USER MOD reduce.3.24.130724 H: found=0, std=0, add=695, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 694 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 45 LYS NZ :NH3+ 163:sc= 2.69 (180deg=1.84) USER MOD Set 1.2: A 59 MET CE :methyl -150:sc= -0.493 (180deg=-1.93!) USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 LYS NZ :NH3+ -154:sc= 2.32 (180deg=1.79) USER MOD Single : A 25 LYS NZ :NH3+ -174:sc= 1.28 (180deg=1.15) USER MOD Single : A 29 GLN : amide:sc= 0.377 X(o=0.38,f=-0.074) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot -123:sc= 0.369 USER MOD Single : A 35 HIS : no HD1:sc= -1.03 K(o=-1,f=-2.9!) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 MET CE :methyl -111:sc=-0.00138 (180deg=-0.437) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0.0373 USER MOD Single : A 43 HIS : no HD1:sc= -0.0345 X(o=-0.035,f=-0.039) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 LYS NZ :NH3+ 163:sc= 2.22 (180deg=1.81) USER MOD Single : A 50 SER OG : rot 78:sc= 1.22 USER MOD Single : A 51 TYR OH : rot -140:sc= -0.704 USER MOD Single : A 52 CYS SG : rot 60:sc= -0.344! USER MOD Single : A 53 GLN : amide:sc= -2.46! C(o=-2.5!,f=-5.3!) USER MOD Single : A 55 GLN : amide:sc= -0.128 X(o=-0.13,f=-0.13) USER MOD Single : A 60 ASN : amide:sc= -0.0233 X(o=-0.023,f=0) USER MOD Single : A 61 SER OG : rot -77:sc= 1.24 USER MOD Single : A 69 GLN : amide:sc= -0.19 K(o=-0.19,f=-1.3) USER MOD Single : A 74 ASN : amide:sc= -0.0717 X(o=-0.072,f=-0.43) USER MOD Single : A 75 HIS : no HD1:sc= 0.638 K(o=0.64,f=-6.7!) USER MOD Single : A 76 THR OG1 : rot 25:sc= 0.476 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 91 TYR OH : rot 151:sc= 1.25 USER MOD Single : A 92 GLN : amide:sc= 1.1 K(o=1.1,f=0) USER MOD Single : A 94 GLN : amide:sc= 0 X(o=0,f=-0.24) USER MOD Single : A 95 THR OG1 : rot 180:sc= 0.0214 USER MOD Single : B 357 ASN : amide:sc= -0.108 X(o=-0.11,f=-0.11) USER MOD Single : B 358 ASN : amide:sc= 0 K(o=0,f=-0.56) USER MOD ----------------------------------------------------------------- ATOM 1 N TYR A 21 2.316 5.812 10.030 1.00 10.00 N ATOM 2 CA TYR A 21 2.548 5.308 8.663 1.00 10.00 C ATOM 3 C TYR A 21 1.261 4.732 8.094 1.00 10.00 C ATOM 4 O TYR A 21 0.286 4.544 8.819 1.00 10.00 O ATOM 5 CB TYR A 21 3.639 4.232 8.662 1.00 10.00 C ATOM 6 CG TYR A 21 5.052 4.775 8.711 1.00 10.00 C ATOM 7 CD1 TYR A 21 5.830 4.836 7.562 1.00 10.00 C ATOM 8 CD2 TYR A 21 5.609 5.221 9.902 1.00 10.00 C ATOM 9 CE1 TYR A 21 7.122 5.329 7.598 1.00 10.00 C ATOM 10 CE2 TYR A 21 6.899 5.715 9.946 1.00 10.00 C ATOM 11 CZ TYR A 21 7.651 5.767 8.794 1.00 10.00 C ATOM 12 OH TYR A 21 8.938 6.262 8.839 1.00 10.00 O ATOM 0 HA TYR A 21 2.877 6.141 8.041 1.00 10.00 H new ATOM 0 HB2 TYR A 21 3.485 3.575 9.518 1.00 10.00 H new ATOM 0 HB3 TYR A 21 3.528 3.620 7.767 1.00 10.00 H new ATOM 0 HD1 TYR A 21 5.419 4.493 6.624 1.00 10.00 H new ATOM 0 HD2 TYR A 21 5.024 5.181 10.809 1.00 10.00 H new ATOM 0 HE1 TYR A 21 7.713 5.371 6.695 1.00 10.00 H new ATOM 0 HE2 TYR A 21 7.316 6.059 10.881 1.00 10.00 H new ATOM 0 HH TYR A 21 9.154 6.528 9.757 1.00 10.00 H new ATOM 22 N ILE A 22 1.263 4.457 6.799 1.00 10.00 N ATOM 23 CA ILE A 22 0.097 3.901 6.130 1.00 10.00 C ATOM 24 C ILE A 22 0.379 2.468 5.699 1.00 10.00 C ATOM 25 O ILE A 22 1.230 2.227 4.843 1.00 10.00 O ATOM 26 CB ILE A 22 -0.294 4.734 4.887 1.00 10.00 C ATOM 27 CG1 ILE A 22 -0.399 6.224 5.238 1.00 10.00 C ATOM 28 CG2 ILE A 22 -1.602 4.232 4.292 1.00 10.00 C ATOM 29 CD1 ILE A 22 -1.513 6.548 6.210 1.00 10.00 C ATOM 0 H ILE A 22 2.064 4.611 6.187 1.00 10.00 H new ATOM 0 HA ILE A 22 -0.732 3.924 6.838 1.00 10.00 H new ATOM 0 HB ILE A 22 0.491 4.615 4.141 1.00 10.00 H new ATOM 0 HG12 ILE A 22 0.549 6.555 5.663 1.00 10.00 H new ATOM 0 HG13 ILE A 22 -0.553 6.793 4.321 1.00 10.00 H new ATOM 0 HG21 ILE A 22 -1.858 4.832 3.419 1.00 10.00 H new ATOM 0 HG22 ILE A 22 -1.490 3.189 3.996 1.00 10.00 H new ATOM 0 HG23 ILE A 22 -2.395 4.315 5.035 1.00 10.00 H new ATOM 0 HD11 ILE A 22 -1.523 7.620 6.408 1.00 10.00 H new ATOM 0 HD12 ILE A 22 -2.469 6.250 5.780 1.00 10.00 H new ATOM 0 HD13 ILE A 22 -1.351 6.008 7.143 1.00 10.00 H new ATOM 41 N LYS A 23 -0.313 1.517 6.302 1.00 10.00 N ATOM 42 CA LYS A 23 -0.129 0.117 5.962 1.00 10.00 C ATOM 43 C LYS A 23 -1.179 -0.323 4.948 1.00 10.00 C ATOM 44 O LYS A 23 -2.366 -0.434 5.262 1.00 10.00 O ATOM 45 CB LYS A 23 -0.201 -0.750 7.218 1.00 10.00 C ATOM 46 CG LYS A 23 0.213 -2.195 6.987 1.00 10.00 C ATOM 47 CD LYS A 23 -0.481 -3.137 7.958 1.00 10.00 C ATOM 48 CE LYS A 23 -1.918 -3.410 7.542 1.00 10.00 C ATOM 49 NZ LYS A 23 -2.893 -2.715 8.423 1.00 10.00 N ATOM 0 H LYS A 23 -1.007 1.689 7.029 1.00 10.00 H new ATOM 0 HA LYS A 23 0.857 -0.006 5.515 1.00 10.00 H new ATOM 0 HB2 LYS A 23 0.440 -0.316 7.986 1.00 10.00 H new ATOM 0 HB3 LYS A 23 -1.220 -0.730 7.605 1.00 10.00 H new ATOM 0 HG2 LYS A 23 -0.027 -2.484 5.964 1.00 10.00 H new ATOM 0 HG3 LYS A 23 1.293 -2.287 7.099 1.00 10.00 H new ATOM 0 HD2 LYS A 23 0.068 -4.077 8.009 1.00 10.00 H new ATOM 0 HD3 LYS A 23 -0.467 -2.704 8.958 1.00 10.00 H new ATOM 0 HE2 LYS A 23 -2.065 -3.086 6.512 1.00 10.00 H new ATOM 0 HE3 LYS A 23 -2.106 -4.483 7.569 1.00 10.00 H new ATOM 0 HZ1 LYS A 23 -3.795 -3.232 8.418 1.00 10.00 H new ATOM 0 HZ2 LYS A 23 -2.520 -2.679 9.393 1.00 10.00 H new ATOM 0 HZ3 LYS A 23 -3.047 -1.747 8.075 1.00 10.00 H new ATOM 63 N LEU A 24 -0.736 -0.561 3.727 1.00 10.00 N ATOM 64 CA LEU A 24 -1.623 -0.985 2.659 1.00 10.00 C ATOM 65 C LEU A 24 -1.602 -2.500 2.535 1.00 10.00 C ATOM 66 O LEU A 24 -0.559 -3.131 2.735 1.00 10.00 O ATOM 67 CB LEU A 24 -1.203 -0.341 1.334 1.00 10.00 C ATOM 68 CG LEU A 24 -1.190 1.187 1.329 1.00 10.00 C ATOM 69 CD1 LEU A 24 -0.552 1.709 0.050 1.00 10.00 C ATOM 70 CD2 LEU A 24 -2.600 1.737 1.487 1.00 10.00 C ATOM 0 H LEU A 24 0.241 -0.467 3.449 1.00 10.00 H new ATOM 0 HA LEU A 24 -2.637 -0.664 2.897 1.00 10.00 H new ATOM 0 HB2 LEU A 24 -0.206 -0.698 1.075 1.00 10.00 H new ATOM 0 HB3 LEU A 24 -1.878 -0.685 0.551 1.00 10.00 H new ATOM 0 HG LEU A 24 -0.594 1.528 2.176 1.00 10.00 H new ATOM 0 HD11 LEU A 24 -0.551 2.799 0.063 1.00 10.00 H new ATOM 0 HD12 LEU A 24 0.473 1.346 -0.020 1.00 10.00 H new ATOM 0 HD13 LEU A 24 -1.121 1.357 -0.810 1.00 10.00 H new ATOM 0 HD21 LEU A 24 -2.568 2.827 1.481 1.00 10.00 H new ATOM 0 HD22 LEU A 24 -3.221 1.387 0.663 1.00 10.00 H new ATOM 0 HD23 LEU A 24 -3.022 1.392 2.431 1.00 10.00 H new ATOM 82 N LYS A 25 -2.747 -3.083 2.219 1.00 10.00 N ATOM 83 CA LYS A 25 -2.851 -4.525 2.073 1.00 10.00 C ATOM 84 C LYS A 25 -2.922 -4.909 0.603 1.00 10.00 C ATOM 85 O LYS A 25 -3.916 -4.640 -0.074 1.00 10.00 O ATOM 86 CB LYS A 25 -4.081 -5.063 2.811 1.00 10.00 C ATOM 87 CG LYS A 25 -4.045 -4.832 4.314 1.00 10.00 C ATOM 88 CD LYS A 25 -5.122 -5.635 5.029 1.00 10.00 C ATOM 89 CE LYS A 25 -4.730 -7.098 5.175 1.00 10.00 C ATOM 90 NZ LYS A 25 -5.778 -7.888 5.875 1.00 10.00 N ATOM 0 H LYS A 25 -3.619 -2.578 2.059 1.00 10.00 H new ATOM 0 HA LYS A 25 -1.959 -4.971 2.514 1.00 10.00 H new ATOM 0 HB2 LYS A 25 -4.974 -4.591 2.402 1.00 10.00 H new ATOM 0 HB3 LYS A 25 -4.169 -6.132 2.619 1.00 10.00 H new ATOM 0 HG2 LYS A 25 -3.065 -5.110 4.702 1.00 10.00 H new ATOM 0 HG3 LYS A 25 -4.182 -3.771 4.523 1.00 10.00 H new ATOM 0 HD2 LYS A 25 -5.301 -5.206 6.015 1.00 10.00 H new ATOM 0 HD3 LYS A 25 -6.058 -5.563 4.475 1.00 10.00 H new ATOM 0 HE2 LYS A 25 -4.552 -7.526 4.188 1.00 10.00 H new ATOM 0 HE3 LYS A 25 -3.793 -7.169 5.727 1.00 10.00 H new ATOM 0 HZ1 LYS A 25 -5.430 -8.853 6.044 1.00 10.00 H new ATOM 0 HZ2 LYS A 25 -6.003 -7.437 6.785 1.00 10.00 H new ATOM 0 HZ3 LYS A 25 -6.635 -7.927 5.286 1.00 10.00 H new ATOM 104 N VAL A 26 -1.855 -5.519 0.112 1.00 10.00 N ATOM 105 CA VAL A 26 -1.791 -5.956 -1.273 1.00 10.00 C ATOM 106 C VAL A 26 -2.313 -7.381 -1.381 1.00 10.00 C ATOM 107 O VAL A 26 -1.889 -8.261 -0.628 1.00 10.00 O ATOM 108 CB VAL A 26 -0.353 -5.898 -1.836 1.00 10.00 C ATOM 109 CG1 VAL A 26 -0.374 -5.830 -3.355 1.00 10.00 C ATOM 110 CG2 VAL A 26 0.414 -4.719 -1.256 1.00 10.00 C ATOM 0 H VAL A 26 -1.017 -5.724 0.656 1.00 10.00 H new ATOM 0 HA VAL A 26 -2.408 -5.276 -1.861 1.00 10.00 H new ATOM 0 HB VAL A 26 0.162 -6.812 -1.540 1.00 10.00 H new ATOM 0 HG11 VAL A 26 0.648 -5.790 -3.732 1.00 10.00 H new ATOM 0 HG12 VAL A 26 -0.872 -6.714 -3.752 1.00 10.00 H new ATOM 0 HG13 VAL A 26 -0.913 -4.937 -3.672 1.00 10.00 H new ATOM 0 HG21 VAL A 26 1.423 -4.702 -1.669 1.00 10.00 H new ATOM 0 HG22 VAL A 26 -0.098 -3.791 -1.511 1.00 10.00 H new ATOM 0 HG23 VAL A 26 0.468 -4.818 -0.172 1.00 10.00 H new ATOM 120 N ILE A 27 -3.243 -7.599 -2.299 1.00 10.00 N ATOM 121 CA ILE A 27 -3.831 -8.915 -2.492 1.00 10.00 C ATOM 122 C ILE A 27 -3.017 -9.748 -3.478 1.00 10.00 C ATOM 123 O ILE A 27 -2.985 -9.457 -4.677 1.00 10.00 O ATOM 124 CB ILE A 27 -5.289 -8.812 -2.993 1.00 10.00 C ATOM 125 CG1 ILE A 27 -6.143 -8.015 -2.001 1.00 10.00 C ATOM 126 CG2 ILE A 27 -5.883 -10.197 -3.217 1.00 10.00 C ATOM 127 CD1 ILE A 27 -6.267 -8.661 -0.636 1.00 10.00 C ATOM 0 H ILE A 27 -3.607 -6.879 -2.923 1.00 10.00 H new ATOM 0 HA ILE A 27 -3.824 -9.409 -1.520 1.00 10.00 H new ATOM 0 HB ILE A 27 -5.285 -8.285 -3.947 1.00 10.00 H new ATOM 0 HG12 ILE A 27 -5.712 -7.021 -1.883 1.00 10.00 H new ATOM 0 HG13 ILE A 27 -7.140 -7.882 -2.421 1.00 10.00 H new ATOM 0 HG21 ILE A 27 -6.910 -10.100 -3.569 1.00 10.00 H new ATOM 0 HG22 ILE A 27 -5.292 -10.730 -3.962 1.00 10.00 H new ATOM 0 HG23 ILE A 27 -5.872 -10.753 -2.280 1.00 10.00 H new ATOM 0 HD11 ILE A 27 -6.886 -8.036 0.007 1.00 10.00 H new ATOM 0 HD12 ILE A 27 -6.727 -9.644 -0.739 1.00 10.00 H new ATOM 0 HD13 ILE A 27 -5.277 -8.769 -0.193 1.00 10.00 H new ATOM 139 N GLY A 28 -2.345 -10.767 -2.960 1.00 10.00 N ATOM 140 CA GLY A 28 -1.560 -11.641 -3.803 1.00 10.00 C ATOM 141 C GLY A 28 -2.426 -12.696 -4.463 1.00 10.00 C ATOM 142 O GLY A 28 -3.530 -12.976 -3.990 1.00 10.00 O ATOM 0 H GLY A 28 -2.331 -11.003 -1.968 1.00 10.00 H new ATOM 0 HA2 GLY A 28 -1.054 -11.053 -4.568 1.00 10.00 H new ATOM 0 HA3 GLY A 28 -0.785 -12.124 -3.208 1.00 10.00 H new ATOM 146 N GLN A 29 -1.931 -13.290 -5.543 1.00 10.00 N ATOM 147 CA GLN A 29 -2.682 -14.311 -6.271 1.00 10.00 C ATOM 148 C GLN A 29 -2.949 -15.537 -5.399 1.00 10.00 C ATOM 149 O GLN A 29 -4.016 -16.147 -5.480 1.00 10.00 O ATOM 150 CB GLN A 29 -1.931 -14.721 -7.544 1.00 10.00 C ATOM 151 CG GLN A 29 -2.682 -15.730 -8.403 1.00 10.00 C ATOM 152 CD GLN A 29 -4.031 -15.215 -8.878 1.00 10.00 C ATOM 153 OE1 GLN A 29 -4.128 -14.564 -9.918 1.00 10.00 O ATOM 154 NE2 GLN A 29 -5.078 -15.509 -8.124 1.00 10.00 N ATOM 0 H GLN A 29 -1.013 -13.083 -5.935 1.00 10.00 H new ATOM 0 HA GLN A 29 -3.644 -13.880 -6.548 1.00 10.00 H new ATOM 0 HB2 GLN A 29 -1.730 -13.830 -8.139 1.00 10.00 H new ATOM 0 HB3 GLN A 29 -0.965 -15.143 -7.265 1.00 10.00 H new ATOM 0 HG2 GLN A 29 -2.072 -15.988 -9.269 1.00 10.00 H new ATOM 0 HG3 GLN A 29 -2.829 -16.647 -7.832 1.00 10.00 H new ATOM 0 HE21 GLN A 29 -4.955 -16.051 -7.269 1.00 10.00 H new ATOM 0 HE22 GLN A 29 -6.008 -15.193 -8.398 1.00 10.00 H new ATOM 163 N ASP A 30 -1.995 -15.880 -4.547 1.00 10.00 N ATOM 164 CA ASP A 30 -2.134 -17.036 -3.662 1.00 10.00 C ATOM 165 C ASP A 30 -2.800 -16.647 -2.345 1.00 10.00 C ATOM 166 O ASP A 30 -2.570 -17.276 -1.307 1.00 10.00 O ATOM 167 CB ASP A 30 -0.771 -17.689 -3.400 1.00 10.00 C ATOM 168 CG ASP A 30 0.213 -16.767 -2.702 1.00 10.00 C ATOM 169 OD1 ASP A 30 0.391 -15.619 -3.162 1.00 10.00 O ATOM 170 OD2 ASP A 30 0.834 -17.192 -1.711 1.00 10.00 O ATOM 0 H ASP A 30 -1.114 -15.376 -4.446 1.00 10.00 H new ATOM 0 HA ASP A 30 -2.775 -17.761 -4.164 1.00 10.00 H new ATOM 0 HB2 ASP A 30 -0.915 -18.582 -2.792 1.00 10.00 H new ATOM 0 HB3 ASP A 30 -0.343 -18.014 -4.348 1.00 10.00 H new ATOM 175 N SER A 31 -3.628 -15.605 -2.405 1.00 10.00 N ATOM 176 CA SER A 31 -4.361 -15.106 -1.243 1.00 10.00 C ATOM 177 C SER A 31 -3.410 -14.631 -0.144 1.00 10.00 C ATOM 178 O SER A 31 -3.729 -14.694 1.043 1.00 10.00 O ATOM 179 CB SER A 31 -5.305 -16.192 -0.717 1.00 10.00 C ATOM 180 OG SER A 31 -6.038 -16.780 -1.784 1.00 10.00 O ATOM 0 H SER A 31 -3.810 -15.082 -3.262 1.00 10.00 H new ATOM 0 HA SER A 31 -4.952 -14.245 -1.554 1.00 10.00 H new ATOM 0 HB2 SER A 31 -4.731 -16.959 -0.197 1.00 10.00 H new ATOM 0 HB3 SER A 31 -5.994 -15.761 0.010 1.00 10.00 H new ATOM 0 HG SER A 31 -6.634 -17.472 -1.429 1.00 10.00 H new ATOM 186 N SER A 32 -2.247 -14.146 -0.552 1.00 10.00 N ATOM 187 CA SER A 32 -1.248 -13.657 0.381 1.00 10.00 C ATOM 188 C SER A 32 -1.559 -12.223 0.794 1.00 10.00 C ATOM 189 O SER A 32 -1.868 -11.382 -0.053 1.00 10.00 O ATOM 190 CB SER A 32 0.133 -13.735 -0.271 1.00 10.00 C ATOM 191 OG SER A 32 0.035 -13.526 -1.674 1.00 10.00 O ATOM 0 H SER A 32 -1.972 -14.081 -1.532 1.00 10.00 H new ATOM 0 HA SER A 32 -1.260 -14.278 1.277 1.00 10.00 H new ATOM 0 HB2 SER A 32 0.792 -12.986 0.169 1.00 10.00 H new ATOM 0 HB3 SER A 32 0.580 -14.709 -0.073 1.00 10.00 H new ATOM 0 HG SER A 32 0.414 -14.296 -2.147 1.00 10.00 H new ATOM 197 N GLU A 33 -1.494 -11.949 2.089 1.00 10.00 N ATOM 198 CA GLU A 33 -1.762 -10.613 2.589 1.00 10.00 C ATOM 199 C GLU A 33 -0.460 -9.847 2.767 1.00 10.00 C ATOM 200 O GLU A 33 0.229 -9.985 3.782 1.00 10.00 O ATOM 201 CB GLU A 33 -2.523 -10.661 3.913 1.00 10.00 C ATOM 202 CG GLU A 33 -3.913 -11.260 3.804 1.00 10.00 C ATOM 203 CD GLU A 33 -4.538 -11.507 5.157 1.00 10.00 C ATOM 204 OE1 GLU A 33 -5.167 -10.574 5.708 1.00 10.00 O ATOM 205 OE2 GLU A 33 -4.403 -12.635 5.677 1.00 10.00 O ATOM 0 H GLU A 33 -1.259 -12.633 2.808 1.00 10.00 H new ATOM 0 HA GLU A 33 -2.384 -10.099 1.856 1.00 10.00 H new ATOM 0 HB2 GLU A 33 -1.944 -11.240 4.632 1.00 10.00 H new ATOM 0 HB3 GLU A 33 -2.605 -9.649 4.310 1.00 10.00 H new ATOM 0 HG2 GLU A 33 -4.551 -10.590 3.228 1.00 10.00 H new ATOM 0 HG3 GLU A 33 -3.859 -12.199 3.254 1.00 10.00 H new ATOM 212 N ILE A 34 -0.113 -9.052 1.769 1.00 10.00 N ATOM 213 CA ILE A 34 1.111 -8.270 1.826 1.00 10.00 C ATOM 214 C ILE A 34 0.863 -6.951 2.552 1.00 10.00 C ATOM 215 O ILE A 34 0.083 -6.115 2.090 1.00 10.00 O ATOM 216 CB ILE A 34 1.675 -7.976 0.420 1.00 10.00 C ATOM 217 CG1 ILE A 34 1.428 -9.161 -0.527 1.00 10.00 C ATOM 218 CG2 ILE A 34 3.162 -7.648 0.511 1.00 10.00 C ATOM 219 CD1 ILE A 34 2.381 -10.324 -0.339 1.00 10.00 C ATOM 0 H ILE A 34 -0.657 -8.931 0.915 1.00 10.00 H new ATOM 0 HA ILE A 34 1.845 -8.864 2.371 1.00 10.00 H new ATOM 0 HB ILE A 34 1.155 -7.111 0.009 1.00 10.00 H new ATOM 0 HG12 ILE A 34 0.408 -9.517 -0.385 1.00 10.00 H new ATOM 0 HG13 ILE A 34 1.502 -8.809 -1.556 1.00 10.00 H new ATOM 0 HG21 ILE A 34 3.551 -7.442 -0.486 1.00 10.00 H new ATOM 0 HG22 ILE A 34 3.303 -6.772 1.144 1.00 10.00 H new ATOM 0 HG23 ILE A 34 3.696 -8.496 0.941 1.00 10.00 H new ATOM 0 HD11 ILE A 34 2.134 -11.115 -1.047 1.00 10.00 H new ATOM 0 HD12 ILE A 34 3.403 -9.988 -0.512 1.00 10.00 H new ATOM 0 HD13 ILE A 34 2.292 -10.707 0.678 1.00 10.00 H new ATOM 231 N HIS A 35 1.517 -6.777 3.688 1.00 10.00 N ATOM 232 CA HIS A 35 1.370 -5.568 4.482 1.00 10.00 C ATOM 233 C HIS A 35 2.489 -4.591 4.146 1.00 10.00 C ATOM 234 O HIS A 35 3.603 -4.705 4.662 1.00 10.00 O ATOM 235 CB HIS A 35 1.390 -5.893 5.982 1.00 10.00 C ATOM 236 CG HIS A 35 0.184 -6.643 6.473 1.00 10.00 C ATOM 237 ND1 HIS A 35 -0.272 -6.489 7.758 1.00 10.00 N ATOM 238 CD2 HIS A 35 -0.608 -7.537 5.830 1.00 10.00 C ATOM 239 CE1 HIS A 35 -1.318 -7.290 7.872 1.00 10.00 C ATOM 240 NE2 HIS A 35 -1.561 -7.947 6.730 1.00 10.00 N ATOM 0 H HIS A 35 2.160 -7.463 4.084 1.00 10.00 H new ATOM 0 HA HIS A 35 0.409 -5.113 4.244 1.00 10.00 H new ATOM 0 HB2 HIS A 35 2.282 -6.480 6.202 1.00 10.00 H new ATOM 0 HB3 HIS A 35 1.476 -4.962 6.542 1.00 10.00 H new ATOM 0 HD2 HIS A 35 -0.508 -7.864 4.806 1.00 10.00 H new ATOM 0 HE1 HIS A 35 -1.903 -7.401 8.773 1.00 10.00 H new ATOM 0 HE2 HIS A 35 -2.308 -8.621 6.562 1.00 10.00 H new ATOM 248 N PHE A 36 2.201 -3.646 3.267 1.00 10.00 N ATOM 249 CA PHE A 36 3.194 -2.666 2.860 1.00 10.00 C ATOM 250 C PHE A 36 3.042 -1.381 3.665 1.00 10.00 C ATOM 251 O PHE A 36 2.032 -0.685 3.554 1.00 10.00 O ATOM 252 CB PHE A 36 3.071 -2.362 1.367 1.00 10.00 C ATOM 253 CG PHE A 36 4.398 -2.169 0.688 1.00 10.00 C ATOM 254 CD1 PHE A 36 5.432 -1.498 1.326 1.00 10.00 C ATOM 255 CD2 PHE A 36 4.614 -2.672 -0.583 1.00 10.00 C ATOM 256 CE1 PHE A 36 6.656 -1.338 0.708 1.00 10.00 C ATOM 257 CE2 PHE A 36 5.836 -2.512 -1.208 1.00 10.00 C ATOM 258 CZ PHE A 36 6.859 -1.845 -0.560 1.00 10.00 C ATOM 0 H PHE A 36 1.290 -3.537 2.822 1.00 10.00 H new ATOM 0 HA PHE A 36 4.181 -3.086 3.053 1.00 10.00 H new ATOM 0 HB2 PHE A 36 2.537 -3.178 0.880 1.00 10.00 H new ATOM 0 HB3 PHE A 36 2.469 -1.463 1.235 1.00 10.00 H new ATOM 0 HD1 PHE A 36 5.277 -1.097 2.317 1.00 10.00 H new ATOM 0 HD2 PHE A 36 3.818 -3.196 -1.092 1.00 10.00 H new ATOM 0 HE1 PHE A 36 7.454 -0.817 1.216 1.00 10.00 H new ATOM 0 HE2 PHE A 36 5.992 -2.907 -2.201 1.00 10.00 H new ATOM 0 HZ PHE A 36 7.816 -1.721 -1.045 1.00 10.00 H new ATOM 268 N LYS A 37 4.044 -1.075 4.471 1.00 10.00 N ATOM 269 CA LYS A 37 4.027 0.123 5.290 1.00 10.00 C ATOM 270 C LYS A 37 4.676 1.282 4.541 1.00 10.00 C ATOM 271 O LYS A 37 5.897 1.323 4.379 1.00 10.00 O ATOM 272 CB LYS A 37 4.756 -0.136 6.610 1.00 10.00 C ATOM 273 CG LYS A 37 4.750 1.055 7.551 1.00 10.00 C ATOM 274 CD LYS A 37 5.308 0.697 8.918 1.00 10.00 C ATOM 275 CE LYS A 37 4.404 -0.279 9.654 1.00 10.00 C ATOM 276 NZ LYS A 37 4.476 -0.100 11.127 1.00 10.00 N ATOM 0 H LYS A 37 4.884 -1.644 4.575 1.00 10.00 H new ATOM 0 HA LYS A 37 2.993 0.389 5.508 1.00 10.00 H new ATOM 0 HB2 LYS A 37 4.293 -0.986 7.111 1.00 10.00 H new ATOM 0 HB3 LYS A 37 5.788 -0.415 6.397 1.00 10.00 H new ATOM 0 HG2 LYS A 37 5.340 1.863 7.118 1.00 10.00 H new ATOM 0 HG3 LYS A 37 3.731 1.427 7.660 1.00 10.00 H new ATOM 0 HD2 LYS A 37 6.300 0.260 8.803 1.00 10.00 H new ATOM 0 HD3 LYS A 37 5.426 1.603 9.512 1.00 10.00 H new ATOM 0 HE2 LYS A 37 3.375 -0.142 9.322 1.00 10.00 H new ATOM 0 HE3 LYS A 37 4.688 -1.300 9.398 1.00 10.00 H new ATOM 0 HZ1 LYS A 37 3.845 -0.784 11.591 1.00 10.00 H new ATOM 0 HZ2 LYS A 37 5.453 -0.256 11.448 1.00 10.00 H new ATOM 0 HZ3 LYS A 37 4.181 0.866 11.374 1.00 10.00 H new ATOM 290 N VAL A 38 3.850 2.206 4.070 1.00 10.00 N ATOM 291 CA VAL A 38 4.332 3.362 3.328 1.00 10.00 C ATOM 292 C VAL A 38 4.135 4.643 4.137 1.00 10.00 C ATOM 293 O VAL A 38 3.479 4.634 5.182 1.00 10.00 O ATOM 294 CB VAL A 38 3.611 3.501 1.964 1.00 10.00 C ATOM 295 CG1 VAL A 38 3.610 2.175 1.216 1.00 10.00 C ATOM 296 CG2 VAL A 38 2.186 4.008 2.144 1.00 10.00 C ATOM 0 H VAL A 38 2.837 2.177 4.190 1.00 10.00 H new ATOM 0 HA VAL A 38 5.396 3.208 3.146 1.00 10.00 H new ATOM 0 HB VAL A 38 4.160 4.233 1.372 1.00 10.00 H new ATOM 0 HG11 VAL A 38 3.098 2.296 0.261 1.00 10.00 H new ATOM 0 HG12 VAL A 38 4.637 1.856 1.039 1.00 10.00 H new ATOM 0 HG13 VAL A 38 3.094 1.422 1.811 1.00 10.00 H new ATOM 0 HG21 VAL A 38 1.705 4.096 1.170 1.00 10.00 H new ATOM 0 HG22 VAL A 38 1.626 3.307 2.763 1.00 10.00 H new ATOM 0 HG23 VAL A 38 2.206 4.985 2.628 1.00 10.00 H new ATOM 306 N LYS A 39 4.706 5.738 3.660 1.00 10.00 N ATOM 307 CA LYS A 39 4.572 7.017 4.337 1.00 10.00 C ATOM 308 C LYS A 39 3.845 8.005 3.437 1.00 10.00 C ATOM 309 O LYS A 39 3.953 7.940 2.210 1.00 10.00 O ATOM 310 CB LYS A 39 5.939 7.579 4.731 1.00 10.00 C ATOM 311 CG LYS A 39 5.936 8.268 6.086 1.00 10.00 C ATOM 312 CD LYS A 39 7.038 9.306 6.193 1.00 10.00 C ATOM 313 CE LYS A 39 6.588 10.656 5.659 1.00 10.00 C ATOM 314 NZ LYS A 39 7.670 11.669 5.720 1.00 10.00 N ATOM 0 H LYS A 39 5.266 5.766 2.808 1.00 10.00 H new ATOM 0 HA LYS A 39 3.994 6.861 5.248 1.00 10.00 H new ATOM 0 HB2 LYS A 39 6.668 6.768 4.745 1.00 10.00 H new ATOM 0 HB3 LYS A 39 6.266 8.288 3.971 1.00 10.00 H new ATOM 0 HG2 LYS A 39 4.970 8.746 6.249 1.00 10.00 H new ATOM 0 HG3 LYS A 39 6.060 7.524 6.873 1.00 10.00 H new ATOM 0 HD2 LYS A 39 7.342 9.409 7.235 1.00 10.00 H new ATOM 0 HD3 LYS A 39 7.913 8.968 5.638 1.00 10.00 H new ATOM 0 HE2 LYS A 39 6.254 10.544 4.627 1.00 10.00 H new ATOM 0 HE3 LYS A 39 5.731 11.006 6.235 1.00 10.00 H new ATOM 0 HZ1 LYS A 39 7.320 12.574 5.346 1.00 10.00 H new ATOM 0 HZ2 LYS A 39 7.972 11.796 6.707 1.00 10.00 H new ATOM 0 HZ3 LYS A 39 8.478 11.348 5.149 1.00 10.00 H new ATOM 328 N MET A 40 3.112 8.921 4.049 1.00 10.00 N ATOM 329 CA MET A 40 2.351 9.919 3.308 1.00 10.00 C ATOM 330 C MET A 40 3.252 11.053 2.801 1.00 10.00 C ATOM 331 O MET A 40 3.178 12.179 3.291 1.00 10.00 O ATOM 332 CB MET A 40 1.229 10.477 4.195 1.00 10.00 C ATOM 333 CG MET A 40 0.266 11.402 3.465 1.00 10.00 C ATOM 334 SD MET A 40 -0.571 10.599 2.085 1.00 10.00 S ATOM 335 CE MET A 40 -1.636 9.446 2.951 1.00 10.00 C ATOM 0 H MET A 40 3.027 8.996 5.063 1.00 10.00 H new ATOM 0 HA MET A 40 1.913 9.436 2.434 1.00 10.00 H new ATOM 0 HB2 MET A 40 0.667 9.645 4.619 1.00 10.00 H new ATOM 0 HB3 MET A 40 1.675 11.018 5.030 1.00 10.00 H new ATOM 0 HG2 MET A 40 -0.479 11.771 4.170 1.00 10.00 H new ATOM 0 HG3 MET A 40 0.813 12.269 3.096 1.00 10.00 H new ATOM 0 HE1 MET A 40 -1.292 8.427 2.771 1.00 10.00 H new ATOM 0 HE2 MET A 40 -1.606 9.656 4.020 1.00 10.00 H new ATOM 0 HE3 MET A 40 -2.658 9.553 2.589 1.00 10.00 H new ATOM 345 N THR A 41 4.108 10.733 1.829 1.00 10.00 N ATOM 346 CA THR A 41 5.022 11.706 1.227 1.00 10.00 C ATOM 347 C THR A 41 5.981 11.013 0.251 1.00 10.00 C ATOM 348 O THR A 41 6.409 11.608 -0.741 1.00 10.00 O ATOM 349 CB THR A 41 5.814 12.512 2.302 1.00 10.00 C ATOM 350 OG1 THR A 41 5.449 13.896 2.236 1.00 10.00 O ATOM 351 CG2 THR A 41 7.323 12.393 2.139 1.00 10.00 C ATOM 0 H THR A 41 4.187 9.794 1.438 1.00 10.00 H new ATOM 0 HA THR A 41 4.414 12.422 0.673 1.00 10.00 H new ATOM 0 HB THR A 41 5.551 12.086 3.270 1.00 10.00 H new ATOM 0 HG1 THR A 41 5.947 14.398 2.914 1.00 10.00 H new ATOM 0 HG21 THR A 41 7.820 12.975 2.915 1.00 10.00 H new ATOM 0 HG22 THR A 41 7.617 11.347 2.225 1.00 10.00 H new ATOM 0 HG23 THR A 41 7.614 12.772 1.159 1.00 10.00 H new ATOM 359 N THR A 42 6.290 9.747 0.524 1.00 10.00 N ATOM 360 CA THR A 42 7.189 8.982 -0.326 1.00 10.00 C ATOM 361 C THR A 42 6.537 8.674 -1.670 1.00 10.00 C ATOM 362 O THR A 42 5.354 8.334 -1.735 1.00 10.00 O ATOM 363 CB THR A 42 7.598 7.669 0.364 1.00 10.00 C ATOM 364 OG1 THR A 42 7.496 7.827 1.784 1.00 10.00 O ATOM 365 CG2 THR A 42 9.022 7.279 -0.009 1.00 10.00 C ATOM 0 H THR A 42 5.929 9.233 1.328 1.00 10.00 H new ATOM 0 HA THR A 42 8.079 9.587 -0.499 1.00 10.00 H new ATOM 0 HB THR A 42 6.928 6.877 0.030 1.00 10.00 H new ATOM 0 HG1 THR A 42 7.754 6.991 2.226 1.00 10.00 H new ATOM 0 HG21 THR A 42 9.287 6.348 0.492 1.00 10.00 H new ATOM 0 HG22 THR A 42 9.091 7.143 -1.088 1.00 10.00 H new ATOM 0 HG23 THR A 42 9.708 8.066 0.302 1.00 10.00 H new ATOM 373 N HIS A 43 7.310 8.811 -2.738 1.00 10.00 N ATOM 374 CA HIS A 43 6.811 8.545 -4.080 1.00 10.00 C ATOM 375 C HIS A 43 6.598 7.051 -4.266 1.00 10.00 C ATOM 376 O HIS A 43 7.433 6.241 -3.853 1.00 10.00 O ATOM 377 CB HIS A 43 7.792 9.063 -5.138 1.00 10.00 C ATOM 378 CG HIS A 43 8.288 10.456 -4.884 1.00 10.00 C ATOM 379 ND1 HIS A 43 9.588 10.692 -4.507 1.00 10.00 N ATOM 380 CD2 HIS A 43 7.622 11.638 -4.946 1.00 10.00 C ATOM 381 CE1 HIS A 43 9.687 12.001 -4.351 1.00 10.00 C ATOM 382 NE2 HIS A 43 8.522 12.615 -4.606 1.00 10.00 N ATOM 0 H HIS A 43 8.286 9.105 -2.701 1.00 10.00 H new ATOM 0 HA HIS A 43 5.861 9.066 -4.203 1.00 10.00 H new ATOM 0 HB2 HIS A 43 8.646 8.388 -5.187 1.00 10.00 H new ATOM 0 HB3 HIS A 43 7.306 9.034 -6.113 1.00 10.00 H new ATOM 0 HD2 HIS A 43 6.585 11.781 -5.212 1.00 10.00 H new ATOM 0 HE1 HIS A 43 10.592 12.512 -4.056 1.00 10.00 H new ATOM 0 HE2 HIS A 43 8.340 13.617 -4.556 1.00 10.00 H new ATOM 390 N LEU A 44 5.498 6.686 -4.910 1.00 10.00 N ATOM 391 CA LEU A 44 5.178 5.283 -5.136 1.00 10.00 C ATOM 392 C LEU A 44 6.172 4.622 -6.088 1.00 10.00 C ATOM 393 O LEU A 44 6.145 3.407 -6.271 1.00 10.00 O ATOM 394 CB LEU A 44 3.743 5.138 -5.648 1.00 10.00 C ATOM 395 CG LEU A 44 2.669 5.260 -4.560 1.00 10.00 C ATOM 396 CD1 LEU A 44 1.308 5.547 -5.173 1.00 10.00 C ATOM 397 CD2 LEU A 44 2.615 3.991 -3.721 1.00 10.00 C ATOM 0 H LEU A 44 4.812 7.341 -5.285 1.00 10.00 H new ATOM 0 HA LEU A 44 5.258 4.765 -4.180 1.00 10.00 H new ATOM 0 HB2 LEU A 44 3.562 5.899 -6.407 1.00 10.00 H new ATOM 0 HB3 LEU A 44 3.640 4.169 -6.136 1.00 10.00 H new ATOM 0 HG LEU A 44 2.935 6.095 -3.912 1.00 10.00 H new ATOM 0 HD11 LEU A 44 0.563 5.629 -4.382 1.00 10.00 H new ATOM 0 HD12 LEU A 44 1.350 6.483 -5.731 1.00 10.00 H new ATOM 0 HD13 LEU A 44 1.034 4.735 -5.847 1.00 10.00 H new ATOM 0 HD21 LEU A 44 1.848 4.094 -2.954 1.00 10.00 H new ATOM 0 HD22 LEU A 44 2.376 3.142 -4.361 1.00 10.00 H new ATOM 0 HD23 LEU A 44 3.583 3.827 -3.247 1.00 10.00 H new ATOM 409 N LYS A 45 7.055 5.425 -6.679 1.00 10.00 N ATOM 410 CA LYS A 45 8.078 4.916 -7.585 1.00 10.00 C ATOM 411 C LYS A 45 8.940 3.883 -6.867 1.00 10.00 C ATOM 412 O LYS A 45 9.149 2.775 -7.369 1.00 10.00 O ATOM 413 CB LYS A 45 8.952 6.069 -8.100 1.00 10.00 C ATOM 414 CG LYS A 45 10.217 5.623 -8.830 1.00 10.00 C ATOM 415 CD LYS A 45 9.893 4.783 -10.055 1.00 10.00 C ATOM 416 CE LYS A 45 11.146 4.376 -10.814 1.00 10.00 C ATOM 417 NZ LYS A 45 10.836 3.494 -11.972 1.00 10.00 N ATOM 0 H LYS A 45 7.081 6.436 -6.544 1.00 10.00 H new ATOM 0 HA LYS A 45 7.591 4.441 -8.436 1.00 10.00 H new ATOM 0 HB2 LYS A 45 8.358 6.687 -8.773 1.00 10.00 H new ATOM 0 HB3 LYS A 45 9.236 6.698 -7.257 1.00 10.00 H new ATOM 0 HG2 LYS A 45 10.791 6.499 -9.131 1.00 10.00 H new ATOM 0 HG3 LYS A 45 10.846 5.048 -8.150 1.00 10.00 H new ATOM 0 HD2 LYS A 45 9.349 3.890 -9.748 1.00 10.00 H new ATOM 0 HD3 LYS A 45 9.235 5.346 -10.717 1.00 10.00 H new ATOM 0 HE2 LYS A 45 11.662 5.269 -11.167 1.00 10.00 H new ATOM 0 HE3 LYS A 45 11.828 3.860 -10.138 1.00 10.00 H new ATOM 0 HZ1 LYS A 45 11.649 3.473 -12.620 1.00 10.00 H new ATOM 0 HZ2 LYS A 45 10.639 2.531 -11.632 1.00 10.00 H new ATOM 0 HZ3 LYS A 45 10.003 3.861 -12.474 1.00 10.00 H new ATOM 431 N LYS A 46 9.417 4.247 -5.679 1.00 10.00 N ATOM 432 CA LYS A 46 10.253 3.355 -4.888 1.00 10.00 C ATOM 433 C LYS A 46 9.428 2.191 -4.348 1.00 10.00 C ATOM 434 O LYS A 46 9.917 1.070 -4.240 1.00 10.00 O ATOM 435 CB LYS A 46 10.922 4.116 -3.735 1.00 10.00 C ATOM 436 CG LYS A 46 11.660 3.211 -2.756 1.00 10.00 C ATOM 437 CD LYS A 46 12.780 3.942 -2.033 1.00 10.00 C ATOM 438 CE LYS A 46 12.244 4.993 -1.076 1.00 10.00 C ATOM 439 NZ LYS A 46 13.318 5.562 -0.222 1.00 10.00 N ATOM 0 H LYS A 46 9.238 5.153 -5.246 1.00 10.00 H new ATOM 0 HA LYS A 46 11.035 2.957 -5.535 1.00 10.00 H new ATOM 0 HB2 LYS A 46 11.624 4.841 -4.148 1.00 10.00 H new ATOM 0 HB3 LYS A 46 10.163 4.680 -3.194 1.00 10.00 H new ATOM 0 HG2 LYS A 46 10.954 2.817 -2.025 1.00 10.00 H new ATOM 0 HG3 LYS A 46 12.073 2.357 -3.293 1.00 10.00 H new ATOM 0 HD2 LYS A 46 13.386 3.223 -1.481 1.00 10.00 H new ATOM 0 HD3 LYS A 46 13.435 4.416 -2.764 1.00 10.00 H new ATOM 0 HE2 LYS A 46 11.769 5.793 -1.644 1.00 10.00 H new ATOM 0 HE3 LYS A 46 11.474 4.550 -0.444 1.00 10.00 H new ATOM 0 HZ1 LYS A 46 12.912 6.275 0.417 1.00 10.00 H new ATOM 0 HZ2 LYS A 46 13.754 4.803 0.339 1.00 10.00 H new ATOM 0 HZ3 LYS A 46 14.040 6.007 -0.823 1.00 10.00 H new ATOM 453 N LEU A 47 8.168 2.458 -4.030 1.00 10.00 N ATOM 454 CA LEU A 47 7.280 1.428 -3.499 1.00 10.00 C ATOM 455 C LEU A 47 7.026 0.342 -4.539 1.00 10.00 C ATOM 456 O LEU A 47 7.085 -0.850 -4.235 1.00 10.00 O ATOM 457 CB LEU A 47 5.946 2.040 -3.045 1.00 10.00 C ATOM 458 CG LEU A 47 5.940 2.684 -1.650 1.00 10.00 C ATOM 459 CD1 LEU A 47 6.642 1.793 -0.641 1.00 10.00 C ATOM 460 CD2 LEU A 47 6.578 4.064 -1.679 1.00 10.00 C ATOM 0 H LEU A 47 7.737 3.377 -4.130 1.00 10.00 H new ATOM 0 HA LEU A 47 7.771 0.977 -2.636 1.00 10.00 H new ATOM 0 HB2 LEU A 47 5.649 2.795 -3.773 1.00 10.00 H new ATOM 0 HB3 LEU A 47 5.185 1.260 -3.066 1.00 10.00 H new ATOM 0 HG LEU A 47 4.901 2.800 -1.342 1.00 10.00 H new ATOM 0 HD11 LEU A 47 6.625 2.270 0.339 1.00 10.00 H new ATOM 0 HD12 LEU A 47 6.130 0.832 -0.586 1.00 10.00 H new ATOM 0 HD13 LEU A 47 7.675 1.637 -0.951 1.00 10.00 H new ATOM 0 HD21 LEU A 47 6.559 4.495 -0.678 1.00 10.00 H new ATOM 0 HD22 LEU A 47 7.610 3.981 -2.019 1.00 10.00 H new ATOM 0 HD23 LEU A 47 6.022 4.707 -2.361 1.00 10.00 H new ATOM 472 N LYS A 48 6.764 0.765 -5.768 1.00 10.00 N ATOM 473 CA LYS A 48 6.492 -0.160 -6.859 1.00 10.00 C ATOM 474 C LYS A 48 7.671 -1.098 -7.110 1.00 10.00 C ATOM 475 O LYS A 48 7.489 -2.306 -7.271 1.00 10.00 O ATOM 476 CB LYS A 48 6.150 0.609 -8.140 1.00 10.00 C ATOM 477 CG LYS A 48 4.773 1.261 -8.118 1.00 10.00 C ATOM 478 CD LYS A 48 4.538 2.117 -9.356 1.00 10.00 C ATOM 479 CE LYS A 48 4.343 1.266 -10.602 1.00 10.00 C ATOM 480 NZ LYS A 48 4.200 2.100 -11.822 1.00 10.00 N ATOM 0 H LYS A 48 6.734 1.749 -6.035 1.00 10.00 H new ATOM 0 HA LYS A 48 5.636 -0.768 -6.567 1.00 10.00 H new ATOM 0 HB2 LYS A 48 6.904 1.380 -8.302 1.00 10.00 H new ATOM 0 HB3 LYS A 48 6.205 -0.074 -8.988 1.00 10.00 H new ATOM 0 HG2 LYS A 48 4.005 0.489 -8.057 1.00 10.00 H new ATOM 0 HG3 LYS A 48 4.676 1.878 -7.225 1.00 10.00 H new ATOM 0 HD2 LYS A 48 3.660 2.744 -9.203 1.00 10.00 H new ATOM 0 HD3 LYS A 48 5.386 2.786 -9.502 1.00 10.00 H new ATOM 0 HE2 LYS A 48 5.192 0.593 -10.719 1.00 10.00 H new ATOM 0 HE3 LYS A 48 3.457 0.643 -10.482 1.00 10.00 H new ATOM 0 HZ1 LYS A 48 4.357 1.512 -12.665 1.00 10.00 H new ATOM 0 HZ2 LYS A 48 3.243 2.505 -11.856 1.00 10.00 H new ATOM 0 HZ3 LYS A 48 4.900 2.869 -11.801 1.00 10.00 H new ATOM 494 N GLU A 49 8.881 -0.551 -7.126 1.00 10.00 N ATOM 495 CA GLU A 49 10.063 -1.367 -7.371 1.00 10.00 C ATOM 496 C GLU A 49 10.413 -2.213 -6.150 1.00 10.00 C ATOM 497 O GLU A 49 10.860 -3.349 -6.296 1.00 10.00 O ATOM 498 CB GLU A 49 11.259 -0.514 -7.802 1.00 10.00 C ATOM 499 CG GLU A 49 11.652 0.575 -6.819 1.00 10.00 C ATOM 500 CD GLU A 49 12.892 1.323 -7.262 1.00 10.00 C ATOM 501 OE1 GLU A 49 13.595 0.828 -8.171 1.00 10.00 O ATOM 502 OE2 GLU A 49 13.172 2.407 -6.708 1.00 10.00 O ATOM 0 H GLU A 49 9.068 0.440 -6.974 1.00 10.00 H new ATOM 0 HA GLU A 49 9.824 -2.041 -8.194 1.00 10.00 H new ATOM 0 HB2 GLU A 49 12.116 -1.169 -7.959 1.00 10.00 H new ATOM 0 HB3 GLU A 49 11.030 -0.052 -8.762 1.00 10.00 H new ATOM 0 HG2 GLU A 49 10.826 1.277 -6.708 1.00 10.00 H new ATOM 0 HG3 GLU A 49 11.828 0.132 -5.839 1.00 10.00 H new ATOM 509 N SER A 50 10.188 -1.673 -4.952 1.00 10.00 N ATOM 510 CA SER A 50 10.479 -2.407 -3.722 1.00 10.00 C ATOM 511 C SER A 50 9.660 -3.692 -3.665 1.00 10.00 C ATOM 512 O SER A 50 10.138 -4.730 -3.209 1.00 10.00 O ATOM 513 CB SER A 50 10.194 -1.544 -2.494 1.00 10.00 C ATOM 514 OG SER A 50 11.100 -0.460 -2.418 1.00 10.00 O ATOM 0 H SER A 50 9.808 -0.737 -4.808 1.00 10.00 H new ATOM 0 HA SER A 50 11.538 -2.665 -3.722 1.00 10.00 H new ATOM 0 HB2 SER A 50 9.172 -1.167 -2.539 1.00 10.00 H new ATOM 0 HB3 SER A 50 10.271 -2.151 -1.592 1.00 10.00 H new ATOM 0 HG SER A 50 10.825 0.241 -3.046 1.00 10.00 H new ATOM 520 N TYR A 51 8.421 -3.618 -4.144 1.00 10.00 N ATOM 521 CA TYR A 51 7.546 -4.782 -4.178 1.00 10.00 C ATOM 522 C TYR A 51 8.130 -5.833 -5.118 1.00 10.00 C ATOM 523 O TYR A 51 8.122 -7.027 -4.821 1.00 10.00 O ATOM 524 CB TYR A 51 6.147 -4.378 -4.645 1.00 10.00 C ATOM 525 CG TYR A 51 5.092 -5.437 -4.411 1.00 10.00 C ATOM 526 CD1 TYR A 51 4.409 -5.507 -3.204 1.00 10.00 C ATOM 527 CD2 TYR A 51 4.777 -6.363 -5.397 1.00 10.00 C ATOM 528 CE1 TYR A 51 3.444 -6.470 -2.988 1.00 10.00 C ATOM 529 CE2 TYR A 51 3.813 -7.328 -5.187 1.00 10.00 C ATOM 530 CZ TYR A 51 3.151 -7.378 -3.979 1.00 10.00 C ATOM 531 OH TYR A 51 2.191 -8.337 -3.765 1.00 10.00 O ATOM 0 H TYR A 51 8.002 -2.764 -4.513 1.00 10.00 H new ATOM 0 HA TYR A 51 7.469 -5.201 -3.175 1.00 10.00 H new ATOM 0 HB2 TYR A 51 5.852 -3.465 -4.128 1.00 10.00 H new ATOM 0 HB3 TYR A 51 6.183 -4.144 -5.709 1.00 10.00 H new ATOM 0 HD1 TYR A 51 4.636 -4.797 -2.422 1.00 10.00 H new ATOM 0 HD2 TYR A 51 5.295 -6.327 -6.344 1.00 10.00 H new ATOM 0 HE1 TYR A 51 2.921 -6.510 -2.044 1.00 10.00 H new ATOM 0 HE2 TYR A 51 3.579 -8.040 -5.965 1.00 10.00 H new ATOM 0 HH TYR A 51 2.486 -9.188 -4.152 1.00 10.00 H new ATOM 541 N CYS A 52 8.654 -5.364 -6.244 1.00 10.00 N ATOM 542 CA CYS A 52 9.258 -6.240 -7.237 1.00 10.00 C ATOM 543 C CYS A 52 10.488 -6.930 -6.649 1.00 10.00 C ATOM 544 O CYS A 52 10.718 -8.118 -6.883 1.00 10.00 O ATOM 545 CB CYS A 52 9.636 -5.440 -8.487 1.00 10.00 C ATOM 546 SG CYS A 52 8.268 -4.488 -9.195 1.00 10.00 S ATOM 0 H CYS A 52 8.672 -4.375 -6.492 1.00 10.00 H new ATOM 0 HA CYS A 52 8.535 -7.004 -7.522 1.00 10.00 H new ATOM 0 HB2 CYS A 52 10.449 -4.758 -8.237 1.00 10.00 H new ATOM 0 HB3 CYS A 52 10.017 -6.126 -9.243 1.00 10.00 H new ATOM 0 HG CYS A 52 7.825 -3.642 -8.312 1.00 10.00 H new ATOM 552 N GLN A 53 11.258 -6.182 -5.859 1.00 10.00 N ATOM 553 CA GLN A 53 12.458 -6.716 -5.217 1.00 10.00 C ATOM 554 C GLN A 53 12.075 -7.782 -4.199 1.00 10.00 C ATOM 555 O GLN A 53 12.780 -8.777 -4.026 1.00 10.00 O ATOM 556 CB GLN A 53 13.242 -5.597 -4.521 1.00 10.00 C ATOM 557 CG GLN A 53 13.584 -4.429 -5.434 1.00 10.00 C ATOM 558 CD GLN A 53 13.954 -3.174 -4.665 1.00 10.00 C ATOM 559 OE1 GLN A 53 13.549 -2.992 -3.517 1.00 10.00 O ATOM 560 NE2 GLN A 53 14.710 -2.290 -5.296 1.00 10.00 N ATOM 0 H GLN A 53 11.071 -5.202 -5.648 1.00 10.00 H new ATOM 0 HA GLN A 53 13.090 -7.161 -5.986 1.00 10.00 H new ATOM 0 HB2 GLN A 53 12.659 -5.228 -3.677 1.00 10.00 H new ATOM 0 HB3 GLN A 53 14.165 -6.011 -4.114 1.00 10.00 H new ATOM 0 HG2 GLN A 53 14.414 -4.711 -6.082 1.00 10.00 H new ATOM 0 HG3 GLN A 53 12.732 -4.217 -6.080 1.00 10.00 H new ATOM 0 HE21 GLN A 53 15.026 -2.476 -6.248 1.00 10.00 H new ATOM 0 HE22 GLN A 53 14.976 -1.422 -4.831 1.00 10.00 H new ATOM 569 N ARG A 54 10.947 -7.561 -3.530 1.00 10.00 N ATOM 570 CA ARG A 54 10.440 -8.494 -2.528 1.00 10.00 C ATOM 571 C ARG A 54 9.998 -9.801 -3.180 1.00 10.00 C ATOM 572 O ARG A 54 10.186 -10.881 -2.619 1.00 10.00 O ATOM 573 CB ARG A 54 9.262 -7.868 -1.781 1.00 10.00 C ATOM 574 CG ARG A 54 8.820 -8.649 -0.555 1.00 10.00 C ATOM 575 CD ARG A 54 9.760 -8.426 0.615 1.00 10.00 C ATOM 576 NE ARG A 54 9.134 -8.759 1.893 1.00 10.00 N ATOM 577 CZ ARG A 54 9.361 -8.105 3.029 1.00 10.00 C ATOM 578 NH1 ARG A 54 10.190 -7.065 3.052 1.00 10.00 N ATOM 579 NH2 ARG A 54 8.752 -8.487 4.142 1.00 10.00 N ATOM 0 H ARG A 54 10.362 -6.736 -3.665 1.00 10.00 H new ATOM 0 HA ARG A 54 11.243 -8.710 -1.824 1.00 10.00 H new ATOM 0 HB2 ARG A 54 9.534 -6.858 -1.476 1.00 10.00 H new ATOM 0 HB3 ARG A 54 8.418 -7.778 -2.465 1.00 10.00 H new ATOM 0 HG2 ARG A 54 7.811 -8.348 -0.275 1.00 10.00 H new ATOM 0 HG3 ARG A 54 8.781 -9.712 -0.794 1.00 10.00 H new ATOM 0 HD2 ARG A 54 10.655 -9.033 0.481 1.00 10.00 H new ATOM 0 HD3 ARG A 54 10.080 -7.384 0.629 1.00 10.00 H new ATOM 0 HE ARG A 54 8.482 -9.543 1.915 1.00 10.00 H new ATOM 0 HH11 ARG A 54 10.656 -6.765 2.196 1.00 10.00 H new ATOM 0 HH12 ARG A 54 10.360 -6.568 3.926 1.00 10.00 H new ATOM 0 HH21 ARG A 54 8.111 -9.280 4.126 1.00 10.00 H new ATOM 0 HH22 ARG A 54 8.924 -7.988 5.015 1.00 10.00 H new ATOM 593 N GLN A 55 9.403 -9.697 -4.361 1.00 10.00 N ATOM 594 CA GLN A 55 8.937 -10.875 -5.082 1.00 10.00 C ATOM 595 C GLN A 55 10.090 -11.550 -5.820 1.00 10.00 C ATOM 596 O GLN A 55 10.084 -12.760 -6.031 1.00 10.00 O ATOM 597 CB GLN A 55 7.834 -10.496 -6.074 1.00 10.00 C ATOM 598 CG GLN A 55 6.628 -9.821 -5.436 1.00 10.00 C ATOM 599 CD GLN A 55 6.109 -10.564 -4.219 1.00 10.00 C ATOM 600 OE1 GLN A 55 6.499 -10.279 -3.089 1.00 10.00 O ATOM 601 NE2 GLN A 55 5.223 -11.522 -4.440 1.00 10.00 N ATOM 0 H GLN A 55 9.232 -8.812 -4.839 1.00 10.00 H new ATOM 0 HA GLN A 55 8.531 -11.577 -4.353 1.00 10.00 H new ATOM 0 HB2 GLN A 55 8.252 -9.830 -6.829 1.00 10.00 H new ATOM 0 HB3 GLN A 55 7.501 -11.396 -6.592 1.00 10.00 H new ATOM 0 HG2 GLN A 55 6.897 -8.805 -5.147 1.00 10.00 H new ATOM 0 HG3 GLN A 55 5.830 -9.742 -6.174 1.00 10.00 H new ATOM 0 HE21 GLN A 55 4.923 -11.730 -5.393 1.00 10.00 H new ATOM 0 HE22 GLN A 55 4.840 -12.053 -3.658 1.00 10.00 H new ATOM 610 N GLY A 56 11.075 -10.755 -6.216 1.00 10.00 N ATOM 611 CA GLY A 56 12.222 -11.289 -6.922 1.00 10.00 C ATOM 612 C GLY A 56 12.083 -11.156 -8.427 1.00 10.00 C ATOM 613 O GLY A 56 12.594 -11.984 -9.183 1.00 10.00 O ATOM 0 H GLY A 56 11.100 -9.747 -6.060 1.00 10.00 H new ATOM 0 HA2 GLY A 56 13.122 -10.769 -6.595 1.00 10.00 H new ATOM 0 HA3 GLY A 56 12.349 -12.340 -6.662 1.00 10.00 H new ATOM 617 N VAL A 57 11.391 -10.113 -8.863 1.00 10.00 N ATOM 618 CA VAL A 57 11.175 -9.864 -10.283 1.00 10.00 C ATOM 619 C VAL A 57 11.540 -8.424 -10.626 1.00 10.00 C ATOM 620 O VAL A 57 11.529 -7.559 -9.750 1.00 10.00 O ATOM 621 CB VAL A 57 9.703 -10.126 -10.691 1.00 10.00 C ATOM 622 CG1 VAL A 57 9.401 -11.615 -10.698 1.00 10.00 C ATOM 623 CG2 VAL A 57 8.744 -9.394 -9.763 1.00 10.00 C ATOM 0 H VAL A 57 10.966 -9.419 -8.248 1.00 10.00 H new ATOM 0 HA VAL A 57 11.815 -10.552 -10.836 1.00 10.00 H new ATOM 0 HB VAL A 57 9.562 -9.742 -11.701 1.00 10.00 H new ATOM 0 HG11 VAL A 57 8.362 -11.774 -10.987 1.00 10.00 H new ATOM 0 HG12 VAL A 57 10.057 -12.116 -11.410 1.00 10.00 H new ATOM 0 HG13 VAL A 57 9.567 -12.025 -9.702 1.00 10.00 H new ATOM 0 HG21 VAL A 57 7.717 -9.594 -10.070 1.00 10.00 H new ATOM 0 HG22 VAL A 57 8.891 -9.741 -8.740 1.00 10.00 H new ATOM 0 HG23 VAL A 57 8.936 -8.322 -9.813 1.00 10.00 H new ATOM 633 N PRO A 58 11.885 -8.148 -11.895 1.00 10.00 N ATOM 634 CA PRO A 58 12.233 -6.792 -12.338 1.00 10.00 C ATOM 635 C PRO A 58 11.026 -5.861 -12.290 1.00 10.00 C ATOM 636 O PRO A 58 9.883 -6.317 -12.320 1.00 10.00 O ATOM 637 CB PRO A 58 12.701 -6.992 -13.785 1.00 10.00 C ATOM 638 CG PRO A 58 12.078 -8.270 -14.222 1.00 10.00 C ATOM 639 CD PRO A 58 11.979 -9.128 -12.991 1.00 10.00 C ATOM 0 HA PRO A 58 12.987 -6.330 -11.702 1.00 10.00 H new ATOM 0 HB2 PRO A 58 12.386 -6.163 -14.419 1.00 10.00 H new ATOM 0 HB3 PRO A 58 13.788 -7.043 -13.844 1.00 10.00 H new ATOM 0 HG2 PRO A 58 11.093 -8.095 -14.655 1.00 10.00 H new ATOM 0 HG3 PRO A 58 12.682 -8.756 -14.988 1.00 10.00 H new ATOM 0 HD2 PRO A 58 11.105 -9.778 -13.024 1.00 10.00 H new ATOM 0 HD3 PRO A 58 12.851 -9.772 -12.880 1.00 10.00 H new ATOM 647 N MET A 59 11.269 -4.561 -12.218 1.00 10.00 N ATOM 648 CA MET A 59 10.177 -3.598 -12.157 1.00 10.00 C ATOM 649 C MET A 59 9.388 -3.577 -13.465 1.00 10.00 C ATOM 650 O MET A 59 9.899 -3.981 -14.509 1.00 10.00 O ATOM 651 CB MET A 59 10.702 -2.197 -11.839 1.00 10.00 C ATOM 652 CG MET A 59 9.636 -1.273 -11.274 1.00 10.00 C ATOM 653 SD MET A 59 10.124 0.460 -11.287 1.00 10.00 S ATOM 654 CE MET A 59 8.615 1.216 -10.693 1.00 10.00 C ATOM 0 H MET A 59 12.202 -4.150 -12.200 1.00 10.00 H new ATOM 0 HA MET A 59 9.508 -3.910 -11.355 1.00 10.00 H new ATOM 0 HB2 MET A 59 11.521 -2.276 -11.124 1.00 10.00 H new ATOM 0 HB3 MET A 59 11.113 -1.755 -12.747 1.00 10.00 H new ATOM 0 HG2 MET A 59 8.719 -1.390 -11.851 1.00 10.00 H new ATOM 0 HG3 MET A 59 9.409 -1.573 -10.251 1.00 10.00 H new ATOM 0 HE1 MET A 59 8.519 2.216 -11.115 1.00 10.00 H new ATOM 0 HE2 MET A 59 7.761 0.610 -10.996 1.00 10.00 H new ATOM 0 HE3 MET A 59 8.645 1.282 -9.605 1.00 10.00 H new ATOM 664 N ASN A 60 8.128 -3.135 -13.374 1.00 10.00 N ATOM 665 CA ASN A 60 7.212 -3.024 -14.522 1.00 10.00 C ATOM 666 C ASN A 60 6.609 -4.376 -14.905 1.00 10.00 C ATOM 667 O ASN A 60 5.693 -4.440 -15.723 1.00 10.00 O ATOM 668 CB ASN A 60 7.897 -2.375 -15.735 1.00 10.00 C ATOM 669 CG ASN A 60 6.906 -1.761 -16.714 1.00 10.00 C ATOM 670 OD1 ASN A 60 6.348 -0.692 -16.459 1.00 10.00 O ATOM 671 ND2 ASN A 60 6.697 -2.418 -17.849 1.00 10.00 N ATOM 0 H ASN A 60 7.708 -2.840 -12.492 1.00 10.00 H new ATOM 0 HA ASN A 60 6.396 -2.373 -14.207 1.00 10.00 H new ATOM 0 HB2 ASN A 60 8.584 -1.603 -15.388 1.00 10.00 H new ATOM 0 HB3 ASN A 60 8.495 -3.125 -16.253 1.00 10.00 H new ATOM 0 HD21 ASN A 60 6.056 -2.040 -18.546 1.00 10.00 H new ATOM 0 HD22 ASN A 60 7.178 -3.300 -18.023 1.00 10.00 H new ATOM 678 N SER A 61 7.101 -5.452 -14.302 1.00 10.00 N ATOM 679 CA SER A 61 6.577 -6.781 -14.592 1.00 10.00 C ATOM 680 C SER A 61 5.229 -6.970 -13.905 1.00 10.00 C ATOM 681 O SER A 61 4.404 -7.780 -14.329 1.00 10.00 O ATOM 682 CB SER A 61 7.559 -7.859 -14.127 1.00 10.00 C ATOM 683 OG SER A 61 7.772 -7.778 -12.729 1.00 10.00 O ATOM 0 H SER A 61 7.855 -5.431 -13.615 1.00 10.00 H new ATOM 0 HA SER A 61 6.445 -6.875 -15.670 1.00 10.00 H new ATOM 0 HB2 SER A 61 7.171 -8.845 -14.384 1.00 10.00 H new ATOM 0 HB3 SER A 61 8.508 -7.743 -14.651 1.00 10.00 H new ATOM 0 HG SER A 61 8.378 -7.033 -12.533 1.00 10.00 H new ATOM 689 N LEU A 62 5.015 -6.200 -12.847 1.00 10.00 N ATOM 690 CA LEU A 62 3.780 -6.260 -12.089 1.00 10.00 C ATOM 691 C LEU A 62 3.042 -4.934 -12.192 1.00 10.00 C ATOM 692 O LEU A 62 3.661 -3.868 -12.194 1.00 10.00 O ATOM 693 CB LEU A 62 4.071 -6.574 -10.618 1.00 10.00 C ATOM 694 CG LEU A 62 4.845 -7.868 -10.363 1.00 10.00 C ATOM 695 CD1 LEU A 62 5.300 -7.936 -8.914 1.00 10.00 C ATOM 696 CD2 LEU A 62 3.991 -9.080 -10.708 1.00 10.00 C ATOM 0 H LEU A 62 5.690 -5.521 -12.494 1.00 10.00 H new ATOM 0 HA LEU A 62 3.157 -7.053 -12.503 1.00 10.00 H new ATOM 0 HB2 LEU A 62 4.634 -5.744 -10.192 1.00 10.00 H new ATOM 0 HB3 LEU A 62 3.124 -6.626 -10.081 1.00 10.00 H new ATOM 0 HG LEU A 62 5.726 -7.874 -11.005 1.00 10.00 H new ATOM 0 HD11 LEU A 62 5.849 -8.863 -8.748 1.00 10.00 H new ATOM 0 HD12 LEU A 62 5.947 -7.086 -8.696 1.00 10.00 H new ATOM 0 HD13 LEU A 62 4.430 -7.908 -8.258 1.00 10.00 H new ATOM 0 HD21 LEU A 62 4.559 -9.991 -10.520 1.00 10.00 H new ATOM 0 HD22 LEU A 62 3.092 -9.079 -10.091 1.00 10.00 H new ATOM 0 HD23 LEU A 62 3.709 -9.039 -11.760 1.00 10.00 H new ATOM 708 N ARG A 63 1.727 -5.003 -12.295 1.00 10.00 N ATOM 709 CA ARG A 63 0.906 -3.806 -12.382 1.00 10.00 C ATOM 710 C ARG A 63 0.046 -3.670 -11.135 1.00 10.00 C ATOM 711 O ARG A 63 -0.631 -4.616 -10.724 1.00 10.00 O ATOM 712 CB ARG A 63 0.024 -3.824 -13.637 1.00 10.00 C ATOM 713 CG ARG A 63 -0.937 -5.001 -13.709 1.00 10.00 C ATOM 714 CD ARG A 63 -1.750 -4.974 -14.992 1.00 10.00 C ATOM 715 NE ARG A 63 -2.681 -6.101 -15.081 1.00 10.00 N ATOM 716 CZ ARG A 63 -2.794 -6.895 -16.150 1.00 10.00 C ATOM 717 NH1 ARG A 63 -1.991 -6.738 -17.198 1.00 10.00 N ATOM 718 NH2 ARG A 63 -3.708 -7.858 -16.160 1.00 10.00 N ATOM 0 H ARG A 63 1.202 -5.877 -12.321 1.00 10.00 H new ATOM 0 HA ARG A 63 1.571 -2.945 -12.453 1.00 10.00 H new ATOM 0 HB2 ARG A 63 -0.550 -2.898 -13.677 1.00 10.00 H new ATOM 0 HB3 ARG A 63 0.666 -3.839 -14.518 1.00 10.00 H new ATOM 0 HG2 ARG A 63 -0.377 -5.934 -13.651 1.00 10.00 H new ATOM 0 HG3 ARG A 63 -1.608 -4.978 -12.850 1.00 10.00 H new ATOM 0 HD2 ARG A 63 -2.308 -4.039 -15.047 1.00 10.00 H new ATOM 0 HD3 ARG A 63 -1.075 -4.994 -15.848 1.00 10.00 H new ATOM 0 HE ARG A 63 -3.280 -6.292 -14.278 1.00 10.00 H new ATOM 0 HH11 ARG A 63 -1.280 -6.006 -17.191 1.00 10.00 H new ATOM 0 HH12 ARG A 63 -2.085 -7.349 -18.009 1.00 10.00 H new ATOM 0 HH21 ARG A 63 -4.320 -7.989 -15.354 1.00 10.00 H new ATOM 0 HH22 ARG A 63 -3.798 -8.467 -16.973 1.00 10.00 H new ATOM 732 N PHE A 64 0.093 -2.496 -10.530 1.00 10.00 N ATOM 733 CA PHE A 64 -0.678 -2.226 -9.330 1.00 10.00 C ATOM 734 C PHE A 64 -1.978 -1.538 -9.698 1.00 10.00 C ATOM 735 O PHE A 64 -1.971 -0.500 -10.362 1.00 10.00 O ATOM 736 CB PHE A 64 0.125 -1.357 -8.363 1.00 10.00 C ATOM 737 CG PHE A 64 1.391 -2.010 -7.892 1.00 10.00 C ATOM 738 CD1 PHE A 64 2.572 -1.855 -8.601 1.00 10.00 C ATOM 739 CD2 PHE A 64 1.396 -2.791 -6.747 1.00 10.00 C ATOM 740 CE1 PHE A 64 3.735 -2.465 -8.178 1.00 10.00 C ATOM 741 CE2 PHE A 64 2.557 -3.402 -6.316 1.00 10.00 C ATOM 742 CZ PHE A 64 3.729 -3.239 -7.034 1.00 10.00 C ATOM 0 H PHE A 64 0.660 -1.712 -10.852 1.00 10.00 H new ATOM 0 HA PHE A 64 -0.903 -3.171 -8.837 1.00 10.00 H new ATOM 0 HB2 PHE A 64 0.370 -0.414 -8.851 1.00 10.00 H new ATOM 0 HB3 PHE A 64 -0.495 -1.117 -7.499 1.00 10.00 H new ATOM 0 HD1 PHE A 64 2.582 -1.249 -9.495 1.00 10.00 H new ATOM 0 HD2 PHE A 64 0.483 -2.923 -6.186 1.00 10.00 H new ATOM 0 HE1 PHE A 64 4.648 -2.338 -8.740 1.00 10.00 H new ATOM 0 HE2 PHE A 64 2.550 -4.006 -5.421 1.00 10.00 H new ATOM 0 HZ PHE A 64 4.638 -3.717 -6.700 1.00 10.00 H new ATOM 752 N LEU A 65 -3.084 -2.118 -9.270 1.00 10.00 N ATOM 753 CA LEU A 65 -4.392 -1.566 -9.568 1.00 10.00 C ATOM 754 C LEU A 65 -5.093 -1.114 -8.297 1.00 10.00 C ATOM 755 O LEU A 65 -5.217 -1.872 -7.333 1.00 10.00 O ATOM 756 CB LEU A 65 -5.251 -2.597 -10.305 1.00 10.00 C ATOM 757 CG LEU A 65 -4.738 -3.000 -11.691 1.00 10.00 C ATOM 758 CD1 LEU A 65 -5.569 -4.142 -12.253 1.00 10.00 C ATOM 759 CD2 LEU A 65 -4.754 -1.809 -12.641 1.00 10.00 C ATOM 0 H LEU A 65 -3.102 -2.973 -8.714 1.00 10.00 H new ATOM 0 HA LEU A 65 -4.254 -0.697 -10.211 1.00 10.00 H new ATOM 0 HB2 LEU A 65 -5.325 -3.492 -9.688 1.00 10.00 H new ATOM 0 HB3 LEU A 65 -6.260 -2.198 -10.410 1.00 10.00 H new ATOM 0 HG LEU A 65 -3.707 -3.339 -11.589 1.00 10.00 H new ATOM 0 HD11 LEU A 65 -5.191 -4.416 -13.238 1.00 10.00 H new ATOM 0 HD12 LEU A 65 -5.503 -5.002 -11.587 1.00 10.00 H new ATOM 0 HD13 LEU A 65 -6.609 -3.828 -12.338 1.00 10.00 H new ATOM 0 HD21 LEU A 65 -4.386 -2.119 -13.619 1.00 10.00 H new ATOM 0 HD22 LEU A 65 -5.773 -1.435 -12.739 1.00 10.00 H new ATOM 0 HD23 LEU A 65 -4.115 -1.020 -12.246 1.00 10.00 H new ATOM 771 N PHE A 66 -5.517 0.136 -8.302 1.00 10.00 N ATOM 772 CA PHE A 66 -6.222 0.721 -7.180 1.00 10.00 C ATOM 773 C PHE A 66 -7.550 1.283 -7.666 1.00 10.00 C ATOM 774 O PHE A 66 -7.593 2.351 -8.279 1.00 10.00 O ATOM 775 CB PHE A 66 -5.372 1.822 -6.533 1.00 10.00 C ATOM 776 CG PHE A 66 -5.954 2.377 -5.264 1.00 10.00 C ATOM 777 CD1 PHE A 66 -5.934 1.636 -4.094 1.00 10.00 C ATOM 778 CD2 PHE A 66 -6.522 3.642 -5.242 1.00 10.00 C ATOM 779 CE1 PHE A 66 -6.471 2.143 -2.925 1.00 10.00 C ATOM 780 CE2 PHE A 66 -7.059 4.156 -4.077 1.00 10.00 C ATOM 781 CZ PHE A 66 -7.034 3.405 -2.916 1.00 10.00 C ATOM 0 H PHE A 66 -5.381 0.774 -9.086 1.00 10.00 H new ATOM 0 HA PHE A 66 -6.410 -0.044 -6.427 1.00 10.00 H new ATOM 0 HB2 PHE A 66 -4.380 1.424 -6.322 1.00 10.00 H new ATOM 0 HB3 PHE A 66 -5.244 2.635 -7.248 1.00 10.00 H new ATOM 0 HD1 PHE A 66 -5.493 0.650 -4.095 1.00 10.00 H new ATOM 0 HD2 PHE A 66 -6.545 4.232 -6.146 1.00 10.00 H new ATOM 0 HE1 PHE A 66 -6.450 1.554 -2.020 1.00 10.00 H new ATOM 0 HE2 PHE A 66 -7.498 5.143 -4.073 1.00 10.00 H new ATOM 0 HZ PHE A 66 -7.454 3.804 -2.004 1.00 10.00 H new ATOM 791 N GLU A 67 -8.621 0.525 -7.436 1.00 10.00 N ATOM 792 CA GLU A 67 -9.965 0.926 -7.843 1.00 10.00 C ATOM 793 C GLU A 67 -10.078 1.002 -9.362 1.00 10.00 C ATOM 794 O GLU A 67 -10.792 1.844 -9.909 1.00 10.00 O ATOM 795 CB GLU A 67 -10.348 2.266 -7.205 1.00 10.00 C ATOM 796 CG GLU A 67 -10.697 2.158 -5.731 1.00 10.00 C ATOM 797 CD GLU A 67 -12.032 1.483 -5.501 1.00 10.00 C ATOM 798 OE1 GLU A 67 -12.134 0.258 -5.728 1.00 10.00 O ATOM 799 OE2 GLU A 67 -12.988 2.177 -5.103 1.00 10.00 O ATOM 0 H GLU A 67 -8.582 -0.379 -6.965 1.00 10.00 H new ATOM 0 HA GLU A 67 -10.663 0.166 -7.491 1.00 10.00 H new ATOM 0 HB2 GLU A 67 -9.521 2.966 -7.324 1.00 10.00 H new ATOM 0 HB3 GLU A 67 -11.199 2.685 -7.742 1.00 10.00 H new ATOM 0 HG2 GLU A 67 -9.917 1.598 -5.216 1.00 10.00 H new ATOM 0 HG3 GLU A 67 -10.717 3.155 -5.291 1.00 10.00 H new ATOM 806 N GLY A 68 -9.355 0.119 -10.038 1.00 10.00 N ATOM 807 CA GLY A 68 -9.388 0.077 -11.487 1.00 10.00 C ATOM 808 C GLY A 68 -8.340 0.960 -12.135 1.00 10.00 C ATOM 809 O GLY A 68 -8.073 0.836 -13.328 1.00 10.00 O ATOM 0 H GLY A 68 -8.743 -0.573 -9.606 1.00 10.00 H new ATOM 0 HA2 GLY A 68 -9.242 -0.951 -11.817 1.00 10.00 H new ATOM 0 HA3 GLY A 68 -10.376 0.385 -11.830 1.00 10.00 H new ATOM 813 N GLN A 69 -7.750 1.854 -11.358 1.00 10.00 N ATOM 814 CA GLN A 69 -6.731 2.758 -11.876 1.00 10.00 C ATOM 815 C GLN A 69 -5.343 2.201 -11.574 1.00 10.00 C ATOM 816 O GLN A 69 -5.092 1.710 -10.473 1.00 10.00 O ATOM 817 CB GLN A 69 -6.896 4.152 -11.255 1.00 10.00 C ATOM 818 CG GLN A 69 -8.327 4.467 -10.839 1.00 10.00 C ATOM 819 CD GLN A 69 -8.512 5.897 -10.370 1.00 10.00 C ATOM 820 OE1 GLN A 69 -7.565 6.556 -9.942 1.00 10.00 O ATOM 821 NE2 GLN A 69 -9.742 6.381 -10.429 1.00 10.00 N ATOM 0 H GLN A 69 -7.958 1.975 -10.367 1.00 10.00 H new ATOM 0 HA GLN A 69 -6.847 2.845 -12.956 1.00 10.00 H new ATOM 0 HB2 GLN A 69 -6.247 4.232 -10.383 1.00 10.00 H new ATOM 0 HB3 GLN A 69 -6.561 4.902 -11.971 1.00 10.00 H new ATOM 0 HG2 GLN A 69 -8.993 4.279 -11.681 1.00 10.00 H new ATOM 0 HG3 GLN A 69 -8.624 3.788 -10.040 1.00 10.00 H new ATOM 0 HE21 GLN A 69 -10.501 5.803 -10.790 1.00 10.00 H new ATOM 0 HE22 GLN A 69 -9.931 7.332 -10.113 1.00 10.00 H new ATOM 830 N ARG A 70 -4.450 2.252 -12.554 1.00 10.00 N ATOM 831 CA ARG A 70 -3.099 1.742 -12.368 1.00 10.00 C ATOM 832 C ARG A 70 -2.215 2.791 -11.707 1.00 10.00 C ATOM 833 O ARG A 70 -2.303 3.980 -12.012 1.00 10.00 O ATOM 834 CB ARG A 70 -2.492 1.276 -13.698 1.00 10.00 C ATOM 835 CG ARG A 70 -2.140 2.400 -14.662 1.00 10.00 C ATOM 836 CD ARG A 70 -1.592 1.853 -15.971 1.00 10.00 C ATOM 837 NE ARG A 70 -0.358 1.085 -15.775 1.00 10.00 N ATOM 838 CZ ARG A 70 -0.155 -0.148 -16.249 1.00 10.00 C ATOM 839 NH1 ARG A 70 -1.089 -0.761 -16.963 1.00 10.00 N ATOM 840 NH2 ARG A 70 0.987 -0.773 -16.011 1.00 10.00 N ATOM 0 H ARG A 70 -4.635 2.639 -13.479 1.00 10.00 H new ATOM 0 HA ARG A 70 -3.156 0.876 -11.708 1.00 10.00 H new ATOM 0 HB2 ARG A 70 -1.591 0.699 -13.489 1.00 10.00 H new ATOM 0 HB3 ARG A 70 -3.196 0.602 -14.187 1.00 10.00 H new ATOM 0 HG2 ARG A 70 -3.026 3.003 -14.860 1.00 10.00 H new ATOM 0 HG3 ARG A 70 -1.402 3.058 -14.203 1.00 10.00 H new ATOM 0 HD2 ARG A 70 -2.343 1.218 -16.441 1.00 10.00 H new ATOM 0 HD3 ARG A 70 -1.400 2.679 -16.656 1.00 10.00 H new ATOM 0 HE ARG A 70 0.395 1.520 -15.242 1.00 10.00 H new ATOM 0 HH11 ARG A 70 -1.974 -0.291 -17.156 1.00 10.00 H new ATOM 0 HH12 ARG A 70 -0.923 -1.702 -17.320 1.00 10.00 H new ATOM 0 HH21 ARG A 70 1.715 -0.314 -15.464 1.00 10.00 H new ATOM 0 HH22 ARG A 70 1.139 -1.714 -16.374 1.00 10.00 H new ATOM 854 N ILE A 71 -1.373 2.339 -10.794 1.00 10.00 N ATOM 855 CA ILE A 71 -0.473 3.226 -10.075 1.00 10.00 C ATOM 856 C ILE A 71 0.717 3.620 -10.942 1.00 10.00 C ATOM 857 O ILE A 71 1.502 2.768 -11.366 1.00 10.00 O ATOM 858 CB ILE A 71 0.041 2.566 -8.779 1.00 10.00 C ATOM 859 CG1 ILE A 71 -1.128 2.193 -7.864 1.00 10.00 C ATOM 860 CG2 ILE A 71 1.014 3.484 -8.055 1.00 10.00 C ATOM 861 CD1 ILE A 71 -1.983 3.372 -7.448 1.00 10.00 C ATOM 0 H ILE A 71 -1.293 1.357 -10.531 1.00 10.00 H new ATOM 0 HA ILE A 71 -1.041 4.120 -9.819 1.00 10.00 H new ATOM 0 HB ILE A 71 0.571 1.653 -9.050 1.00 10.00 H new ATOM 0 HG12 ILE A 71 -1.757 1.463 -8.374 1.00 10.00 H new ATOM 0 HG13 ILE A 71 -0.736 1.708 -6.970 1.00 10.00 H new ATOM 0 HG21 ILE A 71 1.363 2.998 -7.144 1.00 10.00 H new ATOM 0 HG22 ILE A 71 1.865 3.696 -8.703 1.00 10.00 H new ATOM 0 HG23 ILE A 71 0.512 4.417 -7.799 1.00 10.00 H new ATOM 0 HD11 ILE A 71 -2.790 3.026 -6.801 1.00 10.00 H new ATOM 0 HD12 ILE A 71 -1.370 4.094 -6.909 1.00 10.00 H new ATOM 0 HD13 ILE A 71 -2.406 3.845 -8.334 1.00 10.00 H new ATOM 873 N ALA A 72 0.842 4.911 -11.205 1.00 10.00 N ATOM 874 CA ALA A 72 1.937 5.425 -12.010 1.00 10.00 C ATOM 875 C ALA A 72 3.180 5.628 -11.153 1.00 10.00 C ATOM 876 O ALA A 72 3.093 5.720 -9.930 1.00 10.00 O ATOM 877 CB ALA A 72 1.534 6.728 -12.684 1.00 10.00 C ATOM 0 H ALA A 72 0.195 5.625 -10.870 1.00 10.00 H new ATOM 0 HA ALA A 72 2.170 4.694 -12.784 1.00 10.00 H new ATOM 0 HB1 ALA A 72 2.365 7.100 -13.283 1.00 10.00 H new ATOM 0 HB2 ALA A 72 0.672 6.553 -13.328 1.00 10.00 H new ATOM 0 HB3 ALA A 72 1.276 7.466 -11.924 1.00 10.00 H new ATOM 883 N ASP A 73 4.334 5.699 -11.798 1.00 10.00 N ATOM 884 CA ASP A 73 5.606 5.881 -11.095 1.00 10.00 C ATOM 885 C ASP A 73 5.668 7.233 -10.393 1.00 10.00 C ATOM 886 O ASP A 73 6.371 7.392 -9.397 1.00 10.00 O ATOM 887 CB ASP A 73 6.780 5.758 -12.075 1.00 10.00 C ATOM 888 CG ASP A 73 7.238 4.325 -12.273 1.00 10.00 C ATOM 889 OD1 ASP A 73 6.486 3.398 -11.908 1.00 10.00 O ATOM 890 OD2 ASP A 73 8.351 4.123 -12.808 1.00 10.00 O ATOM 0 H ASP A 73 4.422 5.634 -12.812 1.00 10.00 H new ATOM 0 HA ASP A 73 5.678 5.098 -10.340 1.00 10.00 H new ATOM 0 HB2 ASP A 73 6.488 6.177 -13.038 1.00 10.00 H new ATOM 0 HB3 ASP A 73 7.616 6.354 -11.709 1.00 10.00 H new ATOM 895 N ASN A 74 4.917 8.198 -10.904 1.00 10.00 N ATOM 896 CA ASN A 74 4.899 9.545 -10.337 1.00 10.00 C ATOM 897 C ASN A 74 3.740 9.730 -9.361 1.00 10.00 C ATOM 898 O ASN A 74 3.498 10.839 -8.882 1.00 10.00 O ATOM 899 CB ASN A 74 4.792 10.586 -11.457 1.00 10.00 C ATOM 900 CG ASN A 74 3.530 10.419 -12.284 1.00 10.00 C ATOM 901 OD1 ASN A 74 3.499 9.639 -13.234 1.00 10.00 O ATOM 902 ND2 ASN A 74 2.480 11.144 -11.926 1.00 10.00 N ATOM 0 H ASN A 74 4.309 8.075 -11.714 1.00 10.00 H new ATOM 0 HA ASN A 74 5.832 9.683 -9.790 1.00 10.00 H new ATOM 0 HB2 ASN A 74 4.809 11.586 -11.023 1.00 10.00 H new ATOM 0 HB3 ASN A 74 5.663 10.506 -12.108 1.00 10.00 H new ATOM 0 HD21 ASN A 74 1.605 11.066 -12.445 1.00 10.00 H new ATOM 0 HD22 ASN A 74 2.546 11.780 -11.131 1.00 10.00 H new ATOM 909 N HIS A 75 3.033 8.651 -9.060 1.00 10.00 N ATOM 910 CA HIS A 75 1.897 8.722 -8.152 1.00 10.00 C ATOM 911 C HIS A 75 2.350 8.779 -6.697 1.00 10.00 C ATOM 912 O HIS A 75 3.408 8.255 -6.335 1.00 10.00 O ATOM 913 CB HIS A 75 0.962 7.526 -8.356 1.00 10.00 C ATOM 914 CG HIS A 75 -0.159 7.785 -9.316 1.00 10.00 C ATOM 915 ND1 HIS A 75 -0.898 6.755 -9.846 1.00 10.00 N ATOM 916 CD2 HIS A 75 -0.640 8.961 -9.788 1.00 10.00 C ATOM 917 CE1 HIS A 75 -1.802 7.319 -10.625 1.00 10.00 C ATOM 918 NE2 HIS A 75 -1.685 8.655 -10.621 1.00 10.00 N ATOM 0 H HIS A 75 3.224 7.720 -9.429 1.00 10.00 H new ATOM 0 HA HIS A 75 1.356 9.640 -8.381 1.00 10.00 H new ATOM 0 HB2 HIS A 75 1.546 6.679 -8.715 1.00 10.00 H new ATOM 0 HB3 HIS A 75 0.542 7.238 -7.392 1.00 10.00 H new ATOM 0 HD2 HIS A 75 -0.271 9.949 -9.553 1.00 10.00 H new ATOM 0 HE1 HIS A 75 -2.541 6.774 -11.193 1.00 10.00 H new ATOM 0 HE2 HIS A 75 -2.263 9.317 -11.139 1.00 10.00 H new ATOM 926 N THR A 76 1.546 9.430 -5.874 1.00 10.00 N ATOM 927 CA THR A 76 1.831 9.558 -4.456 1.00 10.00 C ATOM 928 C THR A 76 0.588 9.216 -3.638 1.00 10.00 C ATOM 929 O THR A 76 -0.526 9.454 -4.091 1.00 10.00 O ATOM 930 CB THR A 76 2.297 10.985 -4.106 1.00 10.00 C ATOM 931 OG1 THR A 76 1.952 11.904 -5.159 1.00 10.00 O ATOM 932 CG2 THR A 76 3.801 11.020 -3.871 1.00 10.00 C ATOM 0 H THR A 76 0.681 9.883 -6.169 1.00 10.00 H new ATOM 0 HA THR A 76 2.634 8.862 -4.214 1.00 10.00 H new ATOM 0 HB THR A 76 1.789 11.286 -3.190 1.00 10.00 H new ATOM 0 HG1 THR A 76 1.189 11.552 -5.663 1.00 10.00 H new ATOM 0 HG21 THR A 76 4.107 12.037 -3.626 1.00 10.00 H new ATOM 0 HG22 THR A 76 4.056 10.355 -3.046 1.00 10.00 H new ATOM 0 HG23 THR A 76 4.318 10.693 -4.773 1.00 10.00 H new ATOM 940 N PRO A 77 0.756 8.659 -2.421 1.00 10.00 N ATOM 941 CA PRO A 77 -0.375 8.289 -1.552 1.00 10.00 C ATOM 942 C PRO A 77 -1.248 9.489 -1.182 1.00 10.00 C ATOM 943 O PRO A 77 -2.386 9.336 -0.735 1.00 10.00 O ATOM 944 CB PRO A 77 0.299 7.714 -0.298 1.00 10.00 C ATOM 945 CG PRO A 77 1.676 7.347 -0.729 1.00 10.00 C ATOM 946 CD PRO A 77 2.054 8.327 -1.801 1.00 10.00 C ATOM 0 HA PRO A 77 -1.048 7.589 -2.048 1.00 10.00 H new ATOM 0 HB2 PRO A 77 0.321 8.447 0.508 1.00 10.00 H new ATOM 0 HB3 PRO A 77 -0.242 6.845 0.076 1.00 10.00 H new ATOM 0 HG2 PRO A 77 2.372 7.398 0.108 1.00 10.00 H new ATOM 0 HG3 PRO A 77 1.706 6.325 -1.107 1.00 10.00 H new ATOM 0 HD2 PRO A 77 2.541 9.210 -1.387 1.00 10.00 H new ATOM 0 HD3 PRO A 77 2.745 7.890 -2.522 1.00 10.00 H new ATOM 954 N LYS A 78 -0.698 10.684 -1.371 1.00 10.00 N ATOM 955 CA LYS A 78 -1.409 11.919 -1.073 1.00 10.00 C ATOM 956 C LYS A 78 -2.587 12.100 -2.026 1.00 10.00 C ATOM 957 O LYS A 78 -3.638 12.623 -1.646 1.00 10.00 O ATOM 958 CB LYS A 78 -0.446 13.111 -1.171 1.00 10.00 C ATOM 959 CG LYS A 78 -1.110 14.473 -1.008 1.00 10.00 C ATOM 960 CD LYS A 78 -1.757 14.641 0.361 1.00 10.00 C ATOM 961 CE LYS A 78 -0.735 14.588 1.486 1.00 10.00 C ATOM 962 NZ LYS A 78 -1.307 15.069 2.771 1.00 10.00 N ATOM 0 H LYS A 78 0.246 10.822 -1.732 1.00 10.00 H new ATOM 0 HA LYS A 78 -1.800 11.866 -0.057 1.00 10.00 H new ATOM 0 HB2 LYS A 78 0.325 13.003 -0.408 1.00 10.00 H new ATOM 0 HB3 LYS A 78 0.056 13.078 -2.138 1.00 10.00 H new ATOM 0 HG2 LYS A 78 -0.367 15.257 -1.155 1.00 10.00 H new ATOM 0 HG3 LYS A 78 -1.866 14.601 -1.783 1.00 10.00 H new ATOM 0 HD2 LYS A 78 -2.286 15.593 0.397 1.00 10.00 H new ATOM 0 HD3 LYS A 78 -2.500 13.857 0.509 1.00 10.00 H new ATOM 0 HE2 LYS A 78 -0.379 13.565 1.606 1.00 10.00 H new ATOM 0 HE3 LYS A 78 0.129 15.197 1.222 1.00 10.00 H new ATOM 0 HZ1 LYS A 78 -0.582 15.018 3.514 1.00 10.00 H new ATOM 0 HZ2 LYS A 78 -1.624 16.054 2.663 1.00 10.00 H new ATOM 0 HZ3 LYS A 78 -2.116 14.472 3.036 1.00 10.00 H new ATOM 976 N GLU A 79 -2.419 11.648 -3.260 1.00 10.00 N ATOM 977 CA GLU A 79 -3.470 11.764 -4.251 1.00 10.00 C ATOM 978 C GLU A 79 -4.259 10.462 -4.326 1.00 10.00 C ATOM 979 O GLU A 79 -3.900 9.482 -3.671 1.00 10.00 O ATOM 980 CB GLU A 79 -2.889 12.138 -5.615 1.00 10.00 C ATOM 981 CG GLU A 79 -1.979 11.085 -6.213 1.00 10.00 C ATOM 982 CD GLU A 79 -1.051 11.656 -7.257 1.00 10.00 C ATOM 983 OE1 GLU A 79 -1.541 12.343 -8.179 1.00 10.00 O ATOM 984 OE2 GLU A 79 0.173 11.434 -7.152 1.00 10.00 O ATOM 0 H GLU A 79 -1.566 11.199 -3.595 1.00 10.00 H new ATOM 0 HA GLU A 79 -4.150 12.562 -3.953 1.00 10.00 H new ATOM 0 HB2 GLU A 79 -3.709 12.328 -6.307 1.00 10.00 H new ATOM 0 HB3 GLU A 79 -2.332 13.070 -5.517 1.00 10.00 H new ATOM 0 HG2 GLU A 79 -1.390 10.624 -5.420 1.00 10.00 H new ATOM 0 HG3 GLU A 79 -2.584 10.296 -6.660 1.00 10.00 H new ATOM 991 N LEU A 80 -5.340 10.475 -5.109 1.00 10.00 N ATOM 992 CA LEU A 80 -6.228 9.320 -5.281 1.00 10.00 C ATOM 993 C LEU A 80 -7.060 9.093 -4.022 1.00 10.00 C ATOM 994 O LEU A 80 -8.291 9.148 -4.060 1.00 10.00 O ATOM 995 CB LEU A 80 -5.449 8.043 -5.637 1.00 10.00 C ATOM 996 CG LEU A 80 -4.611 8.114 -6.918 1.00 10.00 C ATOM 997 CD1 LEU A 80 -3.864 6.805 -7.136 1.00 10.00 C ATOM 998 CD2 LEU A 80 -5.485 8.437 -8.121 1.00 10.00 C ATOM 0 H LEU A 80 -5.627 11.293 -5.646 1.00 10.00 H new ATOM 0 HA LEU A 80 -6.893 9.545 -6.115 1.00 10.00 H new ATOM 0 HB2 LEU A 80 -4.788 7.798 -4.805 1.00 10.00 H new ATOM 0 HB3 LEU A 80 -6.158 7.221 -5.733 1.00 10.00 H new ATOM 0 HG LEU A 80 -3.882 8.916 -6.805 1.00 10.00 H new ATOM 0 HD11 LEU A 80 -3.273 6.871 -8.050 1.00 10.00 H new ATOM 0 HD12 LEU A 80 -3.203 6.618 -6.290 1.00 10.00 H new ATOM 0 HD13 LEU A 80 -4.580 5.988 -7.225 1.00 10.00 H new ATOM 0 HD21 LEU A 80 -4.867 8.482 -9.018 1.00 10.00 H new ATOM 0 HD22 LEU A 80 -6.241 7.661 -8.240 1.00 10.00 H new ATOM 0 HD23 LEU A 80 -5.973 9.399 -7.968 1.00 10.00 H new ATOM 1010 N GLY A 81 -6.384 8.871 -2.907 1.00 10.00 N ATOM 1011 CA GLY A 81 -7.063 8.643 -1.653 1.00 10.00 C ATOM 1012 C GLY A 81 -6.714 7.300 -1.058 1.00 10.00 C ATOM 1013 O GLY A 81 -7.398 6.310 -1.305 1.00 10.00 O ATOM 0 H GLY A 81 -5.366 8.845 -2.850 1.00 10.00 H new ATOM 0 HA2 GLY A 81 -6.798 9.432 -0.949 1.00 10.00 H new ATOM 0 HA3 GLY A 81 -8.140 8.702 -1.808 1.00 10.00 H new ATOM 1017 N MET A 82 -5.635 7.259 -0.293 1.00 10.00 N ATOM 1018 CA MET A 82 -5.193 6.029 0.346 1.00 10.00 C ATOM 1019 C MET A 82 -5.229 6.175 1.861 1.00 10.00 C ATOM 1020 O MET A 82 -4.769 7.181 2.406 1.00 10.00 O ATOM 1021 CB MET A 82 -3.778 5.667 -0.109 1.00 10.00 C ATOM 1022 CG MET A 82 -3.712 5.161 -1.540 1.00 10.00 C ATOM 1023 SD MET A 82 -2.022 4.866 -2.097 1.00 10.00 S ATOM 1024 CE MET A 82 -2.318 4.252 -3.753 1.00 10.00 C ATOM 0 H MET A 82 -5.046 8.068 -0.098 1.00 10.00 H new ATOM 0 HA MET A 82 -5.872 5.228 0.052 1.00 10.00 H new ATOM 0 HB2 MET A 82 -3.138 6.544 -0.012 1.00 10.00 H new ATOM 0 HB3 MET A 82 -3.375 4.904 0.557 1.00 10.00 H new ATOM 0 HG2 MET A 82 -4.283 4.236 -1.621 1.00 10.00 H new ATOM 0 HG3 MET A 82 -4.186 5.887 -2.200 1.00 10.00 H new ATOM 0 HE1 MET A 82 -1.366 4.023 -4.232 1.00 10.00 H new ATOM 0 HE2 MET A 82 -2.925 3.348 -3.703 1.00 10.00 H new ATOM 0 HE3 MET A 82 -2.843 5.010 -4.334 1.00 10.00 H new ATOM 1034 N GLU A 83 -5.797 5.184 2.530 1.00 10.00 N ATOM 1035 CA GLU A 83 -5.894 5.189 3.979 1.00 10.00 C ATOM 1036 C GLU A 83 -5.315 3.904 4.566 1.00 10.00 C ATOM 1037 O GLU A 83 -4.853 3.027 3.835 1.00 10.00 O ATOM 1038 CB GLU A 83 -7.357 5.340 4.404 1.00 10.00 C ATOM 1039 CG GLU A 83 -7.685 6.699 4.999 1.00 10.00 C ATOM 1040 CD GLU A 83 -6.901 6.988 6.265 1.00 10.00 C ATOM 1041 OE1 GLU A 83 -6.571 6.034 7.002 1.00 10.00 O ATOM 1042 OE2 GLU A 83 -6.612 8.174 6.530 1.00 10.00 O ATOM 0 H GLU A 83 -6.201 4.359 2.086 1.00 10.00 H new ATOM 0 HA GLU A 83 -5.318 6.033 4.359 1.00 10.00 H new ATOM 0 HB2 GLU A 83 -7.997 5.169 3.538 1.00 10.00 H new ATOM 0 HB3 GLU A 83 -7.595 4.567 5.134 1.00 10.00 H new ATOM 0 HG2 GLU A 83 -7.475 7.474 4.262 1.00 10.00 H new ATOM 0 HG3 GLU A 83 -8.752 6.747 5.218 1.00 10.00 H new ATOM 1049 N GLU A 84 -5.338 3.811 5.887 1.00 10.00 N ATOM 1050 CA GLU A 84 -4.834 2.640 6.590 1.00 10.00 C ATOM 1051 C GLU A 84 -5.757 1.448 6.351 1.00 10.00 C ATOM 1052 O GLU A 84 -6.981 1.599 6.368 1.00 10.00 O ATOM 1053 CB GLU A 84 -4.727 2.949 8.089 1.00 10.00 C ATOM 1054 CG GLU A 84 -4.329 1.760 8.952 1.00 10.00 C ATOM 1055 CD GLU A 84 -3.052 1.097 8.484 1.00 10.00 C ATOM 1056 OE1 GLU A 84 -2.024 1.795 8.368 1.00 10.00 O ATOM 1057 OE2 GLU A 84 -3.074 -0.125 8.234 1.00 10.00 O ATOM 0 H GLU A 84 -5.704 4.540 6.499 1.00 10.00 H new ATOM 0 HA GLU A 84 -3.844 2.387 6.211 1.00 10.00 H new ATOM 0 HB2 GLU A 84 -3.997 3.746 8.232 1.00 10.00 H new ATOM 0 HB3 GLU A 84 -5.687 3.330 8.438 1.00 10.00 H new ATOM 0 HG2 GLU A 84 -4.204 2.091 9.983 1.00 10.00 H new ATOM 0 HG3 GLU A 84 -5.136 1.027 8.948 1.00 10.00 H new ATOM 1064 N GLU A 85 -5.157 0.281 6.105 1.00 10.00 N ATOM 1065 CA GLU A 85 -5.898 -0.959 5.859 1.00 10.00 C ATOM 1066 C GLU A 85 -6.576 -0.946 4.493 1.00 10.00 C ATOM 1067 O GLU A 85 -7.522 -1.703 4.257 1.00 10.00 O ATOM 1068 CB GLU A 85 -6.939 -1.211 6.956 1.00 10.00 C ATOM 1069 CG GLU A 85 -6.343 -1.731 8.252 1.00 10.00 C ATOM 1070 CD GLU A 85 -6.268 -3.244 8.291 1.00 10.00 C ATOM 1071 OE1 GLU A 85 -5.241 -3.801 7.856 1.00 10.00 O ATOM 1072 OE2 GLU A 85 -7.231 -3.883 8.772 1.00 10.00 O ATOM 0 H GLU A 85 -4.144 0.169 6.071 1.00 10.00 H new ATOM 0 HA GLU A 85 -5.171 -1.771 5.873 1.00 10.00 H new ATOM 0 HB2 GLU A 85 -7.473 -0.283 7.158 1.00 10.00 H new ATOM 0 HB3 GLU A 85 -7.674 -1.928 6.590 1.00 10.00 H new ATOM 0 HG2 GLU A 85 -5.343 -1.318 8.380 1.00 10.00 H new ATOM 0 HG3 GLU A 85 -6.943 -1.379 9.091 1.00 10.00 H new ATOM 1079 N ASP A 86 -6.096 -0.093 3.593 1.00 10.00 N ATOM 1080 CA ASP A 86 -6.670 -0.015 2.255 1.00 10.00 C ATOM 1081 C ASP A 86 -6.210 -1.197 1.414 1.00 10.00 C ATOM 1082 O ASP A 86 -5.090 -1.688 1.576 1.00 10.00 O ATOM 1083 CB ASP A 86 -6.303 1.301 1.569 1.00 10.00 C ATOM 1084 CG ASP A 86 -7.510 2.188 1.343 1.00 10.00 C ATOM 1085 OD1 ASP A 86 -8.648 1.664 1.306 1.00 10.00 O ATOM 1086 OD2 ASP A 86 -7.330 3.416 1.210 1.00 10.00 O ATOM 0 H ASP A 86 -5.320 0.547 3.763 1.00 10.00 H new ATOM 0 HA ASP A 86 -7.755 -0.051 2.352 1.00 10.00 H new ATOM 0 HB2 ASP A 86 -5.572 1.834 2.177 1.00 10.00 H new ATOM 0 HB3 ASP A 86 -5.827 1.089 0.612 1.00 10.00 H new ATOM 1091 N VAL A 87 -7.074 -1.647 0.517 1.00 10.00 N ATOM 1092 CA VAL A 87 -6.775 -2.793 -0.331 1.00 10.00 C ATOM 1093 C VAL A 87 -6.305 -2.366 -1.720 1.00 10.00 C ATOM 1094 O VAL A 87 -6.900 -1.492 -2.349 1.00 10.00 O ATOM 1095 CB VAL A 87 -8.011 -3.708 -0.474 1.00 10.00 C ATOM 1096 CG1 VAL A 87 -7.697 -4.927 -1.330 1.00 10.00 C ATOM 1097 CG2 VAL A 87 -8.522 -4.129 0.896 1.00 10.00 C ATOM 0 H VAL A 87 -7.993 -1.234 0.356 1.00 10.00 H new ATOM 0 HA VAL A 87 -5.968 -3.341 0.155 1.00 10.00 H new ATOM 0 HB VAL A 87 -8.795 -3.141 -0.977 1.00 10.00 H new ATOM 0 HG11 VAL A 87 -8.586 -5.552 -1.413 1.00 10.00 H new ATOM 0 HG12 VAL A 87 -7.387 -4.604 -2.324 1.00 10.00 H new ATOM 0 HG13 VAL A 87 -6.893 -5.499 -0.867 1.00 10.00 H new ATOM 0 HG21 VAL A 87 -9.393 -4.773 0.777 1.00 10.00 H new ATOM 0 HG22 VAL A 87 -7.739 -4.672 1.425 1.00 10.00 H new ATOM 0 HG23 VAL A 87 -8.801 -3.244 1.468 1.00 10.00 H new ATOM 1107 N ILE A 88 -5.231 -2.991 -2.179 1.00 10.00 N ATOM 1108 CA ILE A 88 -4.676 -2.719 -3.497 1.00 10.00 C ATOM 1109 C ILE A 88 -4.346 -4.047 -4.185 1.00 10.00 C ATOM 1110 O ILE A 88 -3.941 -5.010 -3.528 1.00 10.00 O ATOM 1111 CB ILE A 88 -3.421 -1.812 -3.407 1.00 10.00 C ATOM 1112 CG1 ILE A 88 -2.868 -1.507 -4.804 1.00 10.00 C ATOM 1113 CG2 ILE A 88 -2.350 -2.452 -2.534 1.00 10.00 C ATOM 1114 CD1 ILE A 88 -1.814 -0.417 -4.821 1.00 10.00 C ATOM 0 H ILE A 88 -4.721 -3.699 -1.651 1.00 10.00 H new ATOM 0 HA ILE A 88 -5.416 -2.179 -4.088 1.00 10.00 H new ATOM 0 HB ILE A 88 -3.719 -0.871 -2.945 1.00 10.00 H new ATOM 0 HG12 ILE A 88 -2.441 -2.419 -5.222 1.00 10.00 H new ATOM 0 HG13 ILE A 88 -3.692 -1.213 -5.454 1.00 10.00 H new ATOM 0 HG21 ILE A 88 -1.480 -1.797 -2.486 1.00 10.00 H new ATOM 0 HG22 ILE A 88 -2.744 -2.606 -1.529 1.00 10.00 H new ATOM 0 HG23 ILE A 88 -2.059 -3.412 -2.961 1.00 10.00 H new ATOM 0 HD11 ILE A 88 -1.471 -0.258 -5.843 1.00 10.00 H new ATOM 0 HD12 ILE A 88 -2.241 0.508 -4.434 1.00 10.00 H new ATOM 0 HD13 ILE A 88 -0.971 -0.716 -4.198 1.00 10.00 H new ATOM 1126 N GLU A 89 -4.537 -4.113 -5.496 1.00 10.00 N ATOM 1127 CA GLU A 89 -4.276 -5.344 -6.232 1.00 10.00 C ATOM 1128 C GLU A 89 -2.998 -5.256 -7.056 1.00 10.00 C ATOM 1129 O GLU A 89 -2.560 -4.169 -7.439 1.00 10.00 O ATOM 1130 CB GLU A 89 -5.447 -5.665 -7.157 1.00 10.00 C ATOM 1131 CG GLU A 89 -6.745 -5.969 -6.430 1.00 10.00 C ATOM 1132 CD GLU A 89 -7.885 -6.232 -7.389 1.00 10.00 C ATOM 1133 OE1 GLU A 89 -8.118 -7.407 -7.739 1.00 10.00 O ATOM 1134 OE2 GLU A 89 -8.554 -5.262 -7.801 1.00 10.00 O ATOM 0 H GLU A 89 -4.869 -3.336 -6.068 1.00 10.00 H new ATOM 0 HA GLU A 89 -4.153 -6.138 -5.495 1.00 10.00 H new ATOM 0 HB2 GLU A 89 -5.608 -4.821 -7.828 1.00 10.00 H new ATOM 0 HB3 GLU A 89 -5.182 -6.521 -7.778 1.00 10.00 H new ATOM 0 HG2 GLU A 89 -6.605 -6.838 -5.787 1.00 10.00 H new ATOM 0 HG3 GLU A 89 -7.002 -5.131 -5.782 1.00 10.00 H new ATOM 1141 N VAL A 90 -2.415 -6.415 -7.329 1.00 10.00 N ATOM 1142 CA VAL A 90 -1.202 -6.504 -8.122 1.00 10.00 C ATOM 1143 C VAL A 90 -1.298 -7.707 -9.060 1.00 10.00 C ATOM 1144 O VAL A 90 -1.609 -8.818 -8.631 1.00 10.00 O ATOM 1145 CB VAL A 90 0.065 -6.603 -7.231 1.00 10.00 C ATOM 1146 CG1 VAL A 90 0.021 -7.837 -6.338 1.00 10.00 C ATOM 1147 CG2 VAL A 90 1.325 -6.600 -8.086 1.00 10.00 C ATOM 0 H VAL A 90 -2.770 -7.316 -7.007 1.00 10.00 H new ATOM 0 HA VAL A 90 -1.107 -5.590 -8.708 1.00 10.00 H new ATOM 0 HB VAL A 90 0.086 -5.726 -6.584 1.00 10.00 H new ATOM 0 HG11 VAL A 90 0.923 -7.876 -5.727 1.00 10.00 H new ATOM 0 HG12 VAL A 90 -0.854 -7.786 -5.690 1.00 10.00 H new ATOM 0 HG13 VAL A 90 -0.037 -8.732 -6.957 1.00 10.00 H new ATOM 0 HG21 VAL A 90 2.202 -6.670 -7.442 1.00 10.00 H new ATOM 0 HG22 VAL A 90 1.305 -7.452 -8.766 1.00 10.00 H new ATOM 0 HG23 VAL A 90 1.371 -5.676 -8.663 1.00 10.00 H new ATOM 1157 N TYR A 91 -1.078 -7.476 -10.345 1.00 10.00 N ATOM 1158 CA TYR A 91 -1.152 -8.546 -11.332 1.00 10.00 C ATOM 1159 C TYR A 91 0.045 -8.489 -12.265 1.00 10.00 C ATOM 1160 O TYR A 91 0.679 -7.446 -12.402 1.00 10.00 O ATOM 1161 CB TYR A 91 -2.452 -8.442 -12.140 1.00 10.00 C ATOM 1162 CG TYR A 91 -3.697 -8.710 -11.323 1.00 10.00 C ATOM 1163 CD1 TYR A 91 -4.177 -10.003 -11.159 1.00 10.00 C ATOM 1164 CD2 TYR A 91 -4.387 -7.671 -10.711 1.00 10.00 C ATOM 1165 CE1 TYR A 91 -5.309 -10.252 -10.406 1.00 10.00 C ATOM 1166 CE2 TYR A 91 -5.519 -7.912 -9.959 1.00 10.00 C ATOM 1167 CZ TYR A 91 -5.977 -9.203 -9.809 1.00 10.00 C ATOM 1168 OH TYR A 91 -7.099 -9.449 -9.052 1.00 10.00 O ATOM 0 H TYR A 91 -0.847 -6.560 -10.730 1.00 10.00 H new ATOM 0 HA TYR A 91 -1.142 -9.500 -10.805 1.00 10.00 H new ATOM 0 HB2 TYR A 91 -2.521 -7.445 -12.575 1.00 10.00 H new ATOM 0 HB3 TYR A 91 -2.412 -9.149 -12.969 1.00 10.00 H new ATOM 0 HD1 TYR A 91 -3.658 -10.826 -11.627 1.00 10.00 H new ATOM 0 HD2 TYR A 91 -4.032 -6.658 -10.826 1.00 10.00 H new ATOM 0 HE1 TYR A 91 -5.669 -11.263 -10.286 1.00 10.00 H new ATOM 0 HE2 TYR A 91 -6.043 -7.092 -9.490 1.00 10.00 H new ATOM 0 HH TYR A 91 -7.183 -8.762 -8.358 1.00 10.00 H new ATOM 1178 N GLN A 92 0.354 -9.610 -12.894 1.00 10.00 N ATOM 1179 CA GLN A 92 1.478 -9.675 -13.816 1.00 10.00 C ATOM 1180 C GLN A 92 1.125 -8.978 -15.123 1.00 10.00 C ATOM 1181 O GLN A 92 0.042 -9.189 -15.676 1.00 10.00 O ATOM 1182 CB GLN A 92 1.853 -11.130 -14.092 1.00 10.00 C ATOM 1183 CG GLN A 92 3.147 -11.294 -14.878 1.00 10.00 C ATOM 1184 CD GLN A 92 3.061 -12.406 -15.902 1.00 10.00 C ATOM 1185 OE1 GLN A 92 3.263 -13.575 -15.580 1.00 10.00 O ATOM 1186 NE2 GLN A 92 2.769 -12.053 -17.145 1.00 10.00 N ATOM 0 H GLN A 92 -0.156 -10.487 -12.784 1.00 10.00 H new ATOM 0 HA GLN A 92 2.330 -9.170 -13.361 1.00 10.00 H new ATOM 0 HB2 GLN A 92 1.946 -11.657 -13.143 1.00 10.00 H new ATOM 0 HB3 GLN A 92 1.042 -11.606 -14.643 1.00 10.00 H new ATOM 0 HG2 GLN A 92 3.385 -10.357 -15.382 1.00 10.00 H new ATOM 0 HG3 GLN A 92 3.965 -11.501 -14.188 1.00 10.00 H new ATOM 0 HE21 GLN A 92 2.608 -11.072 -17.372 1.00 10.00 H new ATOM 0 HE22 GLN A 92 2.705 -12.763 -17.875 1.00 10.00 H new ATOM 1195 N GLU A 93 2.033 -8.147 -15.609 1.00 10.00 N ATOM 1196 CA GLU A 93 1.816 -7.427 -16.851 1.00 10.00 C ATOM 1197 C GLU A 93 1.994 -8.348 -18.045 1.00 10.00 C ATOM 1198 O GLU A 93 2.703 -9.354 -17.967 1.00 10.00 O ATOM 1199 CB GLU A 93 2.769 -6.235 -16.967 1.00 10.00 C ATOM 1200 CG GLU A 93 2.242 -4.976 -16.304 1.00 10.00 C ATOM 1201 CD GLU A 93 1.008 -4.417 -16.990 1.00 10.00 C ATOM 1202 OE1 GLU A 93 0.206 -5.203 -17.546 1.00 10.00 O ATOM 1203 OE2 GLU A 93 0.819 -3.187 -16.964 1.00 10.00 O ATOM 0 H GLU A 93 2.929 -7.955 -15.160 1.00 10.00 H new ATOM 0 HA GLU A 93 0.792 -7.054 -16.843 1.00 10.00 H new ATOM 0 HB2 GLU A 93 3.726 -6.500 -16.518 1.00 10.00 H new ATOM 0 HB3 GLU A 93 2.957 -6.030 -18.021 1.00 10.00 H new ATOM 0 HG2 GLU A 93 2.005 -5.192 -15.262 1.00 10.00 H new ATOM 0 HG3 GLU A 93 3.025 -4.218 -16.302 1.00 10.00 H new ATOM 1210 N GLN A 94 1.354 -7.995 -19.148 1.00 10.00 N ATOM 1211 CA GLN A 94 1.433 -8.786 -20.365 1.00 10.00 C ATOM 1212 C GLN A 94 2.812 -8.648 -21.002 1.00 10.00 C ATOM 1213 O GLN A 94 3.262 -9.534 -21.731 1.00 10.00 O ATOM 1214 CB GLN A 94 0.347 -8.356 -21.349 1.00 10.00 C ATOM 1215 CG GLN A 94 -0.131 -9.480 -22.249 1.00 10.00 C ATOM 1216 CD GLN A 94 -1.319 -9.089 -23.100 1.00 10.00 C ATOM 1217 OE1 GLN A 94 -1.449 -7.941 -23.525 1.00 10.00 O ATOM 1218 NE2 GLN A 94 -2.197 -10.044 -23.356 1.00 10.00 N ATOM 0 H GLN A 94 0.771 -7.161 -19.225 1.00 10.00 H new ATOM 0 HA GLN A 94 1.274 -9.833 -20.108 1.00 10.00 H new ATOM 0 HB2 GLN A 94 -0.502 -7.961 -20.791 1.00 10.00 H new ATOM 0 HB3 GLN A 94 0.728 -7.543 -21.967 1.00 10.00 H new ATOM 0 HG2 GLN A 94 0.687 -9.792 -22.898 1.00 10.00 H new ATOM 0 HG3 GLN A 94 -0.397 -10.341 -21.636 1.00 10.00 H new ATOM 0 HE21 GLN A 94 -2.052 -10.983 -22.985 1.00 10.00 H new ATOM 0 HE22 GLN A 94 -3.019 -9.842 -23.925 1.00 10.00 H new ATOM 1227 N THR A 95 3.481 -7.535 -20.716 1.00 10.00 N ATOM 1228 CA THR A 95 4.811 -7.285 -21.249 1.00 10.00 C ATOM 1229 C THR A 95 5.814 -8.272 -20.665 1.00 10.00 C ATOM 1230 O THR A 95 6.698 -8.770 -21.363 1.00 10.00 O ATOM 1231 CB THR A 95 5.270 -5.849 -20.931 1.00 10.00 C ATOM 1232 OG1 THR A 95 4.892 -5.507 -19.590 1.00 10.00 O ATOM 1233 CG2 THR A 95 4.664 -4.851 -21.910 1.00 10.00 C ATOM 0 H THR A 95 3.121 -6.792 -20.117 1.00 10.00 H new ATOM 0 HA THR A 95 4.764 -7.412 -22.331 1.00 10.00 H new ATOM 0 HB THR A 95 6.355 -5.805 -21.028 1.00 10.00 H new ATOM 0 HG1 THR A 95 5.187 -4.594 -19.390 1.00 10.00 H new ATOM 0 HG21 THR A 95 5.005 -3.846 -21.662 1.00 10.00 H new ATOM 0 HG22 THR A 95 4.976 -5.100 -22.924 1.00 10.00 H new ATOM 0 HG23 THR A 95 3.577 -4.892 -21.845 1.00 10.00 H new ATOM 1241 N GLY A 96 5.658 -8.563 -19.380 1.00 10.00 N ATOM 1242 CA GLY A 96 6.551 -9.488 -18.717 1.00 10.00 C ATOM 1243 C GLY A 96 7.745 -8.789 -18.102 1.00 10.00 C ATOM 1244 O GLY A 96 8.615 -9.431 -17.514 1.00 10.00 O ATOM 0 H GLY A 96 4.927 -8.173 -18.785 1.00 10.00 H new ATOM 0 HA2 GLY A 96 6.005 -10.023 -17.940 1.00 10.00 H new ATOM 0 HA3 GLY A 96 6.897 -10.233 -19.434 1.00 10.00 H new ATOM 1248 N GLY A 97 7.785 -7.472 -18.241 1.00 10.00 N ATOM 1249 CA GLY A 97 8.875 -6.696 -17.697 1.00 10.00 C ATOM 1250 C GLY A 97 8.899 -5.303 -18.277 1.00 10.00 C ATOM 1251 O GLY A 97 9.991 -4.704 -18.359 1.00 10.00 O ATOM 0 H GLY A 97 7.074 -6.925 -18.726 1.00 10.00 H new ATOM 0 HA2 GLY A 97 8.778 -6.639 -16.613 1.00 10.00 H new ATOM 0 HA3 GLY A 97 9.821 -7.196 -17.907 1.00 10.00 H new ATOM 1256 N ASN B 357 -4.591 -15.262 5.467 1.00 10.00 N ATOM 1257 CA ASN B 357 -4.053 -15.857 6.717 1.00 10.00 C ATOM 1258 C ASN B 357 -2.528 -15.732 6.768 1.00 10.00 C ATOM 1259 O ASN B 357 -1.891 -16.092 7.759 1.00 10.00 O ATOM 1260 CB ASN B 357 -4.469 -17.328 6.814 1.00 10.00 C ATOM 1261 CG ASN B 357 -4.169 -17.941 8.172 1.00 10.00 C ATOM 1262 OD1 ASN B 357 -3.188 -18.666 8.336 1.00 10.00 O ATOM 1263 ND2 ASN B 357 -5.006 -17.652 9.158 1.00 10.00 N ATOM 0 HA ASN B 357 -4.466 -15.312 7.566 1.00 10.00 H new ATOM 0 HB2 ASN B 357 -5.537 -17.412 6.611 1.00 10.00 H new ATOM 0 HB3 ASN B 357 -3.952 -17.898 6.042 1.00 10.00 H new ATOM 0 HD21 ASN B 357 -4.847 -18.034 10.090 1.00 10.00 H new ATOM 0 HD22 ASN B 357 -5.809 -17.047 8.985 1.00 10.00 H new ATOM 1270 N ASN B 358 -1.945 -15.186 5.705 1.00 10.00 N ATOM 1271 CA ASN B 358 -0.500 -15.008 5.626 1.00 10.00 C ATOM 1272 C ASN B 358 -0.193 -13.534 5.547 1.00 10.00 C ATOM 1273 O ASN B 358 -0.691 -12.847 4.664 1.00 10.00 O ATOM 1274 CB ASN B 358 0.034 -15.686 4.361 1.00 10.00 C ATOM 1275 CG ASN B 358 1.544 -15.618 4.241 1.00 10.00 C ATOM 1276 OD1 ASN B 358 2.256 -15.573 5.244 1.00 10.00 O ATOM 1277 ND2 ASN B 358 2.042 -15.624 3.011 1.00 10.00 N ATOM 0 H ASN B 358 -2.454 -14.858 4.884 1.00 10.00 H new ATOM 0 HA ASN B 358 -0.032 -15.449 6.506 1.00 10.00 H new ATOM 0 HB2 ASN B 358 -0.278 -16.730 4.357 1.00 10.00 H new ATOM 0 HB3 ASN B 358 -0.415 -15.215 3.487 1.00 10.00 H new ATOM 0 HD21 ASN B 358 3.052 -15.591 2.869 1.00 10.00 H new ATOM 0 HD22 ASN B 358 1.415 -15.662 2.207 1.00 10.00 H new ATOM 1284 N ARG B 359 0.624 -13.043 6.455 1.00 10.00 N ATOM 1285 CA ARG B 359 0.969 -11.636 6.442 1.00 10.00 C ATOM 1286 C ARG B 359 2.474 -11.438 6.392 1.00 10.00 C ATOM 1287 O ARG B 359 3.223 -12.007 7.185 1.00 10.00 O ATOM 1288 CB ARG B 359 0.359 -10.905 7.641 1.00 10.00 C ATOM 1289 CG ARG B 359 0.741 -11.476 8.995 1.00 10.00 C ATOM 1290 CD ARG B 359 -0.067 -10.815 10.100 1.00 10.00 C ATOM 1291 NE ARG B 359 0.671 -10.734 11.357 1.00 10.00 N ATOM 1292 CZ ARG B 359 0.172 -10.221 12.478 1.00 10.00 C ATOM 1293 NH1 ARG B 359 -1.082 -9.790 12.516 1.00 10.00 N ATOM 1294 NH2 ARG B 359 0.923 -10.148 13.565 1.00 10.00 N ATOM 0 H ARG B 359 1.056 -13.587 7.201 1.00 10.00 H new ATOM 0 HA ARG B 359 0.546 -11.202 5.536 1.00 10.00 H new ATOM 0 HB2 ARG B 359 0.663 -9.859 7.604 1.00 10.00 H new ATOM 0 HB3 ARG B 359 -0.727 -10.925 7.547 1.00 10.00 H new ATOM 0 HG2 ARG B 359 0.568 -12.552 9.004 1.00 10.00 H new ATOM 0 HG3 ARG B 359 1.805 -11.323 9.174 1.00 10.00 H new ATOM 0 HD2 ARG B 359 -0.355 -9.812 9.786 1.00 10.00 H new ATOM 0 HD3 ARG B 359 -0.988 -11.376 10.258 1.00 10.00 H new ATOM 0 HE ARG B 359 1.626 -11.092 11.377 1.00 10.00 H new ATOM 0 HH11 ARG B 359 -1.668 -9.851 11.683 1.00 10.00 H new ATOM 0 HH12 ARG B 359 -1.460 -9.397 13.378 1.00 10.00 H new ATOM 0 HH21 ARG B 359 1.885 -10.485 13.544 1.00 10.00 H new ATOM 0 HH22 ARG B 359 0.540 -9.754 14.424 1.00 10.00 H new ATOM 1308 N ASP B 360 2.903 -10.636 5.443 1.00 10.00 N ATOM 1309 CA ASP B 360 4.308 -10.302 5.279 1.00 10.00 C ATOM 1310 C ASP B 360 4.415 -8.793 5.416 1.00 10.00 C ATOM 1311 O ASP B 360 3.664 -8.076 4.765 1.00 10.00 O ATOM 1312 CB ASP B 360 4.830 -10.760 3.908 1.00 10.00 C ATOM 1313 CG ASP B 360 6.320 -10.517 3.728 1.00 10.00 C ATOM 1314 OD1 ASP B 360 6.752 -10.238 2.589 1.00 10.00 O ATOM 1315 OD2 ASP B 360 7.077 -10.600 4.719 1.00 10.00 O ATOM 0 H ASP B 360 2.289 -10.194 4.759 1.00 10.00 H new ATOM 0 HA ASP B 360 4.914 -10.809 6.030 1.00 10.00 H new ATOM 0 HB2 ASP B 360 4.623 -11.823 3.783 1.00 10.00 H new ATOM 0 HB3 ASP B 360 4.285 -10.235 3.124 1.00 10.00 H new ATOM 1320 N PRO B 361 5.329 -8.272 6.240 1.00 10.00 N ATOM 1321 CA PRO B 361 5.452 -6.845 6.434 1.00 10.00 C ATOM 1322 C PRO B 361 6.701 -6.255 5.793 1.00 10.00 C ATOM 1323 O PRO B 361 7.825 -6.722 5.993 1.00 10.00 O ATOM 1324 CB PRO B 361 5.566 -6.772 7.961 1.00 10.00 C ATOM 1325 CG PRO B 361 6.183 -8.083 8.385 1.00 10.00 C ATOM 1326 CD PRO B 361 6.200 -8.991 7.172 1.00 10.00 C ATOM 0 HA PRO B 361 4.631 -6.285 5.987 1.00 10.00 H new ATOM 0 HB2 PRO B 361 6.186 -5.930 8.268 1.00 10.00 H new ATOM 0 HB3 PRO B 361 4.588 -6.632 8.421 1.00 10.00 H new ATOM 0 HG2 PRO B 361 7.194 -7.927 8.762 1.00 10.00 H new ATOM 0 HG3 PRO B 361 5.608 -8.534 9.194 1.00 10.00 H new ATOM 0 HD2 PRO B 361 7.206 -9.120 6.773 1.00 10.00 H new ATOM 0 HD3 PRO B 361 5.818 -9.986 7.402 1.00 10.00 H new ATOM 1334 N ILE B 362 6.475 -5.203 5.024 1.00 10.00 N ATOM 1335 CA ILE B 362 7.537 -4.510 4.322 1.00 10.00 C ATOM 1336 C ILE B 362 7.643 -3.090 4.846 1.00 10.00 C ATOM 1337 O ILE B 362 6.640 -2.386 4.959 1.00 10.00 O ATOM 1338 CB ILE B 362 7.283 -4.447 2.799 1.00 10.00 C ATOM 1339 CG1 ILE B 362 6.651 -5.749 2.291 1.00 10.00 C ATOM 1340 CG2 ILE B 362 8.579 -4.146 2.050 1.00 10.00 C ATOM 1341 CD1 ILE B 362 6.321 -5.724 0.814 1.00 10.00 C ATOM 0 H ILE B 362 5.548 -4.807 4.870 1.00 10.00 H new ATOM 0 HA ILE B 362 8.459 -5.065 4.496 1.00 10.00 H new ATOM 0 HB ILE B 362 6.580 -3.637 2.607 1.00 10.00 H new ATOM 0 HG12 ILE B 362 7.333 -6.576 2.489 1.00 10.00 H new ATOM 0 HG13 ILE B 362 5.740 -5.946 2.856 1.00 10.00 H new ATOM 0 HG21 ILE B 362 8.379 -4.106 0.979 1.00 10.00 H new ATOM 0 HG22 ILE B 362 8.976 -3.187 2.381 1.00 10.00 H new ATOM 0 HG23 ILE B 362 9.308 -4.931 2.254 1.00 10.00 H new ATOM 0 HD11 ILE B 362 5.877 -6.677 0.524 1.00 10.00 H new ATOM 0 HD12 ILE B 362 5.615 -4.919 0.613 1.00 10.00 H new ATOM 0 HD13 ILE B 362 7.233 -5.559 0.240 1.00 10.00 H new ATOM 1353 N VAL B 363 8.857 -2.672 5.157 1.00 10.00 N ATOM 1354 CA VAL B 363 9.085 -1.340 5.678 1.00 10.00 C ATOM 1355 C VAL B 363 9.912 -0.545 4.686 1.00 10.00 C ATOM 1356 O VAL B 363 10.941 -1.005 4.185 1.00 10.00 O ATOM 1357 CB VAL B 363 9.790 -1.360 7.054 1.00 10.00 C ATOM 1358 CG1 VAL B 363 9.867 0.042 7.644 1.00 10.00 C ATOM 1359 CG2 VAL B 363 9.070 -2.299 8.007 1.00 10.00 C ATOM 0 H VAL B 363 9.700 -3.238 5.057 1.00 10.00 H new ATOM 0 HA VAL B 363 8.112 -0.869 5.821 1.00 10.00 H new ATOM 0 HB VAL B 363 10.807 -1.725 6.910 1.00 10.00 H new ATOM 0 HG11 VAL B 363 10.367 0.003 8.612 1.00 10.00 H new ATOM 0 HG12 VAL B 363 10.429 0.689 6.971 1.00 10.00 H new ATOM 0 HG13 VAL B 363 8.860 0.439 7.772 1.00 10.00 H new ATOM 0 HG21 VAL B 363 9.580 -2.301 8.970 1.00 10.00 H new ATOM 0 HG22 VAL B 363 8.042 -1.963 8.141 1.00 10.00 H new ATOM 0 HG23 VAL B 363 9.071 -3.308 7.594 1.00 10.00 H new ATOM 1369 N ILE B 364 9.433 0.649 4.423 1.00 10.00 N ATOM 1370 CA ILE B 364 10.031 1.551 3.469 1.00 10.00 C ATOM 1371 C ILE B 364 10.550 2.797 4.162 1.00 10.00 C ATOM 1372 O ILE B 364 9.980 3.273 5.148 1.00 10.00 O ATOM 1373 CB ILE B 364 9.060 1.937 2.321 1.00 10.00 C ATOM 1374 CG1 ILE B 364 9.858 2.331 1.073 1.00 10.00 C ATOM 1375 CG2 ILE B 364 8.123 3.072 2.728 1.00 10.00 C ATOM 1376 CD1 ILE B 364 10.675 1.200 0.479 1.00 10.00 C ATOM 0 H ILE B 364 8.601 1.027 4.876 1.00 10.00 H new ATOM 0 HA ILE B 364 10.867 1.018 3.016 1.00 10.00 H new ATOM 0 HB ILE B 364 8.443 1.066 2.099 1.00 10.00 H new ATOM 0 HG12 ILE B 364 9.168 2.703 0.316 1.00 10.00 H new ATOM 0 HG13 ILE B 364 10.527 3.154 1.327 1.00 10.00 H new ATOM 0 HG21 ILE B 364 7.460 3.312 1.897 1.00 10.00 H new ATOM 0 HG22 ILE B 364 7.529 2.763 3.588 1.00 10.00 H new ATOM 0 HG23 ILE B 364 8.710 3.952 2.990 1.00 10.00 H new ATOM 0 HD11 ILE B 364 11.210 1.560 -0.400 1.00 10.00 H new ATOM 0 HD12 ILE B 364 11.392 0.842 1.218 1.00 10.00 H new ATOM 0 HD13 ILE B 364 10.012 0.384 0.191 1.00 10.00 H new