 -22.221 -8.718 1.00 0.00 H new ATOM 0 HB VAL A 41 31.164 -22.402 -7.496 1.00 0.00 H new ATOM 0 HG11 VAL A 41 31.416 -20.049 -8.171 1.00 0.00 H new ATOM 0 HG12 VAL A 41 31.213 -21.122 -9.576 1.00 0.00 H new ATOM 0 HG13 VAL A 41 29.850 -20.127 -9.012 1.00 0.00 H new ATOM 0 HG21 VAL A 41 30.361 -20.612 -6.009 1.00 0.00 H new ATOM 0 HG22 VAL A 41 28.752 -20.714 -6.762 1.00 0.00 H new ATOM 0 HG23 VAL A 41 29.392 -22.095 -5.840 1.00 0.00 H new ATOM 625 N VAL A 42 29.084 -23.563 -10.780 1.00 0.00 N ATOM 626 CA VAL A 42 29.558 -24.026 -12.078 1.00 0.00 C ATOM 627 C VAL A 42 30.556 -23.044 -12.681 1.00 0.00 C ATOM 628 O VAL A 42 31.625 -23.436 -13.151 1.00 0.00 O ATOM 629 CB VAL A 42 28.391 -24.224 -13.064 1.00 0.00 C ATOM 630 CG1 VAL A 42 28.904 -24.729 -14.404 1.00 0.00 C ATOM 631 CG2 VAL A 42 27.361 -25.181 -12.483 1.00 0.00 C ATOM 0 H VAL A 42 28.069 -23.514 -10.695 1.00 0.00 H new ATOM 0 HA VAL A 42 30.050 -24.984 -11.911 1.00 0.00 H new ATOM 0 HB VAL A 42 27.908 -23.261 -13.227 1.00 0.00 H new ATOM 0 HG11 VAL A 42 28.066 -24.863 -15.088 1.00 0.00 H new ATOM 0 HG12 VAL A 42 29.602 -24.004 -14.823 1.00 0.00 H new ATOM 0 HG13 VAL A 42 29.413 -25.682 -14.263 1.00 0.00 H new ATOM 0 HG21 VAL A 42 26.543 -25.310 -13.192 1.00 0.00 H new ATOM 0 HG22 VAL A 42 27.829 -26.146 -12.290 1.00 0.00 H new ATOM 0 HG23 VAL A 42 26.971 -24.774 -11.550 1.00 0.00 H new ATOM 641 N LYS A 43 30.202 -21.763 -12.664 1.00 0.00 N ATOM 642 CA LYS A 43 31.067 -20.722 -13.207 1.00 0.00 C ATOM 643 C LYS A 43 31.550 -19.786 -12.104 1.00 0.00 C ATOM 644 O LYS A 43 30.797 -18.941 -11.619 1.00 0.00 O ATOM 645 CB LYS A 43 30.324 -19.922 -14.280 1.00 0.00 C ATOM 646 CG LYS A 43 29.980 -20.736 -15.515 1.00 0.00 C ATOM 647 CD LYS A 43 29.057 -19.969 -16.448 1.00 0.00 C ATOM 648 CE LYS A 43 28.822 -20.727 -17.746 1.00 0.00 C ATOM 649 NZ LYS A 43 29.802 -20.340 -18.798 1.00 0.00 N ATOM 0 H LYS A 43 29.321 -21.421 -12.280 1.00 0.00 H new ATOM 0 HA LYS A 43 31.935 -21.204 -13.657 1.00 0.00 H new ATOM 0 HB2 LYS A 43 29.405 -19.521 -13.852 1.00 0.00 H new ATOM 0 HB3 LYS A 43 30.936 -19.070 -14.575 1.00 0.00 H new ATOM 0 HG2 LYS A 43 30.895 -21.001 -16.044 1.00 0.00 H new ATOM 0 HG3 LYS A 43 29.503 -21.669 -15.216 1.00 0.00 H new ATOM 0 HD2 LYS A 43 28.103 -19.790 -15.952 1.00 0.00 H new ATOM 0 HD3 LYS A 43 29.490 -18.993 -16.668 1.00 0.00 H new ATOM 0 HE2 LYS A 43 28.894 -21.798 -17.559 1.00 0.00 H new ATOM 0 HE3 LYS A 43 27.810 -20.532 -18.102 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 29.609 -20.878 -19.667 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 29.717 -19.322 -18.995 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 30.766 -20.549 -18.468 1.00 0.00 H new ATOM 663 N SER A 44 32.811 -19.942 -11.712 1.00 0.00 N ATOM 664 CA SER A 44 33.394 -19.112 -10.665 1.00 0.00 C ATOM 665 C SER A 44 33.742 -17.726 -11.200 1.00 0.00 C ATOM 666 O SER A 44 33.760 -16.748 -10.454 1.00 0.00 O ATOM 667 CB SER A 44 34.646 -19.780 -10.093 1.00 0.00 C ATOM 668 OG SER A 44 35.696 -19.793 -11.045 1.00 0.00 O ATOM 0 H SER A 44 33.448 -20.636 -12.104 1.00 0.00 H new ATOM 0 HA SER A 44 32.656 -19.000 -9.871 1.00 0.00 H new ATOM 0 HB2 SER A 44 34.969 -19.249 -9.198 1.00 0.00 H new ATOM 0 HB3 SER A 44 34.412 -20.801 -9.791 1.00 0.00 H new ATOM 0 HG SER A 44 36.486 -20.223 -10.655 1.00 0.00 H new ATOM 674 N GLU A 45 34.018 -17.652 -12.498 1.00 0.00 N ATOM 675 CA GLU A 45 34.367 -16.387 -13.134 1.00 0.00 C ATOM 676 C GLU A 45 33.122 -15.539 -13.377 1.00 0.00 C ATOM 677 O GLU A 45 33.122 -14.333 -13.132 1.00 0.00 O ATOM 678 CB GLU A 45 35.093 -16.638 -14.457 1.00 0.00 C ATOM 679 CG GLU A 45 34.276 -17.440 -15.457 1.00 0.00 C ATOM 680 CD GLU A 45 35.142 -18.241 -16.409 1.00 0.00 C ATOM 681 OE1 GLU A 45 35.755 -19.233 -15.963 1.00 0.00 O ATOM 682 OE2 GLU A 45 35.206 -17.875 -17.602 1.00 0.00 O ATOM 0 H GLU A 45 34.007 -18.453 -13.130 1.00 0.00 H new ATOM 0 HA GLU A 45 35.031 -15.843 -12.462 1.00 0.00 H new ATOM 0 HB2 GLU A 45 35.359 -15.680 -14.903 1.00 0.00 H new ATOM 0 HB3 GLU A 45 36.025 -17.166 -14.256 1.00 0.00 H new ATOM 0 HG2 GLU A 45 33.612 -18.117 -14.919 1.00 0.00 H new ATOM 0 HG3 GLU A 45 33.643 -16.762 -16.030 1.00 0.00 H new ATOM 689 N ALA A 46 32.062 -16.179 -13.860 1.00 0.00 N ATOM 690 CA ALA A 46 30.810 -15.485 -14.135 1.00 0.00 C ATOM 691 C ALA A 46 30.128 -15.052 -12.842 1.00 0.00 C ATOM 692 O ALA A 46 29.531 -13.977 -12.773 1.00 0.00 O ATOM 693 CB ALA A 46 29.883 -16.373 -14.952 1.00 0.00 C ATOM 0 H ALA A 46 32.046 -17.177 -14.069 1.00 0.00 H new ATOM 0 HA ALA A 46 31.038 -14.589 -14.712 1.00 0.00 H new ATOM 0 HB1 ALA A 46 28.952 -15.842 -15.150 1.00 0.00 H new ATOM 0 HB2 ALA A 46 30.363 -16.628 -15.897 1.00 0.00 H new ATOM 0 HB3 ALA A 46 29.669 -17.285 -14.395 1.00 0.00 H new ATOM 699 N LEU A 47 30.218 -15.895 -11.819 1.00 0.00 N ATOM 700 CA LEU A 47 29.608 -15.599 -10.527 1.00 0.00 C ATOM 701 C LEU A 47 30.112 -14.268 -9.979 1.00 0.00 C ATOM 702 O LEU A 47 29.326 -13.426 -9.547 1.00 0.00 O ATOM 703 CB LEU A 47 29.908 -16.720 -9.531 1.00 0.00 C ATOM 704 CG LEU A 47 29.517 -16.450 -8.078 1.00 0.00 C ATOM 705 CD1 LEU A 47 28.031 -16.141 -7.974 1.00 0.00 C ATOM 706 CD2 LEU A 47 29.879 -17.637 -7.198 1.00 0.00 C ATOM 0 H LEU A 47 30.707 -16.789 -11.859 1.00 0.00 H new ATOM 0 HA LEU A 47 28.530 -15.527 -10.670 1.00 0.00 H new ATOM 0 HB2 LEU A 47 29.393 -17.621 -9.863 1.00 0.00 H new ATOM 0 HB3 LEU A 47 30.977 -16.933 -9.565 1.00 0.00 H new ATOM 0 HG LEU A 47 30.074 -15.581 -7.728 1.00 0.00 H new ATOM 0 HD11 LEU A 47 27.771 -15.951 -6.933 1.00 0.00 H new ATOM 0 HD12 LEU A 47 27.800 -15.259 -8.572 1.00 0.00 H new ATOM 0 HD13 LEU A 47 27.456 -16.990 -8.343 1.00 0.00 H new ATOM 0 HD21 LEU A 47 29.593 -17.426 -6.167 1.00 0.00 H new ATOM 0 HD22 LEU A 47 29.350 -18.524 -7.547 1.00 0.00 H new ATOM 0 HD23 LEU A 47 30.954 -17.813 -7.248 1.00 0.00 H new ATOM 718 N ALA A 48 31.428 -14.084 -10.003 1.00 0.00 N ATOM 719 CA ALA A 48 32.037 -12.854 -9.512 1.00 0.00 C ATOM 720 C ALA A 48 31.743 -11.685 -10.447 1.00 0.00 C ATOM 721 O ALA A 48 31.287 -10.628 -10.012 1.00 0.00 O ATOM 722 CB ALA A 48 33.538 -13.036 -9.348 1.00 0.00 C ATOM 0 H ALA A 48 32.093 -14.771 -10.357 1.00 0.00 H new ATOM 0 HA ALA A 48 31.602 -12.626 -8.539 1.00 0.00 H new ATOM 0 HB1 ALA A 48 33.979 -12.109 -8.981 1.00 0.00 H new ATOM 0 HB2 ALA A 48 33.732 -13.837 -8.635 1.00 0.00 H new ATOM 0 HB3 ALA A 48 33.981 -13.292 -10.311 1.00 0.00 H new ATOM 728 N LYS A 49 32.008 -11.883 -11.734 1.00 0.00 N ATOM 729 CA LYS A 49 31.771 -10.846 -12.732 1.00 0.00 C ATOM 730 C LYS A 49 30.372 -10.258 -12.584 1.00 0.00 C ATOM 731 O LYS A 49 30.200 -9.039 -12.565 1.00 0.00 O ATOM 732 CB LYS A 49 31.951 -11.415 -14.141 1.00 0.00 C ATOM 733 CG LYS A 49 32.913 -10.616 -15.002 1.00 0.00 C ATOM 734 CD LYS A 49 33.408 -11.428 -16.187 1.00 0.00 C ATOM 735 CE LYS A 49 34.518 -10.705 -16.934 1.00 0.00 C ATOM 736 NZ LYS A 49 34.077 -10.252 -18.282 1.00 0.00 N ATOM 0 H LYS A 49 32.387 -12.752 -12.111 1.00 0.00 H new ATOM 0 HA LYS A 49 32.499 -10.050 -12.573 1.00 0.00 H new ATOM 0 HB2 LYS A 49 32.311 -12.441 -14.066 1.00 0.00 H new ATOM 0 HB3 LYS A 49 30.980 -11.453 -14.635 1.00 0.00 H new ATOM 0 HG2 LYS A 49 32.418 -9.713 -15.360 1.00 0.00 H new ATOM 0 HG3 LYS A 49 33.763 -10.296 -14.399 1.00 0.00 H new ATOM 0 HD2 LYS A 49 33.772 -12.395 -15.840 1.00 0.00 H new ATOM 0 HD3 LYS A 49 32.579 -11.624 -16.867 1.00 0.00 H new ATOM 0 HE2 LYS A 49 34.847 -9.844 -16.351 1.00 0.00 H new ATOM 0 HE3 LYS A 49 35.378 -11.367 -17.037 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 34.862 -9.764 -18.758 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 33.787 -11.075 -18.847 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 33.273 -9.600 -18.183 1.00 0.00 H new ATOM 750 N MET A 50 29.376 -11.131 -12.479 1.00 0.00 N ATOM 751 CA MET A 50 27.992 -10.697 -12.330 1.00 0.00 C ATOM 752 C MET A 50 27.786 -9.985 -10.997 1.00 0.00 C ATOM 753 O MET A 50 27.142 -8.938 -10.935 1.00 0.00 O ATOM 754 CB MET A 50 27.045 -11.894 -12.434 1.00 0.00 C ATOM 755 CG MET A 50 26.551 -12.157 -13.848 1.00 0.00 C ATOM 756 SD MET A 50 24.898 -11.499 -14.139 1.00 0.00 S ATOM 757 CE MET A 50 23.926 -12.526 -13.041 1.00 0.00 C ATOM 0 H MET A 50 29.501 -12.143 -12.494 1.00 0.00 H new ATOM 0 HA MET A 50 27.769 -9.996 -13.134 1.00 0.00 H new ATOM 0 HB2 MET A 50 27.555 -12.784 -12.065 1.00 0.00 H new ATOM 0 HB3 MET A 50 26.187 -11.726 -11.783 1.00 0.00 H new ATOM 0 HG2 MET A 50 27.246 -11.712 -14.560 1.00 0.00 H new ATOM 0 HG3 MET A 50 26.548 -13.231 -14.034 1.00 0.00 H new ATOM 0 HE1 MET A 50 22.952 -12.719 -13.490 1.00 0.00 H new ATOM 0 HE2 MET A 50 24.443 -13.471 -12.875 1.00 0.00 H new ATOM 0 HE3 MET A 50 23.791 -12.014 -12.088 1.00 0.00 H new ATOM 767 N TRP A 51 28.335 -10.561 -9.933 1.00 0.00 N ATOM 768 CA TRP A 51 28.210 -9.981 -8.601 1.00 0.00 C ATOM 769 C TRP A 51 28.646 -8.520 -8.600 1.00 0.00 C ATOM 770 O TRP A 51 27.896 -7.639 -8.182 1.00 0.00 O ATOM 771 CB TRP A 51 29.046 -10.776 -7.596 1.00 0.00 C ATOM 772 CG TRP A 51 29.085 -10.154 -6.233 1.00 0.00 C ATOM 773 CD1 TRP A 51 30.196 -9.896 -5.482 1.00 0.00 C ATOM 774 CD2 TRP A 51 27.964 -9.715 -5.459 1.00 0.00 C ATOM 775 NE1 TRP A 51 29.833 -9.322 -4.287 1.00 0.00 N ATOM 776 CE2 TRP A 51 28.470 -9.200 -4.249 1.00 0.00 C ATOM 777 CE3 TRP A 51 26.583 -9.705 -5.670 1.00 0.00 C ATOM 778 CZ2 TRP A 51 27.641 -8.683 -3.257 1.00 0.00 C ATOM 779 CZ3 TRP A 51 25.762 -9.192 -4.684 1.00 0.00 C ATOM 780 CH2 TRP A 51 26.293 -8.685 -3.490 1.00 0.00 C ATOM 0 H TRP A 51 28.871 -11.428 -9.967 1.00 0.00 H new ATOM 0 HA TRP A 51 27.161 -10.028 -8.309 1.00 0.00 H new ATOM 0 HB2 TRP A 51 28.642 -11.785 -7.516 1.00 0.00 H new ATOM 0 HB3 TRP A 51 30.064 -10.869 -7.974 1.00 0.00 H new ATOM 0 HD1 TRP A 51 31.211 -10.111 -5.783 1.00 0.00 H new ATOM 0 HE1 TRP A 51 30.475 -9.034 -3.549 1.00 0.00 H new ATOM 0 HE3 TRP A 51 26.164 -10.091 -6.588 1.00 0.00 H new ATOM 0 HZ2 TRP A 51 28.048 -8.294 -2.335 1.00 0.00 H new ATOM 0 HZ3 TRP A 51 24.693 -9.182 -4.836 1.00 0.00 H new ATOM 0 HH2 TRP A 51 25.625 -8.288 -2.740 1.00 0.00 H new ATOM 791 N GLY A 52 29.864 -8.270 -9.071 1.00 0.00 N ATOM 792 CA GLY A 52 30.378 -6.913 -9.116 1.00 0.00 C ATOM 793 C GLY A 52 29.397 -5.942 -9.742 1.00 0.00 C ATOM 794 O GLY A 52 29.143 -4.869 -9.196 1.00 0.00 O ATOM 0 H GLY A 52 30.504 -8.983 -9.422 1.00 0.00 H new ATOM 0 HA2 GLY A 52 30.615 -6.584 -8.104 1.00 0.00 H new ATOM 0 HA3 GLY A 52 31.309 -6.899 -9.682 1.00 0.00 H new ATOM 798 N GLN A 53 28.846 -6.318 -10.891 1.00 0.00 N ATOM 799 CA GLN A 53 27.889 -5.470 -11.593 1.00 0.00 C ATOM 800 C GLN A 53 26.804 -4.973 -10.643 1.00 0.00 C ATOM 801 O GLN A 53 26.359 -3.829 -10.739 1.00 0.00 O ATOM 802 CB GLN A 53 27.254 -6.236 -12.755 1.00 0.00 C ATOM 803 CG GLN A 53 28.162 -6.364 -13.967 1.00 0.00 C ATOM 804 CD GLN A 53 27.869 -5.323 -15.030 1.00 0.00 C ATOM 805 OE1 GLN A 53 28.268 -4.164 -14.907 1.00 0.00 O ATOM 806 NE2 GLN A 53 27.167 -5.731 -16.081 1.00 0.00 N ATOM 0 H GLN A 53 29.045 -7.204 -11.356 1.00 0.00 H new ATOM 0 HA GLN A 53 28.426 -4.607 -11.986 1.00 0.00 H new ATOM 0 HB2 GLN A 53 26.975 -7.233 -12.413 1.00 0.00 H new ATOM 0 HB3 GLN A 53 26.334 -5.732 -13.052 1.00 0.00 H new ATOM 0 HG2 GLN A 53 29.201 -6.271 -13.649 1.00 0.00 H new ATOM 0 HG3 GLN A 53 28.049 -7.359 -14.398 1.00 0.00 H new ATOM 0 HE21 GLN A 53 26.857 -6.701 -16.142 1.00 0.00 H new ATOM 0 HE22 GLN A 53 26.938 -5.075 -16.827 1.00 0.00 H new ATOM 815 N ARG A 54 26.382 -5.839 -9.728 1.00 0.00 N ATOM 816 CA ARG A 54 25.348 -5.488 -8.762 1.00 0.00 C ATOM 817 C ARG A 54 25.885 -4.506 -7.725 1.00 0.00 C ATOM 818 O ARG A 54 25.200 -3.558 -7.339 1.00 0.00 O ATOM 819 CB ARG A 54 24.822 -6.745 -8.067 1.00 0.00 C ATOM 820 CG ARG A 54 24.745 -7.959 -8.979 1.00 0.00 C ATOM 821 CD ARG A 54 23.980 -7.648 -10.256 1.00 0.00 C ATOM 822 NE ARG A 54 22.568 -8.006 -10.148 1.00 0.00 N ATOM 823 CZ ARG A 54 21.666 -7.729 -11.084 1.00 0.00 C ATOM 824 NH1 ARG A 54 22.027 -7.095 -12.190 1.00 0.00 N ATOM 825 NH2 ARG A 54 20.400 -8.087 -10.913 1.00 0.00 N ATOM 0 H ARG A 54 26.740 -6.789 -9.635 1.00 0.00 H new ATOM 0 HA ARG A 54 24.529 -5.010 -9.300 1.00 0.00 H new ATOM 0 HB2 ARG A 54 25.467 -6.978 -7.220 1.00 0.00 H new ATOM 0 HB3 ARG A 54 23.830 -6.539 -7.665 1.00 0.00 H new ATOM 0 HG2 ARG A 54 25.752 -8.292 -9.229 1.00 0.00 H new ATOM 0 HG3 ARG A 54 24.259 -8.781 -8.453 1.00 0.00 H new ATOM 0 HD2 ARG A 54 24.068 -6.585 -10.482 1.00 0.00 H new ATOM 0 HD3 ARG A 54 24.429 -8.190 -11.089 1.00 0.00 H new ATOM 0 HE ARG A 54 22.257 -8.495 -9.309 1.00 0.00 H new ATOM 0 HH11 ARG A 54 22.999 -6.818 -12.325 1.00 0.00 H new ATOM 0 HH12 ARG A 54 21.333 -6.884 -12.907 1.00 0.00 H new ATOM 0 HH21 ARG A 54 20.118 -8.575 -10.063 1.00 0.00 H new ATOM 0 HH22 ARG A 54 19.708 -7.874 -11.632 1.00 0.00 H new ATOM 839 N LYS A 55 27.113 -4.741 -7.276 1.00 0.00 N ATOM 840 CA LYS A 55 27.743 -3.878 -6.283 1.00 0.00 C ATOM 841 C LYS A 55 28.430 -2.691 -6.952 1.00 0.00 C ATOM 842 O LYS A 55 28.978 -1.818 -6.278 1.00 0.00 O ATOM 843 CB LYS A 55 28.760 -4.672 -5.459 1.00 0.00 C ATOM 844 CG LYS A 55 28.127 -5.714 -4.553 1.00 0.00 C ATOM 845 CD LYS A 55 28.110 -5.256 -3.104 1.00 0.00 C ATOM 846 CE LYS A 55 26.879 -4.417 -2.799 1.00 0.00 C ATOM 847 NZ LYS A 55 27.160 -2.959 -2.909 1.00 0.00 N ATOM 0 H LYS A 55 27.692 -5.522 -7.584 1.00 0.00 H new ATOM 0 HA LYS A 55 26.965 -3.499 -5.621 1.00 0.00 H new ATOM 0 HB2 LYS A 55 29.457 -5.166 -6.136 1.00 0.00 H new ATOM 0 HB3 LYS A 55 29.343 -3.980 -4.851 1.00 0.00 H new ATOM 0 HG2 LYS A 55 27.108 -5.915 -4.884 1.00 0.00 H new ATOM 0 HG3 LYS A 55 28.679 -6.651 -4.633 1.00 0.00 H new ATOM 0 HD2 LYS A 55 28.131 -6.125 -2.446 1.00 0.00 H new ATOM 0 HD3 LYS A 55 29.008 -4.675 -2.894 1.00 0.00 H new ATOM 0 HE2 LYS A 55 26.077 -4.685 -3.487 1.00 0.00 H new ATOM 0 HE3 LYS A 55 26.525 -4.644 -1.793 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 26.265 -2.440 -3.015 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 27.649 -2.634 -2.051 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 27.763 -2.783 -3.738 1.00 0.00 H new ATOM 861 N LYS A 56 28.396 -2.665 -8.280 1.00 0.00 N ATOM 862 CA LYS A 56 29.012 -1.584 -9.040 1.00 0.00 C ATOM 863 C LYS A 56 30.464 -1.380 -8.617 1.00 0.00 C ATOM 864 O LYS A 56 30.985 -0.267 -8.669 1.00 0.00 O ATOM 865 CB LYS A 56 28.227 -0.285 -8.847 1.00 0.00 C ATOM 866 CG LYS A 56 27.381 0.099 -10.049 1.00 0.00 C ATOM 867 CD LYS A 56 27.679 1.515 -10.512 1.00 0.00 C ATOM 868 CE LYS A 56 27.337 1.706 -11.981 1.00 0.00 C ATOM 869 NZ LYS A 56 27.912 2.967 -12.526 1.00 0.00 N ATOM 0 H LYS A 56 27.948 -3.381 -8.852 1.00 0.00 H new ATOM 0 HA LYS A 56 28.994 -1.859 -10.095 1.00 0.00 H new ATOM 0 HB2 LYS A 56 27.580 -0.387 -7.976 1.00 0.00 H new ATOM 0 HB3 LYS A 56 28.926 0.523 -8.632 1.00 0.00 H new ATOM 0 HG2 LYS A 56 27.569 -0.599 -10.865 1.00 0.00 H new ATOM 0 HG3 LYS A 56 26.325 0.014 -9.794 1.00 0.00 H new ATOM 0 HD2 LYS A 56 27.109 2.223 -9.910 1.00 0.00 H new ATOM 0 HD3 LYS A 56 28.734 1.737 -10.351 1.00 0.00 H new ATOM 0 HE2 LYS A 56 27.712 0.858 -12.554 1.00 0.00 H new ATOM 0 HE3 LYS A 56 26.254 1.719 -12.103 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 27.656 3.060 -13.530 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 27.534 3.778 -11.996 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 28.948 2.945 -12.433 1.00 0.00 H new ATOM 883 N ASN A 57 31.111 -2.463 -8.199 1.00 0.00 N ATOM 884 CA ASN A 57 32.503 -2.403 -7.768 1.00 0.00 C ATOM 885 C ASN A 57 33.397 -1.876 -8.887 1.00 0.00 C ATOM 886 O ASN A 57 33.637 -0.673 -8.989 1.00 0.00 O ATOM 887 CB ASN A 57 32.983 -3.787 -7.326 1.00 0.00 C ATOM 888 CG ASN A 57 34.488 -3.849 -7.153 1.00 0.00 C ATOM 889 OD1 ASN A 57 35.170 -2.825 -7.183 1.00 0.00 O ATOM 890 ND2 ASN A 57 35.013 -5.055 -6.970 1.00 0.00 N ATOM 0 H ASN A 57 30.694 -3.392 -8.150 1.00 0.00 H new ATOM 0 HA ASN A 57 32.566 -1.717 -6.923 1.00 0.00 H new ATOM 0 HB2 ASN A 57 32.501 -4.052 -6.385 1.00 0.00 H new ATOM 0 HB3 ASN A 57 32.674 -4.528 -8.063 1.00 0.00 H new ATOM 0 HD21 ASN A 57 36.020 -5.159 -6.847 1.00 0.00 H new ATOM 0 HD22 ASN A 57 34.409 -5.877 -6.952 1.00 0.00 H new ATOM 897 N ASP A 58 33.886 -2.785 -9.723 1.00 0.00 N ATOM 898 CA ASP A 58 34.751 -2.413 -10.836 1.00 0.00 C ATOM 899 C ASP A 58 35.158 -3.642 -11.643 1.00 0.00 C ATOM 900 O ASP A 58 34.939 -3.702 -12.853 1.00 0.00 O ATOM 901 CB ASP A 58 35.998 -1.691 -10.321 1.00 0.00 C ATOM 902 CG ASP A 58 37.066 -1.548 -11.387 1.00 0.00 C ATOM 903 OD1 ASP A 58 36.750 -1.030 -12.479 1.00 0.00 O ATOM 904 OD2 ASP A 58 38.219 -1.954 -11.130 1.00 0.00 O ATOM 0 H ASP A 58 33.698 -3.785 -9.651 1.00 0.00 H new ATOM 0 HA ASP A 58 34.193 -1.741 -11.488 1.00 0.00 H new ATOM 0 HB2 ASP A 58 35.718 -0.703 -9.957 1.00 0.00 H new ATOM 0 HB3 ASP A 58 36.407 -2.239 -9.472 1.00 0.00 H new ATOM 909 N ARG A 59 35.751 -4.619 -10.965 1.00 0.00 N ATOM 910 CA ARG A 59 36.190 -5.846 -11.620 1.00 0.00 C ATOM 911 C ARG A 59 36.127 -7.028 -10.657 1.00 0.00 C ATOM 912 O ARG A 59 36.993 -7.902 -10.675 1.00 0.00 O ATOM 913 CB ARG A 59 37.614 -5.683 -12.153 1.00 0.00 C ATOM 914 CG ARG A 59 38.687 -5.887 -11.096 1.00 0.00 C ATOM 915 CD ARG A 59 39.941 -5.088 -11.413 1.00 0.00 C ATOM 916 NE ARG A 59 41.128 -5.936 -11.482 1.00 0.00 N ATOM 917 CZ ARG A 59 42.342 -5.479 -11.768 1.00 0.00 C ATOM 918 NH1 ARG A 59 42.529 -4.189 -12.010 1.00 0.00 N ATOM 919 NH2 ARG A 59 43.373 -6.313 -11.811 1.00 0.00 N ATOM 0 H ARG A 59 35.939 -4.585 -9.963 1.00 0.00 H new ATOM 0 HA ARG A 59 35.518 -6.044 -12.455 1.00 0.00 H new ATOM 0 HB2 ARG A 59 37.774 -6.395 -12.963 1.00 0.00 H new ATOM 0 HB3 ARG A 59 37.721 -4.686 -12.580 1.00 0.00 H new ATOM 0 HG2 ARG A 59 38.301 -5.588 -10.122 1.00 0.00 H new ATOM 0 HG3 ARG A 59 38.936 -6.946 -11.029 1.00 0.00 H new ATOM 0 HD2 ARG A 59 39.810 -4.570 -12.363 1.00 0.00 H new ATOM 0 HD3 ARG A 59 40.086 -4.323 -10.650 1.00 0.00 H new ATOM 0 HE ARG A 59 41.019 -6.934 -11.301 1.00 0.00 H new ATOM 0 HH11 ARG A 59 41.739 -3.544 -11.977 1.00 0.00 H new ATOM 0 HH12 ARG A 59 43.463 -3.841 -12.229 1.00 0.00 H new ATOM 0 HH21 ARG A 59 43.234 -7.306 -11.624 1.00 0.00 H new ATOM 0 HH22 ARG A 59 44.305 -5.961 -12.031 1.00 0.00 H new ATOM 933 N MET A 60 35.098 -7.047 -9.816 1.00 0.00 N ATOM 934 CA MET A 60 34.923 -8.122 -8.847 1.00 0.00 C ATOM 935 C MET A 60 35.405 -9.452 -9.417 1.00 0.00 C ATOM 936 O MET A 60 35.192 -9.749 -10.593 1.00 0.00 O ATOM 937 CB MET A 60 33.454 -8.232 -8.435 1.00 0.00 C ATOM 938 CG MET A 60 33.124 -9.520 -7.698 1.00 0.00 C ATOM 939 SD MET A 60 33.778 -9.545 -6.018 1.00 0.00 S ATOM 940 CE MET A 60 32.920 -8.147 -5.300 1.00 0.00 C ATOM 0 H MET A 60 34.373 -6.330 -9.786 1.00 0.00 H new ATOM 0 HA MET A 60 35.522 -7.886 -7.968 1.00 0.00 H new ATOM 0 HB2 MET A 60 33.199 -7.384 -7.800 1.00 0.00 H new ATOM 0 HB3 MET A 60 32.829 -8.162 -9.325 1.00 0.00 H new ATOM 0 HG2 MET A 60 32.042 -9.648 -7.665 1.00 0.00 H new ATOM 0 HG3 MET A 60 33.528 -10.366 -8.254 1.00 0.00 H new ATOM 0 HE1 MET A 60 32.493 -8.436 -4.340 1.00 0.00 H new ATOM 0 HE2 MET A 60 33.622 -7.326 -5.153 1.00 0.00 H new ATOM 0 HE3 MET A 60 32.122 -7.827 -5.970 1.00 0.00 H new ATOM 950 N THR A 61 36.056 -10.250 -8.576 1.00 0.00 N ATOM 951 CA THR A 61 36.569 -11.547 -8.996 1.00 0.00 C ATOM 952 C THR A 61 36.340 -12.604 -7.922 1.00 0.00 C ATOM 953 O THR A 61 36.466 -12.327 -6.728 1.00 0.00 O ATOM 954 CB THR A 61 38.074 -11.478 -9.320 1.00 0.00 C ATOM 955 OG1 THR A 61 38.840 -11.835 -8.164 1.00 0.00 O ATOM 956 CG2 THR A 61 38.464 -10.083 -9.782 1.00 0.00 C ATOM 0 H THR A 61 36.240 -10.020 -7.600 1.00 0.00 H new ATOM 0 HA THR A 61 36.023 -11.825 -9.897 1.00 0.00 H new ATOM 0 HB THR A 61 38.283 -12.182 -10.126 1.00 0.00 H new ATOM 0 HG1 THR A 61 39.795 -11.790 -8.378 1.00 0.00 H new ATOM 0 HG21 THR A 61 39.531 -10.058 -10.005 1.00 0.00 H new ATOM 0 HG22 THR A 61 37.900 -9.826 -10.678 1.00 0.00 H new ATOM 0 HG23 THR A 61 38.241 -9.363 -8.994 1.00 0.00 H new ATOM 964 N TYR A 62 36.004 -13.815 -8.352 1.00 0.00 N ATOM 965 CA TYR A 62 35.756 -14.913 -7.425 1.00 0.00 C ATOM 966 C TYR A 62 36.717 -14.856 -6.242 1.00 0.00 C ATOM 967 O TYR A 62 36.369 -15.241 -5.126 1.00 0.00 O ATOM 968 CB TYR A 62 35.894 -16.256 -8.144 1.00 0.00 C ATOM 969 CG TYR A 62 35.264 -17.410 -7.399 1.00 0.00 C ATOM 970 CD1 TYR A 62 33.958 -17.331 -6.931 1.00 0.00 C ATOM 971 CD2 TYR A 62 35.974 -18.581 -7.162 1.00 0.00 C ATOM 972 CE1 TYR A 62 33.378 -18.382 -6.249 1.00 0.00 C ATOM 973 CE2 TYR A 62 35.401 -19.639 -6.482 1.00 0.00 C ATOM 974 CZ TYR A 62 34.103 -19.534 -6.027 1.00 0.00 C ATOM 975 OH TYR A 62 33.529 -20.585 -5.349 1.00 0.00 O ATOM 0 H TYR A 62 35.897 -14.061 -9.336 1.00 0.00 H new ATOM 0 HA TYR A 62 34.738 -14.813 -7.048 1.00 0.00 H new ATOM 0 HB2 TYR A 62 35.437 -16.179 -9.131 1.00 0.00 H new ATOM 0 HB3 TYR A 62 36.952 -16.469 -8.298 1.00 0.00 H new ATOM 0 HD1 TYR A 62 33.386 -16.431 -7.104 1.00 0.00 H new ATOM 0 HD2 TYR A 62 36.991 -18.666 -7.515 1.00 0.00 H new ATOM 0 HE1 TYR A 62 32.362 -18.302 -5.891 1.00 0.00 H new ATOM 0 HE2 TYR A 62 35.966 -20.543 -6.308 1.00 0.00 H new ATOM 0 HH TYR A 62 33.108 -20.254 -4.528 1.00 0.00 H new ATOM 985 N GLU A 63 37.929 -14.371 -6.495 1.00 0.00 N ATOM 986 CA GLU A 63 38.941 -14.263 -5.451 1.00 0.00 C ATOM 987 C GLU A 63 38.472 -13.338 -4.332 1.00 0.00 C ATOM 988 O GLU A 63 38.579 -13.670 -3.151 1.00 0.00 O ATOM 989 CB GLU A 63 40.257 -13.746 -6.037 1.00 0.00 C ATOM 990 CG GLU A 63 41.462 -14.596 -5.670 1.00 0.00 C ATOM 991 CD GLU A 63 42.748 -14.082 -6.288 1.00 0.00 C ATOM 992 OE1 GLU A 63 42.986 -12.858 -6.229 1.00 0.00 O ATOM 993 OE2 GLU A 63 43.515 -14.904 -6.832 1.00 0.00 O ATOM 0 H GLU A 63 38.233 -14.047 -7.413 1.00 0.00 H new ATOM 0 HA GLU A 63 39.103 -15.257 -5.034 1.00 0.00 H new ATOM 0 HB2 GLU A 63 40.170 -13.704 -7.123 1.00 0.00 H new ATOM 0 HB3 GLU A 63 40.423 -12.726 -5.691 1.00 0.00 H new ATOM 0 HG2 GLU A 63 41.569 -14.620 -4.585 1.00 0.00 H new ATOM 0 HG3 GLU A 63 41.291 -15.622 -5.996 1.00 0.00 H new ATOM 1000 N LYS A 64 37.952 -12.176 -4.712 1.00 0.00 N ATOM 1001 CA LYS A 64 37.466 -11.202 -3.742 1.00 0.00 C ATOM 1002 C LYS A 64 36.065 -11.566 -3.261 1.00 0.00 C ATOM 1003 O LYS A 64 35.725 -11.359 -2.095 1.00 0.00 O ATOM 1004 CB LYS A 64 37.456 -9.800 -4.358 1.00 0.00 C ATOM 1005 CG LYS A 64 38.713 -9.474 -5.146 1.00 0.00 C ATOM 1006 CD LYS A 64 38.463 -8.372 -6.162 1.00 0.00 C ATOM 1007 CE LYS A 64 37.916 -7.117 -5.500 1.00 0.00 C ATOM 1008 NZ LYS A 64 38.835 -5.957 -5.664 1.00 0.00 N ATOM 0 H LYS A 64 37.856 -11.886 -5.685 1.00 0.00 H new ATOM 0 HA LYS A 64 38.140 -11.212 -2.885 1.00 0.00 H new ATOM 0 HB2 LYS A 64 36.591 -9.707 -5.015 1.00 0.00 H new ATOM 0 HB3 LYS A 64 37.334 -9.064 -3.563 1.00 0.00 H new ATOM 0 HG2 LYS A 64 39.503 -9.167 -4.461 1.00 0.00 H new ATOM 0 HG3 LYS A 64 39.065 -10.369 -5.658 1.00 0.00 H new ATOM 0 HD2 LYS A 64 39.392 -8.136 -6.680 1.00 0.00 H new ATOM 0 HD3 LYS A 64 37.758 -8.724 -6.916 1.00 0.00 H new ATOM 0 HE2 LYS A 64 36.944 -6.874 -5.930 1.00 0.00 H new ATOM 0 HE3 LYS A 64 37.757 -7.307 -4.439 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 38.426 -5.122 -5.199 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 39.754 -6.179 -5.231 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 38.967 -5.759 -6.676 1.00 0.00 H new ATOM 1022 N LEU A 65 35.257 -12.111 -4.164 1.00 0.00 N ATOM 1023 CA LEU A 65 33.893 -12.507 -3.830 1.00 0.00 C ATOM 1024 C LEU A 65 33.887 -13.594 -2.761 1.00 0.00 C ATOM 1025 O LEU A 65 33.091 -13.552 -1.823 1.00 0.00 O ATOM 1026 CB LEU A 65 33.165 -13.002 -5.081 1.00 0.00 C ATOM 1027 CG LEU A 65 31.713 -13.441 -4.883 1.00 0.00 C ATOM 1028 CD1 LEU A 65 30.840 -12.926 -6.016 1.00 0.00 C ATOM 1029 CD2 LEU A 65 31.624 -14.957 -4.784 1.00 0.00 C ATOM 0 H LEU A 65 35.523 -12.289 -5.133 1.00 0.00 H new ATOM 0 HA LEU A 65 33.374 -11.634 -3.436 1.00 0.00 H new ATOM 0 HB2 LEU A 65 33.185 -12.207 -5.827 1.00 0.00 H new ATOM 0 HB3 LEU A 65 33.724 -13.841 -5.494 1.00 0.00 H new ATOM 0 HG LEU A 65 31.348 -13.014 -3.949 1.00 0.00 H new ATOM 0 HD11 LEU A 65 29.811 -13.248 -5.858 1.00 0.00 H new ATOM 0 HD12 LEU A 65 30.880 -11.837 -6.040 1.00 0.00 H new ATOM 0 HD13 LEU A 65 31.203 -13.323 -6.964 1.00 0.00 H new ATOM 0 HD21 LEU A 65 30.584 -15.252 -4.643 1.00 0.00 H new ATOM 0 HD22 LEU A 65 32.007 -15.405 -5.701 1.00 0.00 H new ATOM 0 HD23 LEU A 65 32.217 -15.302 -3.937 1.00 0.00 H new ATOM 1041 N SER A 66 34.782 -14.566 -2.907 1.00 0.00 N ATOM 1042 CA SER A 66 34.879 -15.665 -1.954 1.00 0.00 C ATOM 1043 C SER A 66 35.070 -15.139 -0.535 1.00 0.00 C ATOM 1044 O SER A 66 34.628 -15.759 0.433 1.00 0.00 O ATOM 1045 CB SER A 66 36.039 -16.590 -2.328 1.00 0.00 C ATOM 1046 OG SER A 66 37.278 -16.055 -1.894 1.00 0.00 O ATOM 0 H SER A 66 35.450 -14.615 -3.676 1.00 0.00 H new ATOM 0 HA SER A 66 33.947 -16.229 -1.991 1.00 0.00 H new ATOM 0 HB2 SER A 66 35.885 -17.571 -1.879 1.00 0.00 H new ATOM 0 HB3 SER A 66 36.060 -16.734 -3.408 1.00 0.00 H new ATOM 0 HG SER A 66 37.504 -15.271 -2.437 1.00 0.00 H new ATOM 1052 N ARG A 67 35.730 -13.992 -0.420 1.00 0.00 N ATOM 1053 CA ARG A 67 35.980 -13.382 0.880 1.00 0.00 C ATOM 1054 C ARG A 67 34.710 -13.362 1.726 1.00 0.00 C ATOM 1055 O ARG A 67 34.734 -13.704 2.908 1.00 0.00 O ATOM 1056 CB ARG A 67 36.511 -11.958 0.706 1.00 0.00 C ATOM 1057 CG ARG A 67 35.423 -10.897 0.715 1.00 0.00 C ATOM 1058 CD ARG A 67 36.002 -9.503 0.527 1.00 0.00 C ATOM 1059 NE ARG A 67 35.096 -8.464 1.008 1.00 0.00 N ATOM 1060 CZ ARG A 67 35.370 -7.166 0.951 1.00 0.00 C ATOM 1061 NH1 ARG A 67 36.519 -6.749 0.438 1.00 0.00 N ATOM 1062 NH2 ARG A 67 34.494 -6.281 1.409 1.00 0.00 N ATOM 0 H ARG A 67 36.101 -13.466 -1.211 1.00 0.00 H new ATOM 0 HA ARG A 67 36.730 -13.982 1.395 1.00 0.00 H new ATOM 0 HB2 ARG A 67 37.222 -11.744 1.504 1.00 0.00 H new ATOM 0 HB3 ARG A 67 37.059 -11.896 -0.234 1.00 0.00 H new ATOM 0 HG2 ARG A 67 34.705 -11.104 -0.079 1.00 0.00 H new ATOM 0 HG3 ARG A 67 34.878 -10.942 1.658 1.00 0.00 H new ATOM 0 HD2 ARG A 67 36.951 -9.430 1.058 1.00 0.00 H new ATOM 0 HD3 ARG A 67 36.214 -9.338 -0.529 1.00 0.00 H new ATOM 0 HE ARG A 67 34.204 -8.751 1.410 1.00 0.00 H new ATOM 0 HH11 ARG A 67 37.196 -7.426 0.086 1.00 0.00 H new ATOM 0 HH12 ARG A 67 36.726 -5.751 0.396 1.00 0.00 H new ATOM 0 HH21 ARG A 67 33.609 -6.597 1.805 1.00 0.00 H new ATOM 0 HH22 ARG A 67 34.706 -5.284 1.365 1.00 0.00 H new ATOM 1076 N ALA A 68 33.603 -12.960 1.111 1.00 0.00 N ATOM 1077 CA ALA A 68 32.323 -12.897 1.806 1.00 0.00 C ATOM 1078 C ALA A 68 31.748 -14.293 2.025 1.00 0.00 C ATOM 1079 O ALA A 68 31.165 -14.578 3.072 1.00 0.00 O ATOM 1080 CB ALA A 68 31.341 -12.036 1.026 1.00 0.00 C ATOM 0 H ALA A 68 33.567 -12.673 0.133 1.00 0.00 H new ATOM 0 HA ALA A 68 32.490 -12.444 2.783 1.00 0.00 H new ATOM 0 HB1 ALA A 68 30.390 -11.998 1.556 1.00 0.00 H new ATOM 0 HB2 ALA A 68 31.741 -11.027 0.926 1.00 0.00 H new ATOM 0 HB3 ALA A 68 31.187 -12.465 0.036 1.00 0.00 H new ATOM 1086 N LEU A 69 31.915 -15.158 1.031 1.00 0.00 N ATOM 1087 CA LEU A 69 31.411 -16.525 1.114 1.00 0.00 C ATOM 1088 C LEU A 69 31.872 -17.198 2.403 1.00 0.00 C ATOM 1089 O LEU A 69 31.099 -17.893 3.063 1.00 0.00 O ATOM 1090 CB LEU A 69 31.880 -17.337 -0.094 1.00 0.00 C ATOM 1091 CG LEU A 69 31.391 -16.853 -1.460 1.00 0.00 C ATOM 1092 CD1 LEU A 69 31.926 -17.748 -2.567 1.00 0.00 C ATOM 1093 CD2 LEU A 69 29.871 -16.807 -1.496 1.00 0.00 C ATOM 0 H LEU A 69 32.395 -14.938 0.158 1.00 0.00 H new ATOM 0 HA LEU A 69 30.322 -16.485 1.116 1.00 0.00 H new ATOM 0 HB2 LEU A 69 32.970 -17.342 -0.102 1.00 0.00 H new ATOM 0 HB3 LEU A 69 31.557 -18.369 0.040 1.00 0.00 H new ATOM 0 HG LEU A 69 31.769 -15.844 -1.623 1.00 0.00 H new ATOM 0 HD11 LEU A 69 31.567 -17.388 -3.531 1.00 0.00 H new ATOM 0 HD12 LEU A 69 33.016 -17.729 -2.555 1.00 0.00 H new ATOM 0 HD13 LEU A 69 31.579 -18.769 -2.409 1.00 0.00 H new ATOM 0 HD21 LEU A 69 29.541 -16.460 -2.475 1.00 0.00 H new ATOM 0 HD22 LEU A 69 29.472 -17.804 -1.310 1.00 0.00 H new ATOM 0 HD23 LEU A 69 29.509 -16.123 -0.728 1.00 0.00 H new ATOM 1105 N ARG A 70 33.135 -16.984 2.757 1.00 0.00 N ATOM 1106 CA ARG A 70 33.698 -17.569 3.968 1.00 0.00 C ATOM 1107 C ARG A 70 33.370 -16.714 5.188 1.00 0.00 C ATOM 1108 O ARG A 70 33.401 -17.194 6.322 1.00 0.00 O ATOM 1109 CB ARG A 70 35.215 -17.718 3.830 1.00 0.00 C ATOM 1110 CG ARG A 70 35.634 -18.704 2.752 1.00 0.00 C ATOM 1111 CD ARG A 70 36.149 -20.002 3.354 1.00 0.00 C ATOM 1112 NE ARG A 70 37.576 -20.191 3.108 1.00 0.00 N ATOM 1113 CZ ARG A 70 38.092 -20.411 1.904 1.00 0.00 C ATOM 1114 NH1 ARG A 70 37.302 -20.470 0.842 1.00 0.00 N ATOM 1115 NH2 ARG A 70 39.401 -20.573 1.761 1.00 0.00 N ATOM 0 H ARG A 70 33.787 -16.410 2.223 1.00 0.00 H new ATOM 0 HA ARG A 70 33.253 -18.555 4.106 1.00 0.00 H new ATOM 0 HB2 ARG A 70 35.649 -16.743 3.607 1.00 0.00 H new ATOM 0 HB3 ARG A 70 35.628 -18.040 4.786 1.00 0.00 H new ATOM 0 HG2 ARG A 70 34.786 -18.915 2.101 1.00 0.00 H new ATOM 0 HG3 ARG A 70 36.410 -18.257 2.130 1.00 0.00 H new ATOM 0 HD2 ARG A 70 35.963 -20.002 4.428 1.00 0.00 H new ATOM 0 HD3 ARG A 70 35.594 -20.841 2.934 1.00 0.00 H new ATOM 0 HE ARG A 70 38.212 -20.152 3.905 1.00 0.00 H new ATOM 0 HH11 ARG A 70 36.295 -20.346 0.948 1.00 0.00 H new ATOM 0 HH12 ARG A 70 37.701 -20.639 -0.081 1.00 0.00 H new ATOM 0 HH21 ARG A 70 40.012 -20.529 2.576 1.00 0.00 H new ATOM 0 HH22 ARG A 70 39.796 -20.742 0.836 1.00 0.00 H new ATOM 1129 N TYR A 71 33.055 -15.446 4.948 1.00 0.00 N ATOM 1130 CA TYR A 71 32.724 -14.523 6.028 1.00 0.00 C ATOM 1131 C TYR A 71 31.328 -14.804 6.575 1.00 0.00 C ATOM 1132 O TYR A 71 31.034 -14.516 7.735 1.00 0.00 O ATOM 1133 CB TYR A 71 32.810 -13.078 5.535 1.00 0.00 C ATOM 1134 CG TYR A 71 32.634 -12.053 6.633 1.00 0.00 C ATOM 1135 CD1 TYR A 71 31.388 -11.821 7.201 1.00 0.00 C ATOM 1136 CD2 TYR A 71 33.715 -11.317 7.102 1.00 0.00 C ATOM 1137 CE1 TYR A 71 31.223 -10.885 8.204 1.00 0.00 C ATOM 1138 CE2 TYR A 71 33.560 -10.380 8.106 1.00 0.00 C ATOM 1139 CZ TYR A 71 32.312 -10.167 8.653 1.00 0.00 C ATOM 1140 OH TYR A 71 32.152 -9.235 9.652 1.00 0.00 O ATOM 0 H TYR A 71 33.022 -15.034 4.016 1.00 0.00 H new ATOM 0 HA TYR A 71 33.445 -14.669 6.832 1.00 0.00 H new ATOM 0 HB2 TYR A 71 33.777 -12.923 5.056 1.00 0.00 H new ATOM 0 HB3 TYR A 71 32.047 -12.917 4.773 1.00 0.00 H new ATOM 0 HD1 TYR A 71 30.533 -12.382 6.853 1.00 0.00 H new ATOM 0 HD2 TYR A 71 34.693 -11.480 6.675 1.00 0.00 H new ATOM 0 HE1 TYR A 71 30.247 -10.716 8.634 1.00 0.00 H new ATOM 0 HE2 TYR A 71 34.411 -9.818 8.460 1.00 0.00 H new ATOM 0 HH TYR A 71 33.016 -8.819 9.852 1.00 0.00 H new ATOM 1150 N TYR A 72 30.472 -15.369 5.731 1.00 0.00 N ATOM 1151 CA TYR A 72 29.105 -15.687 6.128 1.00 0.00 C ATOM 1152 C TYR A 72 29.084 -16.827 7.141 1.00 0.00 C ATOM 1153 O TYR A 72 28.142 -16.961 7.922 1.00 0.00 O ATOM 1154 CB TYR A 72 28.271 -16.064 4.902 1.00 0.00 C ATOM 1155 CG TYR A 72 27.772 -14.871 4.119 1.00 0.00 C ATOM 1156 CD1 TYR A 72 27.014 -13.880 4.732 1.00 0.00 C ATOM 1157 CD2 TYR A 72 28.058 -14.734 2.767 1.00 0.00 C ATOM 1158 CE1 TYR A 72 26.556 -12.789 4.020 1.00 0.00 C ATOM 1159 CE2 TYR A 72 27.605 -13.645 2.047 1.00 0.00 C ATOM 1160 CZ TYR A 72 26.854 -12.675 2.678 1.00 0.00 C ATOM 1161 OH TYR A 72 26.400 -11.589 1.966 1.00 0.00 O ATOM 0 H TYR A 72 30.700 -15.616 4.768 1.00 0.00 H new ATOM 0 HA TYR A 72 28.673 -14.802 6.595 1.00 0.00 H new ATOM 0 HB2 TYR A 72 28.870 -16.694 4.245 1.00 0.00 H new ATOM 0 HB3 TYR A 72 27.417 -16.660 5.223 1.00 0.00 H new ATOM 0 HD1 TYR A 72 26.779 -13.965 5.783 1.00 0.00 H new ATOM 0 HD2 TYR A 72 28.645 -15.492 2.269 1.00 0.00 H new ATOM 0 HE1 TYR A 72 25.967 -12.029 4.512 1.00 0.00 H new ATOM 0 HE2 TYR A 72 27.838 -13.554 0.996 1.00 0.00 H new ATOM 0 HH TYR A 72 27.144 -11.189 1.469 1.00 0.00 H new ATOM 1171 N TYR A 73 30.130 -17.646 7.123 1.00 0.00 N ATOM 1172 CA TYR A 73 30.232 -18.776 8.038 1.00 0.00 C ATOM 1173 C TYR A 73 30.267 -18.302 9.488 1.00 0.00 C ATOM 1174 O TYR A 73 30.192 -19.104 10.419 1.00 0.00 O ATOM 1175 CB TYR A 73 31.485 -19.598 7.729 1.00 0.00 C ATOM 1176 CG TYR A 73 31.486 -20.201 6.343 1.00 0.00 C ATOM 1177 CD1 TYR A 73 30.321 -20.712 5.784 1.00 0.00 C ATOM 1178 CD2 TYR A 73 32.653 -20.259 5.590 1.00 0.00 C ATOM 1179 CE1 TYR A 73 30.318 -21.264 4.518 1.00 0.00 C ATOM 1180 CE2 TYR A 73 32.659 -20.809 4.323 1.00 0.00 C ATOM 1181 CZ TYR A 73 31.490 -21.310 3.791 1.00 0.00 C ATOM 1182 OH TYR A 73 31.490 -21.859 2.529 1.00 0.00 O ATOM 0 H TYR A 73 30.919 -17.548 6.484 1.00 0.00 H new ATOM 0 HA TYR A 73 29.351 -19.402 7.900 1.00 0.00 H new ATOM 0 HB2 TYR A 73 32.363 -18.962 7.840 1.00 0.00 H new ATOM 0 HB3 TYR A 73 31.575 -20.398 8.464 1.00 0.00 H new ATOM 0 HD1 TYR A 73 29.402 -20.677 6.350 1.00 0.00 H new ATOM 0 HD2 TYR A 73 33.571 -19.867 6.003 1.00 0.00 H new ATOM 0 HE1 TYR A 73 29.403 -21.657 4.099 1.00 0.00 H new ATOM 0 HE2 TYR A 73 33.575 -20.846 3.752 1.00 0.00 H new ATOM 0 HH TYR A 73 31.502 -21.142 1.861 1.00 0.00 H new ATOM 1192 N LYS A 74 30.380 -16.991 9.672 1.00 0.00 N ATOM 1193 CA LYS A 74 30.423 -16.405 11.007 1.00 0.00 C ATOM 1194 C LYS A 74 29.038 -15.936 11.440 1.00 0.00 C ATOM 1195 O LYS A 74 28.731 -15.888 12.631 1.00 0.00 O ATOM 1196 CB LYS A 74 31.404 -15.231 11.040 1.00 0.00 C ATOM 1197 CG LYS A 74 32.696 -15.497 10.286 1.00 0.00 C ATOM 1198 CD LYS A 74 33.747 -14.444 10.594 1.00 0.00 C ATOM 1199 CE LYS A 74 35.004 -14.651 9.763 1.00 0.00 C ATOM 1200 NZ LYS A 74 35.285 -13.483 8.882 1.00 0.00 N ATOM 0 H LYS A 74 30.444 -16.313 8.912 1.00 0.00 H new ATOM 0 HA LYS A 74 30.761 -17.173 11.703 1.00 0.00 H new ATOM 0 HB2 LYS A 74 30.920 -14.352 10.615 1.00 0.00 H new ATOM 0 HB3 LYS A 74 31.641 -14.995 12.078 1.00 0.00 H new ATOM 0 HG2 LYS A 74 33.078 -16.483 10.553 1.00 0.00 H new ATOM 0 HG3 LYS A 74 32.497 -15.511 9.214 1.00 0.00 H new ATOM 0 HD2 LYS A 74 33.339 -13.453 10.397 1.00 0.00 H new ATOM 0 HD3 LYS A 74 34.000 -14.480 11.654 1.00 0.00 H new ATOM 0 HE2 LYS A 74 35.853 -14.819 10.425 1.00 0.00 H new ATOM 0 HE3 LYS A 74 34.893 -15.548 9.153 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 35.890 -13.783 8.091 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 34.390 -13.105 8.510 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 35.772 -12.745 9.429 1.00 0.00 H new ATOM 1214 N THR A 75 28.203 -15.592 10.464 1.00 0.00 N ATOM 1215 CA THR A 75 26.850 -15.128 10.745 1.00 0.00 C ATOM 1216 C THR A 75 25.836 -16.253 10.575 1.00 0.00 C ATOM 1217 O THR A 75 24.688 -16.138 11.003 1.00 0.00 O ATOM 1218 CB THR A 75 26.457 -13.956 9.826 1.00 0.00 C ATOM 1219 OG1 THR A 75 26.150 -14.443 8.515 1.00 0.00 O ATOM 1220 CG2 THR A 75 27.580 -12.933 9.742 1.00 0.00 C ATOM 0 H THR A 75 28.440 -15.626 9.473 1.00 0.00 H new ATOM 0 HA THR A 75 26.841 -14.788 11.781 1.00 0.00 H new ATOM 0 HB THR A 75 25.577 -13.472 10.249 1.00 0.00 H new ATOM 0 HG1 THR A 75 26.765 -15.170 8.284 1.00 0.00 H new ATOM 0 HG21 THR A 75 27.279 -12.115 9.087 1.00 0.00 H new ATOM 0 HG22 THR A 75 27.791 -12.542 10.737 1.00 0.00 H new ATOM 0 HG23 THR A 75 28.475 -13.408 9.341 1.00 0.00 H new ATOM 1228 N GLY A 76 26.268 -17.344 9.949 1.00 0.00 N ATOM 1229 CA GLY A 76 25.384 -18.475 9.735 1.00 0.00 C ATOM 1230 C GLY A 76 24.747 -18.461 8.359 1.00 0.00 C ATOM 1231 O GLY A 76 24.286 -19.493 7.871 1.00 0.00 O ATOM 0 H GLY A 76 27.214 -17.465 9.587 1.00 0.00 H new ATOM 0 HA2 GLY A 76 25.946 -19.400 9.863 1.00 0.00 H new ATOM 0 HA3 GLY A 76 24.602 -18.470 10.494 1.00 0.00 H new ATOM 1235 N ILE A 77 24.718 -17.289 7.734 1.00 0.00 N ATOM 1236 CA ILE A 77 24.132 -17.145 6.408 1.00 0.00 C ATOM 1237 C ILE A 77 24.508 -18.319 5.510 1.00 0.00 C ATOM 1238 O ILE A 77 23.659 -18.885 4.821 1.00 0.00 O ATOM 1239 CB ILE A 77 24.578 -15.834 5.734 1.00 0.00 C ATOM 1240 CG1 ILE A 77 23.948 -14.632 6.441 1.00 0.00 C ATOM 1241 CG2 ILE A 77 24.205 -15.843 4.259 1.00 0.00 C ATOM 1242 CD1 ILE A 77 22.480 -14.446 6.124 1.00 0.00 C ATOM 0 H ILE A 77 25.094 -16.425 8.125 1.00 0.00 H new ATOM 0 HA ILE A 77 23.050 -17.125 6.542 1.00 0.00 H new ATOM 0 HB ILE A 77 25.662 -15.752 5.814 1.00 0.00 H new ATOM 0 HG12 ILE A 77 24.067 -14.751 7.518 1.00 0.00 H new ATOM 0 HG13 ILE A 77 24.490 -13.729 6.158 1.00 0.00 H new ATOM 0 HG21 ILE A 77 24.527 -14.910 3.797 1.00 0.00 H new ATOM 0 HG22 ILE A 77 24.696 -16.681 3.765 1.00 0.00 H new ATOM 0 HG23 ILE A 77 23.124 -15.944 4.158 1.00 0.00 H new ATOM 0 HD11 ILE A 77 22.100 -13.576 6.659 1.00 0.00 H new ATOM 0 HD12 ILE A 77 22.356 -14.295 5.052 1.00 0.00 H new ATOM 0 HD13 ILE A 77 21.926 -15.333 6.432 1.00 0.00 H new ATOM 1254 N LEU A 78 25.787 -18.680 5.524 1.00 0.00 N ATOM 1255 CA LEU A 78 26.277 -19.788 4.712 1.00 0.00 C ATOM 1256 C LEU A 78 26.767 -20.933 5.592 1.00 0.00 C ATOM 1257 O LEU A 78 26.854 -20.797 6.812 1.00 0.00 O ATOM 1258 CB LEU A 78 27.407 -19.315 3.795 1.00 0.00 C ATOM 1259 CG LEU A 78 26.980 -18.757 2.437 1.00 0.00 C ATOM 1260 CD1 LEU A 78 28.166 -18.128 1.722 1.00 0.00 C ATOM 1261 CD2 LEU A 78 26.358 -19.851 1.582 1.00 0.00 C ATOM 0 H LEU A 78 26.502 -18.222 6.088 1.00 0.00 H new ATOM 0 HA LEU A 78 25.450 -20.151 4.101 1.00 0.00 H new ATOM 0 HB2 LEU A 78 27.975 -18.546 4.319 1.00 0.00 H new ATOM 0 HB3 LEU A 78 28.084 -20.152 3.625 1.00 0.00 H new ATOM 0 HG LEU A 78 26.230 -17.984 2.603 1.00 0.00 H new ATOM 0 HD11 LEU A 78 27.843 -17.736 0.757 1.00 0.00 H new ATOM 0 HD12 LEU A 78 28.567 -17.315 2.328 1.00 0.00 H new ATOM 0 HD13 LEU A 78 28.939 -18.881 1.568 1.00 0.00 H new ATOM 0 HD21 LEU A 78 26.060 -19.435 0.619 1.00 0.00 H new ATOM 0 HD22 LEU A 78 27.085 -20.647 1.424 1.00 0.00 H new ATOM 0 HD23 LEU A 78 25.482 -20.255 2.089 1.00 0.00 H new ATOM 1273 N GLU A 79 27.089 -22.060 4.965 1.00 0.00 N ATOM 1274 CA GLU A 79 27.572 -23.228 5.692 1.00 0.00 C ATOM 1275 C GLU A 79 28.853 -23.769 5.064 1.00 0.00 C ATOM 1276 O GLU A 79 28.896 -24.060 3.868 1.00 0.00 O ATOM 1277 CB GLU A 79 26.502 -24.321 5.716 1.00 0.00 C ATOM 1278 CG GLU A 79 25.686 -24.346 6.998 1.00 0.00 C ATOM 1279 CD GLU A 79 25.105 -25.715 7.292 1.00 0.00 C ATOM 1280 OE1 GLU A 79 25.892 -26.672 7.446 1.00 0.00 O ATOM 1281 OE2 GLU A 79 23.864 -25.829 7.369 1.00 0.00 O ATOM 0 H GLU A 79 27.024 -22.189 3.955 1.00 0.00 H new ATOM 0 HA GLU A 79 27.791 -22.921 6.715 1.00 0.00 H new ATOM 0 HB2 GLU A 79 25.830 -24.178 4.870 1.00 0.00 H new ATOM 0 HB3 GLU A 79 26.982 -25.290 5.582 1.00 0.00 H new ATOM 0 HG2 GLU A 79 26.316 -24.036 7.832 1.00 0.00 H new ATOM 0 HG3 GLU A 79 24.876 -23.620 6.923 1.00 0.00 H new ATOM 1288 N ARG A 80 29.896 -23.900 5.878 1.00 0.00 N ATOM 1289 CA ARG A 80 31.178 -24.404 5.402 1.00 0.00 C ATOM 1290 C ARG A 80 31.027 -25.800 4.806 1.00 0.00 C ATOM 1291 O ARG A 80 30.445 -26.691 5.426 1.00 0.00 O ATOM 1292 CB ARG A 80 32.195 -24.433 6.545 1.00 0.00 C ATOM 1293 CG ARG A 80 33.495 -23.715 6.222 1.00 0.00 C ATOM 1294 CD ARG A 80 34.120 -23.107 7.469 1.00 0.00 C ATOM 1295 NE ARG A 80 35.498 -23.552 7.662 1.00 0.00 N ATOM 1296 CZ ARG A 80 36.244 -23.200 8.703 1.00 0.00 C ATOM 1297 NH1 ARG A 80 35.748 -22.403 9.640 1.00 0.00 N ATOM 1298 NH2 ARG A 80 37.489 -23.645 8.809 1.00 0.00 N ATOM 0 H ARG A 80 29.878 -23.664 6.870 1.00 0.00 H new ATOM 0 HA ARG A 80 31.537 -23.732 4.622 1.00 0.00 H new ATOM 0 HB2 ARG A 80 31.748 -23.978 7.429 1.00 0.00 H new ATOM 0 HB3 ARG A 80 32.416 -25.470 6.797 1.00 0.00 H new ATOM 0 HG2 ARG A 80 34.195 -24.415 5.767 1.00 0.00 H new ATOM 0 HG3 ARG A 80 33.307 -22.931 5.489 1.00 0.00 H new ATOM 0 HD2 ARG A 80 34.097 -22.020 7.393 1.00 0.00 H new ATOM 0 HD3 ARG A 80 33.526 -23.378 8.342 1.00 0.00 H new ATOM 0 HE ARG A 80 35.909 -24.166 6.959 1.00 0.00 H new ATOM 0 HH11 ARG A 80 34.791 -22.059 9.562 1.00 0.00 H new ATOM 0 HH12 ARG A 80 36.323 -22.135 10.438 1.00 0.00 H new ATOM 0 HH21 ARG A 80 37.874 -24.258 8.091 1.00 0.00 H new ATOM 0 HH22 ARG A 80 38.061 -23.374 9.609 1.00 0.00 H new ATOM 1312 N VAL A 81 31.553 -25.983 3.600 1.00 0.00 N ATOM 1313 CA VAL A 81 31.477 -27.271 2.920 1.00 0.00 C ATOM 1314 C VAL A 81 32.868 -27.835 2.654 1.00 0.00 C ATOM 1315 O VAL A 81 33.805 -27.091 2.362 1.00 0.00 O ATOM 1316 CB VAL A 81 30.717 -27.157 1.585 1.00 0.00 C ATOM 1317 CG1 VAL A 81 30.570 -28.525 0.936 1.00 0.00 C ATOM 1318 CG2 VAL A 81 29.357 -26.511 1.800 1.00 0.00 C ATOM 0 H VAL A 81 32.037 -25.256 3.073 1.00 0.00 H new ATOM 0 HA VAL A 81 30.935 -27.947 3.582 1.00 0.00 H new ATOM 0 HB VAL A 81 31.293 -26.522 0.912 1.00 0.00 H new ATOM 0 HG11 VAL A 81 30.031 -28.425 -0.006 1.00 0.00 H new ATOM 0 HG12 VAL A 81 31.557 -28.945 0.746 1.00 0.00 H new ATOM 0 HG13 VAL A 81 30.016 -29.186 1.603 1.00 0.00 H new ATOM 0 HG21 VAL A 81 28.834 -26.438 0.847 1.00 0.00 H new ATOM 0 HG22 VAL A 81 28.771 -27.118 2.490 1.00 0.00 H new ATOM 0 HG23 VAL A 81 29.490 -25.513 2.218 1.00 0.00 H new ATOM 1328 N ASP A 82 32.995 -29.153 2.755 1.00 0.00 N ATOM 1329 CA ASP A 82 34.273 -29.818 2.523 1.00 0.00 C ATOM 1330 C ASP A 82 34.382 -30.297 1.079 1.00 0.00 C ATOM 1331 O ASP A 82 35.010 -31.318 0.799 1.00 0.00 O ATOM 1332 CB ASP A 82 34.437 -31.001 3.479 1.00 0.00 C ATOM 1333 CG ASP A 82 34.847 -30.566 4.873 1.00 0.00 C ATOM 1334 OD1 ASP A 82 33.955 -30.197 5.665 1.00 0.00 O ATOM 1335 OD2 ASP A 82 36.059 -30.595 5.171 1.00 0.00 O ATOM 0 H ASP A 82 32.229 -29.783 2.996 1.00 0.00 H new ATOM 0 HA ASP A 82 35.069 -29.097 2.709 1.00 0.00 H new ATOM 0 HB2 ASP A 82 33.498 -31.552 3.535 1.00 0.00 H new ATOM 0 HB3 ASP A 82 35.185 -31.686 3.080 1.00 0.00 H new ATOM 1340 N ARG A 83 33.766 -29.552 0.166 1.00 0.00 N ATOM 1341 CA ARG A 83 33.793 -29.902 -1.249 1.00 0.00 C ATOM 1342 C ARG A 83 34.450 -28.796 -2.070 1.00 0.00 C ATOM 1343 O ARG A 83 34.953 -27.816 -1.520 1.00 0.00 O ATOM 1344 CB ARG A 83 32.374 -30.157 -1.760 1.00 0.00 C ATOM 1345 CG ARG A 83 31.856 -31.552 -1.450 1.00 0.00 C ATOM 1346 CD ARG A 83 30.446 -31.510 -0.883 1.00 0.00 C ATOM 1347 NE ARG A 83 29.574 -32.500 -1.510 1.00 0.00 N ATOM 1348 CZ ARG A 83 29.570 -33.788 -1.183 1.00 0.00 C ATOM 1349 NH1 ARG A 83 30.387 -34.238 -0.241 1.00 0.00 N ATOM 1350 NH2 ARG A 83 28.748 -34.627 -1.799 1.00 0.00 N ATOM 0 H ARG A 83 33.243 -28.703 0.381 1.00 0.00 H new ATOM 0 HA ARG A 83 34.381 -30.813 -1.361 1.00 0.00 H new ATOM 0 HB2 ARG A 83 31.701 -29.422 -1.319 1.00 0.00 H new ATOM 0 HB3 ARG A 83 32.352 -30.002 -2.839 1.00 0.00 H new ATOM 0 HG2 ARG A 83 31.866 -32.155 -2.358 1.00 0.00 H new ATOM 0 HG3 ARG A 83 32.522 -32.038 -0.737 1.00 0.00 H new ATOM 0 HD2 ARG A 83 30.482 -31.688 0.192 1.00 0.00 H new ATOM 0 HD3 ARG A 83 30.027 -30.514 -1.028 1.00 0.00 H new ATOM 0 HE ARG A 83 28.933 -32.186 -2.239 1.00 0.00 H new ATOM 0 HH11 ARG A 83 31.020 -33.595 0.234 1.00 0.00 H new ATOM 0 HH12 ARG A 83 30.382 -35.227 0.008 1.00 0.00 H new ATOM 0 HH21 ARG A 83 28.118 -34.284 -2.524 1.00 0.00 H new ATOM 0 HH22 ARG A 83 28.746 -35.615 -1.547 1.00 0.00 H new ATOM 1364 N ARG A 84 34.441 -28.960 -3.389 1.00 0.00 N ATOM 1365 CA ARG A 84 35.037 -27.977 -4.285 1.00 0.00 C ATOM 1366 C ARG A 84 33.958 -27.183 -5.016 1.00 0.00 C ATOM 1367 O ARG A 84 33.054 -27.758 -5.625 1.00 0.00 O ATOM 1368 CB ARG A 84 35.951 -28.668 -5.299 1.00 0.00 C ATOM 1369 CG ARG A 84 36.713 -27.701 -6.190 1.00 0.00 C ATOM 1370 CD ARG A 84 38.055 -28.276 -6.616 1.00 0.00 C ATOM 1371 NE ARG A 84 37.920 -29.221 -7.721 1.00 0.00 N ATOM 1372 CZ ARG A 84 38.876 -30.068 -8.085 1.00 0.00 C ATOM 1373 NH1 ARG A 84 40.032 -30.087 -7.435 1.00 0.00 N ATOM 1374 NH2 ARG A 84 38.678 -30.898 -9.101 1.00 0.00 N ATOM 0 H ARG A 84 34.027 -29.764 -3.860 1.00 0.00 H new ATOM 0 HA ARG A 84 35.628 -27.286 -3.684 1.00 0.00 H new ATOM 0 HB2 ARG A 84 36.664 -29.295 -4.764 1.00 0.00 H new ATOM 0 HB3 ARG A 84 35.351 -29.329 -5.924 1.00 0.00 H new ATOM 0 HG2 ARG A 84 36.117 -27.472 -7.073 1.00 0.00 H new ATOM 0 HG3 ARG A 84 36.870 -26.762 -5.659 1.00 0.00 H new ATOM 0 HD2 ARG A 84 38.719 -27.464 -6.912 1.00 0.00 H new ATOM 0 HD3 ARG A 84 38.521 -28.776 -5.767 1.00 0.00 H new ATOM 0 HE ARG A 84 37.043 -29.231 -8.242 1.00 0.00 H new ATOM 0 HH11 ARG A 84 40.188 -29.450 -6.654 1.00 0.00 H new ATOM 0 HH12 ARG A 84 40.765 -30.738 -7.716 1.00 0.00 H new ATOM 0 HH21 ARG A 84 37.791 -30.886 -9.604 1.00 0.00 H new ATOM 0 HH22 ARG A 84 39.413 -31.548 -9.379 1.00 0.00 H new ATOM 1388 N LEU A 85 34.058 -25.860 -4.951 1.00 0.00 N ATOM 1389 CA LEU A 85 33.091 -24.986 -5.606 1.00 0.00 C ATOM 1390 C LEU A 85 31.664 -25.395 -5.256 1.00 0.00 C ATOM 1391 O LEU A 85 30.764 -25.323 -6.093 1.00 0.00 O ATOM 1392 CB LEU A 85 33.287 -25.023 -7.123 1.00 0.00 C ATOM 1393 CG LEU A 85 34.345 -24.073 -7.686 1.00 0.00 C ATOM 1394 CD1 LEU A 85 35.659 -24.234 -6.937 1.00 0.00 C ATOM 1395 CD2 LEU A 85 34.543 -24.319 -9.175 1.00 0.00 C ATOM 0 H LEU A 85 34.799 -25.369 -4.451 1.00 0.00 H new ATOM 0 HA LEU A 85 33.256 -23.969 -5.249 1.00 0.00 H new ATOM 0 HB2 LEU A 85 33.551 -26.041 -7.410 1.00 0.00 H new ATOM 0 HB3 LEU A 85 32.333 -24.795 -7.598 1.00 0.00 H new ATOM 0 HG LEU A 85 33.997 -23.049 -7.550 1.00 0.00 H new ATOM 0 HD11 LEU A 85 36.400 -23.550 -7.351 1.00 0.00 H new ATOM 0 HD12 LEU A 85 35.506 -24.008 -5.882 1.00 0.00 H new ATOM 0 HD13 LEU A 85 36.014 -25.259 -7.041 1.00 0.00 H new ATOM 0 HD21 LEU A 85 35.299 -23.635 -9.559 1.00 0.00 H new ATOM 0 HD22 LEU A 85 34.870 -25.347 -9.334 1.00 0.00 H new ATOM 0 HD23 LEU A 85 33.602 -24.152 -9.700 1.00 0.00 H new ATOM 1407 N VAL A 86 31.464 -25.821 -4.013 1.00 0.00 N ATOM 1408 CA VAL A 86 30.145 -26.237 -3.550 1.00 0.00 C ATOM 1409 C VAL A 86 29.812 -25.609 -2.202 1.00 0.00 C ATOM 1410 O VAL A 86 30.391 -25.971 -1.177 1.00 0.00 O ATOM 1411 CB VAL A 86 30.052 -27.770 -3.428 1.00 0.00 C ATOM 1412 CG1 VAL A 86 28.709 -28.178 -2.840 1.00 0.00 C ATOM 1413 CG2 VAL A 86 30.272 -28.427 -4.782 1.00 0.00 C ATOM 0 H VAL A 86 32.198 -25.887 -3.308 1.00 0.00 H new ATOM 0 HA VAL A 86 29.425 -25.894 -4.294 1.00 0.00 H new ATOM 0 HB VAL A 86 30.837 -28.112 -2.753 1.00 0.00 H new ATOM 0 HG11 VAL A 86 28.661 -29.264 -2.761 1.00 0.00 H new ATOM 0 HG12 VAL A 86 28.596 -27.737 -1.850 1.00 0.00 H new ATOM 0 HG13 VAL A 86 27.906 -27.826 -3.488 1.00 0.00 H new ATOM 0 HG21 VAL A 86 30.203 -29.510 -4.677 1.00 0.00 H new ATOM 0 HG22 VAL A 86 29.511 -28.081 -5.482 1.00 0.00 H new ATOM 0 HG23 VAL A 86 31.260 -28.162 -5.159 1.00 0.00 H new ATOM 1423 N TYR A 87 28.875 -24.668 -2.209 1.00 0.00 N ATOM 1424 CA TYR A 87 28.466 -23.987 -0.986 1.00 0.00 C ATOM 1425 C TYR A 87 27.055 -24.400 -0.580 1.00 0.00 C ATOM 1426 O TYR A 87 26.371 -25.119 -1.308 1.00 0.00 O ATOM 1427 CB TYR A 87 28.532 -22.471 -1.175 1.00 0.00 C ATOM 1428 CG TYR A 87 29.932 -21.949 -1.402 1.00 0.00 C ATOM 1429 CD1 TYR A 87 30.587 -22.162 -2.609 1.00 0.00 C ATOM 1430 CD2 TYR A 87 30.601 -21.243 -0.410 1.00 0.00 C ATOM 1431 CE1 TYR A 87 31.868 -21.688 -2.821 1.00 0.00 C ATOM 1432 CE2 TYR A 87 31.881 -20.764 -0.613 1.00 0.00 C ATOM 1433 CZ TYR A 87 32.510 -20.989 -1.820 1.00 0.00 C ATOM 1434 OH TYR A 87 33.785 -20.515 -2.026 1.00 0.00 O ATOM 0 H TYR A 87 28.384 -24.359 -3.048 1.00 0.00 H new ATOM 0 HA TYR A 87 29.153 -24.277 -0.191 1.00 0.00 H new ATOM 0 HB2 TYR A 87 27.907 -22.192 -2.023 1.00 0.00 H new ATOM 0 HB3 TYR A 87 28.110 -21.985 -0.295 1.00 0.00 H new ATOM 0 HD1 TYR A 87 30.086 -22.707 -3.395 1.00 0.00 H new ATOM 0 HD2 TYR A 87 30.112 -21.065 0.536 1.00 0.00 H new ATOM 0 HE1 TYR A 87 32.363 -21.864 -3.765 1.00 0.00 H new ATOM 0 HE2 TYR A 87 32.386 -20.216 0.169 1.00 0.00 H new ATOM 0 HH TYR A 87 34.093 -20.044 -1.223 1.00 0.00 H new ATOM 1444 N LYS A 88 26.624 -23.938 0.589 1.00 0.00 N ATOM 1445 CA LYS A 88 25.294 -24.255 1.094 1.00 0.00 C ATOM 1446 C LYS A 88 24.777 -23.144 2.003 1.00 0.00 C ATOM 1447 O LYS A 88 25.503 -22.644 2.863 1.00 0.00 O ATOM 1448 CB LYS A 88 25.318 -25.582 1.857 1.00 0.00 C ATOM 1449 CG LYS A 88 24.027 -25.881 2.598 1.00 0.00 C ATOM 1450 CD LYS A 88 24.267 -26.793 3.790 1.00 0.00 C ATOM 1451 CE LYS A 88 23.100 -27.745 4.007 1.00 0.00 C ATOM 1452 NZ LYS A 88 23.071 -28.278 5.397 1.00 0.00 N ATOM 0 H LYS A 88 27.177 -23.342 1.205 1.00 0.00 H new ATOM 0 HA LYS A 88 24.622 -24.345 0.241 1.00 0.00 H new ATOM 0 HB2 LYS A 88 25.520 -26.391 1.155 1.00 0.00 H new ATOM 0 HB3 LYS A 88 26.142 -25.566 2.571 1.00 0.00 H new ATOM 0 HG2 LYS A 88 23.577 -24.948 2.937 1.00 0.00 H new ATOM 0 HG3 LYS A 88 23.316 -26.349 1.918 1.00 0.00 H new ATOM 0 HD2 LYS A 88 25.181 -27.366 3.633 1.00 0.00 H new ATOM 0 HD3 LYS A 88 24.418 -26.191 4.686 1.00 0.00 H new ATOM 0 HE2 LYS A 88 22.164 -27.227 3.797 1.00 0.00 H new ATOM 0 HE3 LYS A 88 23.171 -28.573 3.302 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 22.113 -28.618 5.619 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 23.746 -29.065 5.481 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 23.333 -27.524 6.063 1.00 0.00 H new ATOM 1466 N PHE A 89 23.520 -22.762 1.808 1.00 0.00 N ATOM 1467 CA PHE A 89 22.906 -21.710 2.610 1.00 0.00 C ATOM 1468 C PHE A 89 22.519 -22.235 3.990 1.00 0.00 C ATOM 1469 O PHE A 89 21.782 -23.212 4.110 1.00 0.00 O ATOM 1470 CB PHE A 89 21.672 -21.151 1.899 1.00 0.00 C ATOM 1471 CG PHE A 89 21.975 -20.553 0.555 1.00 0.00 C ATOM 1472 CD1 PHE A 89 22.305 -19.212 0.437 1.00 0.00 C ATOM 1473 CD2 PHE A 89 21.928 -21.331 -0.590 1.00 0.00 C ATOM 1474 CE1 PHE A 89 22.583 -18.659 -0.799 1.00 0.00 C ATOM 1475 CE2 PHE A 89 22.206 -20.783 -1.829 1.00 0.00 C ATOM 1476 CZ PHE A 89 22.534 -19.446 -1.933 1.00 0.00 C ATOM 0 H PHE A 89 22.906 -23.165 1.101 1.00 0.00 H new ATOM 0 HA PHE A 89 23.636 -20.910 2.736 1.00 0.00 H new ATOM 0 HB2 PHE A 89 20.940 -21.950 1.776 1.00 0.00 H new ATOM 0 HB3 PHE A 89 21.212 -20.391 2.531 1.00 0.00 H new ATOM 0 HD1 PHE A 89 22.345 -18.592 1.321 1.00 0.00 H new ATOM 0 HD2 PHE A 89 21.671 -22.377 -0.514 1.00 0.00 H new ATOM 0 HE1 PHE A 89 22.838 -17.613 -0.878 1.00 0.00 H new ATOM 0 HE2 PHE A 89 22.167 -21.400 -2.714 1.00 0.00 H new ATOM 0 HZ PHE A 89 22.752 -19.016 -2.900 1.00 0.00 H new ATOM 1486 N GLY A 90 23.022 -21.576 5.030 1.00 0.00 N ATOM 1487 CA GLY A 90 22.718 -21.990 6.387 1.00 0.00 C ATOM 1488 C GLY A 90 21.283 -21.696 6.776 1.00 0.00 C ATOM 1489 O GLY A 90 20.398 -21.646 5.921 1.00 0.00 O ATOM 0 H GLY A 90 23.634 -20.763 4.957 1.00 0.00 H new ATOM 0 HA2 GLY A 90 22.907 -23.059 6.488 1.00 0.00 H new ATOM 0 HA3 GLY A 90 23.390 -21.481 7.078 1.00 0.00 H new ATOM 1493 N LYS A 91 21.050 -21.501 8.069 1.00 0.00 N ATOM 1494 CA LYS A 91 19.712 -21.211 8.571 1.00 0.00 C ATOM 1495 C LYS A 91 19.458 -19.707 8.603 1.00 0.00 C ATOM 1496 O LYS A 91 18.314 -19.260 8.531 1.00 0.00 O ATOM 1497 CB LYS A 91 19.531 -21.799 9.972 1.00 0.00 C ATOM 1498 CG LYS A 91 20.476 -21.210 11.005 1.00 0.00 C ATOM 1499 CD LYS A 91 21.046 -22.284 11.917 1.00 0.00 C ATOM 1500 CE LYS A 91 20.851 -21.932 13.383 1.00 0.00 C ATOM 1501 NZ LYS A 91 21.781 -22.691 14.265 1.00 0.00 N ATOM 0 H LYS A 91 21.771 -21.539 8.789 1.00 0.00 H new ATOM 0 HA LYS A 91 18.990 -21.670 7.895 1.00 0.00 H new ATOM 0 HB2 LYS A 91 18.503 -21.634 10.296 1.00 0.00 H new ATOM 0 HB3 LYS A 91 19.682 -22.878 9.927 1.00 0.00 H new ATOM 0 HG2 LYS A 91 21.290 -20.691 10.500 1.00 0.00 H new ATOM 0 HG3 LYS A 91 19.946 -20.468 11.602 1.00 0.00 H new ATOM 0 HD2 LYS A 91 20.563 -23.238 11.704 1.00 0.00 H new ATOM 0 HD3 LYS A 91 22.109 -22.411 11.711 1.00 0.00 H new ATOM 0 HE2 LYS A 91 21.009 -20.863 13.524 1.00 0.00 H new ATOM 0 HE3 LYS A 91 19.822 -22.143 13.673 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 21.616 -22.422 15.256 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 21.613 -23.711 14.150 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 22.764 -22.470 14.005 1.00 0.00 H new ATOM 1515 N ASN A 92 20.532 -18.932 8.709 1.00 0.00 N ATOM 1516 CA ASN A 92 20.425 -17.478 8.749 1.00 0.00 C ATOM 1517 C ASN A 92 19.765 -16.946 7.481 1.00 0.00 C ATOM 1518 O ASN A 92 19.031 -15.959 7.518 1.00 0.00 O ATOM 1519 CB ASN A 92 21.808 -16.848 8.920 1.00 0.00 C ATOM 1520 CG ASN A 92 22.068 -16.400 10.346 1.00 0.00 C ATOM 1521 OD1 ASN A 92 22.311 -15.221 10.604 1.00 0.00 O ATOM 1522 ND2 ASN A 92 22.017 -17.343 11.280 1.00 0.00 N ATOM 0 H ASN A 92 21.487 -19.286 8.769 1.00 0.00 H new ATOM 0 HA ASN A 92 19.803 -17.208 9.602 1.00 0.00 H new ATOM 0 HB2 ASN A 92 22.571 -17.568 8.623 1.00 0.00 H new ATOM 0 HB3 ASN A 92 21.900 -15.992 8.251 1.00 0.00 H new ATOM 0 HD21 ASN A 92 22.183 -17.102 12.257 1.00 0.00 H new ATOM 0 HD22 ASN A 92 21.812 -18.308 11.020 1.00 0.00 H new ATOM 1529 N ALA A 93 20.031 -17.608 6.360 1.00 0.00 N ATOM 1530 CA ALA A 93 19.461 -17.204 5.080 1.00 0.00 C ATOM 1531 C ALA A 93 18.007 -17.649 4.962 1.00 0.00 C ATOM 1532 O ALA A 93 17.655 -18.764 5.350 1.00 0.00 O ATOM 1533 CB ALA A 93 20.284 -17.772 3.933 1.00 0.00 C ATOM 0 H ALA A 93 20.638 -18.427 6.312 1.00 0.00 H new ATOM 0 HA ALA A 93 19.486 -16.116 5.026 1.00 0.00 H new ATOM 0 HB1 ALA A 93 19.847 -17.463 2.984 1.00 0.00 H new ATOM 0 HB2 ALA A 93 21.307 -17.401 4.000 1.00 0.00 H new ATOM 0 HB3 ALA A 93 20.289 -18.860 3.993 1.00 0.00 H new ATOM 1539 N HIS A 94 17.166 -16.771 4.424 1.00 0.00 N ATOM 1540 CA HIS A 94 15.750 -17.074 4.255 1.00 0.00 C ATOM 1541 C HIS A 94 15.298 -16.779 2.828 1.00 0.00 C ATOM 1542 O HIS A 94 15.382 -15.644 2.362 1.00 0.00 O ATOM 1543 CB HIS A 94 14.912 -16.265 5.246 1.00 0.00 C ATOM 1544 CG HIS A 94 15.101 -14.785 5.121 1.00 0.00 C ATOM 1545 ND1 HIS A 94 14.446 -14.019 4.180 1.00 0.00 N ATOM 1546 CD2 HIS A 94 15.876 -13.929 5.828 1.00 0.00 C ATOM 1547 CE1 HIS A 94 14.812 -12.756 4.311 1.00 0.00 C ATOM 1548 NE2 HIS A 94 15.679 -12.675 5.305 1.00 0.00 N ATOM 0 H HIS A 94 17.441 -15.844 4.098 1.00 0.00 H new ATOM 0 HA HIS A 94 15.605 -18.136 4.451 1.00 0.00 H new ATOM 0 HB2 HIS A 94 13.859 -16.502 5.097 1.00 0.00 H new ATOM 0 HB3 HIS A 94 15.168 -16.571 6.260 1.00 0.00 H new ATOM 0 HD1 HIS A 94 13.783 -14.372 3.490 1.00 0.00 H new ATOM 0 HD2 HIS A 94 16.528 -14.185 6.650 1.00 0.00 H new ATOM 0 HE1 HIS A 94 14.462 -11.931 3.708 1.00 0.00 H new ATOM 1556 N GLY A 95 14.818 -17.810 2.139 1.00 0.00 N ATOM 1557 CA GLY A 95 14.361 -17.641 0.772 1.00 0.00 C ATOM 1558 C GLY A 95 14.298 -18.953 0.015 1.00 0.00 C ATOM 1559 O GLY A 95 13.357 -19.197 -0.739 1.00 0.00 O ATOM 0 H GLY A 95 14.738 -18.759 2.503 1.00 0.00 H new ATOM 0 HA2 GLY A 95 13.373 -17.180 0.777 1.00 0.00 H new ATOM 0 HA3 GLY A 95 15.030 -16.956 0.251 1.00 0.00 H new ATOM 1563 N TRP A 96 15.303 -19.797 0.215 1.00 0.00 N ATOM 1564 CA TRP A 96 15.359 -21.091 -0.457 1.00 0.00 C ATOM 1565 C TRP A 96 14.561 -22.138 0.312 1.00 0.00 C ATOM 1566 O TRP A 96 13.683 -22.795 -0.246 1.00 0.00 O ATOM 1567 CB TRP A 96 16.810 -21.548 -0.609 1.00 0.00 C ATOM 1568 CG TRP A 96 17.514 -21.738 0.701 1.00 0.00 C ATOM 1569 CD1 TRP A 96 18.144 -20.778 1.440 1.00 0.00 C ATOM 1570 CD2 TRP A 96 17.659 -22.965 1.425 1.00 0.00 C ATOM 1571 NE1 TRP A 96 18.673 -21.334 2.580 1.00 0.00 N ATOM 1572 CE2 TRP A 96 18.388 -22.674 2.595 1.00 0.00 C ATOM 1573 CE3 TRP A 96 17.242 -24.280 1.201 1.00 0.00 C ATOM 1574 CZ2 TRP A 96 18.709 -23.651 3.534 1.00 0.00 C ATOM 1575 CZ3 TRP A 96 17.562 -25.248 2.133 1.00 0.00 C ATOM 1576 CH2 TRP A 96 18.289 -24.930 3.288 1.00 0.00 C ATOM 0 H TRP A 96 16.090 -19.610 0.836 1.00 0.00 H new ATOM 0 HA TRP A 96 14.916 -20.978 -1.447 1.00 0.00 H new ATOM 0 HB2 TRP A 96 16.832 -22.486 -1.164 1.00 0.00 H new ATOM 0 HB3 TRP A 96 17.354 -20.814 -1.203 1.00 0.00 H new ATOM 0 HD1 TRP A 96 18.216 -19.735 1.169 1.00 0.00 H new ATOM 0 HE1 TRP A 96 19.193 -20.831 3.298 1.00 0.00 H new ATOM 0 HE3 TRP A 96 16.680 -24.535 0.315 1.00 0.00 H new ATOM 0 HZ2 TRP A 96 19.269 -23.408 4.425 1.00 0.00 H new ATOM 0 HZ3 TRP A 96 17.246 -26.268 1.969 1.00 0.00 H new ATOM 0 HH2 TRP A 96 18.522 -25.710 3.998 1.00 0.00 H new ATOM 1587 N GLN A 97 14.873 -22.289 1.596 1.00 0.00 N ATOM 1588 CA GLN A 97 14.185 -23.258 2.440 1.00 0.00 C ATOM 1589 C GLN A 97 12.673 -23.078 2.353 1.00 0.00 C ATOM 1590 O GLN A 97 12.181 -21.969 2.148 1.00 0.00 O ATOM 1591 CB GLN A 97 14.644 -23.118 3.892 1.00 0.00 C ATOM 1592 CG GLN A 97 13.726 -22.253 4.740 1.00 0.00 C ATOM 1593 CD GLN A 97 14.464 -21.536 5.854 1.00 0.00 C ATOM 1594 OE1 GLN A 97 14.042 -21.563 7.011 1.00 0.00 O ATOM 1595 NE2 GLN A 97 15.572 -20.890 5.511 1.00 0.00 N ATOM 0 H GLN A 97 15.597 -21.753 2.074 1.00 0.00 H new ATOM 0 HA GLN A 97 14.435 -24.257 2.082 1.00 0.00 H new ATOM 0 HB2 GLN A 97 14.711 -24.109 4.340 1.00 0.00 H new ATOM 0 HB3 GLN A 97 15.647 -22.692 3.908 1.00 0.00 H new ATOM 0 HG2 GLN A 97 13.235 -21.518 4.103 1.00 0.00 H new ATOM 0 HG3 GLN A 97 12.942 -22.876 5.171 1.00 0.00 H new ATOM 0 HE21 GLN A 97 15.885 -20.894 4.540 1.00 0.00 H new ATOM 0 HE22 GLN A 97 16.110 -20.390 6.218 1.00 0.00 H new ATOM 1604 N GLU A 98 11.941 -24.177 2.510 1.00 0.00 N ATOM 1605 CA GLU A 98 10.485 -24.140 2.448 1.00 0.00 C ATOM 1606 C GLU A 98 9.913 -23.307 3.591 1.00 0.00 C ATOM 1607 O GLU A 98 9.987 -23.698 4.756 1.00 0.00 O ATOM 1608 CB GLU A 98 9.913 -25.558 2.500 1.00 0.00 C ATOM 1609 CG GLU A 98 9.043 -25.908 1.305 1.00 0.00 C ATOM 1610 CD GLU A 98 9.600 -27.064 0.496 1.00 0.00 C ATOM 1611 OE1 GLU A 98 9.854 -28.134 1.089 1.00 0.00 O ATOM 1612 OE2 GLU A 98 9.781 -26.900 -0.728 1.00 0.00 O ATOM 0 H GLU A 98 12.333 -25.103 2.681 1.00 0.00 H new ATOM 0 HA GLU A 98 10.199 -23.676 1.504 1.00 0.00 H new ATOM 0 HB2 GLU A 98 10.736 -26.270 2.561 1.00 0.00 H new ATOM 0 HB3 GLU A 98 9.326 -25.671 3.411 1.00 0.00 H new ATOM 0 HG2 GLU A 98 8.041 -26.161 1.652 1.00 0.00 H new ATOM 0 HG3 GLU A 98 8.946 -25.033 0.662 1.00 0.00 H new ATOM 1619 N ASP A 99 9.342 -22.157 3.249 1.00 0.00 N ATOM 1620 CA ASP A 99 8.757 -21.268 4.246 1.00 0.00 C ATOM 1621 C ASP A 99 9.797 -20.850 5.280 1.00 0.00 C ATOM 1622 O ASP A 99 10.951 -21.276 5.223 1.00 0.00 O ATOM 1623 CB ASP A 99 7.576 -21.951 4.939 1.00 0.00 C ATOM 1624 CG ASP A 99 6.498 -22.376 3.962 1.00 0.00 C ATOM 1625 OD1 ASP A 99 6.847 -22.928 2.897 1.00 0.00 O ATOM 1626 OD2 ASP A 99 5.306 -22.158 4.262 1.00 0.00 O ATOM 0 H ASP A 99 9.272 -21.819 2.289 1.00 0.00 H new ATOM 0 HA ASP A 99 8.401 -20.374 3.734 1.00 0.00 H new ATOM 0 HB2 ASP A 99 7.934 -22.825 5.483 1.00 0.00 H new ATOM 0 HB3 ASP A 99 7.147 -21.271 5.675 1.00 0.00 H new ATOM 1631 N LYS A 100 9.382 -20.014 6.225 1.00 0.00 N ATOM 1632 CA LYS A 100 10.277 -19.538 7.273 1.00 0.00 C ATOM 1633 C LYS A 100 10.178 -20.418 8.515 1.00 0.00 C ATOM 1634 O LYS A 100 9.104 -20.923 8.846 1.00 0.00 O ATOM 1635 CB LYS A 100 9.947 -18.088 7.635 1.00 0.00 C ATOM 1636 CG LYS A 100 10.639 -17.067 6.748 1.00 0.00 C ATOM 1637 CD LYS A 100 9.781 -16.697 5.550 1.00 0.00 C ATOM 1638 CE LYS A 100 9.147 -15.325 5.721 1.00 0.00 C ATOM 1639 NZ LYS A 100 7.898 -15.388 6.528 1.00 0.00 N ATOM 0 H LYS A 100 8.431 -19.652 6.287 1.00 0.00 H new ATOM 0 HA LYS A 100 11.298 -19.588 6.894 1.00 0.00 H new ATOM 0 HB2 LYS A 100 8.869 -17.942 7.569 1.00 0.00 H new ATOM 0 HB3 LYS A 100 10.231 -17.908 8.672 1.00 0.00 H new ATOM 0 HG2 LYS A 100 10.862 -16.171 7.328 1.00 0.00 H new ATOM 0 HG3 LYS A 100 11.592 -17.469 6.404 1.00 0.00 H new ATOM 0 HD2 LYS A 100 10.391 -16.707 4.647 1.00 0.00 H new ATOM 0 HD3 LYS A 100 9.000 -17.446 5.415 1.00 0.00 H new ATOM 0 HE2 LYS A 100 9.858 -14.654 6.204 1.00 0.00 H new ATOM 0 HE3 LYS A 100 8.925 -14.903 4.741 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 7.497 -14.433 6.622 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 7.210 -16.008 6.055 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 8.114 -15.767 7.472 1.00 0.00 H new ATOM 1653 N LEU A 101 11.302 -20.597 9.199 1.00 0.00 N ATOM 1654 CA LEU A 101 11.341 -21.416 10.407 1.00 0.00 C ATOM 1655 C LEU A 101 12.758 -21.496 10.964 1.00 0.00 C ATOM 1656 O LEU A 101 13.695 -21.865 10.256 1.00 0.00 O ATOM 1657 CB LEU A 101 10.816 -22.822 10.110 1.00 0.00 C ATOM 1658 CG LEU A 101 9.452 -23.169 10.707 1.00 0.00 C ATOM 1659 CD1 LEU A 101 8.872 -24.401 10.031 1.00 0.00 C ATOM 1660 CD2 LEU A 101 9.565 -23.385 12.209 1.00 0.00 C ATOM 0 H LEU A 101 12.199 -20.187 8.939 1.00 0.00 H new ATOM 0 HA LEU A 101 10.702 -20.948 11.156 1.00 0.00 H new ATOM 0 HB2 LEU A 101 10.759 -22.946 9.029 1.00 0.00 H new ATOM 0 HB3 LEU A 101 11.545 -23.545 10.476 1.00 0.00 H new ATOM 0 HG LEU A 101 8.777 -22.332 10.532 1.00 0.00 H new ATOM 0 HD11 LEU A 101 7.901 -24.633 10.469 1.00 0.00 H new ATOM 0 HD12 LEU A 101 8.753 -24.209 8.965 1.00 0.00 H new ATOM 0 HD13 LEU A 101 9.546 -25.246 10.174 1.00 0.00 H new ATOM 0 HD21 LEU A 101 8.584 -23.631 12.616 1.00 0.00 H new ATOM 0 HD22 LEU A 101 10.256 -24.204 12.408 1.00 0.00 H new ATOM 0 HD23 LEU A 101 9.936 -22.475 12.681 1.00 0.00 H new ATOM 1672 N SER A 102 12.907 -21.151 12.239 1.00 0.00 N ATOM 1673 CA SER A 102 14.211 -21.183 12.893 1.00 0.00 C ATOM 1674 C SER A 102 15.172 -20.198 12.235 1.00 0.00 C ATOM 1675 O SER A 102 15.818 -20.516 11.237 1.00 0.00 O ATOM 1676 CB SER A 102 14.796 -22.596 12.841 1.00 0.00 C ATOM 1677 OG SER A 102 13.968 -23.517 13.530 1.00 0.00 O ATOM 0 H SER A 102 12.141 -20.846 12.840 1.00 0.00 H new ATOM 0 HA SER A 102 14.076 -20.891 13.935 1.00 0.00 H new ATOM 0 HB2 SER A 102 14.908 -22.909 11.803 1.00 0.00 H new ATOM 0 HB3 SER A 102 15.792 -22.597 13.283 1.00 0.00 H new ATOM 0 HG SER A 102 14.363 -24.413 13.480 1.00 0.00 H new ATOM 1683 N GLY A 103 15.260 -18.999 12.802 1.00 0.00 N ATOM 1684 CA GLY A 103 16.144 -17.984 12.258 1.00 0.00 C ATOM 1685 C GLY A 103 15.744 -16.583 12.675 1.00 0.00 C ATOM 1686 O GLY A 103 15.141 -15.832 11.908 1.00 0.00 O ATOM 0 H GLY A 103 14.735 -18.712 13.628 1.00 0.00 H new ATOM 0 HA2 GLY A 103 17.164 -18.181 12.588 1.00 0.00 H new ATOM 0 HA3 GLY A 103 16.142 -18.050 11.170 1.00 0.00 H new ATOM 1690 N PRO A 104 16.082 -16.212 13.920 1.00 0.00 N ATOM 1691 CA PRO A 104 15.763 -14.890 14.466 1.00 0.00 C ATOM 1692 C PRO A 104 16.576 -13.780 13.809 1.00 0.00 C ATOM 1693 O PRO A 104 16.300 -12.596 14.004 1.00 0.00 O ATOM 1694 CB PRO A 104 16.131 -15.019 15.946 1.00 0.00 C ATOM 1695 CG PRO A 104 17.162 -16.094 15.987 1.00 0.00 C ATOM 1696 CD PRO A 104 16.802 -17.056 14.889 1.00 0.00 C ATOM 0 HA PRO A 104 14.721 -14.619 14.294 1.00 0.00 H new ATOM 0 HB2 PRO A 104 16.521 -14.081 16.340 1.00 0.00 H new ATOM 0 HB3 PRO A 104 15.262 -15.281 16.549 1.00 0.00 H new ATOM 0 HG2 PRO A 104 18.160 -15.683 15.834 1.00 0.00 H new ATOM 0 HG3 PRO A 104 17.167 -16.593 16.956 1.00 0.00 H new ATOM 0 HD2 PRO A 104 17.688 -17.510 14.446 1.00 0.00 H new ATOM 0 HD3 PRO A 104 16.177 -17.870 15.256 1.00 0.00 H new ATOM 1704 N SER A 105 17.580 -14.169 13.030 1.00 0.00 N ATOM 1705 CA SER A 105 18.436 -13.207 12.347 1.00 0.00 C ATOM 1706 C SER A 105 19.196 -12.347 13.352 1.00 0.00 C ATOM 1707 O SER A 105 18.750 -12.154 14.483 1.00 0.00 O ATOM 1708 CB SER A 105 17.602 -12.316 11.424 1.00 0.00 C ATOM 1709 OG SER A 105 18.415 -11.358 10.768 1.00 0.00 O ATOM 0 H SER A 105 17.821 -15.145 12.856 1.00 0.00 H new ATOM 0 HA SER A 105 19.159 -13.761 11.749 1.00 0.00 H new ATOM 0 HB2 SER A 105 17.091 -12.932 10.684 1.00 0.00 H new ATOM 0 HB3 SER A 105 16.831 -11.808 12.003 1.00 0.00 H new ATOM 0 HG SER A 105 17.859 -10.802 10.183 1.00 0.00 H new ATOM 1715 N SER A 106 20.347 -11.832 12.931 1.00 0.00 N ATOM 1716 CA SER A 106 21.172 -10.996 13.794 1.00 0.00 C ATOM 1717 C SER A 106 22.182 -10.199 12.974 1.00 0.00 C ATOM 1718 O SER A 106 23.213 -10.724 12.557 1.00 0.00 O ATOM 1719 CB SER A 106 21.903 -11.857 14.827 1.00 0.00 C ATOM 1720 OG SER A 106 22.707 -12.838 14.196 1.00 0.00 O ATOM 0 H SER A 106 20.729 -11.979 11.997 1.00 0.00 H new ATOM 0 HA SER A 106 20.517 -10.296 14.313 1.00 0.00 H new ATOM 0 HB2 SER A 106 22.526 -11.223 15.458 1.00 0.00 H new ATOM 0 HB3 SER A 106 21.177 -12.342 15.480 1.00 0.00 H new ATOM 0 HG SER A 106 23.190 -12.432 13.446 1.00 0.00 H new ATOM 1726 N GLY A 107 21.876 -8.925 12.747 1.00 0.00 N ATOM 1727 CA GLY A 107 22.766 -8.075 11.978 1.00 0.00 C ATOM 1728 C GLY A 107 22.016 -7.140 11.049 1.00 0.00 C ATOM 1729 O GLY A 107 21.991 -5.929 11.264 1.00 0.00 O ATOM 0 H GLY A 107 21.028 -8.467 13.082 1.00 0.00 H new ATOM 0 HA2 GLY A 107 23.382 -7.488 12.660 1.00 0.00 H new ATOM 0 HA3 GLY A 107 23.443 -8.698 11.393 1.00 0.00 H new TER 1733 GLY A 107