USER MOD reduce.3.24.130724 H: found=0, std=0, add=1062, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1060 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 128 TYR OH : rot 180:sc= 0.00903 USER MOD Set 1.2: A 132 LYS NZ :NH3+ 160:sc= 0.00908 (180deg=0) USER MOD Set 2.1: A 69 TYR OH : rot 114:sc= 0.673 USER MOD Set 2.2: A 114 THR OG1 : rot -83:sc= 1.3 USER MOD Set 3.1: A 55 THR OG1 : rot -65:sc= 0 USER MOD Set 3.2: A 59 LYS NZ :NH3+ 165:sc= -0.0235 (180deg=-0.282) USER MOD Set 4.1: A 14 SER OG : rot -78:sc= 1.2 USER MOD Set 4.2: A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl -163:sc= -0.123 (180deg=-0.629) USER MOD Single : A 1 MET N :NH3+ 142:sc= -0.0489 (180deg=-0.377) USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 63:sc= 0.174 USER MOD Single : A 15 SER OG : rot -170:sc= -0.149 USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 MET CE :methyl 159:sc= -0.191 (180deg=-0.792) USER MOD Single : A 38 GLN : amide:sc= 0 K(o=0,f=-0.73) USER MOD Single : A 41 GLN : amide:sc= -1.33 K(o=-1.3,f=-2.6) USER MOD Single : A 43 ASN : amide:sc= -0.681 K(o=-0.68,f=-4.4) USER MOD Single : A 45 MET CE :methyl -160:sc= -0.159 (180deg=-1.13) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 TYR OH : rot 76:sc= -0.943 USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 ASN : amide:sc= -0.464 K(o=-0.46,f=-3.6!) USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 ASN : amide:sc= -0.0568 K(o=-0.057,f=-0.65) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ 161:sc= -0.109 (180deg=-0.561) USER MOD Single : A 76 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 GLN : amide:sc= -1.22 K(o=-1.2,f=-0.13) USER MOD Single : A 83 GLN : amide:sc= -0.113 K(o=-0.11,f=-0.94) USER MOD Single : A 89 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 90 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 94 THR OG1 : rot -20:sc= 0.305 USER MOD Single : A 95 THR OG1 : rot 75:sc= 0.51 USER MOD Single : A 96 THR OG1 : rot 80:sc= 0.86 USER MOD Single : A 98 GLN : amide:sc= -0.472 K(o=-0.47,f=-4.2!) USER MOD Single : A 99 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 100 HIS : no HD1:sc= -0.0251 X(o=-0.025,f=-0.45) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 MET CE :methyl -165:sc= -0.65 (180deg=-0.983) USER MOD Single : A 116 THR OG1 : rot 180:sc=-0.00703 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 MET CE :methyl 149:sc= -0.0888 (180deg=-0.597) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 19.322 -18.558 16.718 1.00 0.00 N ATOM 2 CA MET A 1 20.535 -17.964 16.099 1.00 0.00 C ATOM 3 C MET A 1 20.986 -16.723 16.864 1.00 0.00 C ATOM 4 O MET A 1 20.217 -16.141 17.630 1.00 0.00 O ATOM 5 CB MET A 1 20.254 -17.600 14.639 1.00 0.00 C ATOM 6 CG MET A 1 19.091 -16.637 14.465 1.00 0.00 C ATOM 7 SD MET A 1 18.704 -16.321 12.732 1.00 0.00 S ATOM 8 CE MET A 1 20.254 -15.632 12.156 1.00 0.00 C ATOM 0 H1 MET A 1 18.687 -18.907 15.972 1.00 0.00 H new ATOM 0 H2 MET A 1 19.599 -19.348 17.335 1.00 0.00 H new ATOM 0 H3 MET A 1 18.830 -17.835 17.281 1.00 0.00 H new ATOM 0 HA MET A 1 21.335 -18.703 16.140 1.00 0.00 H new ATOM 0 HB2 MET A 1 21.150 -17.157 14.205 1.00 0.00 H new ATOM 0 HB3 MET A 1 20.047 -18.512 14.079 1.00 0.00 H new ATOM 0 HG2 MET A 1 18.210 -17.044 14.962 1.00 0.00 H new ATOM 0 HG3 MET A 1 19.328 -15.694 14.958 1.00 0.00 H new ATOM 0 HE1 MET A 1 20.093 -15.114 11.210 1.00 0.00 H new ATOM 0 HE2 MET A 1 20.636 -14.927 12.895 1.00 0.00 H new ATOM 0 HE3 MET A 1 20.978 -16.434 12.012 1.00 0.00 H new ATOM 18 N ASP A 2 22.236 -16.325 16.649 1.00 0.00 N ATOM 19 CA ASP A 2 22.792 -15.154 17.320 1.00 0.00 C ATOM 20 C ASP A 2 23.533 -14.257 16.333 1.00 0.00 C ATOM 21 O ASP A 2 24.414 -14.712 15.605 1.00 0.00 O ATOM 22 CB ASP A 2 23.739 -15.589 18.440 1.00 0.00 C ATOM 23 CG ASP A 2 23.055 -16.472 19.466 1.00 0.00 C ATOM 24 OD1 ASP A 2 22.502 -15.927 20.444 1.00 0.00 O ATOM 25 OD2 ASP A 2 23.073 -17.708 19.290 1.00 0.00 O ATOM 0 H ASP A 2 22.883 -16.795 16.016 1.00 0.00 H new ATOM 0 HA ASP A 2 21.966 -14.585 17.747 1.00 0.00 H new ATOM 0 HB2 ASP A 2 24.584 -16.125 18.009 1.00 0.00 H new ATOM 0 HB3 ASP A 2 24.141 -14.705 18.936 1.00 0.00 H new ATOM 30 N ALA A 3 23.166 -12.977 16.315 1.00 0.00 N ATOM 31 CA ALA A 3 23.797 -12.013 15.420 1.00 0.00 C ATOM 32 C ALA A 3 25.018 -11.374 16.071 1.00 0.00 C ATOM 33 O ALA A 3 25.721 -10.578 15.448 1.00 0.00 O ATOM 34 CB ALA A 3 22.797 -10.941 15.009 1.00 0.00 C ATOM 0 H ALA A 3 22.436 -12.585 16.910 1.00 0.00 H new ATOM 0 HA ALA A 3 24.130 -12.547 14.530 1.00 0.00 H new ATOM 0 HB1 ALA A 3 23.281 -10.228 14.341 1.00 0.00 H new ATOM 0 HB2 ALA A 3 21.956 -11.406 14.495 1.00 0.00 H new ATOM 0 HB3 ALA A 3 22.437 -10.420 15.896 1.00 0.00 H new ATOM 40 N LEU A 4 25.267 -11.729 17.328 1.00 0.00 N ATOM 41 CA LEU A 4 26.404 -11.191 18.064 1.00 0.00 C ATOM 42 C LEU A 4 27.621 -12.101 17.928 1.00 0.00 C ATOM 43 O LEU A 4 28.651 -11.875 18.563 1.00 0.00 O ATOM 44 CB LEU A 4 26.045 -11.018 19.541 1.00 0.00 C ATOM 45 CG LEU A 4 24.805 -10.163 19.815 1.00 0.00 C ATOM 46 CD1 LEU A 4 24.480 -10.156 21.300 1.00 0.00 C ATOM 47 CD2 LEU A 4 25.011 -8.741 19.309 1.00 0.00 C ATOM 0 H LEU A 4 24.696 -12.387 17.858 1.00 0.00 H new ATOM 0 HA LEU A 4 26.652 -10.218 17.640 1.00 0.00 H new ATOM 0 HB2 LEU A 4 25.890 -12.004 19.979 1.00 0.00 H new ATOM 0 HB3 LEU A 4 26.896 -10.571 20.055 1.00 0.00 H new ATOM 0 HG LEU A 4 23.963 -10.600 19.279 1.00 0.00 H new ATOM 0 HD11 LEU A 4 23.596 -9.543 21.476 1.00 0.00 H new ATOM 0 HD12 LEU A 4 24.288 -11.175 21.635 1.00 0.00 H new ATOM 0 HD13 LEU A 4 25.323 -9.744 21.855 1.00 0.00 H new ATOM 0 HD21 LEU A 4 24.119 -8.149 19.513 1.00 0.00 H new ATOM 0 HD22 LEU A 4 25.866 -8.295 19.816 1.00 0.00 H new ATOM 0 HD23 LEU A 4 25.196 -8.760 18.235 1.00 0.00 H new ATOM 59 N GLU A 5 27.495 -13.131 17.098 1.00 0.00 N ATOM 60 CA GLU A 5 28.584 -14.076 16.879 1.00 0.00 C ATOM 61 C GLU A 5 29.622 -13.495 15.924 1.00 0.00 C ATOM 62 O GLU A 5 30.800 -13.852 15.978 1.00 0.00 O ATOM 63 CB GLU A 5 28.041 -15.394 16.324 1.00 0.00 C ATOM 64 CG GLU A 5 29.113 -16.450 16.100 1.00 0.00 C ATOM 65 CD GLU A 5 29.781 -16.889 17.389 1.00 0.00 C ATOM 66 OE1 GLU A 5 30.782 -16.257 17.786 1.00 0.00 O ATOM 67 OE2 GLU A 5 29.303 -17.868 18.001 1.00 0.00 O ATOM 0 H GLU A 5 26.649 -13.333 16.565 1.00 0.00 H new ATOM 0 HA GLU A 5 29.066 -14.267 17.838 1.00 0.00 H new ATOM 0 HB2 GLU A 5 27.294 -15.788 17.013 1.00 0.00 H new ATOM 0 HB3 GLU A 5 27.533 -15.199 15.380 1.00 0.00 H new ATOM 0 HG2 GLU A 5 28.667 -17.317 15.613 1.00 0.00 H new ATOM 0 HG3 GLU A 5 29.868 -16.056 15.420 1.00 0.00 H new ATOM 74 N GLY A 6 29.178 -12.598 15.049 1.00 0.00 N ATOM 75 CA GLY A 6 30.080 -11.981 14.094 1.00 0.00 C ATOM 76 C GLY A 6 29.555 -12.049 12.673 1.00 0.00 C ATOM 77 O GLY A 6 30.098 -11.408 11.772 1.00 0.00 O ATOM 0 H GLY A 6 28.209 -12.287 14.984 1.00 0.00 H new ATOM 0 HA2 GLY A 6 30.239 -10.939 14.370 1.00 0.00 H new ATOM 0 HA3 GLY A 6 31.050 -12.475 14.144 1.00 0.00 H new ATOM 81 N GLU A 7 28.498 -12.831 12.472 1.00 0.00 N ATOM 82 CA GLU A 7 27.896 -12.982 11.153 1.00 0.00 C ATOM 83 C GLU A 7 26.519 -12.328 11.105 1.00 0.00 C ATOM 84 O GLU A 7 25.668 -12.588 11.956 1.00 0.00 O ATOM 85 CB GLU A 7 27.785 -14.464 10.785 1.00 0.00 C ATOM 86 CG GLU A 7 27.028 -15.290 11.813 1.00 0.00 C ATOM 87 CD GLU A 7 26.942 -16.757 11.437 1.00 0.00 C ATOM 88 OE1 GLU A 7 25.971 -17.137 10.749 1.00 0.00 O ATOM 89 OE2 GLU A 7 27.843 -17.525 11.832 1.00 0.00 O ATOM 0 H GLU A 7 28.041 -13.370 13.207 1.00 0.00 H new ATOM 0 HA GLU A 7 28.540 -12.483 10.428 1.00 0.00 H new ATOM 0 HB2 GLU A 7 27.286 -14.554 9.820 1.00 0.00 H new ATOM 0 HB3 GLU A 7 28.787 -14.876 10.666 1.00 0.00 H new ATOM 0 HG2 GLU A 7 27.519 -15.196 12.782 1.00 0.00 H new ATOM 0 HG3 GLU A 7 26.021 -14.888 11.926 1.00 0.00 H new ATOM 96 N SER A 8 26.308 -11.477 10.106 1.00 0.00 N ATOM 97 CA SER A 8 25.034 -10.783 9.950 1.00 0.00 C ATOM 98 C SER A 8 24.941 -10.112 8.585 1.00 0.00 C ATOM 99 O SER A 8 23.859 -9.724 8.144 1.00 0.00 O ATOM 100 CB SER A 8 24.861 -9.740 11.056 1.00 0.00 C ATOM 101 OG SER A 8 23.628 -9.054 10.923 1.00 0.00 O ATOM 0 H SER A 8 27.002 -11.251 9.393 1.00 0.00 H new ATOM 0 HA SER A 8 24.236 -11.521 10.025 1.00 0.00 H new ATOM 0 HB2 SER A 8 24.906 -10.227 12.030 1.00 0.00 H new ATOM 0 HB3 SER A 8 25.684 -9.026 11.019 1.00 0.00 H new ATOM 0 HG SER A 8 23.541 -8.394 11.643 1.00 0.00 H new ATOM 107 N PHE A 9 26.084 -9.977 7.920 1.00 0.00 N ATOM 108 CA PHE A 9 26.136 -9.355 6.602 1.00 0.00 C ATOM 109 C PHE A 9 26.296 -10.410 5.511 1.00 0.00 C ATOM 110 O PHE A 9 27.229 -11.212 5.544 1.00 0.00 O ATOM 111 CB PHE A 9 27.291 -8.356 6.532 1.00 0.00 C ATOM 112 CG PHE A 9 27.217 -7.276 7.575 1.00 0.00 C ATOM 113 CD1 PHE A 9 26.431 -6.152 7.373 1.00 0.00 C ATOM 114 CD2 PHE A 9 27.933 -7.383 8.756 1.00 0.00 C ATOM 115 CE1 PHE A 9 26.361 -5.157 8.328 1.00 0.00 C ATOM 116 CE2 PHE A 9 27.867 -6.391 9.715 1.00 0.00 C ATOM 117 CZ PHE A 9 27.081 -5.276 9.502 1.00 0.00 C ATOM 0 H PHE A 9 26.988 -10.291 8.273 1.00 0.00 H new ATOM 0 HA PHE A 9 25.197 -8.826 6.439 1.00 0.00 H new ATOM 0 HB2 PHE A 9 28.233 -8.894 6.644 1.00 0.00 H new ATOM 0 HB3 PHE A 9 27.302 -7.895 5.544 1.00 0.00 H new ATOM 0 HD1 PHE A 9 25.867 -6.053 6.458 1.00 0.00 H new ATOM 0 HD2 PHE A 9 28.550 -8.252 8.929 1.00 0.00 H new ATOM 0 HE1 PHE A 9 25.744 -4.287 8.158 1.00 0.00 H new ATOM 0 HE2 PHE A 9 28.430 -6.488 10.631 1.00 0.00 H new ATOM 0 HZ PHE A 9 27.029 -4.499 10.250 1.00 0.00 H new ATOM 127 N ALA A 10 25.378 -10.404 4.548 1.00 0.00 N ATOM 128 CA ALA A 10 25.419 -11.362 3.447 1.00 0.00 C ATOM 129 C ALA A 10 26.208 -10.811 2.266 1.00 0.00 C ATOM 130 O ALA A 10 26.494 -11.532 1.310 1.00 0.00 O ATOM 131 CB ALA A 10 24.008 -11.731 3.015 1.00 0.00 C ATOM 0 H ALA A 10 24.598 -9.748 4.508 1.00 0.00 H new ATOM 0 HA ALA A 10 25.926 -12.260 3.800 1.00 0.00 H new ATOM 0 HB1 ALA A 10 24.054 -12.446 2.193 1.00 0.00 H new ATOM 0 HB2 ALA A 10 23.475 -12.177 3.855 1.00 0.00 H new ATOM 0 HB3 ALA A 10 23.482 -10.835 2.687 1.00 0.00 H new ATOM 137 N LEU A 11 26.553 -9.527 2.337 1.00 0.00 N ATOM 138 CA LEU A 11 27.312 -8.874 1.275 1.00 0.00 C ATOM 139 C LEU A 11 26.575 -8.957 -0.059 1.00 0.00 C ATOM 140 O LEU A 11 27.168 -8.762 -1.121 1.00 0.00 O ATOM 141 CB LEU A 11 28.698 -9.513 1.145 1.00 0.00 C ATOM 142 CG LEU A 11 29.566 -9.440 2.403 1.00 0.00 C ATOM 143 CD1 LEU A 11 30.828 -10.269 2.230 1.00 0.00 C ATOM 144 CD2 LEU A 11 29.917 -7.994 2.727 1.00 0.00 C ATOM 0 H LEU A 11 26.318 -8.918 3.121 1.00 0.00 H new ATOM 0 HA LEU A 11 27.424 -7.823 1.540 1.00 0.00 H new ATOM 0 HB2 LEU A 11 28.574 -10.560 0.868 1.00 0.00 H new ATOM 0 HB3 LEU A 11 29.230 -9.028 0.327 1.00 0.00 H new ATOM 0 HG LEU A 11 28.997 -9.851 3.237 1.00 0.00 H new ATOM 0 HD11 LEU A 11 31.432 -10.205 3.135 1.00 0.00 H new ATOM 0 HD12 LEU A 11 30.558 -11.309 2.047 1.00 0.00 H new ATOM 0 HD13 LEU A 11 31.400 -9.889 1.384 1.00 0.00 H new ATOM 0 HD21 LEU A 11 30.535 -7.962 3.625 1.00 0.00 H new ATOM 0 HD22 LEU A 11 30.466 -7.557 1.893 1.00 0.00 H new ATOM 0 HD23 LEU A 11 29.002 -7.426 2.896 1.00 0.00 H new ATOM 156 N SER A 12 25.277 -9.239 0.003 1.00 0.00 N ATOM 157 CA SER A 12 24.459 -9.348 -1.200 1.00 0.00 C ATOM 158 C SER A 12 23.290 -8.369 -1.157 1.00 0.00 C ATOM 159 O SER A 12 22.348 -8.545 -0.385 1.00 0.00 O ATOM 160 CB SER A 12 23.935 -10.777 -1.358 1.00 0.00 C ATOM 161 OG SER A 12 25.003 -11.703 -1.458 1.00 0.00 O ATOM 0 H SER A 12 24.769 -9.396 0.874 1.00 0.00 H new ATOM 0 HA SER A 12 25.085 -9.100 -2.057 1.00 0.00 H new ATOM 0 HB2 SER A 12 23.306 -11.033 -0.506 1.00 0.00 H new ATOM 0 HB3 SER A 12 23.309 -10.842 -2.248 1.00 0.00 H new ATOM 0 HG SER A 12 25.526 -11.690 -0.629 1.00 0.00 H new ATOM 167 N PHE A 13 23.361 -7.338 -1.997 1.00 0.00 N ATOM 168 CA PHE A 13 22.316 -6.322 -2.069 1.00 0.00 C ATOM 169 C PHE A 13 22.113 -5.644 -0.715 1.00 0.00 C ATOM 170 O PHE A 13 22.773 -4.650 -0.410 1.00 0.00 O ATOM 171 CB PHE A 13 21.003 -6.939 -2.562 1.00 0.00 C ATOM 172 CG PHE A 13 19.926 -5.927 -2.833 1.00 0.00 C ATOM 173 CD1 PHE A 13 20.039 -5.048 -3.898 1.00 0.00 C ATOM 174 CD2 PHE A 13 18.802 -5.856 -2.027 1.00 0.00 C ATOM 175 CE1 PHE A 13 19.051 -4.117 -4.154 1.00 0.00 C ATOM 176 CE2 PHE A 13 17.810 -4.927 -2.277 1.00 0.00 C ATOM 177 CZ PHE A 13 17.935 -4.056 -3.343 1.00 0.00 C ATOM 0 H PHE A 13 24.137 -7.185 -2.641 1.00 0.00 H new ATOM 0 HA PHE A 13 22.634 -5.561 -2.782 1.00 0.00 H new ATOM 0 HB2 PHE A 13 21.197 -7.504 -3.474 1.00 0.00 H new ATOM 0 HB3 PHE A 13 20.643 -7.649 -1.818 1.00 0.00 H new ATOM 0 HD1 PHE A 13 20.910 -5.091 -4.536 1.00 0.00 H new ATOM 0 HD2 PHE A 13 18.700 -6.535 -1.193 1.00 0.00 H new ATOM 0 HE1 PHE A 13 19.151 -3.438 -4.988 1.00 0.00 H new ATOM 0 HE2 PHE A 13 16.939 -4.882 -1.641 1.00 0.00 H new ATOM 0 HZ PHE A 13 17.161 -3.329 -3.541 1.00 0.00 H new ATOM 187 N SER A 14 21.204 -6.189 0.093 1.00 0.00 N ATOM 188 CA SER A 14 20.916 -5.640 1.417 1.00 0.00 C ATOM 189 C SER A 14 20.459 -4.185 1.330 1.00 0.00 C ATOM 190 O SER A 14 21.258 -3.285 1.073 1.00 0.00 O ATOM 191 CB SER A 14 22.150 -5.747 2.317 1.00 0.00 C ATOM 192 OG SER A 14 21.874 -5.267 3.622 1.00 0.00 O ATOM 0 H SER A 14 20.653 -7.013 -0.148 1.00 0.00 H new ATOM 0 HA SER A 14 20.104 -6.225 1.849 1.00 0.00 H new ATOM 0 HB2 SER A 14 22.476 -6.786 2.370 1.00 0.00 H new ATOM 0 HB3 SER A 14 22.971 -5.177 1.883 1.00 0.00 H new ATOM 0 HG SER A 14 21.879 -4.287 3.618 1.00 0.00 H new ATOM 198 N SER A 15 19.166 -3.963 1.551 1.00 0.00 N ATOM 199 CA SER A 15 18.601 -2.617 1.500 1.00 0.00 C ATOM 200 C SER A 15 17.631 -2.391 2.655 1.00 0.00 C ATOM 201 O SER A 15 17.348 -1.251 3.025 1.00 0.00 O ATOM 202 CB SER A 15 17.885 -2.389 0.168 1.00 0.00 C ATOM 203 OG SER A 15 16.775 -3.259 0.030 1.00 0.00 O ATOM 0 H SER A 15 18.491 -4.696 1.767 1.00 0.00 H new ATOM 0 HA SER A 15 19.420 -1.904 1.590 1.00 0.00 H new ATOM 0 HB2 SER A 15 17.550 -1.354 0.104 1.00 0.00 H new ATOM 0 HB3 SER A 15 18.581 -2.550 -0.655 1.00 0.00 H new ATOM 0 HG SER A 15 16.431 -3.208 -0.886 1.00 0.00 H new ATOM 209 N ALA A 16 17.127 -3.484 3.221 1.00 0.00 N ATOM 210 CA ALA A 16 16.185 -3.408 4.333 1.00 0.00 C ATOM 211 C ALA A 16 16.892 -3.052 5.637 1.00 0.00 C ATOM 212 O ALA A 16 16.374 -2.277 6.442 1.00 0.00 O ATOM 213 CB ALA A 16 15.438 -4.725 4.480 1.00 0.00 C ATOM 0 H ALA A 16 17.356 -4.434 2.927 1.00 0.00 H new ATOM 0 HA ALA A 16 15.470 -2.615 4.114 1.00 0.00 H new ATOM 0 HB1 ALA A 16 14.738 -4.655 5.313 1.00 0.00 H new ATOM 0 HB2 ALA A 16 14.890 -4.937 3.562 1.00 0.00 H new ATOM 0 HB3 ALA A 16 16.150 -5.528 4.670 1.00 0.00 H new ATOM 219 N SER A 17 18.075 -3.621 5.838 1.00 0.00 N ATOM 220 CA SER A 17 18.852 -3.363 7.047 1.00 0.00 C ATOM 221 C SER A 17 19.789 -2.177 6.847 1.00 0.00 C ATOM 222 O SER A 17 20.730 -1.980 7.617 1.00 0.00 O ATOM 223 CB SER A 17 19.658 -4.604 7.435 1.00 0.00 C ATOM 224 OG SER A 17 20.564 -4.968 6.408 1.00 0.00 O ATOM 0 H SER A 17 18.518 -4.263 5.181 1.00 0.00 H new ATOM 0 HA SER A 17 18.157 -3.123 7.852 1.00 0.00 H new ATOM 0 HB2 SER A 17 20.207 -4.411 8.356 1.00 0.00 H new ATOM 0 HB3 SER A 17 18.980 -5.433 7.636 1.00 0.00 H new ATOM 0 HG SER A 17 21.067 -5.763 6.682 1.00 0.00 H new ATOM 230 N ASP A 18 19.524 -1.387 5.812 1.00 0.00 N ATOM 231 CA ASP A 18 20.344 -0.221 5.510 1.00 0.00 C ATOM 232 C ASP A 18 19.513 1.057 5.517 1.00 0.00 C ATOM 233 O ASP A 18 18.300 1.024 5.726 1.00 0.00 O ATOM 234 CB ASP A 18 21.027 -0.390 4.151 1.00 0.00 C ATOM 235 CG ASP A 18 22.122 -1.437 4.181 1.00 0.00 C ATOM 236 OD1 ASP A 18 23.275 -1.082 4.504 1.00 0.00 O ATOM 237 OD2 ASP A 18 21.828 -2.613 3.882 1.00 0.00 O ATOM 0 H ASP A 18 18.747 -1.534 5.168 1.00 0.00 H new ATOM 0 HA ASP A 18 21.104 -0.138 6.287 1.00 0.00 H new ATOM 0 HB2 ASP A 18 20.282 -0.668 3.405 1.00 0.00 H new ATOM 0 HB3 ASP A 18 21.450 0.565 3.839 1.00 0.00 H new ATOM 242 N ALA A 19 20.184 2.181 5.286 1.00 0.00 N ATOM 243 CA ALA A 19 19.527 3.483 5.263 1.00 0.00 C ATOM 244 C ALA A 19 18.513 3.572 4.127 1.00 0.00 C ATOM 245 O ALA A 19 17.583 4.378 4.177 1.00 0.00 O ATOM 246 CB ALA A 19 20.561 4.590 5.134 1.00 0.00 C ATOM 0 H ALA A 19 21.188 2.216 5.111 1.00 0.00 H new ATOM 0 HA ALA A 19 18.989 3.606 6.203 1.00 0.00 H new ATOM 0 HB1 ALA A 19 20.059 5.557 5.118 1.00 0.00 H new ATOM 0 HB2 ALA A 19 21.244 4.550 5.982 1.00 0.00 H new ATOM 0 HB3 ALA A 19 21.123 4.457 4.209 1.00 0.00 H new ATOM 252 N GLU A 20 18.700 2.744 3.102 1.00 0.00 N ATOM 253 CA GLU A 20 17.805 2.738 1.949 1.00 0.00 C ATOM 254 C GLU A 20 16.358 2.502 2.371 1.00 0.00 C ATOM 255 O GLU A 20 15.454 3.219 1.944 1.00 0.00 O ATOM 256 CB GLU A 20 18.236 1.664 0.948 1.00 0.00 C ATOM 257 CG GLU A 20 17.344 1.583 -0.281 1.00 0.00 C ATOM 258 CD GLU A 20 17.317 2.879 -1.067 1.00 0.00 C ATOM 259 OE1 GLU A 20 16.463 3.739 -0.765 1.00 0.00 O ATOM 260 OE2 GLU A 20 18.150 3.035 -1.985 1.00 0.00 O ATOM 0 H GLU A 20 19.463 2.069 3.047 1.00 0.00 H new ATOM 0 HA GLU A 20 17.867 3.718 1.475 1.00 0.00 H new ATOM 0 HB2 GLU A 20 19.259 1.865 0.631 1.00 0.00 H new ATOM 0 HB3 GLU A 20 18.241 0.695 1.447 1.00 0.00 H new ATOM 0 HG2 GLU A 20 17.694 0.778 -0.927 1.00 0.00 H new ATOM 0 HG3 GLU A 20 16.330 1.327 0.027 1.00 0.00 H new ATOM 267 N PHE A 21 16.144 1.492 3.210 1.00 0.00 N ATOM 268 CA PHE A 21 14.803 1.169 3.682 1.00 0.00 C ATOM 269 C PHE A 21 14.223 2.319 4.500 1.00 0.00 C ATOM 270 O PHE A 21 13.032 2.608 4.421 1.00 0.00 O ATOM 271 CB PHE A 21 14.828 -0.109 4.524 1.00 0.00 C ATOM 272 CG PHE A 21 13.463 -0.666 4.815 1.00 0.00 C ATOM 273 CD1 PHE A 21 12.744 -0.235 5.919 1.00 0.00 C ATOM 274 CD2 PHE A 21 12.898 -1.620 3.983 1.00 0.00 C ATOM 275 CE1 PHE A 21 11.489 -0.746 6.188 1.00 0.00 C ATOM 276 CE2 PHE A 21 11.644 -2.135 4.247 1.00 0.00 C ATOM 277 CZ PHE A 21 10.939 -1.698 5.351 1.00 0.00 C ATOM 0 H PHE A 21 16.879 0.886 3.575 1.00 0.00 H new ATOM 0 HA PHE A 21 14.168 1.009 2.811 1.00 0.00 H new ATOM 0 HB2 PHE A 21 15.416 -0.865 4.004 1.00 0.00 H new ATOM 0 HB3 PHE A 21 15.335 0.097 5.466 1.00 0.00 H new ATOM 0 HD1 PHE A 21 13.170 0.509 6.576 1.00 0.00 H new ATOM 0 HD2 PHE A 21 13.445 -1.965 3.118 1.00 0.00 H new ATOM 0 HE1 PHE A 21 10.939 -0.402 7.051 1.00 0.00 H new ATOM 0 HE2 PHE A 21 11.215 -2.878 3.591 1.00 0.00 H new ATOM 0 HZ PHE A 21 9.959 -2.100 5.560 1.00 0.00 H new ATOM 287 N ASP A 22 15.072 2.970 5.285 1.00 0.00 N ATOM 288 CA ASP A 22 14.637 4.089 6.115 1.00 0.00 C ATOM 289 C ASP A 22 14.208 5.273 5.251 1.00 0.00 C ATOM 290 O ASP A 22 13.273 5.999 5.595 1.00 0.00 O ATOM 291 CB ASP A 22 15.762 4.513 7.060 1.00 0.00 C ATOM 292 CG ASP A 22 15.385 5.714 7.904 1.00 0.00 C ATOM 293 OD1 ASP A 22 14.757 5.521 8.967 1.00 0.00 O ATOM 294 OD2 ASP A 22 15.719 6.849 7.503 1.00 0.00 O ATOM 0 H ASP A 22 16.063 2.744 5.365 1.00 0.00 H new ATOM 0 HA ASP A 22 13.779 3.763 6.703 1.00 0.00 H new ATOM 0 HB2 ASP A 22 16.018 3.679 7.713 1.00 0.00 H new ATOM 0 HB3 ASP A 22 16.653 4.747 6.478 1.00 0.00 H new ATOM 299 N ALA A 23 14.894 5.456 4.128 1.00 0.00 N ATOM 300 CA ALA A 23 14.595 6.552 3.212 1.00 0.00 C ATOM 301 C ALA A 23 13.214 6.390 2.585 1.00 0.00 C ATOM 302 O ALA A 23 12.380 7.295 2.657 1.00 0.00 O ATOM 303 CB ALA A 23 15.657 6.632 2.127 1.00 0.00 C ATOM 0 H ALA A 23 15.664 4.857 3.829 1.00 0.00 H new ATOM 0 HA ALA A 23 14.597 7.479 3.785 1.00 0.00 H new ATOM 0 HB1 ALA A 23 15.424 7.453 1.449 1.00 0.00 H new ATOM 0 HB2 ALA A 23 16.632 6.804 2.584 1.00 0.00 H new ATOM 0 HB3 ALA A 23 15.678 5.696 1.569 1.00 0.00 H new ATOM 309 N VAL A 24 12.979 5.236 1.968 1.00 0.00 N ATOM 310 CA VAL A 24 11.702 4.966 1.322 1.00 0.00 C ATOM 311 C VAL A 24 10.547 5.144 2.298 1.00 0.00 C ATOM 312 O VAL A 24 9.553 5.795 1.983 1.00 0.00 O ATOM 313 CB VAL A 24 11.666 3.553 0.704 1.00 0.00 C ATOM 314 CG1 VAL A 24 11.457 2.476 1.752 1.00 0.00 C ATOM 315 CG2 VAL A 24 10.603 3.468 -0.381 1.00 0.00 C ATOM 0 H VAL A 24 13.655 4.475 1.903 1.00 0.00 H new ATOM 0 HA VAL A 24 11.590 5.690 0.515 1.00 0.00 H new ATOM 0 HB VAL A 24 12.641 3.373 0.251 1.00 0.00 H new ATOM 0 HG11 VAL A 24 11.439 1.498 1.270 1.00 0.00 H new ATOM 0 HG12 VAL A 24 12.272 2.509 2.475 1.00 0.00 H new ATOM 0 HG13 VAL A 24 10.510 2.646 2.265 1.00 0.00 H new ATOM 0 HG21 VAL A 24 10.594 2.463 -0.804 1.00 0.00 H new ATOM 0 HG22 VAL A 24 9.626 3.689 0.049 1.00 0.00 H new ATOM 0 HG23 VAL A 24 10.826 4.190 -1.166 1.00 0.00 H new ATOM 325 N VAL A 25 10.696 4.574 3.485 1.00 0.00 N ATOM 326 CA VAL A 25 9.668 4.675 4.516 1.00 0.00 C ATOM 327 C VAL A 25 9.292 6.132 4.757 1.00 0.00 C ATOM 328 O VAL A 25 8.113 6.468 4.878 1.00 0.00 O ATOM 329 CB VAL A 25 10.123 4.036 5.845 1.00 0.00 C ATOM 330 CG1 VAL A 25 9.103 4.294 6.945 1.00 0.00 C ATOM 331 CG2 VAL A 25 10.346 2.542 5.667 1.00 0.00 C ATOM 0 H VAL A 25 11.518 4.036 3.760 1.00 0.00 H new ATOM 0 HA VAL A 25 8.797 4.128 4.154 1.00 0.00 H new ATOM 0 HB VAL A 25 11.066 4.496 6.140 1.00 0.00 H new ATOM 0 HG11 VAL A 25 9.444 3.835 7.873 1.00 0.00 H new ATOM 0 HG12 VAL A 25 8.990 5.368 7.092 1.00 0.00 H new ATOM 0 HG13 VAL A 25 8.143 3.864 6.659 1.00 0.00 H new ATOM 0 HG21 VAL A 25 10.667 2.107 6.613 1.00 0.00 H new ATOM 0 HG22 VAL A 25 9.417 2.071 5.347 1.00 0.00 H new ATOM 0 HG23 VAL A 25 11.115 2.376 4.913 1.00 0.00 H new ATOM 341 N GLY A 26 10.302 6.995 4.822 1.00 0.00 N ATOM 342 CA GLY A 26 10.054 8.407 5.034 1.00 0.00 C ATOM 343 C GLY A 26 9.215 9.006 3.923 1.00 0.00 C ATOM 344 O GLY A 26 8.378 9.876 4.167 1.00 0.00 O ATOM 0 H GLY A 26 11.286 6.741 4.732 1.00 0.00 H new ATOM 0 HA2 GLY A 26 9.546 8.547 5.988 1.00 0.00 H new ATOM 0 HA3 GLY A 26 11.004 8.937 5.098 1.00 0.00 H new ATOM 348 N TYR A 27 9.439 8.535 2.700 1.00 0.00 N ATOM 349 CA TYR A 27 8.693 9.025 1.546 1.00 0.00 C ATOM 350 C TYR A 27 7.226 8.616 1.631 1.00 0.00 C ATOM 351 O TYR A 27 6.334 9.459 1.533 1.00 0.00 O ATOM 352 CB TYR A 27 9.306 8.497 0.244 1.00 0.00 C ATOM 353 CG TYR A 27 10.698 9.023 -0.039 1.00 0.00 C ATOM 354 CD1 TYR A 27 11.011 10.364 0.156 1.00 0.00 C ATOM 355 CD2 TYR A 27 11.699 8.177 -0.501 1.00 0.00 C ATOM 356 CE1 TYR A 27 12.280 10.845 -0.102 1.00 0.00 C ATOM 357 CE2 TYR A 27 12.971 8.652 -0.761 1.00 0.00 C ATOM 358 CZ TYR A 27 13.256 9.986 -0.561 1.00 0.00 C ATOM 359 OH TYR A 27 14.521 10.461 -0.820 1.00 0.00 O ATOM 0 H TYR A 27 10.129 7.816 2.483 1.00 0.00 H new ATOM 0 HA TYR A 27 8.751 10.113 1.549 1.00 0.00 H new ATOM 0 HB2 TYR A 27 9.342 7.408 0.287 1.00 0.00 H new ATOM 0 HB3 TYR A 27 8.652 8.762 -0.587 1.00 0.00 H new ATOM 0 HD1 TYR A 27 10.249 11.040 0.515 1.00 0.00 H new ATOM 0 HD2 TYR A 27 11.480 7.131 -0.660 1.00 0.00 H new ATOM 0 HE1 TYR A 27 12.507 11.889 0.055 1.00 0.00 H new ATOM 0 HE2 TYR A 27 13.738 7.981 -1.119 1.00 0.00 H new ATOM 0 HH TYR A 27 15.088 9.726 -1.135 1.00 0.00 H new ATOM 369 N LEU A 28 6.982 7.318 1.814 1.00 0.00 N ATOM 370 CA LEU A 28 5.621 6.802 1.916 1.00 0.00 C ATOM 371 C LEU A 28 4.827 7.569 2.968 1.00 0.00 C ATOM 372 O LEU A 28 3.705 8.000 2.714 1.00 0.00 O ATOM 373 CB LEU A 28 5.632 5.310 2.261 1.00 0.00 C ATOM 374 CG LEU A 28 5.911 4.368 1.086 1.00 0.00 C ATOM 375 CD1 LEU A 28 7.378 4.402 0.706 1.00 0.00 C ATOM 376 CD2 LEU A 28 5.477 2.951 1.426 1.00 0.00 C ATOM 0 H LEU A 28 7.709 6.607 1.894 1.00 0.00 H new ATOM 0 HA LEU A 28 5.140 6.937 0.947 1.00 0.00 H new ATOM 0 HB2 LEU A 28 6.385 5.137 3.030 1.00 0.00 H new ATOM 0 HB3 LEU A 28 4.667 5.047 2.695 1.00 0.00 H new ATOM 0 HG LEU A 28 5.331 4.709 0.228 1.00 0.00 H new ATOM 0 HD11 LEU A 28 7.553 3.725 -0.131 1.00 0.00 H new ATOM 0 HD12 LEU A 28 7.656 5.416 0.417 1.00 0.00 H new ATOM 0 HD13 LEU A 28 7.982 4.089 1.558 1.00 0.00 H new ATOM 0 HD21 LEU A 28 5.682 2.295 0.580 1.00 0.00 H new ATOM 0 HD22 LEU A 28 6.028 2.601 2.299 1.00 0.00 H new ATOM 0 HD23 LEU A 28 4.409 2.940 1.643 1.00 0.00 H new ATOM 388 N GLU A 29 5.422 7.736 4.147 1.00 0.00 N ATOM 389 CA GLU A 29 4.769 8.453 5.238 1.00 0.00 C ATOM 390 C GLU A 29 4.359 9.854 4.798 1.00 0.00 C ATOM 391 O GLU A 29 3.260 10.315 5.107 1.00 0.00 O ATOM 392 CB GLU A 29 5.699 8.536 6.449 1.00 0.00 C ATOM 393 CG GLU A 29 5.952 7.192 7.114 1.00 0.00 C ATOM 394 CD GLU A 29 6.915 7.290 8.281 1.00 0.00 C ATOM 395 OE1 GLU A 29 8.141 7.265 8.043 1.00 0.00 O ATOM 396 OE2 GLU A 29 6.443 7.392 9.433 1.00 0.00 O ATOM 0 H GLU A 29 6.353 7.385 4.370 1.00 0.00 H new ATOM 0 HA GLU A 29 3.871 7.902 5.517 1.00 0.00 H new ATOM 0 HB2 GLU A 29 6.652 8.963 6.136 1.00 0.00 H new ATOM 0 HB3 GLU A 29 5.269 9.219 7.181 1.00 0.00 H new ATOM 0 HG2 GLU A 29 5.005 6.780 7.463 1.00 0.00 H new ATOM 0 HG3 GLU A 29 6.351 6.495 6.376 1.00 0.00 H new ATOM 403 N ASP A 30 5.249 10.527 4.074 1.00 0.00 N ATOM 404 CA ASP A 30 4.978 11.873 3.585 1.00 0.00 C ATOM 405 C ASP A 30 3.777 11.868 2.645 1.00 0.00 C ATOM 406 O ASP A 30 3.026 12.842 2.574 1.00 0.00 O ATOM 407 CB ASP A 30 6.206 12.436 2.865 1.00 0.00 C ATOM 408 CG ASP A 30 5.981 13.844 2.350 1.00 0.00 C ATOM 409 OD1 ASP A 30 5.485 13.988 1.213 1.00 0.00 O ATOM 410 OD2 ASP A 30 6.302 14.803 3.084 1.00 0.00 O ATOM 0 H ASP A 30 6.165 10.161 3.813 1.00 0.00 H new ATOM 0 HA ASP A 30 4.750 12.509 4.440 1.00 0.00 H new ATOM 0 HB2 ASP A 30 7.056 12.433 3.547 1.00 0.00 H new ATOM 0 HB3 ASP A 30 6.465 11.784 2.031 1.00 0.00 H new ATOM 415 N ILE A 31 3.608 10.765 1.923 1.00 0.00 N ATOM 416 CA ILE A 31 2.501 10.620 0.986 1.00 0.00 C ATOM 417 C ILE A 31 1.201 10.300 1.718 1.00 0.00 C ATOM 418 O ILE A 31 0.132 10.773 1.336 1.00 0.00 O ATOM 419 CB ILE A 31 2.786 9.509 -0.045 1.00 0.00 C ATOM 420 CG1 ILE A 31 4.099 9.791 -0.779 1.00 0.00 C ATOM 421 CG2 ILE A 31 1.633 9.387 -1.033 1.00 0.00 C ATOM 422 CD1 ILE A 31 4.575 8.640 -1.638 1.00 0.00 C ATOM 0 H ILE A 31 4.227 9.956 1.970 1.00 0.00 H new ATOM 0 HA ILE A 31 2.395 11.572 0.466 1.00 0.00 H new ATOM 0 HB ILE A 31 2.882 8.561 0.484 1.00 0.00 H new ATOM 0 HG12 ILE A 31 3.972 10.673 -1.407 1.00 0.00 H new ATOM 0 HG13 ILE A 31 4.870 10.030 -0.047 1.00 0.00 H new ATOM 0 HG21 ILE A 31 1.852 8.598 -1.753 1.00 0.00 H new ATOM 0 HG22 ILE A 31 0.717 9.143 -0.495 1.00 0.00 H new ATOM 0 HG23 ILE A 31 1.503 10.333 -1.560 1.00 0.00 H new ATOM 0 HD11 ILE A 31 5.510 8.913 -2.127 1.00 0.00 H new ATOM 0 HD12 ILE A 31 4.735 7.762 -1.013 1.00 0.00 H new ATOM 0 HD13 ILE A 31 3.823 8.415 -2.394 1.00 0.00 H new ATOM 434 N ILE A 32 1.301 9.495 2.771 1.00 0.00 N ATOM 435 CA ILE A 32 0.132 9.108 3.553 1.00 0.00 C ATOM 436 C ILE A 32 -0.527 10.324 4.199 1.00 0.00 C ATOM 437 O ILE A 32 -1.752 10.399 4.296 1.00 0.00 O ATOM 438 CB ILE A 32 0.501 8.093 4.654 1.00 0.00 C ATOM 439 CG1 ILE A 32 1.107 6.831 4.032 1.00 0.00 C ATOM 440 CG2 ILE A 32 -0.726 7.742 5.486 1.00 0.00 C ATOM 441 CD1 ILE A 32 1.748 5.903 5.043 1.00 0.00 C ATOM 0 H ILE A 32 2.180 9.098 3.103 1.00 0.00 H new ATOM 0 HA ILE A 32 -0.570 8.643 2.861 1.00 0.00 H new ATOM 0 HB ILE A 32 1.244 8.546 5.311 1.00 0.00 H new ATOM 0 HG12 ILE A 32 0.327 6.289 3.498 1.00 0.00 H new ATOM 0 HG13 ILE A 32 1.855 7.123 3.294 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -0.449 7.025 6.259 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -1.119 8.645 5.953 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -1.489 7.305 4.842 1.00 0.00 H new ATOM 0 HD11 ILE A 32 2.155 5.032 4.530 1.00 0.00 H new ATOM 0 HD12 ILE A 32 2.551 6.428 5.561 1.00 0.00 H new ATOM 0 HD13 ILE A 32 1.000 5.581 5.767 1.00 0.00 H new ATOM 453 N MET A 33 0.293 11.274 4.635 1.00 0.00 N ATOM 454 CA MET A 33 -0.211 12.483 5.277 1.00 0.00 C ATOM 455 C MET A 33 -0.417 13.603 4.262 1.00 0.00 C ATOM 456 O MET A 33 -0.568 14.768 4.633 1.00 0.00 O ATOM 457 CB MET A 33 0.753 12.941 6.374 1.00 0.00 C ATOM 458 CG MET A 33 0.965 11.904 7.465 1.00 0.00 C ATOM 459 SD MET A 33 2.036 12.496 8.790 1.00 0.00 S ATOM 460 CE MET A 33 1.083 13.880 9.412 1.00 0.00 C ATOM 0 H MET A 33 1.309 11.231 4.556 1.00 0.00 H new ATOM 0 HA MET A 33 -1.177 12.248 5.724 1.00 0.00 H new ATOM 0 HB2 MET A 33 1.715 13.185 5.923 1.00 0.00 H new ATOM 0 HB3 MET A 33 0.371 13.857 6.824 1.00 0.00 H new ATOM 0 HG2 MET A 33 -0.001 11.620 7.883 1.00 0.00 H new ATOM 0 HG3 MET A 33 1.399 11.005 7.027 1.00 0.00 H new ATOM 0 HE1 MET A 33 1.400 14.112 10.429 1.00 0.00 H new ATOM 0 HE2 MET A 33 1.244 14.749 8.774 1.00 0.00 H new ATOM 0 HE3 MET A 33 0.024 13.622 9.412 1.00 0.00 H new ATOM 470 N ASP A 34 -0.428 13.245 2.982 1.00 0.00 N ATOM 471 CA ASP A 34 -0.621 14.223 1.918 1.00 0.00 C ATOM 472 C ASP A 34 -2.109 14.446 1.662 1.00 0.00 C ATOM 473 O ASP A 34 -2.885 13.492 1.603 1.00 0.00 O ATOM 474 CB ASP A 34 0.072 13.758 0.636 1.00 0.00 C ATOM 475 CG ASP A 34 0.100 14.833 -0.432 1.00 0.00 C ATOM 476 OD1 ASP A 34 0.998 15.699 -0.378 1.00 0.00 O ATOM 477 OD2 ASP A 34 -0.774 14.809 -1.322 1.00 0.00 O ATOM 0 H ASP A 34 -0.306 12.286 2.657 1.00 0.00 H new ATOM 0 HA ASP A 34 -0.177 15.167 2.233 1.00 0.00 H new ATOM 0 HB2 ASP A 34 1.093 13.455 0.868 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -0.441 12.878 0.248 1.00 0.00 H new ATOM 482 N ASP A 35 -2.501 15.709 1.513 1.00 0.00 N ATOM 483 CA ASP A 35 -3.899 16.056 1.273 1.00 0.00 C ATOM 484 C ASP A 35 -4.437 15.362 0.025 1.00 0.00 C ATOM 485 O ASP A 35 -5.550 14.837 0.029 1.00 0.00 O ATOM 486 CB ASP A 35 -4.053 17.573 1.133 1.00 0.00 C ATOM 487 CG ASP A 35 -5.491 17.986 0.884 1.00 0.00 C ATOM 488 OD1 ASP A 35 -6.237 18.162 1.870 1.00 0.00 O ATOM 489 OD2 ASP A 35 -5.869 18.134 -0.296 1.00 0.00 O ATOM 0 H ASP A 35 -1.870 16.509 1.554 1.00 0.00 H new ATOM 0 HA ASP A 35 -4.479 15.713 2.130 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -3.690 18.058 2.039 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -3.429 17.925 0.311 1.00 0.00 H new ATOM 494 N GLU A 36 -3.639 15.359 -1.038 1.00 0.00 N ATOM 495 CA GLU A 36 -4.043 14.734 -2.293 1.00 0.00 C ATOM 496 C GLU A 36 -4.265 13.234 -2.115 1.00 0.00 C ATOM 497 O GLU A 36 -5.076 12.630 -2.817 1.00 0.00 O ATOM 498 CB GLU A 36 -2.992 14.983 -3.377 1.00 0.00 C ATOM 499 CG GLU A 36 -3.400 14.475 -4.750 1.00 0.00 C ATOM 500 CD GLU A 36 -4.677 15.121 -5.252 1.00 0.00 C ATOM 501 OE1 GLU A 36 -4.612 16.277 -5.720 1.00 0.00 O ATOM 502 OE2 GLU A 36 -5.741 14.471 -5.175 1.00 0.00 O ATOM 0 H GLU A 36 -2.711 15.781 -1.056 1.00 0.00 H new ATOM 0 HA GLU A 36 -4.986 15.185 -2.602 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -2.793 16.053 -3.439 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -2.059 14.502 -3.084 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -2.595 14.669 -5.459 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -3.535 13.394 -4.709 1.00 0.00 H new ATOM 509 N PHE A 37 -3.541 12.636 -1.172 1.00 0.00 N ATOM 510 CA PHE A 37 -3.664 11.206 -0.910 1.00 0.00 C ATOM 511 C PHE A 37 -4.932 10.900 -0.118 1.00 0.00 C ATOM 512 O PHE A 37 -5.678 9.982 -0.460 1.00 0.00 O ATOM 513 CB PHE A 37 -2.439 10.695 -0.151 1.00 0.00 C ATOM 514 CG PHE A 37 -2.515 9.235 0.193 1.00 0.00 C ATOM 515 CD1 PHE A 37 -2.340 8.270 -0.786 1.00 0.00 C ATOM 516 CD2 PHE A 37 -2.766 8.828 1.493 1.00 0.00 C ATOM 517 CE1 PHE A 37 -2.413 6.926 -0.475 1.00 0.00 C ATOM 518 CE2 PHE A 37 -2.841 7.485 1.811 1.00 0.00 C ATOM 519 CZ PHE A 37 -2.664 6.533 0.826 1.00 0.00 C ATOM 0 H PHE A 37 -2.866 13.118 -0.579 1.00 0.00 H new ATOM 0 HA PHE A 37 -3.727 10.694 -1.870 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -1.548 10.873 -0.753 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -2.323 11.271 0.767 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -2.144 8.572 -1.804 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -2.905 9.568 2.267 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -2.274 6.184 -1.247 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -3.038 7.180 2.828 1.00 0.00 H new ATOM 0 HZ PHE A 37 -2.722 5.483 1.072 1.00 0.00 H new ATOM 529 N GLN A 38 -5.169 11.668 0.940 1.00 0.00 N ATOM 530 CA GLN A 38 -6.350 11.476 1.775 1.00 0.00 C ATOM 531 C GLN A 38 -7.624 11.590 0.945 1.00 0.00 C ATOM 532 O GLN A 38 -8.591 10.864 1.172 1.00 0.00 O ATOM 533 CB GLN A 38 -6.373 12.497 2.914 1.00 0.00 C ATOM 534 CG GLN A 38 -5.278 12.281 3.945 1.00 0.00 C ATOM 535 CD GLN A 38 -5.343 13.283 5.083 1.00 0.00 C ATOM 536 OE1 GLN A 38 -6.418 13.768 5.437 1.00 0.00 O ATOM 537 NE2 GLN A 38 -4.190 13.597 5.662 1.00 0.00 N ATOM 0 H GLN A 38 -4.560 12.429 1.240 1.00 0.00 H new ATOM 0 HA GLN A 38 -6.303 10.474 2.202 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -6.274 13.499 2.495 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -7.342 12.453 3.411 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -5.358 11.272 4.349 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -4.306 12.353 3.458 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -3.323 13.170 5.336 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -4.172 14.265 6.433 1.00 0.00 H new ATOM 546 N LEU A 39 -7.616 12.508 -0.015 1.00 0.00 N ATOM 547 CA LEU A 39 -8.767 12.715 -0.884 1.00 0.00 C ATOM 548 C LEU A 39 -8.957 11.528 -1.824 1.00 0.00 C ATOM 549 O LEU A 39 -10.067 11.026 -1.988 1.00 0.00 O ATOM 550 CB LEU A 39 -8.594 14.001 -1.694 1.00 0.00 C ATOM 551 CG LEU A 39 -9.771 14.361 -2.602 1.00 0.00 C ATOM 552 CD1 LEU A 39 -11.019 14.630 -1.776 1.00 0.00 C ATOM 553 CD2 LEU A 39 -9.428 15.567 -3.464 1.00 0.00 C ATOM 0 H LEU A 39 -6.824 13.121 -0.211 1.00 0.00 H new ATOM 0 HA LEU A 39 -9.655 12.805 -0.258 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -8.423 14.827 -1.003 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -7.698 13.908 -2.307 1.00 0.00 H new ATOM 0 HG LEU A 39 -9.972 13.515 -3.259 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -11.846 14.885 -2.439 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -11.275 13.739 -1.202 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -10.832 15.459 -1.094 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -10.276 15.810 -4.104 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -9.201 16.419 -2.824 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -8.561 15.337 -4.083 1.00 0.00 H new ATOM 565 N LEU A 40 -7.864 11.088 -2.438 1.00 0.00 N ATOM 566 CA LEU A 40 -7.897 9.963 -3.370 1.00 0.00 C ATOM 567 C LEU A 40 -8.327 8.670 -2.678 1.00 0.00 C ATOM 568 O LEU A 40 -8.983 7.822 -3.285 1.00 0.00 O ATOM 569 CB LEU A 40 -6.516 9.771 -4.005 1.00 0.00 C ATOM 570 CG LEU A 40 -6.356 8.511 -4.861 1.00 0.00 C ATOM 571 CD1 LEU A 40 -7.103 8.656 -6.177 1.00 0.00 C ATOM 572 CD2 LEU A 40 -4.885 8.220 -5.111 1.00 0.00 C ATOM 0 H LEU A 40 -6.938 11.495 -2.307 1.00 0.00 H new ATOM 0 HA LEU A 40 -8.631 10.193 -4.142 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -6.295 10.641 -4.624 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -5.770 9.747 -3.211 1.00 0.00 H new ATOM 0 HG LEU A 40 -6.786 7.671 -4.316 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -6.976 7.750 -6.769 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -8.163 8.814 -5.978 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -6.706 9.508 -6.728 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -4.790 7.321 -5.721 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -4.431 9.062 -5.633 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -4.377 8.067 -4.159 1.00 0.00 H new ATOM 584 N GLN A 41 -7.957 8.525 -1.411 1.00 0.00 N ATOM 585 CA GLN A 41 -8.288 7.325 -0.648 1.00 0.00 C ATOM 586 C GLN A 41 -9.775 7.274 -0.303 1.00 0.00 C ATOM 587 O GLN A 41 -10.401 6.217 -0.375 1.00 0.00 O ATOM 588 CB GLN A 41 -7.448 7.267 0.629 1.00 0.00 C ATOM 589 CG GLN A 41 -7.480 5.916 1.328 1.00 0.00 C ATOM 590 CD GLN A 41 -8.771 5.674 2.086 1.00 0.00 C ATOM 591 OE1 GLN A 41 -9.401 6.611 2.578 1.00 0.00 O ATOM 592 NE2 GLN A 41 -9.172 4.412 2.185 1.00 0.00 N ATOM 0 H GLN A 41 -7.427 9.223 -0.889 1.00 0.00 H new ATOM 0 HA GLN A 41 -8.060 6.459 -1.269 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -6.415 7.514 0.384 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -7.803 8.031 1.320 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -7.345 5.127 0.588 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -6.641 5.851 2.020 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -8.619 3.667 1.762 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -10.033 4.188 2.684 1.00 0.00 H new ATOM 601 N ARG A 42 -10.333 8.417 0.077 1.00 0.00 N ATOM 602 CA ARG A 42 -11.744 8.493 0.440 1.00 0.00 C ATOM 603 C ARG A 42 -12.635 8.539 -0.801 1.00 0.00 C ATOM 604 O ARG A 42 -13.759 8.037 -0.788 1.00 0.00 O ATOM 605 CB ARG A 42 -12.000 9.721 1.318 1.00 0.00 C ATOM 606 CG ARG A 42 -13.439 9.843 1.793 1.00 0.00 C ATOM 607 CD ARG A 42 -13.645 11.091 2.637 1.00 0.00 C ATOM 608 NE ARG A 42 -13.308 12.308 1.905 1.00 0.00 N ATOM 609 CZ ARG A 42 -13.338 13.524 2.442 1.00 0.00 C ATOM 610 NH1 ARG A 42 -13.685 13.684 3.712 1.00 0.00 N ATOM 611 NH2 ARG A 42 -13.020 14.581 1.708 1.00 0.00 N ATOM 0 H ARG A 42 -9.832 9.303 0.142 1.00 0.00 H new ATOM 0 HA ARG A 42 -11.994 7.593 1.002 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -11.342 9.679 2.186 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -11.734 10.618 0.759 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -14.106 9.871 0.931 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -13.707 8.961 2.375 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -14.684 11.140 2.964 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -13.031 11.027 3.535 1.00 0.00 H new ATOM 0 HE ARG A 42 -13.034 12.221 0.926 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -13.930 12.873 4.280 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -13.707 14.618 4.121 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -12.752 14.462 0.731 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -13.043 15.514 2.120 1.00 0.00 H new ATOM 625 N ASN A 43 -12.128 9.145 -1.869 1.00 0.00 N ATOM 626 CA ASN A 43 -12.883 9.264 -3.113 1.00 0.00 C ATOM 627 C ASN A 43 -13.059 7.907 -3.789 1.00 0.00 C ATOM 628 O ASN A 43 -14.114 7.622 -4.355 1.00 0.00 O ATOM 629 CB ASN A 43 -12.187 10.237 -4.068 1.00 0.00 C ATOM 630 CG ASN A 43 -12.349 11.683 -3.640 1.00 0.00 C ATOM 631 OD1 ASN A 43 -12.514 11.978 -2.456 1.00 0.00 O ATOM 632 ND2 ASN A 43 -12.302 12.596 -4.604 1.00 0.00 N ATOM 0 H ASN A 43 -11.198 9.562 -1.899 1.00 0.00 H new ATOM 0 HA ASN A 43 -13.872 9.651 -2.865 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -11.126 9.993 -4.121 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -12.594 10.110 -5.071 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -12.404 13.585 -4.375 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -12.163 12.308 -5.573 1.00 0.00 H new ATOM 639 N PHE A 44 -12.025 7.075 -3.729 1.00 0.00 N ATOM 640 CA PHE A 44 -12.078 5.752 -4.342 1.00 0.00 C ATOM 641 C PHE A 44 -12.857 4.774 -3.462 1.00 0.00 C ATOM 642 O PHE A 44 -13.610 3.938 -3.963 1.00 0.00 O ATOM 643 CB PHE A 44 -10.655 5.236 -4.619 1.00 0.00 C ATOM 644 CG PHE A 44 -10.229 4.072 -3.765 1.00 0.00 C ATOM 645 CD1 PHE A 44 -9.607 4.280 -2.545 1.00 0.00 C ATOM 646 CD2 PHE A 44 -10.449 2.771 -4.187 1.00 0.00 C ATOM 647 CE1 PHE A 44 -9.213 3.211 -1.761 1.00 0.00 C ATOM 648 CE2 PHE A 44 -10.059 1.699 -3.408 1.00 0.00 C ATOM 649 CZ PHE A 44 -9.440 1.919 -2.193 1.00 0.00 C ATOM 0 H PHE A 44 -11.143 7.292 -3.264 1.00 0.00 H new ATOM 0 HA PHE A 44 -12.605 5.832 -5.293 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -10.587 4.944 -5.667 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -9.951 6.055 -4.470 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -9.428 5.288 -2.202 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -10.931 2.593 -5.137 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -8.728 3.386 -0.812 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -10.238 0.690 -3.749 1.00 0.00 H new ATOM 0 HZ PHE A 44 -9.134 1.083 -1.582 1.00 0.00 H new ATOM 659 N MET A 45 -12.680 4.891 -2.148 1.00 0.00 N ATOM 660 CA MET A 45 -13.361 4.011 -1.205 1.00 0.00 C ATOM 661 C MET A 45 -14.867 4.261 -1.220 1.00 0.00 C ATOM 662 O MET A 45 -15.658 3.377 -0.897 1.00 0.00 O ATOM 663 CB MET A 45 -12.804 4.210 0.207 1.00 0.00 C ATOM 664 CG MET A 45 -13.447 5.355 0.975 1.00 0.00 C ATOM 665 SD MET A 45 -12.738 5.571 2.619 1.00 0.00 S ATOM 666 CE MET A 45 -13.067 3.969 3.349 1.00 0.00 C ATOM 0 H MET A 45 -12.072 5.585 -1.714 1.00 0.00 H new ATOM 0 HA MET A 45 -13.182 2.980 -1.511 1.00 0.00 H new ATOM 0 HB2 MET A 45 -12.939 3.288 0.772 1.00 0.00 H new ATOM 0 HB3 MET A 45 -11.731 4.389 0.140 1.00 0.00 H new ATOM 0 HG2 MET A 45 -13.330 6.279 0.408 1.00 0.00 H new ATOM 0 HG3 MET A 45 -14.517 5.171 1.066 1.00 0.00 H new ATOM 0 HE1 MET A 45 -13.022 4.048 4.435 1.00 0.00 H new ATOM 0 HE2 MET A 45 -14.059 3.630 3.051 1.00 0.00 H new ATOM 0 HE3 MET A 45 -12.321 3.253 3.006 1.00 0.00 H new ATOM 676 N ASP A 46 -15.250 5.477 -1.593 1.00 0.00 N ATOM 677 CA ASP A 46 -16.659 5.853 -1.657 1.00 0.00 C ATOM 678 C ASP A 46 -17.425 4.965 -2.634 1.00 0.00 C ATOM 679 O ASP A 46 -18.617 4.716 -2.455 1.00 0.00 O ATOM 680 CB ASP A 46 -16.799 7.321 -2.066 1.00 0.00 C ATOM 681 CG ASP A 46 -18.247 7.766 -2.131 1.00 0.00 C ATOM 682 OD1 ASP A 46 -18.782 8.200 -1.090 1.00 0.00 O ATOM 683 OD2 ASP A 46 -18.847 7.679 -3.223 1.00 0.00 O ATOM 0 H ASP A 46 -14.604 6.221 -1.856 1.00 0.00 H new ATOM 0 HA ASP A 46 -17.087 5.715 -0.664 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -16.261 7.947 -1.354 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -16.331 7.471 -3.039 1.00 0.00 H new ATOM 688 N LYS A 47 -16.738 4.493 -3.670 1.00 0.00 N ATOM 689 CA LYS A 47 -17.366 3.642 -4.678 1.00 0.00 C ATOM 690 C LYS A 47 -17.184 2.162 -4.350 1.00 0.00 C ATOM 691 O LYS A 47 -18.115 1.365 -4.478 1.00 0.00 O ATOM 692 CB LYS A 47 -16.776 3.939 -6.056 1.00 0.00 C ATOM 693 CG LYS A 47 -16.928 5.388 -6.492 1.00 0.00 C ATOM 694 CD LYS A 47 -18.386 5.764 -6.701 1.00 0.00 C ATOM 695 CE LYS A 47 -18.529 7.229 -7.081 1.00 0.00 C ATOM 696 NZ LYS A 47 -19.948 7.607 -7.330 1.00 0.00 N ATOM 0 H LYS A 47 -15.750 4.684 -3.834 1.00 0.00 H new ATOM 0 HA LYS A 47 -18.434 3.862 -4.681 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -15.717 3.681 -6.050 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -17.257 3.296 -6.793 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -16.488 6.042 -5.739 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -16.375 5.549 -7.417 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -18.816 5.139 -7.484 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -18.949 5.566 -5.789 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -18.123 7.851 -6.283 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -17.938 7.431 -7.975 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -19.999 8.614 -7.586 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -20.329 7.032 -8.108 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -20.508 7.440 -6.470 1.00 0.00 H new ATOM 710 N TYR A 48 -15.977 1.801 -3.934 1.00 0.00 N ATOM 711 CA TYR A 48 -15.659 0.416 -3.596 1.00 0.00 C ATOM 712 C TYR A 48 -16.531 -0.108 -2.457 1.00 0.00 C ATOM 713 O TYR A 48 -17.115 -1.186 -2.565 1.00 0.00 O ATOM 714 CB TYR A 48 -14.181 0.288 -3.223 1.00 0.00 C ATOM 715 CG TYR A 48 -13.260 0.164 -4.417 1.00 0.00 C ATOM 716 CD1 TYR A 48 -13.274 1.109 -5.434 1.00 0.00 C ATOM 717 CD2 TYR A 48 -12.377 -0.904 -4.525 1.00 0.00 C ATOM 718 CE1 TYR A 48 -12.435 0.996 -6.525 1.00 0.00 C ATOM 719 CE2 TYR A 48 -11.534 -1.024 -5.613 1.00 0.00 C ATOM 720 CZ TYR A 48 -11.566 -0.072 -6.609 1.00 0.00 C ATOM 721 OH TYR A 48 -10.728 -0.188 -7.693 1.00 0.00 O ATOM 0 H TYR A 48 -15.198 2.450 -3.822 1.00 0.00 H new ATOM 0 HA TYR A 48 -15.865 -0.190 -4.478 1.00 0.00 H new ATOM 0 HB2 TYR A 48 -13.887 1.159 -2.637 1.00 0.00 H new ATOM 0 HB3 TYR A 48 -14.051 -0.585 -2.583 1.00 0.00 H new ATOM 0 HD1 TYR A 48 -13.953 1.947 -5.371 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -12.349 -1.652 -3.746 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -12.459 1.739 -7.308 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -10.853 -1.860 -5.683 1.00 0.00 H new ATOM 0 HH TYR A 48 -9.988 0.448 -7.604 1.00 0.00 H new ATOM 731 N TYR A 49 -16.618 0.650 -1.367 1.00 0.00 N ATOM 732 CA TYR A 49 -17.414 0.236 -0.213 1.00 0.00 C ATOM 733 C TYR A 49 -18.869 -0.017 -0.609 1.00 0.00 C ATOM 734 O TYR A 49 -19.613 -0.676 0.118 1.00 0.00 O ATOM 735 CB TYR A 49 -17.324 1.281 0.909 1.00 0.00 C ATOM 736 CG TYR A 49 -18.535 2.181 1.037 1.00 0.00 C ATOM 737 CD1 TYR A 49 -18.661 3.324 0.261 1.00 0.00 C ATOM 738 CD2 TYR A 49 -19.549 1.886 1.941 1.00 0.00 C ATOM 739 CE1 TYR A 49 -19.763 4.150 0.381 1.00 0.00 C ATOM 740 CE2 TYR A 49 -20.654 2.707 2.067 1.00 0.00 C ATOM 741 CZ TYR A 49 -20.756 3.837 1.284 1.00 0.00 C ATOM 742 OH TYR A 49 -21.854 4.657 1.405 1.00 0.00 O ATOM 0 H TYR A 49 -16.150 1.550 -1.258 1.00 0.00 H new ATOM 0 HA TYR A 49 -17.004 -0.702 0.161 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -17.171 0.764 1.856 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -16.444 1.901 0.739 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -17.886 3.573 -0.448 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -19.472 1.001 2.555 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -19.845 5.037 -0.230 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -21.433 2.465 2.775 1.00 0.00 H new ATOM 0 HH TYR A 49 -22.460 4.294 2.084 1.00 0.00 H new ATOM 752 N LEU A 50 -19.266 0.510 -1.763 1.00 0.00 N ATOM 753 CA LEU A 50 -20.627 0.328 -2.255 1.00 0.00 C ATOM 754 C LEU A 50 -20.775 -1.023 -2.943 1.00 0.00 C ATOM 755 O LEU A 50 -21.712 -1.773 -2.667 1.00 0.00 O ATOM 756 CB LEU A 50 -21.003 1.452 -3.223 1.00 0.00 C ATOM 757 CG LEU A 50 -21.204 2.825 -2.581 1.00 0.00 C ATOM 758 CD1 LEU A 50 -21.432 3.884 -3.650 1.00 0.00 C ATOM 759 CD2 LEU A 50 -22.373 2.792 -1.608 1.00 0.00 C ATOM 0 H LEU A 50 -18.666 1.065 -2.373 1.00 0.00 H new ATOM 0 HA LEU A 50 -21.303 0.360 -1.400 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -20.223 1.534 -3.980 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -21.921 1.173 -3.740 1.00 0.00 H new ATOM 0 HG LEU A 50 -20.301 3.082 -2.027 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -21.573 4.855 -3.176 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -20.567 3.926 -4.311 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -22.320 3.631 -4.230 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -22.502 3.777 -1.160 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -23.282 2.514 -2.141 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -22.174 2.061 -0.825 1.00 0.00 H new ATOM 771 N GLU A 51 -19.844 -1.328 -3.842 1.00 0.00 N ATOM 772 CA GLU A 51 -19.871 -2.592 -4.572 1.00 0.00 C ATOM 773 C GLU A 51 -19.650 -3.771 -3.631 1.00 0.00 C ATOM 774 O GLU A 51 -20.271 -4.825 -3.780 1.00 0.00 O ATOM 775 CB GLU A 51 -18.806 -2.596 -5.668 1.00 0.00 C ATOM 776 CG GLU A 51 -18.983 -1.487 -6.692 1.00 0.00 C ATOM 777 CD GLU A 51 -20.316 -1.565 -7.408 1.00 0.00 C ATOM 778 OE1 GLU A 51 -21.297 -0.979 -6.904 1.00 0.00 O ATOM 779 OE2 GLU A 51 -20.380 -2.214 -8.474 1.00 0.00 O ATOM 0 H GLU A 51 -19.062 -0.718 -4.083 1.00 0.00 H new ATOM 0 HA GLU A 51 -20.855 -2.695 -5.030 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -17.823 -2.501 -5.208 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -18.827 -3.558 -6.180 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -18.897 -0.521 -6.195 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -18.177 -1.541 -7.424 1.00 0.00 H new ATOM 786 N PHE A 52 -18.762 -3.588 -2.658 1.00 0.00 N ATOM 787 CA PHE A 52 -18.459 -4.638 -1.695 1.00 0.00 C ATOM 788 C PHE A 52 -19.562 -4.755 -0.649 1.00 0.00 C ATOM 789 O PHE A 52 -19.502 -4.121 0.404 1.00 0.00 O ATOM 790 CB PHE A 52 -17.117 -4.366 -1.010 1.00 0.00 C ATOM 791 CG PHE A 52 -15.925 -4.730 -1.848 1.00 0.00 C ATOM 792 CD1 PHE A 52 -15.509 -3.911 -2.885 1.00 0.00 C ATOM 793 CD2 PHE A 52 -15.218 -5.895 -1.597 1.00 0.00 C ATOM 794 CE1 PHE A 52 -14.410 -4.246 -3.654 1.00 0.00 C ATOM 795 CE2 PHE A 52 -14.119 -6.236 -2.362 1.00 0.00 C ATOM 796 CZ PHE A 52 -13.715 -5.409 -3.392 1.00 0.00 C ATOM 0 H PHE A 52 -18.241 -2.723 -2.517 1.00 0.00 H new ATOM 0 HA PHE A 52 -18.396 -5.581 -2.237 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -17.059 -3.309 -0.752 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -17.077 -4.925 -0.075 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -16.050 -3.000 -3.095 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -15.530 -6.545 -0.793 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -14.096 -3.598 -4.459 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -13.577 -7.147 -2.155 1.00 0.00 H new ATOM 0 HZ PHE A 52 -12.856 -5.672 -3.992 1.00 0.00 H new ATOM 806 N GLU A 53 -20.577 -5.557 -0.954 1.00 0.00 N ATOM 807 CA GLU A 53 -21.690 -5.761 -0.033 1.00 0.00 C ATOM 808 C GLU A 53 -21.502 -7.052 0.755 1.00 0.00 C ATOM 809 O GLU A 53 -21.030 -8.054 0.218 1.00 0.00 O ATOM 810 CB GLU A 53 -23.015 -5.808 -0.796 1.00 0.00 C ATOM 811 CG GLU A 53 -23.296 -4.557 -1.615 1.00 0.00 C ATOM 812 CD GLU A 53 -24.607 -4.639 -2.374 1.00 0.00 C ATOM 813 OE1 GLU A 53 -25.654 -4.286 -1.791 1.00 0.00 O ATOM 814 OE2 GLU A 53 -24.587 -5.058 -3.551 1.00 0.00 O ATOM 0 H GLU A 53 -20.652 -6.075 -1.829 1.00 0.00 H new ATOM 0 HA GLU A 53 -21.713 -4.923 0.663 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -23.011 -6.672 -1.460 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -23.828 -5.956 -0.085 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -23.317 -3.691 -0.953 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -22.481 -4.399 -2.321 1.00 0.00 H new ATOM 821 N ASP A 54 -21.874 -7.021 2.031 1.00 0.00 N ATOM 822 CA ASP A 54 -21.747 -8.182 2.892 1.00 0.00 C ATOM 823 C ASP A 54 -22.642 -9.322 2.411 1.00 0.00 C ATOM 824 O ASP A 54 -23.833 -9.364 2.716 1.00 0.00 O ATOM 825 CB ASP A 54 -22.100 -7.796 4.327 1.00 0.00 C ATOM 826 CG ASP A 54 -23.479 -7.173 4.442 1.00 0.00 C ATOM 827 OD1 ASP A 54 -23.630 -5.990 4.071 1.00 0.00 O ATOM 828 OD2 ASP A 54 -24.408 -7.871 4.902 1.00 0.00 O ATOM 0 H ASP A 54 -22.267 -6.199 2.489 1.00 0.00 H new ATOM 0 HA ASP A 54 -20.715 -8.531 2.856 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -22.052 -8.682 4.960 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -21.356 -7.094 4.704 1.00 0.00 H new ATOM 833 N THR A 55 -22.057 -10.242 1.650 1.00 0.00 N ATOM 834 CA THR A 55 -22.795 -11.384 1.123 1.00 0.00 C ATOM 835 C THR A 55 -21.958 -12.657 1.197 1.00 0.00 C ATOM 836 O THR A 55 -20.758 -12.608 1.461 1.00 0.00 O ATOM 837 CB THR A 55 -23.220 -11.151 -0.340 1.00 0.00 C ATOM 838 OG1 THR A 55 -22.064 -10.942 -1.158 1.00 0.00 O ATOM 839 CG2 THR A 55 -24.149 -9.951 -0.450 1.00 0.00 C ATOM 0 H THR A 55 -21.072 -10.218 1.384 1.00 0.00 H new ATOM 0 HA THR A 55 -23.686 -11.498 1.740 1.00 0.00 H new ATOM 0 HB THR A 55 -23.754 -12.036 -0.685 1.00 0.00 H new ATOM 0 HG1 THR A 55 -21.619 -10.111 -0.890 1.00 0.00 H new ATOM 0 HG21 THR A 55 -24.435 -9.807 -1.492 1.00 0.00 H new ATOM 0 HG22 THR A 55 -25.042 -10.126 0.151 1.00 0.00 H new ATOM 0 HG23 THR A 55 -23.637 -9.060 -0.088 1.00 0.00 H new ATOM 847 N GLU A 56 -22.601 -13.796 0.960 1.00 0.00 N ATOM 848 CA GLU A 56 -21.921 -15.082 1.000 1.00 0.00 C ATOM 849 C GLU A 56 -21.620 -15.582 -0.410 1.00 0.00 C ATOM 850 O GLU A 56 -20.624 -16.270 -0.636 1.00 0.00 O ATOM 851 CB GLU A 56 -22.780 -16.100 1.753 1.00 0.00 C ATOM 852 CG GLU A 56 -22.255 -17.522 1.671 1.00 0.00 C ATOM 853 CD GLU A 56 -23.093 -18.497 2.474 1.00 0.00 C ATOM 854 OE1 GLU A 56 -24.079 -19.028 1.921 1.00 0.00 O ATOM 855 OE2 GLU A 56 -22.765 -18.730 3.656 1.00 0.00 O ATOM 0 H GLU A 56 -23.595 -13.852 0.738 1.00 0.00 H new ATOM 0 HA GLU A 56 -20.973 -14.957 1.524 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -22.842 -15.805 2.801 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -23.794 -16.073 1.353 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -22.234 -17.839 0.628 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -21.227 -17.548 2.032 1.00 0.00 H new ATOM 862 N GLU A 57 -22.486 -15.231 -1.355 1.00 0.00 N ATOM 863 CA GLU A 57 -22.314 -15.642 -2.744 1.00 0.00 C ATOM 864 C GLU A 57 -21.217 -14.830 -3.423 1.00 0.00 C ATOM 865 O GLU A 57 -21.204 -13.602 -3.348 1.00 0.00 O ATOM 866 CB GLU A 57 -23.628 -15.482 -3.511 1.00 0.00 C ATOM 867 CG GLU A 57 -24.755 -16.352 -2.979 1.00 0.00 C ATOM 868 CD GLU A 57 -26.033 -16.203 -3.782 1.00 0.00 C ATOM 869 OE1 GLU A 57 -26.207 -16.953 -4.765 1.00 0.00 O ATOM 870 OE2 GLU A 57 -26.858 -15.336 -3.427 1.00 0.00 O ATOM 0 H GLU A 57 -23.315 -14.662 -1.184 1.00 0.00 H new ATOM 0 HA GLU A 57 -22.020 -16.692 -2.750 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -23.937 -14.438 -3.471 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -23.458 -15.724 -4.560 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -24.441 -17.396 -2.992 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -24.951 -16.091 -1.939 1.00 0.00 H new ATOM 877 N ASN A 58 -20.295 -15.524 -4.086 1.00 0.00 N ATOM 878 CA ASN A 58 -19.196 -14.866 -4.782 1.00 0.00 C ATOM 879 C ASN A 58 -19.657 -14.340 -6.136 1.00 0.00 C ATOM 880 O ASN A 58 -20.497 -14.951 -6.796 1.00 0.00 O ATOM 881 CB ASN A 58 -18.026 -15.834 -4.971 1.00 0.00 C ATOM 882 CG ASN A 58 -17.479 -16.352 -3.655 1.00 0.00 C ATOM 883 OD1 ASN A 58 -18.208 -16.480 -2.671 1.00 0.00 O ATOM 884 ND2 ASN A 58 -16.186 -16.652 -3.630 1.00 0.00 N ATOM 0 H ASN A 58 -20.288 -16.542 -4.155 1.00 0.00 H new ATOM 0 HA ASN A 58 -18.864 -14.025 -4.173 1.00 0.00 H new ATOM 0 HB2 ASN A 58 -18.351 -16.676 -5.582 1.00 0.00 H new ATOM 0 HB3 ASN A 58 -17.229 -15.332 -5.519 1.00 0.00 H new ATOM 0 HD21 ASN A 58 -15.761 -17.004 -2.772 1.00 0.00 H new ATOM 0 HD22 ASN A 58 -15.618 -16.531 -4.469 1.00 0.00 H new ATOM 891 N LYS A 59 -19.102 -13.204 -6.545 1.00 0.00 N ATOM 892 CA LYS A 59 -19.460 -12.596 -7.821 1.00 0.00 C ATOM 893 C LYS A 59 -18.230 -12.413 -8.704 1.00 0.00 C ATOM 894 O LYS A 59 -17.108 -12.306 -8.209 1.00 0.00 O ATOM 895 CB LYS A 59 -20.142 -11.245 -7.591 1.00 0.00 C ATOM 896 CG LYS A 59 -21.374 -11.326 -6.704 1.00 0.00 C ATOM 897 CD LYS A 59 -22.052 -9.972 -6.575 1.00 0.00 C ATOM 898 CE LYS A 59 -23.233 -10.025 -5.619 1.00 0.00 C ATOM 899 NZ LYS A 59 -22.815 -10.381 -4.236 1.00 0.00 N ATOM 0 H LYS A 59 -18.403 -12.686 -6.012 1.00 0.00 H new ATOM 0 HA LYS A 59 -20.153 -13.265 -8.331 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -19.425 -10.558 -7.141 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -20.426 -10.823 -8.555 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -22.077 -12.049 -7.119 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -21.090 -11.688 -5.716 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -21.330 -9.235 -6.222 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -22.392 -9.640 -7.556 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -23.735 -9.057 -5.608 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -23.958 -10.756 -5.978 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -23.586 -10.162 -3.573 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -22.597 -11.397 -4.190 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -21.970 -9.833 -3.977 1.00 0.00 H new ATOM 913 N LEU A 60 -18.449 -12.382 -10.016 1.00 0.00 N ATOM 914 CA LEU A 60 -17.359 -12.211 -10.969 1.00 0.00 C ATOM 915 C LEU A 60 -16.962 -10.741 -11.086 1.00 0.00 C ATOM 916 O LEU A 60 -15.946 -10.408 -11.694 1.00 0.00 O ATOM 917 CB LEU A 60 -17.767 -12.758 -12.342 1.00 0.00 C ATOM 918 CG LEU A 60 -16.635 -12.854 -13.368 1.00 0.00 C ATOM 919 CD1 LEU A 60 -15.608 -13.892 -12.939 1.00 0.00 C ATOM 920 CD2 LEU A 60 -17.191 -13.190 -14.744 1.00 0.00 C ATOM 0 H LEU A 60 -19.371 -12.473 -10.442 1.00 0.00 H new ATOM 0 HA LEU A 60 -16.497 -12.770 -10.605 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -18.198 -13.750 -12.207 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -18.553 -12.122 -12.750 1.00 0.00 H new ATOM 0 HG LEU A 60 -16.139 -11.885 -13.423 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -14.812 -13.945 -13.682 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -15.186 -13.610 -11.974 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -16.089 -14.866 -12.853 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -16.373 -13.254 -15.461 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -17.713 -14.146 -14.702 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -17.886 -12.411 -15.056 1.00 0.00 H new ATOM 932 N ILE A 61 -17.772 -9.864 -10.495 1.00 0.00 N ATOM 933 CA ILE A 61 -17.511 -8.427 -10.536 1.00 0.00 C ATOM 934 C ILE A 61 -16.306 -8.057 -9.672 1.00 0.00 C ATOM 935 O ILE A 61 -15.745 -6.968 -9.803 1.00 0.00 O ATOM 936 CB ILE A 61 -18.745 -7.623 -10.069 1.00 0.00 C ATOM 937 CG1 ILE A 61 -18.547 -6.125 -10.328 1.00 0.00 C ATOM 938 CG2 ILE A 61 -19.024 -7.875 -8.595 1.00 0.00 C ATOM 939 CD1 ILE A 61 -18.509 -5.763 -11.797 1.00 0.00 C ATOM 0 H ILE A 61 -18.614 -10.124 -9.982 1.00 0.00 H new ATOM 0 HA ILE A 61 -17.292 -8.171 -11.573 1.00 0.00 H new ATOM 0 HB ILE A 61 -19.607 -7.960 -10.645 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -19.354 -5.572 -9.847 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -17.617 -5.804 -9.859 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -19.897 -7.300 -8.286 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -19.215 -8.936 -8.437 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -18.161 -7.570 -8.004 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -18.366 -4.688 -11.903 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -17.685 -6.288 -12.280 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -19.449 -6.052 -12.267 1.00 0.00 H new ATOM 951 N TYR A 62 -15.905 -8.972 -8.797 1.00 0.00 N ATOM 952 CA TYR A 62 -14.767 -8.734 -7.917 1.00 0.00 C ATOM 953 C TYR A 62 -13.454 -8.744 -8.696 1.00 0.00 C ATOM 954 O TYR A 62 -12.441 -8.224 -8.226 1.00 0.00 O ATOM 955 CB TYR A 62 -14.724 -9.782 -6.801 1.00 0.00 C ATOM 956 CG TYR A 62 -15.851 -9.649 -5.800 1.00 0.00 C ATOM 957 CD1 TYR A 62 -15.999 -8.494 -5.040 1.00 0.00 C ATOM 958 CD2 TYR A 62 -16.767 -10.677 -5.613 1.00 0.00 C ATOM 959 CE1 TYR A 62 -17.027 -8.367 -4.125 1.00 0.00 C ATOM 960 CE2 TYR A 62 -17.798 -10.558 -4.700 1.00 0.00 C ATOM 961 CZ TYR A 62 -17.923 -9.402 -3.959 1.00 0.00 C ATOM 962 OH TYR A 62 -18.947 -9.280 -3.049 1.00 0.00 O ATOM 0 H TYR A 62 -16.349 -9.882 -8.678 1.00 0.00 H new ATOM 0 HA TYR A 62 -14.891 -7.747 -7.472 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -14.760 -10.776 -7.246 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -13.772 -9.703 -6.276 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -15.298 -7.682 -5.167 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -16.672 -11.584 -6.191 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -17.128 -7.463 -3.543 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -18.502 -11.366 -4.568 1.00 0.00 H new ATOM 0 HH TYR A 62 -19.489 -10.096 -3.055 1.00 0.00 H new ATOM 972 N THR A 63 -13.474 -9.332 -9.892 1.00 0.00 N ATOM 973 CA THR A 63 -12.276 -9.400 -10.724 1.00 0.00 C ATOM 974 C THR A 63 -11.953 -8.041 -11.359 1.00 0.00 C ATOM 975 O THR A 63 -10.832 -7.550 -11.224 1.00 0.00 O ATOM 976 CB THR A 63 -12.409 -10.469 -11.830 1.00 0.00 C ATOM 977 OG1 THR A 63 -12.642 -11.754 -11.242 1.00 0.00 O ATOM 978 CG2 THR A 63 -11.154 -10.523 -12.691 1.00 0.00 C ATOM 0 H THR A 63 -14.301 -9.765 -10.303 1.00 0.00 H new ATOM 0 HA THR A 63 -11.456 -9.683 -10.064 1.00 0.00 H new ATOM 0 HB THR A 63 -13.253 -10.198 -12.464 1.00 0.00 H new ATOM 0 HG1 THR A 63 -12.727 -12.427 -11.949 1.00 0.00 H new ATOM 0 HG21 THR A 63 -11.274 -11.284 -13.462 1.00 0.00 H new ATOM 0 HG22 THR A 63 -10.993 -9.553 -13.161 1.00 0.00 H new ATOM 0 HG23 THR A 63 -10.295 -10.771 -12.067 1.00 0.00 H new ATOM 986 N PRO A 64 -12.921 -7.405 -12.058 1.00 0.00 N ATOM 987 CA PRO A 64 -12.695 -6.098 -12.684 1.00 0.00 C ATOM 988 C PRO A 64 -12.423 -5.009 -11.653 1.00 0.00 C ATOM 989 O PRO A 64 -11.540 -4.173 -11.841 1.00 0.00 O ATOM 990 CB PRO A 64 -14.002 -5.814 -13.431 1.00 0.00 C ATOM 991 CG PRO A 64 -15.020 -6.675 -12.770 1.00 0.00 C ATOM 992 CD PRO A 64 -14.287 -7.903 -12.312 1.00 0.00 C ATOM 0 HA PRO A 64 -11.820 -6.107 -13.334 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -14.273 -4.760 -13.365 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -13.911 -6.053 -14.490 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -15.481 -6.159 -11.928 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -15.821 -6.934 -13.462 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -14.735 -8.327 -11.413 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -14.296 -8.684 -13.072 1.00 0.00 H new ATOM 1000 N ILE A 65 -13.188 -5.022 -10.562 1.00 0.00 N ATOM 1001 CA ILE A 65 -13.018 -4.033 -9.504 1.00 0.00 C ATOM 1002 C ILE A 65 -11.613 -4.107 -8.913 1.00 0.00 C ATOM 1003 O ILE A 65 -10.965 -3.082 -8.698 1.00 0.00 O ATOM 1004 CB ILE A 65 -14.058 -4.220 -8.381 1.00 0.00 C ATOM 1005 CG1 ILE A 65 -15.473 -4.025 -8.932 1.00 0.00 C ATOM 1006 CG2 ILE A 65 -13.789 -3.252 -7.236 1.00 0.00 C ATOM 1007 CD1 ILE A 65 -16.564 -4.346 -7.932 1.00 0.00 C ATOM 0 H ILE A 65 -13.927 -5.704 -10.390 1.00 0.00 H new ATOM 0 HA ILE A 65 -13.168 -3.052 -9.955 1.00 0.00 H new ATOM 0 HB ILE A 65 -13.974 -5.236 -7.994 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -15.586 -2.992 -9.261 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -15.601 -4.656 -9.812 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -14.533 -3.399 -6.453 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -12.794 -3.436 -6.830 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -13.847 -2.228 -7.604 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -17.539 -4.185 -8.393 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -16.477 -5.387 -7.621 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -16.462 -3.697 -7.062 1.00 0.00 H new ATOM 1019 N PHE A 66 -11.149 -5.326 -8.654 1.00 0.00 N ATOM 1020 CA PHE A 66 -9.818 -5.532 -8.096 1.00 0.00 C ATOM 1021 C PHE A 66 -8.753 -4.935 -9.011 1.00 0.00 C ATOM 1022 O PHE A 66 -7.786 -4.333 -8.545 1.00 0.00 O ATOM 1023 CB PHE A 66 -9.551 -7.024 -7.890 1.00 0.00 C ATOM 1024 CG PHE A 66 -8.227 -7.315 -7.242 1.00 0.00 C ATOM 1025 CD1 PHE A 66 -8.091 -7.268 -5.864 1.00 0.00 C ATOM 1026 CD2 PHE A 66 -7.120 -7.637 -8.011 1.00 0.00 C ATOM 1027 CE1 PHE A 66 -6.876 -7.535 -5.265 1.00 0.00 C ATOM 1028 CE2 PHE A 66 -5.902 -7.906 -7.417 1.00 0.00 C ATOM 1029 CZ PHE A 66 -5.779 -7.855 -6.042 1.00 0.00 C ATOM 0 H PHE A 66 -11.674 -6.184 -8.821 1.00 0.00 H new ATOM 0 HA PHE A 66 -9.772 -5.028 -7.131 1.00 0.00 H new ATOM 0 HB2 PHE A 66 -10.347 -7.445 -7.276 1.00 0.00 H new ATOM 0 HB3 PHE A 66 -9.592 -7.528 -8.855 1.00 0.00 H new ATOM 0 HD1 PHE A 66 -8.945 -7.020 -5.251 1.00 0.00 H new ATOM 0 HD2 PHE A 66 -7.210 -7.678 -9.086 1.00 0.00 H new ATOM 0 HE1 PHE A 66 -6.783 -7.494 -4.190 1.00 0.00 H new ATOM 0 HE2 PHE A 66 -5.047 -8.156 -8.027 1.00 0.00 H new ATOM 0 HZ PHE A 66 -4.828 -8.065 -5.575 1.00 0.00 H new ATOM 1039 N ASN A 67 -8.939 -5.111 -10.318 1.00 0.00 N ATOM 1040 CA ASN A 67 -7.999 -4.585 -11.301 1.00 0.00 C ATOM 1041 C ASN A 67 -7.917 -3.064 -11.211 1.00 0.00 C ATOM 1042 O ASN A 67 -6.850 -2.478 -11.391 1.00 0.00 O ATOM 1043 CB ASN A 67 -8.418 -5.003 -12.711 1.00 0.00 C ATOM 1044 CG ASN A 67 -8.459 -6.510 -12.880 1.00 0.00 C ATOM 1045 OD1 ASN A 67 -7.711 -7.241 -12.229 1.00 0.00 O ATOM 1046 ND2 ASN A 67 -9.337 -6.985 -13.756 1.00 0.00 N ATOM 0 H ASN A 67 -9.731 -5.613 -10.718 1.00 0.00 H new ATOM 0 HA ASN A 67 -7.014 -4.998 -11.086 1.00 0.00 H new ATOM 0 HB2 ASN A 67 -9.401 -4.589 -12.933 1.00 0.00 H new ATOM 0 HB3 ASN A 67 -7.723 -4.578 -13.435 1.00 0.00 H new ATOM 0 HD21 ASN A 67 -9.410 -7.991 -13.910 1.00 0.00 H new ATOM 0 HD22 ASN A 67 -9.938 -6.344 -14.274 1.00 0.00 H new ATOM 1053 N GLU A 68 -9.054 -2.435 -10.930 1.00 0.00 N ATOM 1054 CA GLU A 68 -9.115 -0.983 -10.811 1.00 0.00 C ATOM 1055 C GLU A 68 -8.339 -0.506 -9.589 1.00 0.00 C ATOM 1056 O GLU A 68 -7.748 0.571 -9.601 1.00 0.00 O ATOM 1057 CB GLU A 68 -10.569 -0.518 -10.711 1.00 0.00 C ATOM 1058 CG GLU A 68 -10.714 0.980 -10.503 1.00 0.00 C ATOM 1059 CD GLU A 68 -10.132 1.785 -11.648 1.00 0.00 C ATOM 1060 OE1 GLU A 68 -10.859 2.025 -12.634 1.00 0.00 O ATOM 1061 OE2 GLU A 68 -8.947 2.172 -11.560 1.00 0.00 O ATOM 0 H GLU A 68 -9.945 -2.908 -10.781 1.00 0.00 H new ATOM 0 HA GLU A 68 -8.661 -0.552 -11.704 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -11.097 -0.803 -11.621 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -11.053 -1.040 -9.885 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -11.770 1.227 -10.389 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -10.218 1.264 -9.575 1.00 0.00 H new ATOM 1068 N TYR A 69 -8.350 -1.315 -8.535 1.00 0.00 N ATOM 1069 CA TYR A 69 -7.650 -0.976 -7.302 1.00 0.00 C ATOM 1070 C TYR A 69 -6.140 -0.955 -7.514 1.00 0.00 C ATOM 1071 O TYR A 69 -5.447 -0.037 -7.072 1.00 0.00 O ATOM 1072 CB TYR A 69 -8.004 -1.978 -6.202 1.00 0.00 C ATOM 1073 CG TYR A 69 -7.283 -1.725 -4.900 1.00 0.00 C ATOM 1074 CD1 TYR A 69 -7.550 -0.589 -4.150 1.00 0.00 C ATOM 1075 CD2 TYR A 69 -6.335 -2.619 -4.422 1.00 0.00 C ATOM 1076 CE1 TYR A 69 -6.892 -0.348 -2.960 1.00 0.00 C ATOM 1077 CE2 TYR A 69 -5.672 -2.388 -3.232 1.00 0.00 C ATOM 1078 CZ TYR A 69 -5.955 -1.251 -2.504 1.00 0.00 C ATOM 1079 OH TYR A 69 -5.298 -1.016 -1.319 1.00 0.00 O ATOM 0 H TYR A 69 -8.837 -2.211 -8.510 1.00 0.00 H new ATOM 0 HA TYR A 69 -7.968 0.022 -6.999 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -9.079 -1.946 -6.025 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -7.768 -2.984 -6.549 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -8.285 0.119 -4.503 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -6.112 -3.510 -4.990 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -7.110 0.543 -2.390 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -4.937 -3.093 -2.874 1.00 0.00 H new ATOM 0 HH TYR A 69 -5.559 -1.693 -0.660 1.00 0.00 H new ATOM 1089 N ILE A 70 -5.638 -1.978 -8.193 1.00 0.00 N ATOM 1090 CA ILE A 70 -4.213 -2.094 -8.469 1.00 0.00 C ATOM 1091 C ILE A 70 -3.756 -1.041 -9.476 1.00 0.00 C ATOM 1092 O ILE A 70 -2.601 -0.618 -9.466 1.00 0.00 O ATOM 1093 CB ILE A 70 -3.867 -3.498 -9.006 1.00 0.00 C ATOM 1094 CG1 ILE A 70 -4.452 -4.578 -8.089 1.00 0.00 C ATOM 1095 CG2 ILE A 70 -2.359 -3.661 -9.141 1.00 0.00 C ATOM 1096 CD1 ILE A 70 -3.882 -4.571 -6.685 1.00 0.00 C ATOM 0 H ILE A 70 -6.201 -2.743 -8.564 1.00 0.00 H new ATOM 0 HA ILE A 70 -3.689 -1.932 -7.527 1.00 0.00 H new ATOM 0 HB ILE A 70 -4.310 -3.612 -9.995 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -5.532 -4.445 -8.032 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -4.274 -5.556 -8.537 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -2.133 -4.657 -9.521 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -1.973 -2.913 -9.833 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -1.890 -3.530 -8.166 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -4.347 -5.364 -6.100 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -2.805 -4.736 -6.729 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -4.083 -3.608 -6.216 1.00 0.00 H new ATOM 1108 N SER A 71 -4.666 -0.627 -10.349 1.00 0.00 N ATOM 1109 CA SER A 71 -4.347 0.366 -11.367 1.00 0.00 C ATOM 1110 C SER A 71 -4.512 1.790 -10.841 1.00 0.00 C ATOM 1111 O SER A 71 -3.858 2.713 -11.322 1.00 0.00 O ATOM 1112 CB SER A 71 -5.235 0.162 -12.596 1.00 0.00 C ATOM 1113 OG SER A 71 -4.949 1.123 -13.598 1.00 0.00 O ATOM 0 H SER A 71 -5.629 -0.963 -10.373 1.00 0.00 H new ATOM 0 HA SER A 71 -3.301 0.230 -11.643 1.00 0.00 H new ATOM 0 HB2 SER A 71 -5.083 -0.841 -12.996 1.00 0.00 H new ATOM 0 HB3 SER A 71 -6.283 0.235 -12.307 1.00 0.00 H new ATOM 0 HG SER A 71 -5.529 0.970 -14.373 1.00 0.00 H new ATOM 1119 N LEU A 72 -5.407 1.975 -9.874 1.00 0.00 N ATOM 1120 CA LEU A 72 -5.645 3.300 -9.310 1.00 0.00 C ATOM 1121 C LEU A 72 -4.750 3.581 -8.098 1.00 0.00 C ATOM 1122 O LEU A 72 -3.898 4.471 -8.137 1.00 0.00 O ATOM 1123 CB LEU A 72 -7.124 3.438 -8.920 1.00 0.00 C ATOM 1124 CG LEU A 72 -7.595 4.841 -8.502 1.00 0.00 C ATOM 1125 CD1 LEU A 72 -7.193 5.145 -7.066 1.00 0.00 C ATOM 1126 CD2 LEU A 72 -7.047 5.904 -9.446 1.00 0.00 C ATOM 0 H LEU A 72 -5.975 1.231 -9.468 1.00 0.00 H new ATOM 0 HA LEU A 72 -5.394 4.036 -10.074 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -7.731 3.112 -9.764 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -7.326 2.751 -8.098 1.00 0.00 H new ATOM 0 HG LEU A 72 -8.683 4.858 -8.563 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -7.538 6.143 -6.795 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -7.645 4.411 -6.399 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -6.108 5.099 -6.974 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -7.395 6.887 -9.128 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -5.957 5.881 -9.427 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -7.396 5.706 -10.459 1.00 0.00 H new ATOM 1138 N VAL A 73 -4.941 2.808 -7.032 1.00 0.00 N ATOM 1139 CA VAL A 73 -4.180 2.997 -5.797 1.00 0.00 C ATOM 1140 C VAL A 73 -2.737 2.506 -5.905 1.00 0.00 C ATOM 1141 O VAL A 73 -1.798 3.290 -5.761 1.00 0.00 O ATOM 1142 CB VAL A 73 -4.858 2.287 -4.609 1.00 0.00 C ATOM 1143 CG1 VAL A 73 -4.132 2.603 -3.310 1.00 0.00 C ATOM 1144 CG2 VAL A 73 -6.324 2.683 -4.520 1.00 0.00 C ATOM 0 H VAL A 73 -5.616 2.044 -6.997 1.00 0.00 H new ATOM 0 HA VAL A 73 -4.161 4.073 -5.627 1.00 0.00 H new ATOM 0 HB VAL A 73 -4.804 1.211 -4.773 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -4.626 2.092 -2.483 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -3.098 2.265 -3.379 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -4.151 3.679 -3.135 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -6.788 2.173 -3.676 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -6.402 3.761 -4.380 1.00 0.00 H new ATOM 0 HG23 VAL A 73 -6.834 2.399 -5.440 1.00 0.00 H new ATOM 1154 N GLU A 74 -2.568 1.211 -6.153 1.00 0.00 N ATOM 1155 CA GLU A 74 -1.234 0.619 -6.250 1.00 0.00 C ATOM 1156 C GLU A 74 -0.360 1.359 -7.259 1.00 0.00 C ATOM 1157 O GLU A 74 0.840 1.535 -7.039 1.00 0.00 O ATOM 1158 CB GLU A 74 -1.335 -0.862 -6.622 1.00 0.00 C ATOM 1159 CG GLU A 74 0.014 -1.541 -6.801 1.00 0.00 C ATOM 1160 CD GLU A 74 0.876 -1.465 -5.556 1.00 0.00 C ATOM 1161 OE1 GLU A 74 0.647 -2.263 -4.624 1.00 0.00 O ATOM 1162 OE2 GLU A 74 1.784 -0.606 -5.515 1.00 0.00 O ATOM 0 H GLU A 74 -3.334 0.552 -6.290 1.00 0.00 H new ATOM 0 HA GLU A 74 -0.761 0.710 -5.272 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -1.895 -1.385 -5.847 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -1.905 -0.957 -7.546 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -0.142 -2.587 -7.067 1.00 0.00 H new ATOM 0 HG3 GLU A 74 0.543 -1.076 -7.633 1.00 0.00 H new ATOM 1169 N LYS A 75 -0.960 1.793 -8.361 1.00 0.00 N ATOM 1170 CA LYS A 75 -0.223 2.508 -9.396 1.00 0.00 C ATOM 1171 C LYS A 75 0.132 3.921 -8.942 1.00 0.00 C ATOM 1172 O LYS A 75 1.193 4.443 -9.285 1.00 0.00 O ATOM 1173 CB LYS A 75 -1.040 2.557 -10.688 1.00 0.00 C ATOM 1174 CG LYS A 75 -0.328 3.237 -11.850 1.00 0.00 C ATOM 1175 CD LYS A 75 -0.665 4.718 -11.924 1.00 0.00 C ATOM 1176 CE LYS A 75 -0.122 5.351 -13.196 1.00 0.00 C ATOM 1177 NZ LYS A 75 -0.668 4.699 -14.418 1.00 0.00 N ATOM 0 H LYS A 75 -1.952 1.663 -8.561 1.00 0.00 H new ATOM 0 HA LYS A 75 0.706 1.970 -9.583 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -1.299 1.539 -10.980 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -1.976 3.080 -10.493 1.00 0.00 H new ATOM 0 HG2 LYS A 75 0.749 3.114 -11.740 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -0.610 2.752 -12.784 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -1.746 4.848 -11.885 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -0.250 5.230 -11.056 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -0.371 6.412 -13.208 1.00 0.00 H new ATOM 0 HE3 LYS A 75 0.966 5.279 -13.201 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -0.545 5.332 -15.234 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -0.161 3.808 -14.592 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -1.680 4.501 -14.283 1.00 0.00 H new ATOM 1191 N TYR A 76 -0.762 4.540 -8.173 1.00 0.00 N ATOM 1192 CA TYR A 76 -0.534 5.895 -7.680 1.00 0.00 C ATOM 1193 C TYR A 76 0.736 5.975 -6.835 1.00 0.00 C ATOM 1194 O TYR A 76 1.636 6.763 -7.127 1.00 0.00 O ATOM 1195 CB TYR A 76 -1.734 6.369 -6.858 1.00 0.00 C ATOM 1196 CG TYR A 76 -1.635 7.815 -6.423 1.00 0.00 C ATOM 1197 CD1 TYR A 76 -2.080 8.840 -7.248 1.00 0.00 C ATOM 1198 CD2 TYR A 76 -1.096 8.156 -5.188 1.00 0.00 C ATOM 1199 CE1 TYR A 76 -1.990 10.162 -6.857 1.00 0.00 C ATOM 1200 CE2 TYR A 76 -1.003 9.475 -4.788 1.00 0.00 C ATOM 1201 CZ TYR A 76 -1.451 10.474 -5.627 1.00 0.00 C ATOM 1202 OH TYR A 76 -1.362 11.790 -5.234 1.00 0.00 O ATOM 0 H TYR A 76 -1.647 4.126 -7.879 1.00 0.00 H new ATOM 0 HA TYR A 76 -0.408 6.546 -8.545 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -2.642 6.236 -7.446 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -1.831 5.738 -5.975 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -2.504 8.599 -8.212 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -0.744 7.376 -4.529 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -2.340 10.947 -7.511 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -0.582 9.722 -3.825 1.00 0.00 H new ATOM 0 HH TYR A 76 -0.960 11.838 -4.342 1.00 0.00 H new ATOM 1212 N ILE A 77 0.805 5.156 -5.789 1.00 0.00 N ATOM 1213 CA ILE A 77 1.963 5.147 -4.901 1.00 0.00 C ATOM 1214 C ILE A 77 3.234 4.753 -5.648 1.00 0.00 C ATOM 1215 O ILE A 77 4.293 5.350 -5.446 1.00 0.00 O ATOM 1216 CB ILE A 77 1.769 4.177 -3.718 1.00 0.00 C ATOM 1217 CG1 ILE A 77 0.431 4.441 -3.018 1.00 0.00 C ATOM 1218 CG2 ILE A 77 2.923 4.310 -2.734 1.00 0.00 C ATOM 1219 CD1 ILE A 77 0.144 3.484 -1.879 1.00 0.00 C ATOM 0 H ILE A 77 0.074 4.491 -5.536 1.00 0.00 H new ATOM 0 HA ILE A 77 2.063 6.163 -4.519 1.00 0.00 H new ATOM 0 HB ILE A 77 1.756 3.157 -4.103 1.00 0.00 H new ATOM 0 HG12 ILE A 77 0.426 5.461 -2.634 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -0.373 4.372 -3.751 1.00 0.00 H new ATOM 0 HG21 ILE A 77 2.774 3.620 -1.903 1.00 0.00 H new ATOM 0 HG22 ILE A 77 3.860 4.074 -3.238 1.00 0.00 H new ATOM 0 HG23 ILE A 77 2.962 5.331 -2.355 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -0.818 3.730 -1.431 1.00 0.00 H new ATOM 0 HD12 ILE A 77 0.116 2.463 -2.260 1.00 0.00 H new ATOM 0 HD13 ILE A 77 0.928 3.569 -1.126 1.00 0.00 H new ATOM 1231 N GLU A 78 3.121 3.747 -6.509 1.00 0.00 N ATOM 1232 CA GLU A 78 4.261 3.262 -7.280 1.00 0.00 C ATOM 1233 C GLU A 78 4.910 4.382 -8.090 1.00 0.00 C ATOM 1234 O GLU A 78 6.128 4.560 -8.049 1.00 0.00 O ATOM 1235 CB GLU A 78 3.823 2.129 -8.212 1.00 0.00 C ATOM 1236 CG GLU A 78 4.965 1.522 -9.010 1.00 0.00 C ATOM 1237 CD GLU A 78 4.511 0.387 -9.906 1.00 0.00 C ATOM 1238 OE1 GLU A 78 4.488 -0.770 -9.434 1.00 0.00 O ATOM 1239 OE2 GLU A 78 4.178 0.653 -11.080 1.00 0.00 O ATOM 0 H GLU A 78 2.249 3.250 -6.691 1.00 0.00 H new ATOM 0 HA GLU A 78 5.002 2.886 -6.575 1.00 0.00 H new ATOM 0 HB2 GLU A 78 3.348 1.346 -7.621 1.00 0.00 H new ATOM 0 HB3 GLU A 78 3.070 2.508 -8.902 1.00 0.00 H new ATOM 0 HG2 GLU A 78 5.430 2.297 -9.619 1.00 0.00 H new ATOM 0 HG3 GLU A 78 5.728 1.155 -8.324 1.00 0.00 H new ATOM 1246 N GLU A 79 4.096 5.135 -8.822 1.00 0.00 N ATOM 1247 CA GLU A 79 4.598 6.230 -9.647 1.00 0.00 C ATOM 1248 C GLU A 79 5.315 7.288 -8.810 1.00 0.00 C ATOM 1249 O GLU A 79 6.385 7.764 -9.186 1.00 0.00 O ATOM 1250 CB GLU A 79 3.453 6.878 -10.429 1.00 0.00 C ATOM 1251 CG GLU A 79 2.914 6.003 -11.549 1.00 0.00 C ATOM 1252 CD GLU A 79 3.956 5.708 -12.609 1.00 0.00 C ATOM 1253 OE1 GLU A 79 4.140 6.551 -13.512 1.00 0.00 O ATOM 1254 OE2 GLU A 79 4.590 4.634 -12.537 1.00 0.00 O ATOM 0 H GLU A 79 3.085 5.008 -8.861 1.00 0.00 H new ATOM 0 HA GLU A 79 5.320 5.806 -10.345 1.00 0.00 H new ATOM 0 HB2 GLU A 79 2.642 7.115 -9.741 1.00 0.00 H new ATOM 0 HB3 GLU A 79 3.799 7.822 -10.850 1.00 0.00 H new ATOM 0 HG2 GLU A 79 2.551 5.064 -11.130 1.00 0.00 H new ATOM 0 HG3 GLU A 79 2.059 6.497 -12.012 1.00 0.00 H new ATOM 1261 N GLN A 80 4.727 7.648 -7.673 1.00 0.00 N ATOM 1262 CA GLN A 80 5.310 8.661 -6.795 1.00 0.00 C ATOM 1263 C GLN A 80 6.715 8.272 -6.346 1.00 0.00 C ATOM 1264 O GLN A 80 7.598 9.124 -6.236 1.00 0.00 O ATOM 1265 CB GLN A 80 4.417 8.881 -5.572 1.00 0.00 C ATOM 1266 CG GLN A 80 3.061 9.479 -5.910 1.00 0.00 C ATOM 1267 CD GLN A 80 3.168 10.860 -6.530 1.00 0.00 C ATOM 1268 OE1 GLN A 80 2.331 11.252 -7.345 1.00 0.00 O ATOM 1269 NE2 GLN A 80 4.197 11.607 -6.146 1.00 0.00 N ATOM 0 H GLN A 80 3.848 7.255 -7.337 1.00 0.00 H new ATOM 0 HA GLN A 80 5.381 9.588 -7.363 1.00 0.00 H new ATOM 0 HB2 GLN A 80 4.268 7.928 -5.065 1.00 0.00 H new ATOM 0 HB3 GLN A 80 4.931 9.539 -4.871 1.00 0.00 H new ATOM 0 HG2 GLN A 80 2.537 8.816 -6.598 1.00 0.00 H new ATOM 0 HG3 GLN A 80 2.458 9.538 -5.004 1.00 0.00 H new ATOM 0 HE21 GLN A 80 4.867 11.243 -5.468 1.00 0.00 H new ATOM 0 HE22 GLN A 80 4.317 12.545 -6.529 1.00 0.00 H new ATOM 1278 N LEU A 81 6.920 6.986 -6.088 1.00 0.00 N ATOM 1279 CA LEU A 81 8.221 6.493 -5.647 1.00 0.00 C ATOM 1280 C LEU A 81 9.210 6.419 -6.807 1.00 0.00 C ATOM 1281 O LEU A 81 10.403 6.672 -6.633 1.00 0.00 O ATOM 1282 CB LEU A 81 8.073 5.114 -5.000 1.00 0.00 C ATOM 1283 CG LEU A 81 7.265 5.086 -3.699 1.00 0.00 C ATOM 1284 CD1 LEU A 81 7.010 3.652 -3.263 1.00 0.00 C ATOM 1285 CD2 LEU A 81 7.992 5.854 -2.604 1.00 0.00 C ATOM 0 H LEU A 81 6.203 6.266 -6.176 1.00 0.00 H new ATOM 0 HA LEU A 81 8.612 7.196 -4.912 1.00 0.00 H new ATOM 0 HB2 LEU A 81 7.600 4.443 -5.717 1.00 0.00 H new ATOM 0 HB3 LEU A 81 9.068 4.716 -4.800 1.00 0.00 H new ATOM 0 HG LEU A 81 6.304 5.568 -3.879 1.00 0.00 H new ATOM 0 HD11 LEU A 81 6.435 3.650 -2.337 1.00 0.00 H new ATOM 0 HD12 LEU A 81 6.450 3.130 -4.039 1.00 0.00 H new ATOM 0 HD13 LEU A 81 7.962 3.147 -3.100 1.00 0.00 H new ATOM 0 HD21 LEU A 81 7.404 5.824 -1.687 1.00 0.00 H new ATOM 0 HD22 LEU A 81 8.966 5.399 -2.426 1.00 0.00 H new ATOM 0 HD23 LEU A 81 8.127 6.890 -2.915 1.00 0.00 H new ATOM 1297 N LEU A 82 8.711 6.076 -7.991 1.00 0.00 N ATOM 1298 CA LEU A 82 9.559 5.962 -9.176 1.00 0.00 C ATOM 1299 C LEU A 82 10.097 7.321 -9.615 1.00 0.00 C ATOM 1300 O LEU A 82 11.176 7.408 -10.201 1.00 0.00 O ATOM 1301 CB LEU A 82 8.785 5.310 -10.326 1.00 0.00 C ATOM 1302 CG LEU A 82 8.429 3.836 -10.120 1.00 0.00 C ATOM 1303 CD1 LEU A 82 7.601 3.321 -11.286 1.00 0.00 C ATOM 1304 CD2 LEU A 82 9.689 2.998 -9.953 1.00 0.00 C ATOM 0 H LEU A 82 7.725 5.872 -8.157 1.00 0.00 H new ATOM 0 HA LEU A 82 10.409 5.333 -8.912 1.00 0.00 H new ATOM 0 HB2 LEU A 82 7.864 5.870 -10.486 1.00 0.00 H new ATOM 0 HB3 LEU A 82 9.376 5.400 -11.237 1.00 0.00 H new ATOM 0 HG LEU A 82 7.836 3.751 -9.209 1.00 0.00 H new ATOM 0 HD11 LEU A 82 7.357 2.271 -11.123 1.00 0.00 H new ATOM 0 HD12 LEU A 82 6.681 3.900 -11.363 1.00 0.00 H new ATOM 0 HD13 LEU A 82 8.171 3.422 -12.210 1.00 0.00 H new ATOM 0 HD21 LEU A 82 9.414 1.953 -9.808 1.00 0.00 H new ATOM 0 HD22 LEU A 82 10.308 3.090 -10.845 1.00 0.00 H new ATOM 0 HD23 LEU A 82 10.248 3.350 -9.086 1.00 0.00 H new ATOM 1316 N GLN A 83 9.343 8.380 -9.333 1.00 0.00 N ATOM 1317 CA GLN A 83 9.752 9.731 -9.707 1.00 0.00 C ATOM 1318 C GLN A 83 11.096 10.099 -9.083 1.00 0.00 C ATOM 1319 O GLN A 83 11.763 11.032 -9.533 1.00 0.00 O ATOM 1320 CB GLN A 83 8.687 10.743 -9.284 1.00 0.00 C ATOM 1321 CG GLN A 83 7.400 10.639 -10.086 1.00 0.00 C ATOM 1322 CD GLN A 83 7.582 11.039 -11.537 1.00 0.00 C ATOM 1323 OE1 GLN A 83 8.427 11.872 -11.863 1.00 0.00 O ATOM 1324 NE2 GLN A 83 6.784 10.446 -12.419 1.00 0.00 N ATOM 0 H GLN A 83 8.447 8.329 -8.848 1.00 0.00 H new ATOM 0 HA GLN A 83 9.863 9.757 -10.791 1.00 0.00 H new ATOM 0 HB2 GLN A 83 8.460 10.600 -8.228 1.00 0.00 H new ATOM 0 HB3 GLN A 83 9.091 11.750 -9.390 1.00 0.00 H new ATOM 0 HG2 GLN A 83 7.029 9.615 -10.039 1.00 0.00 H new ATOM 0 HG3 GLN A 83 6.640 11.274 -9.631 1.00 0.00 H new ATOM 0 HE21 GLN A 83 6.097 9.761 -12.105 1.00 0.00 H new ATOM 0 HE22 GLN A 83 6.859 10.676 -13.410 1.00 0.00 H new ATOM 1333 N ARG A 84 11.490 9.364 -8.047 1.00 0.00 N ATOM 1334 CA ARG A 84 12.755 9.622 -7.366 1.00 0.00 C ATOM 1335 C ARG A 84 13.653 8.389 -7.391 1.00 0.00 C ATOM 1336 O ARG A 84 14.867 8.491 -7.214 1.00 0.00 O ATOM 1337 CB ARG A 84 12.500 10.054 -5.921 1.00 0.00 C ATOM 1338 CG ARG A 84 11.686 11.333 -5.803 1.00 0.00 C ATOM 1339 CD ARG A 84 11.511 11.752 -4.352 1.00 0.00 C ATOM 1340 NE ARG A 84 10.717 12.970 -4.223 1.00 0.00 N ATOM 1341 CZ ARG A 84 10.612 13.667 -3.095 1.00 0.00 C ATOM 1342 NH1 ARG A 84 11.249 13.269 -2.002 1.00 0.00 N ATOM 1343 NH2 ARG A 84 9.868 14.765 -3.060 1.00 0.00 N ATOM 0 H ARG A 84 10.953 8.587 -7.661 1.00 0.00 H new ATOM 0 HA ARG A 84 13.265 10.427 -7.895 1.00 0.00 H new ATOM 0 HB2 ARG A 84 11.979 9.252 -5.397 1.00 0.00 H new ATOM 0 HB3 ARG A 84 13.457 10.194 -5.418 1.00 0.00 H new ATOM 0 HG2 ARG A 84 12.180 12.132 -6.356 1.00 0.00 H new ATOM 0 HG3 ARG A 84 10.708 11.186 -6.261 1.00 0.00 H new ATOM 0 HD2 ARG A 84 11.030 10.946 -3.798 1.00 0.00 H new ATOM 0 HD3 ARG A 84 12.490 11.909 -3.900 1.00 0.00 H new ATOM 0 HE ARG A 84 10.214 13.306 -5.044 1.00 0.00 H new ATOM 0 HH11 ARG A 84 11.822 12.426 -2.024 1.00 0.00 H new ATOM 0 HH12 ARG A 84 11.166 13.806 -1.139 1.00 0.00 H new ATOM 0 HH21 ARG A 84 9.376 15.075 -3.898 1.00 0.00 H new ATOM 0 HH22 ARG A 84 9.788 15.299 -2.195 1.00 0.00 H new ATOM 1357 N ILE A 85 13.050 7.225 -7.609 1.00 0.00 N ATOM 1358 CA ILE A 85 13.799 5.974 -7.657 1.00 0.00 C ATOM 1359 C ILE A 85 13.373 5.126 -8.858 1.00 0.00 C ATOM 1360 O ILE A 85 12.450 4.316 -8.754 1.00 0.00 O ATOM 1361 CB ILE A 85 13.608 5.153 -6.366 1.00 0.00 C ATOM 1362 CG1 ILE A 85 13.791 6.047 -5.135 1.00 0.00 C ATOM 1363 CG2 ILE A 85 14.589 3.988 -6.331 1.00 0.00 C ATOM 1364 CD1 ILE A 85 13.466 5.358 -3.826 1.00 0.00 C ATOM 0 H ILE A 85 12.046 7.122 -7.755 1.00 0.00 H new ATOM 0 HA ILE A 85 14.852 6.237 -7.755 1.00 0.00 H new ATOM 0 HB ILE A 85 12.595 4.752 -6.353 1.00 0.00 H new ATOM 0 HG12 ILE A 85 14.822 6.399 -5.103 1.00 0.00 H new ATOM 0 HG13 ILE A 85 13.156 6.927 -5.239 1.00 0.00 H new ATOM 0 HG21 ILE A 85 14.443 3.417 -5.414 1.00 0.00 H new ATOM 0 HG22 ILE A 85 14.418 3.342 -7.192 1.00 0.00 H new ATOM 0 HG23 ILE A 85 15.609 4.370 -6.362 1.00 0.00 H new ATOM 0 HD11 ILE A 85 13.619 6.054 -3.001 1.00 0.00 H new ATOM 0 HD12 ILE A 85 12.427 5.030 -3.836 1.00 0.00 H new ATOM 0 HD13 ILE A 85 14.118 4.494 -3.698 1.00 0.00 H new ATOM 1376 N PRO A 86 14.034 5.308 -10.019 1.00 0.00 N ATOM 1377 CA PRO A 86 13.711 4.554 -11.236 1.00 0.00 C ATOM 1378 C PRO A 86 14.137 3.091 -11.147 1.00 0.00 C ATOM 1379 O PRO A 86 13.890 2.306 -12.064 1.00 0.00 O ATOM 1380 CB PRO A 86 14.505 5.277 -12.326 1.00 0.00 C ATOM 1381 CG PRO A 86 15.647 5.911 -11.611 1.00 0.00 C ATOM 1382 CD PRO A 86 15.137 6.265 -10.239 1.00 0.00 C ATOM 0 HA PRO A 86 12.637 4.525 -11.421 1.00 0.00 H new ATOM 0 HB2 PRO A 86 14.854 4.581 -13.089 1.00 0.00 H new ATOM 0 HB3 PRO A 86 13.892 6.023 -12.832 1.00 0.00 H new ATOM 0 HG2 PRO A 86 16.494 5.228 -11.547 1.00 0.00 H new ATOM 0 HG3 PRO A 86 15.993 6.800 -12.139 1.00 0.00 H new ATOM 0 HD2 PRO A 86 15.915 6.160 -9.483 1.00 0.00 H new ATOM 0 HD3 PRO A 86 14.787 7.296 -10.195 1.00 0.00 H new ATOM 1390 N GLU A 87 14.775 2.734 -10.039 1.00 0.00 N ATOM 1391 CA GLU A 87 15.233 1.364 -9.824 1.00 0.00 C ATOM 1392 C GLU A 87 14.467 0.714 -8.677 1.00 0.00 C ATOM 1393 O GLU A 87 14.879 -0.320 -8.149 1.00 0.00 O ATOM 1394 CB GLU A 87 16.733 1.346 -9.519 1.00 0.00 C ATOM 1395 CG GLU A 87 17.592 1.878 -10.654 1.00 0.00 C ATOM 1396 CD GLU A 87 19.067 1.894 -10.306 1.00 0.00 C ATOM 1397 OE1 GLU A 87 19.713 0.829 -10.407 1.00 0.00 O ATOM 1398 OE2 GLU A 87 19.577 2.969 -9.929 1.00 0.00 O ATOM 0 H GLU A 87 14.988 3.374 -9.274 1.00 0.00 H new ATOM 0 HA GLU A 87 15.047 0.797 -10.736 1.00 0.00 H new ATOM 0 HB2 GLU A 87 16.920 1.939 -8.624 1.00 0.00 H new ATOM 0 HB3 GLU A 87 17.037 0.324 -9.293 1.00 0.00 H new ATOM 0 HG2 GLU A 87 17.438 1.264 -11.541 1.00 0.00 H new ATOM 0 HG3 GLU A 87 17.270 2.888 -10.906 1.00 0.00 H new ATOM 1405 N PHE A 88 13.350 1.325 -8.299 1.00 0.00 N ATOM 1406 CA PHE A 88 12.528 0.813 -7.210 1.00 0.00 C ATOM 1407 C PHE A 88 11.648 -0.342 -7.677 1.00 0.00 C ATOM 1408 O PHE A 88 11.121 -0.325 -8.789 1.00 0.00 O ATOM 1409 CB PHE A 88 11.657 1.931 -6.636 1.00 0.00 C ATOM 1410 CG PHE A 88 10.892 1.526 -5.408 1.00 0.00 C ATOM 1411 CD1 PHE A 88 11.480 1.601 -4.156 1.00 0.00 C ATOM 1412 CD2 PHE A 88 9.586 1.072 -5.507 1.00 0.00 C ATOM 1413 CE1 PHE A 88 10.778 1.231 -3.024 1.00 0.00 C ATOM 1414 CE2 PHE A 88 8.881 0.701 -4.378 1.00 0.00 C ATOM 1415 CZ PHE A 88 9.478 0.781 -3.135 1.00 0.00 C ATOM 0 H PHE A 88 12.993 2.177 -8.732 1.00 0.00 H new ATOM 0 HA PHE A 88 13.195 0.440 -6.433 1.00 0.00 H new ATOM 0 HB2 PHE A 88 12.289 2.785 -6.395 1.00 0.00 H new ATOM 0 HB3 PHE A 88 10.953 2.261 -7.400 1.00 0.00 H new ATOM 0 HD1 PHE A 88 12.497 1.952 -4.063 1.00 0.00 H new ATOM 0 HD2 PHE A 88 9.115 1.008 -6.477 1.00 0.00 H new ATOM 0 HE1 PHE A 88 11.247 1.294 -2.053 1.00 0.00 H new ATOM 0 HE2 PHE A 88 7.864 0.349 -4.467 1.00 0.00 H new ATOM 0 HZ PHE A 88 8.928 0.492 -2.251 1.00 0.00 H new ATOM 1425 N ASN A 89 11.494 -1.342 -6.814 1.00 0.00 N ATOM 1426 CA ASN A 89 10.672 -2.505 -7.126 1.00 0.00 C ATOM 1427 C ASN A 89 9.615 -2.715 -6.047 1.00 0.00 C ATOM 1428 O ASN A 89 9.904 -3.248 -4.976 1.00 0.00 O ATOM 1429 CB ASN A 89 11.543 -3.757 -7.255 1.00 0.00 C ATOM 1430 CG ASN A 89 12.551 -3.647 -8.384 1.00 0.00 C ATOM 1431 OD1 ASN A 89 13.681 -3.203 -8.181 1.00 0.00 O ATOM 1432 ND2 ASN A 89 12.144 -4.052 -9.582 1.00 0.00 N ATOM 0 H ASN A 89 11.929 -1.369 -5.892 1.00 0.00 H new ATOM 0 HA ASN A 89 10.172 -2.325 -8.078 1.00 0.00 H new ATOM 0 HB2 ASN A 89 12.070 -3.928 -6.316 1.00 0.00 H new ATOM 0 HB3 ASN A 89 10.905 -4.624 -7.425 1.00 0.00 H new ATOM 0 HD21 ASN A 89 12.778 -4.002 -10.380 1.00 0.00 H new ATOM 0 HD22 ASN A 89 11.198 -4.413 -9.704 1.00 0.00 H new ATOM 1439 N MET A 90 8.390 -2.284 -6.336 1.00 0.00 N ATOM 1440 CA MET A 90 7.285 -2.416 -5.391 1.00 0.00 C ATOM 1441 C MET A 90 7.033 -3.880 -5.044 1.00 0.00 C ATOM 1442 O MET A 90 6.555 -4.196 -3.955 1.00 0.00 O ATOM 1443 CB MET A 90 6.014 -1.793 -5.976 1.00 0.00 C ATOM 1444 CG MET A 90 5.355 -0.774 -5.059 1.00 0.00 C ATOM 1445 SD MET A 90 4.844 -1.480 -3.480 1.00 0.00 S ATOM 1446 CE MET A 90 4.226 -0.024 -2.639 1.00 0.00 C ATOM 0 H MET A 90 8.137 -1.840 -7.219 1.00 0.00 H new ATOM 0 HA MET A 90 7.557 -1.889 -4.477 1.00 0.00 H new ATOM 0 HB2 MET A 90 6.258 -1.312 -6.923 1.00 0.00 H new ATOM 0 HB3 MET A 90 5.299 -2.586 -6.196 1.00 0.00 H new ATOM 0 HG2 MET A 90 6.049 0.046 -4.877 1.00 0.00 H new ATOM 0 HG3 MET A 90 4.485 -0.350 -5.561 1.00 0.00 H new ATOM 0 HE1 MET A 90 3.873 -0.300 -1.645 1.00 0.00 H new ATOM 0 HE2 MET A 90 5.026 0.711 -2.548 1.00 0.00 H new ATOM 0 HE3 MET A 90 3.403 0.404 -3.211 1.00 0.00 H new ATOM 1456 N ALA A 91 7.360 -4.769 -5.976 1.00 0.00 N ATOM 1457 CA ALA A 91 7.164 -6.200 -5.771 1.00 0.00 C ATOM 1458 C ALA A 91 8.055 -6.728 -4.651 1.00 0.00 C ATOM 1459 O ALA A 91 7.566 -7.291 -3.670 1.00 0.00 O ATOM 1460 CB ALA A 91 7.435 -6.957 -7.063 1.00 0.00 C ATOM 0 H ALA A 91 7.762 -4.524 -6.881 1.00 0.00 H new ATOM 0 HA ALA A 91 6.127 -6.359 -5.476 1.00 0.00 H new ATOM 0 HB1 ALA A 91 7.286 -8.024 -6.898 1.00 0.00 H new ATOM 0 HB2 ALA A 91 6.751 -6.611 -7.838 1.00 0.00 H new ATOM 0 HB3 ALA A 91 8.463 -6.779 -7.380 1.00 0.00 H new ATOM 1466 N ALA A 92 9.363 -6.542 -4.802 1.00 0.00 N ATOM 1467 CA ALA A 92 10.322 -7.002 -3.804 1.00 0.00 C ATOM 1468 C ALA A 92 10.205 -6.196 -2.515 1.00 0.00 C ATOM 1469 O ALA A 92 10.538 -6.683 -1.434 1.00 0.00 O ATOM 1470 CB ALA A 92 11.738 -6.917 -4.354 1.00 0.00 C ATOM 0 H ALA A 92 9.783 -6.076 -5.606 1.00 0.00 H new ATOM 0 HA ALA A 92 10.095 -8.043 -3.572 1.00 0.00 H new ATOM 0 HB1 ALA A 92 12.443 -7.263 -3.598 1.00 0.00 H new ATOM 0 HB2 ALA A 92 11.821 -7.543 -5.242 1.00 0.00 H new ATOM 0 HB3 ALA A 92 11.965 -5.884 -4.616 1.00 0.00 H new ATOM 1476 N PHE A 93 9.730 -4.961 -2.637 1.00 0.00 N ATOM 1477 CA PHE A 93 9.569 -4.085 -1.482 1.00 0.00 C ATOM 1478 C PHE A 93 8.518 -4.634 -0.524 1.00 0.00 C ATOM 1479 O PHE A 93 8.752 -4.729 0.680 1.00 0.00 O ATOM 1480 CB PHE A 93 9.180 -2.676 -1.937 1.00 0.00 C ATOM 1481 CG PHE A 93 8.872 -1.737 -0.804 1.00 0.00 C ATOM 1482 CD1 PHE A 93 9.868 -1.335 0.071 1.00 0.00 C ATOM 1483 CD2 PHE A 93 7.585 -1.257 -0.617 1.00 0.00 C ATOM 1484 CE1 PHE A 93 9.586 -0.471 1.112 1.00 0.00 C ATOM 1485 CE2 PHE A 93 7.298 -0.392 0.422 1.00 0.00 C ATOM 1486 CZ PHE A 93 8.299 0.001 1.288 1.00 0.00 C ATOM 0 H PHE A 93 9.450 -4.544 -3.525 1.00 0.00 H new ATOM 0 HA PHE A 93 10.522 -4.039 -0.955 1.00 0.00 H new ATOM 0 HB2 PHE A 93 9.993 -2.259 -2.532 1.00 0.00 H new ATOM 0 HB3 PHE A 93 8.309 -2.742 -2.589 1.00 0.00 H new ATOM 0 HD1 PHE A 93 10.875 -1.701 -0.062 1.00 0.00 H new ATOM 0 HD2 PHE A 93 6.798 -1.562 -1.291 1.00 0.00 H new ATOM 0 HE1 PHE A 93 10.371 -0.165 1.788 1.00 0.00 H new ATOM 0 HE2 PHE A 93 6.292 -0.024 0.556 1.00 0.00 H new ATOM 0 HZ PHE A 93 8.077 0.676 2.101 1.00 0.00 H new ATOM 1496 N THR A 94 7.359 -4.993 -1.067 1.00 0.00 N ATOM 1497 CA THR A 94 6.270 -5.529 -0.262 1.00 0.00 C ATOM 1498 C THR A 94 6.644 -6.874 0.352 1.00 0.00 C ATOM 1499 O THR A 94 6.353 -7.134 1.519 1.00 0.00 O ATOM 1500 CB THR A 94 4.987 -5.697 -1.096 1.00 0.00 C ATOM 1501 OG1 THR A 94 5.249 -6.519 -2.241 1.00 0.00 O ATOM 1502 CG2 THR A 94 4.453 -4.346 -1.547 1.00 0.00 C ATOM 0 H THR A 94 7.151 -4.922 -2.063 1.00 0.00 H new ATOM 0 HA THR A 94 6.086 -4.810 0.536 1.00 0.00 H new ATOM 0 HB THR A 94 4.235 -6.177 -0.470 1.00 0.00 H new ATOM 0 HG1 THR A 94 6.212 -6.530 -2.422 1.00 0.00 H new ATOM 0 HG21 THR A 94 3.546 -4.491 -2.134 1.00 0.00 H new ATOM 0 HG22 THR A 94 4.226 -3.735 -0.674 1.00 0.00 H new ATOM 0 HG23 THR A 94 5.204 -3.843 -2.157 1.00 0.00 H new ATOM 1510 N THR A 95 7.292 -7.725 -0.439 1.00 0.00 N ATOM 1511 CA THR A 95 7.700 -9.048 0.026 1.00 0.00 C ATOM 1512 C THR A 95 8.632 -8.954 1.231 1.00 0.00 C ATOM 1513 O THR A 95 8.479 -9.694 2.203 1.00 0.00 O ATOM 1514 CB THR A 95 8.403 -9.844 -1.090 1.00 0.00 C ATOM 1515 OG1 THR A 95 7.559 -9.918 -2.244 1.00 0.00 O ATOM 1516 CG2 THR A 95 8.746 -11.251 -0.621 1.00 0.00 C ATOM 0 H THR A 95 7.546 -7.522 -1.406 1.00 0.00 H new ATOM 0 HA THR A 95 6.789 -9.569 0.319 1.00 0.00 H new ATOM 0 HB THR A 95 9.328 -9.326 -1.345 1.00 0.00 H new ATOM 0 HG1 THR A 95 7.563 -9.055 -2.708 1.00 0.00 H new ATOM 0 HG21 THR A 95 9.241 -11.793 -1.427 1.00 0.00 H new ATOM 0 HG22 THR A 95 9.411 -11.195 0.241 1.00 0.00 H new ATOM 0 HG23 THR A 95 7.832 -11.774 -0.341 1.00 0.00 H new ATOM 1524 N THR A 96 9.597 -8.043 1.159 1.00 0.00 N ATOM 1525 CA THR A 96 10.555 -7.857 2.243 1.00 0.00 C ATOM 1526 C THR A 96 9.912 -7.143 3.429 1.00 0.00 C ATOM 1527 O THR A 96 10.293 -7.362 4.579 1.00 0.00 O ATOM 1528 CB THR A 96 11.780 -7.050 1.773 1.00 0.00 C ATOM 1529 OG1 THR A 96 12.322 -7.632 0.581 1.00 0.00 O ATOM 1530 CG2 THR A 96 12.853 -7.010 2.851 1.00 0.00 C ATOM 0 H THR A 96 9.736 -7.422 0.362 1.00 0.00 H new ATOM 0 HA THR A 96 10.880 -8.850 2.555 1.00 0.00 H new ATOM 0 HB THR A 96 11.455 -6.030 1.568 1.00 0.00 H new ATOM 0 HG1 THR A 96 11.785 -7.356 -0.191 1.00 0.00 H new ATOM 0 HG21 THR A 96 13.707 -6.434 2.493 1.00 0.00 H new ATOM 0 HG22 THR A 96 12.450 -6.541 3.749 1.00 0.00 H new ATOM 0 HG23 THR A 96 13.173 -8.026 3.084 1.00 0.00 H new ATOM 1538 N LEU A 97 8.933 -6.292 3.139 1.00 0.00 N ATOM 1539 CA LEU A 97 8.237 -5.541 4.178 1.00 0.00 C ATOM 1540 C LEU A 97 7.423 -6.472 5.073 1.00 0.00 C ATOM 1541 O LEU A 97 7.348 -6.269 6.286 1.00 0.00 O ATOM 1542 CB LEU A 97 7.319 -4.490 3.546 1.00 0.00 C ATOM 1543 CG LEU A 97 7.208 -3.169 4.315 1.00 0.00 C ATOM 1544 CD1 LEU A 97 6.414 -2.150 3.512 1.00 0.00 C ATOM 1545 CD2 LEU A 97 6.563 -3.389 5.676 1.00 0.00 C ATOM 0 H LEU A 97 8.603 -6.105 2.192 1.00 0.00 H new ATOM 0 HA LEU A 97 8.985 -5.040 4.793 1.00 0.00 H new ATOM 0 HB2 LEU A 97 7.678 -4.276 2.539 1.00 0.00 H new ATOM 0 HB3 LEU A 97 6.321 -4.917 3.444 1.00 0.00 H new ATOM 0 HG LEU A 97 8.215 -2.781 4.471 1.00 0.00 H new ATOM 0 HD11 LEU A 97 6.345 -1.218 4.073 1.00 0.00 H new ATOM 0 HD12 LEU A 97 6.915 -1.965 2.562 1.00 0.00 H new ATOM 0 HD13 LEU A 97 5.412 -2.535 3.325 1.00 0.00 H new ATOM 0 HD21 LEU A 97 6.494 -2.438 6.204 1.00 0.00 H new ATOM 0 HD22 LEU A 97 5.563 -3.803 5.542 1.00 0.00 H new ATOM 0 HD23 LEU A 97 7.169 -4.084 6.258 1.00 0.00 H new ATOM 1557 N GLN A 98 6.831 -7.502 4.470 1.00 0.00 N ATOM 1558 CA GLN A 98 6.010 -8.460 5.208 1.00 0.00 C ATOM 1559 C GLN A 98 6.741 -8.989 6.435 1.00 0.00 C ATOM 1560 O GLN A 98 6.135 -9.201 7.486 1.00 0.00 O ATOM 1561 CB GLN A 98 5.609 -9.626 4.302 1.00 0.00 C ATOM 1562 CG GLN A 98 4.596 -9.247 3.235 1.00 0.00 C ATOM 1563 CD GLN A 98 4.264 -10.400 2.308 1.00 0.00 C ATOM 1564 OE1 GLN A 98 4.911 -10.590 1.278 1.00 0.00 O ATOM 1565 NE2 GLN A 98 3.251 -11.179 2.670 1.00 0.00 N ATOM 0 H GLN A 98 6.905 -7.694 3.471 1.00 0.00 H new ATOM 0 HA GLN A 98 5.114 -7.938 5.543 1.00 0.00 H new ATOM 0 HB2 GLN A 98 6.502 -10.023 3.819 1.00 0.00 H new ATOM 0 HB3 GLN A 98 5.196 -10.426 4.916 1.00 0.00 H new ATOM 0 HG2 GLN A 98 3.682 -8.897 3.715 1.00 0.00 H new ATOM 0 HG3 GLN A 98 4.986 -8.415 2.648 1.00 0.00 H new ATOM 0 HE21 GLN A 98 2.742 -10.985 3.532 1.00 0.00 H new ATOM 0 HE22 GLN A 98 2.983 -11.971 2.086 1.00 0.00 H new ATOM 1574 N HIS A 99 8.044 -9.200 6.299 1.00 0.00 N ATOM 1575 CA HIS A 99 8.851 -9.696 7.405 1.00 0.00 C ATOM 1576 C HIS A 99 9.385 -8.536 8.236 1.00 0.00 C ATOM 1577 O HIS A 99 9.480 -8.624 9.462 1.00 0.00 O ATOM 1578 CB HIS A 99 10.013 -10.543 6.881 1.00 0.00 C ATOM 1579 CG HIS A 99 9.579 -11.790 6.174 1.00 0.00 C ATOM 1580 ND1 HIS A 99 9.457 -13.010 6.805 1.00 0.00 N ATOM 1581 CD2 HIS A 99 9.239 -12.003 4.881 1.00 0.00 C ATOM 1582 CE1 HIS A 99 9.062 -13.919 5.930 1.00 0.00 C ATOM 1583 NE2 HIS A 99 8.922 -13.333 4.755 1.00 0.00 N ATOM 0 H HIS A 99 8.563 -9.036 5.436 1.00 0.00 H new ATOM 0 HA HIS A 99 8.219 -10.320 8.038 1.00 0.00 H new ATOM 0 HB2 HIS A 99 10.612 -9.939 6.199 1.00 0.00 H new ATOM 0 HB3 HIS A 99 10.658 -10.815 7.716 1.00 0.00 H new ATOM 0 HD2 HIS A 99 9.221 -11.264 4.094 1.00 0.00 H new ATOM 0 HE1 HIS A 99 8.884 -14.963 6.140 1.00 0.00 H new ATOM 0 HE2 HIS A 99 8.627 -13.793 3.894 1.00 0.00 H new ATOM 1592 N HIS A 100 9.713 -7.438 7.562 1.00 0.00 N ATOM 1593 CA HIS A 100 10.245 -6.259 8.235 1.00 0.00 C ATOM 1594 C HIS A 100 9.196 -5.636 9.151 1.00 0.00 C ATOM 1595 O HIS A 100 9.483 -4.683 9.876 1.00 0.00 O ATOM 1596 CB HIS A 100 10.729 -5.229 7.213 1.00 0.00 C ATOM 1597 CG HIS A 100 11.832 -4.357 7.727 1.00 0.00 C ATOM 1598 ND1 HIS A 100 11.609 -3.183 8.415 1.00 0.00 N ATOM 1599 CD2 HIS A 100 13.178 -4.501 7.661 1.00 0.00 C ATOM 1600 CE1 HIS A 100 12.768 -2.642 8.747 1.00 0.00 C ATOM 1601 NE2 HIS A 100 13.734 -3.422 8.301 1.00 0.00 N ATOM 0 H HIS A 100 9.620 -7.341 6.551 1.00 0.00 H new ATOM 0 HA HIS A 100 11.092 -6.573 8.844 1.00 0.00 H new ATOM 0 HB2 HIS A 100 11.073 -5.749 6.319 1.00 0.00 H new ATOM 0 HB3 HIS A 100 9.889 -4.602 6.914 1.00 0.00 H new ATOM 0 HD2 HIS A 100 13.713 -5.313 7.192 1.00 0.00 H new ATOM 0 HE1 HIS A 100 12.902 -1.719 9.291 1.00 0.00 H new ATOM 0 HE2 HIS A 100 14.733 -3.251 8.414 1.00 0.00 H new ATOM 1610 N LYS A 101 7.979 -6.175 9.107 1.00 0.00 N ATOM 1611 CA LYS A 101 6.890 -5.679 9.945 1.00 0.00 C ATOM 1612 C LYS A 101 7.274 -5.725 11.420 1.00 0.00 C ATOM 1613 O LYS A 101 6.669 -5.046 12.250 1.00 0.00 O ATOM 1614 CB LYS A 101 5.620 -6.507 9.719 1.00 0.00 C ATOM 1615 CG LYS A 101 5.020 -6.345 8.332 1.00 0.00 C ATOM 1616 CD LYS A 101 3.766 -7.190 8.159 1.00 0.00 C ATOM 1617 CE LYS A 101 2.619 -6.679 9.015 1.00 0.00 C ATOM 1618 NZ LYS A 101 1.427 -7.569 8.932 1.00 0.00 N ATOM 0 H LYS A 101 7.723 -6.954 8.501 1.00 0.00 H new ATOM 0 HA LYS A 101 6.698 -4.643 9.665 1.00 0.00 H new ATOM 0 HB2 LYS A 101 5.850 -7.560 9.884 1.00 0.00 H new ATOM 0 HB3 LYS A 101 4.875 -6.223 10.462 1.00 0.00 H new ATOM 0 HG2 LYS A 101 4.779 -5.296 8.160 1.00 0.00 H new ATOM 0 HG3 LYS A 101 5.757 -6.630 7.581 1.00 0.00 H new ATOM 0 HD2 LYS A 101 3.467 -7.186 7.111 1.00 0.00 H new ATOM 0 HD3 LYS A 101 3.985 -8.224 8.424 1.00 0.00 H new ATOM 0 HE2 LYS A 101 2.945 -6.604 10.052 1.00 0.00 H new ATOM 0 HE3 LYS A 101 2.345 -5.674 8.694 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 0.666 -7.187 9.529 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 1.100 -7.621 7.946 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 1.681 -8.522 9.263 1.00 0.00 H new ATOM 1632 N ASP A 102 8.283 -6.531 11.743 1.00 0.00 N ATOM 1633 CA ASP A 102 8.745 -6.663 13.122 1.00 0.00 C ATOM 1634 C ASP A 102 9.445 -5.392 13.596 1.00 0.00 C ATOM 1635 O ASP A 102 9.859 -5.298 14.753 1.00 0.00 O ATOM 1636 CB ASP A 102 9.692 -7.857 13.254 1.00 0.00 C ATOM 1637 CG ASP A 102 11.018 -7.626 12.555 1.00 0.00 C ATOM 1638 OD1 ASP A 102 11.942 -7.085 13.200 1.00 0.00 O ATOM 1639 OD2 ASP A 102 11.135 -7.984 11.366 1.00 0.00 O ATOM 0 H ASP A 102 8.795 -7.101 11.070 1.00 0.00 H new ATOM 0 HA ASP A 102 7.870 -6.827 13.751 1.00 0.00 H new ATOM 0 HB2 ASP A 102 9.872 -8.059 14.310 1.00 0.00 H new ATOM 0 HB3 ASP A 102 9.214 -8.743 12.837 1.00 0.00 H new ATOM 1644 N GLU A 103 9.576 -4.417 12.701 1.00 0.00 N ATOM 1645 CA GLU A 103 10.233 -3.159 13.034 1.00 0.00 C ATOM 1646 C GLU A 103 9.353 -1.960 12.683 1.00 0.00 C ATOM 1647 O GLU A 103 8.999 -1.166 13.555 1.00 0.00 O ATOM 1648 CB GLU A 103 11.573 -3.054 12.303 1.00 0.00 C ATOM 1649 CG GLU A 103 12.380 -1.820 12.674 1.00 0.00 C ATOM 1650 CD GLU A 103 12.768 -1.797 14.140 1.00 0.00 C ATOM 1651 OE1 GLU A 103 11.973 -1.285 14.956 1.00 0.00 O ATOM 1652 OE2 GLU A 103 13.866 -2.291 14.471 1.00 0.00 O ATOM 0 H GLU A 103 9.236 -4.475 11.741 1.00 0.00 H new ATOM 0 HA GLU A 103 10.406 -3.148 14.110 1.00 0.00 H new ATOM 0 HB2 GLU A 103 12.165 -3.943 12.520 1.00 0.00 H new ATOM 0 HB3 GLU A 103 11.390 -3.048 11.228 1.00 0.00 H new ATOM 0 HG2 GLU A 103 13.282 -1.782 12.063 1.00 0.00 H new ATOM 0 HG3 GLU A 103 11.800 -0.927 12.441 1.00 0.00 H new ATOM 1659 N VAL A 104 9.006 -1.835 11.404 1.00 0.00 N ATOM 1660 CA VAL A 104 8.174 -0.728 10.942 1.00 0.00 C ATOM 1661 C VAL A 104 6.822 -0.721 11.650 1.00 0.00 C ATOM 1662 O VAL A 104 6.388 -1.740 12.187 1.00 0.00 O ATOM 1663 CB VAL A 104 7.948 -0.785 9.415 1.00 0.00 C ATOM 1664 CG1 VAL A 104 6.921 -1.852 9.054 1.00 0.00 C ATOM 1665 CG2 VAL A 104 7.520 0.576 8.885 1.00 0.00 C ATOM 0 H VAL A 104 9.288 -2.486 10.671 1.00 0.00 H new ATOM 0 HA VAL A 104 8.710 0.190 11.184 1.00 0.00 H new ATOM 0 HB VAL A 104 8.893 -1.055 8.944 1.00 0.00 H new ATOM 0 HG11 VAL A 104 6.781 -1.871 7.973 1.00 0.00 H new ATOM 0 HG12 VAL A 104 7.275 -2.826 9.391 1.00 0.00 H new ATOM 0 HG13 VAL A 104 5.972 -1.623 9.539 1.00 0.00 H new ATOM 0 HG21 VAL A 104 7.366 0.515 7.808 1.00 0.00 H new ATOM 0 HG22 VAL A 104 6.591 0.879 9.368 1.00 0.00 H new ATOM 0 HG23 VAL A 104 8.296 1.310 9.099 1.00 0.00 H new ATOM 1675 N ALA A 105 6.164 0.434 11.647 1.00 0.00 N ATOM 1676 CA ALA A 105 4.860 0.569 12.284 1.00 0.00 C ATOM 1677 C ALA A 105 3.842 -0.363 11.635 1.00 0.00 C ATOM 1678 O ALA A 105 3.397 -0.126 10.511 1.00 0.00 O ATOM 1679 CB ALA A 105 4.382 2.011 12.210 1.00 0.00 C ATOM 0 H ALA A 105 6.512 1.288 11.211 1.00 0.00 H new ATOM 0 HA ALA A 105 4.960 0.288 13.332 1.00 0.00 H new ATOM 0 HB1 ALA A 105 3.407 2.096 12.690 1.00 0.00 H new ATOM 0 HB2 ALA A 105 5.096 2.658 12.721 1.00 0.00 H new ATOM 0 HB3 ALA A 105 4.300 2.314 11.166 1.00 0.00 H new ATOM 1685 N GLY A 106 3.479 -1.421 12.350 1.00 0.00 N ATOM 1686 CA GLY A 106 2.517 -2.375 11.832 1.00 0.00 C ATOM 1687 C GLY A 106 1.149 -1.759 11.618 1.00 0.00 C ATOM 1688 O GLY A 106 0.406 -2.174 10.729 1.00 0.00 O ATOM 0 H GLY A 106 3.835 -1.636 13.282 1.00 0.00 H new ATOM 0 HA2 GLY A 106 2.882 -2.779 10.888 1.00 0.00 H new ATOM 0 HA3 GLY A 106 2.431 -3.212 12.525 1.00 0.00 H new ATOM 1692 N ASP A 107 0.819 -0.767 12.437 1.00 0.00 N ATOM 1693 CA ASP A 107 -0.471 -0.092 12.349 1.00 0.00 C ATOM 1694 C ASP A 107 -0.612 0.682 11.040 1.00 0.00 C ATOM 1695 O ASP A 107 -1.688 0.705 10.441 1.00 0.00 O ATOM 1696 CB ASP A 107 -0.650 0.857 13.534 1.00 0.00 C ATOM 1697 CG ASP A 107 -0.616 0.132 14.864 1.00 0.00 C ATOM 1698 OD1 ASP A 107 0.497 -0.134 15.367 1.00 0.00 O ATOM 1699 OD2 ASP A 107 -1.700 -0.174 15.402 1.00 0.00 O ATOM 0 H ASP A 107 1.430 -0.411 13.172 1.00 0.00 H new ATOM 0 HA ASP A 107 -1.247 -0.857 12.374 1.00 0.00 H new ATOM 0 HB2 ASP A 107 0.137 1.611 13.514 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -1.599 1.384 13.434 1.00 0.00 H new ATOM 1704 N ILE A 108 0.472 1.313 10.599 1.00 0.00 N ATOM 1705 CA ILE A 108 0.443 2.091 9.364 1.00 0.00 C ATOM 1706 C ILE A 108 0.376 1.191 8.136 1.00 0.00 C ATOM 1707 O ILE A 108 -0.475 1.379 7.266 1.00 0.00 O ATOM 1708 CB ILE A 108 1.676 3.009 9.239 1.00 0.00 C ATOM 1709 CG1 ILE A 108 1.744 3.978 10.423 1.00 0.00 C ATOM 1710 CG2 ILE A 108 1.633 3.773 7.919 1.00 0.00 C ATOM 1711 CD1 ILE A 108 2.974 4.863 10.415 1.00 0.00 C ATOM 0 H ILE A 108 1.375 1.302 11.074 1.00 0.00 H new ATOM 0 HA ILE A 108 -0.457 2.704 9.411 1.00 0.00 H new ATOM 0 HB ILE A 108 2.574 2.392 9.252 1.00 0.00 H new ATOM 0 HG12 ILE A 108 0.854 4.607 10.418 1.00 0.00 H new ATOM 0 HG13 ILE A 108 1.724 3.406 11.351 1.00 0.00 H new ATOM 0 HG21 ILE A 108 2.509 4.417 7.843 1.00 0.00 H new ATOM 0 HG22 ILE A 108 1.630 3.066 7.089 1.00 0.00 H new ATOM 0 HG23 ILE A 108 0.730 4.382 7.880 1.00 0.00 H new ATOM 0 HD11 ILE A 108 2.954 5.522 11.283 1.00 0.00 H new ATOM 0 HD12 ILE A 108 3.869 4.242 10.452 1.00 0.00 H new ATOM 0 HD13 ILE A 108 2.985 5.462 9.504 1.00 0.00 H new ATOM 1723 N PHE A 109 1.266 0.205 8.070 1.00 0.00 N ATOM 1724 CA PHE A 109 1.294 -0.705 6.936 1.00 0.00 C ATOM 1725 C PHE A 109 0.025 -1.546 6.871 1.00 0.00 C ATOM 1726 O PHE A 109 -0.399 -1.944 5.790 1.00 0.00 O ATOM 1727 CB PHE A 109 2.522 -1.615 6.977 1.00 0.00 C ATOM 1728 CG PHE A 109 2.618 -2.521 5.779 1.00 0.00 C ATOM 1729 CD1 PHE A 109 2.536 -2.002 4.494 1.00 0.00 C ATOM 1730 CD2 PHE A 109 2.774 -3.889 5.936 1.00 0.00 C ATOM 1731 CE1 PHE A 109 2.610 -2.830 3.389 1.00 0.00 C ATOM 1732 CE2 PHE A 109 2.848 -4.722 4.835 1.00 0.00 C ATOM 1733 CZ PHE A 109 2.765 -4.192 3.560 1.00 0.00 C ATOM 0 H PHE A 109 1.971 0.019 8.783 1.00 0.00 H new ATOM 0 HA PHE A 109 1.352 -0.091 6.037 1.00 0.00 H new ATOM 0 HB2 PHE A 109 3.421 -1.002 7.036 1.00 0.00 H new ATOM 0 HB3 PHE A 109 2.490 -2.220 7.883 1.00 0.00 H new ATOM 0 HD1 PHE A 109 2.413 -0.938 4.356 1.00 0.00 H new ATOM 0 HD2 PHE A 109 2.838 -4.309 6.929 1.00 0.00 H new ATOM 0 HE1 PHE A 109 2.547 -2.413 2.395 1.00 0.00 H new ATOM 0 HE2 PHE A 109 2.971 -5.786 4.970 1.00 0.00 H new ATOM 0 HZ PHE A 109 2.821 -4.842 2.699 1.00 0.00 H new ATOM 1743 N ASP A 110 -0.579 -1.809 8.029 1.00 0.00 N ATOM 1744 CA ASP A 110 -1.799 -2.612 8.088 1.00 0.00 C ATOM 1745 C ASP A 110 -2.821 -2.121 7.069 1.00 0.00 C ATOM 1746 O ASP A 110 -3.613 -2.904 6.545 1.00 0.00 O ATOM 1747 CB ASP A 110 -2.404 -2.566 9.492 1.00 0.00 C ATOM 1748 CG ASP A 110 -3.730 -3.298 9.573 1.00 0.00 C ATOM 1749 OD1 ASP A 110 -3.716 -4.534 9.751 1.00 0.00 O ATOM 1750 OD2 ASP A 110 -4.782 -2.635 9.457 1.00 0.00 O ATOM 0 H ASP A 110 -0.245 -1.479 8.935 1.00 0.00 H new ATOM 0 HA ASP A 110 -1.535 -3.642 7.849 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -1.704 -3.008 10.201 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -2.546 -1.527 9.790 1.00 0.00 H new ATOM 1755 N MET A 111 -2.798 -0.823 6.791 1.00 0.00 N ATOM 1756 CA MET A 111 -3.710 -0.237 5.820 1.00 0.00 C ATOM 1757 C MET A 111 -3.296 -0.644 4.409 1.00 0.00 C ATOM 1758 O MET A 111 -4.111 -1.122 3.619 1.00 0.00 O ATOM 1759 CB MET A 111 -3.722 1.289 5.959 1.00 0.00 C ATOM 1760 CG MET A 111 -4.636 1.992 4.967 1.00 0.00 C ATOM 1761 SD MET A 111 -3.824 2.341 3.395 1.00 0.00 S ATOM 1762 CE MET A 111 -2.569 3.510 3.913 1.00 0.00 C ATOM 0 H MET A 111 -2.158 -0.158 7.225 1.00 0.00 H new ATOM 0 HA MET A 111 -4.718 -0.607 6.009 1.00 0.00 H new ATOM 0 HB2 MET A 111 -4.032 1.549 6.971 1.00 0.00 H new ATOM 0 HB3 MET A 111 -2.706 1.664 5.831 1.00 0.00 H new ATOM 0 HG2 MET A 111 -5.515 1.372 4.787 1.00 0.00 H new ATOM 0 HG3 MET A 111 -4.989 2.926 5.404 1.00 0.00 H new ATOM 0 HE1 MET A 111 -2.163 4.019 3.039 1.00 0.00 H new ATOM 0 HE2 MET A 111 -3.011 4.244 4.587 1.00 0.00 H new ATOM 0 HE3 MET A 111 -1.769 2.980 4.429 1.00 0.00 H new ATOM 1772 N LEU A 112 -2.013 -0.463 4.110 1.00 0.00 N ATOM 1773 CA LEU A 112 -1.467 -0.814 2.805 1.00 0.00 C ATOM 1774 C LEU A 112 -1.506 -2.323 2.594 1.00 0.00 C ATOM 1775 O LEU A 112 -1.496 -2.804 1.464 1.00 0.00 O ATOM 1776 CB LEU A 112 -0.029 -0.306 2.674 1.00 0.00 C ATOM 1777 CG LEU A 112 0.132 1.216 2.677 1.00 0.00 C ATOM 1778 CD1 LEU A 112 1.604 1.594 2.624 1.00 0.00 C ATOM 1779 CD2 LEU A 112 -0.620 1.835 1.508 1.00 0.00 C ATOM 0 H LEU A 112 -1.329 -0.073 4.759 1.00 0.00 H new ATOM 0 HA LEU A 112 -2.081 -0.339 2.040 1.00 0.00 H new ATOM 0 HB2 LEU A 112 0.560 -0.718 3.493 1.00 0.00 H new ATOM 0 HB3 LEU A 112 0.394 -0.697 1.749 1.00 0.00 H new ATOM 0 HG LEU A 112 -0.292 1.606 3.603 1.00 0.00 H new ATOM 0 HD11 LEU A 112 1.701 2.680 2.627 1.00 0.00 H new ATOM 0 HD12 LEU A 112 2.117 1.182 3.493 1.00 0.00 H new ATOM 0 HD13 LEU A 112 2.050 1.192 1.714 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -0.494 2.918 1.527 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -0.226 1.440 0.572 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -1.680 1.592 1.587 1.00 0.00 H new ATOM 1791 N LEU A 113 -1.552 -3.059 3.698 1.00 0.00 N ATOM 1792 CA LEU A 113 -1.581 -4.517 3.662 1.00 0.00 C ATOM 1793 C LEU A 113 -2.667 -5.019 2.717 1.00 0.00 C ATOM 1794 O LEU A 113 -2.562 -6.115 2.166 1.00 0.00 O ATOM 1795 CB LEU A 113 -1.801 -5.075 5.071 1.00 0.00 C ATOM 1796 CG LEU A 113 -1.738 -6.599 5.189 1.00 0.00 C ATOM 1797 CD1 LEU A 113 -0.401 -7.125 4.690 1.00 0.00 C ATOM 1798 CD2 LEU A 113 -1.973 -7.029 6.629 1.00 0.00 C ATOM 0 H LEU A 113 -1.570 -2.665 4.639 1.00 0.00 H new ATOM 0 HA LEU A 113 -0.619 -4.869 3.288 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -1.052 -4.645 5.735 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -2.774 -4.739 5.429 1.00 0.00 H new ATOM 0 HG LEU A 113 -2.525 -7.022 4.565 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -0.379 -8.211 4.784 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -0.269 -6.848 3.644 1.00 0.00 H new ATOM 0 HD13 LEU A 113 0.404 -6.693 5.284 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -1.925 -8.116 6.697 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -1.207 -6.592 7.269 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -2.956 -6.688 6.955 1.00 0.00 H new ATOM 1810 N THR A 114 -3.714 -4.217 2.540 1.00 0.00 N ATOM 1811 CA THR A 114 -4.820 -4.579 1.657 1.00 0.00 C ATOM 1812 C THR A 114 -4.338 -4.868 0.232 1.00 0.00 C ATOM 1813 O THR A 114 -5.124 -5.284 -0.619 1.00 0.00 O ATOM 1814 CB THR A 114 -5.882 -3.466 1.606 1.00 0.00 C ATOM 1815 OG1 THR A 114 -5.282 -2.234 1.189 1.00 0.00 O ATOM 1816 CG2 THR A 114 -6.541 -3.282 2.964 1.00 0.00 C ATOM 0 H THR A 114 -3.820 -3.311 2.997 1.00 0.00 H new ATOM 0 HA THR A 114 -5.262 -5.485 2.073 1.00 0.00 H new ATOM 0 HB THR A 114 -6.647 -3.758 0.887 1.00 0.00 H new ATOM 0 HG1 THR A 114 -4.864 -1.796 1.960 1.00 0.00 H new ATOM 0 HG21 THR A 114 -7.287 -2.490 2.902 1.00 0.00 H new ATOM 0 HG22 THR A 114 -7.023 -4.213 3.263 1.00 0.00 H new ATOM 0 HG23 THR A 114 -5.785 -3.011 3.701 1.00 0.00 H new ATOM 1824 N PHE A 115 -3.049 -4.646 -0.023 1.00 0.00 N ATOM 1825 CA PHE A 115 -2.479 -4.895 -1.344 1.00 0.00 C ATOM 1826 C PHE A 115 -2.537 -6.380 -1.688 1.00 0.00 C ATOM 1827 O PHE A 115 -2.545 -6.755 -2.861 1.00 0.00 O ATOM 1828 CB PHE A 115 -1.026 -4.405 -1.409 1.00 0.00 C ATOM 1829 CG PHE A 115 -0.882 -2.915 -1.587 1.00 0.00 C ATOM 1830 CD1 PHE A 115 -1.693 -2.225 -2.475 1.00 0.00 C ATOM 1831 CD2 PHE A 115 0.072 -2.207 -0.869 1.00 0.00 C ATOM 1832 CE1 PHE A 115 -1.559 -0.860 -2.642 1.00 0.00 C ATOM 1833 CE2 PHE A 115 0.210 -0.841 -1.033 1.00 0.00 C ATOM 1834 CZ PHE A 115 -0.608 -0.168 -1.921 1.00 0.00 C ATOM 0 H PHE A 115 -2.383 -4.296 0.666 1.00 0.00 H new ATOM 0 HA PHE A 115 -3.072 -4.342 -2.072 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -0.514 -4.701 -0.494 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -0.522 -4.908 -2.234 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -2.439 -2.761 -3.043 1.00 0.00 H new ATOM 0 HD2 PHE A 115 0.714 -2.729 -0.175 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -2.198 -0.335 -3.336 1.00 0.00 H new ATOM 0 HE2 PHE A 115 0.956 -0.301 -0.468 1.00 0.00 H new ATOM 0 HZ PHE A 115 -0.503 0.899 -2.050 1.00 0.00 H new ATOM 1844 N THR A 116 -2.578 -7.223 -0.659 1.00 0.00 N ATOM 1845 CA THR A 116 -2.636 -8.668 -0.854 1.00 0.00 C ATOM 1846 C THR A 116 -3.712 -9.308 0.018 1.00 0.00 C ATOM 1847 O THR A 116 -4.460 -10.171 -0.439 1.00 0.00 O ATOM 1848 CB THR A 116 -1.284 -9.335 -0.540 1.00 0.00 C ATOM 1849 OG1 THR A 116 -0.903 -9.058 0.813 1.00 0.00 O ATOM 1850 CG2 THR A 116 -0.201 -8.841 -1.486 1.00 0.00 C ATOM 0 H THR A 116 -2.572 -6.930 0.318 1.00 0.00 H new ATOM 0 HA THR A 116 -2.881 -8.827 -1.904 1.00 0.00 H new ATOM 0 HB THR A 116 -1.397 -10.411 -0.674 1.00 0.00 H new ATOM 0 HG1 THR A 116 -0.043 -9.487 1.005 1.00 0.00 H new ATOM 0 HG21 THR A 116 0.744 -9.327 -1.243 1.00 0.00 H new ATOM 0 HG22 THR A 116 -0.478 -9.079 -2.513 1.00 0.00 H new ATOM 0 HG23 THR A 116 -0.091 -7.762 -1.381 1.00 0.00 H new ATOM 1858 N ASP A 117 -3.785 -8.881 1.276 1.00 0.00 N ATOM 1859 CA ASP A 117 -4.766 -9.422 2.211 1.00 0.00 C ATOM 1860 C ASP A 117 -6.182 -9.006 1.818 1.00 0.00 C ATOM 1861 O ASP A 117 -6.683 -7.967 2.254 1.00 0.00 O ATOM 1862 CB ASP A 117 -4.457 -8.961 3.636 1.00 0.00 C ATOM 1863 CG ASP A 117 -5.156 -9.808 4.682 1.00 0.00 C ATOM 1864 OD1 ASP A 117 -4.584 -10.843 5.084 1.00 0.00 O ATOM 1865 OD2 ASP A 117 -6.273 -9.437 5.098 1.00 0.00 O ATOM 0 H ASP A 117 -3.177 -8.163 1.670 1.00 0.00 H new ATOM 0 HA ASP A 117 -4.705 -10.510 2.172 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -3.380 -8.999 3.802 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -4.761 -7.921 3.752 1.00 0.00 H new ATOM 1870 N PHE A 118 -6.821 -9.829 0.991 1.00 0.00 N ATOM 1871 CA PHE A 118 -8.178 -9.556 0.528 1.00 0.00 C ATOM 1872 C PHE A 118 -9.154 -9.472 1.699 1.00 0.00 C ATOM 1873 O PHE A 118 -10.125 -8.716 1.656 1.00 0.00 O ATOM 1874 CB PHE A 118 -8.625 -10.644 -0.452 1.00 0.00 C ATOM 1875 CG PHE A 118 -9.981 -10.399 -1.048 1.00 0.00 C ATOM 1876 CD1 PHE A 118 -10.122 -9.604 -2.175 1.00 0.00 C ATOM 1877 CD2 PHE A 118 -11.113 -10.965 -0.485 1.00 0.00 C ATOM 1878 CE1 PHE A 118 -11.369 -9.379 -2.728 1.00 0.00 C ATOM 1879 CE2 PHE A 118 -12.362 -10.743 -1.033 1.00 0.00 C ATOM 1880 CZ PHE A 118 -12.489 -9.950 -2.157 1.00 0.00 C ATOM 0 H PHE A 118 -6.419 -10.693 0.627 1.00 0.00 H new ATOM 0 HA PHE A 118 -8.176 -8.592 0.020 1.00 0.00 H new ATOM 0 HB2 PHE A 118 -7.893 -10.720 -1.256 1.00 0.00 H new ATOM 0 HB3 PHE A 118 -8.633 -11.604 0.064 1.00 0.00 H new ATOM 0 HD1 PHE A 118 -9.249 -9.156 -2.626 1.00 0.00 H new ATOM 0 HD2 PHE A 118 -11.018 -11.587 0.393 1.00 0.00 H new ATOM 0 HE1 PHE A 118 -11.467 -8.757 -3.606 1.00 0.00 H new ATOM 0 HE2 PHE A 118 -13.237 -11.189 -0.583 1.00 0.00 H new ATOM 0 HZ PHE A 118 -13.464 -9.777 -2.589 1.00 0.00 H new ATOM 1890 N LEU A 119 -8.893 -10.254 2.743 1.00 0.00 N ATOM 1891 CA LEU A 119 -9.752 -10.266 3.924 1.00 0.00 C ATOM 1892 C LEU A 119 -9.795 -8.889 4.578 1.00 0.00 C ATOM 1893 O LEU A 119 -10.833 -8.465 5.084 1.00 0.00 O ATOM 1894 CB LEU A 119 -9.265 -11.310 4.935 1.00 0.00 C ATOM 1895 CG LEU A 119 -9.610 -12.767 4.600 1.00 0.00 C ATOM 1896 CD1 LEU A 119 -11.118 -12.960 4.535 1.00 0.00 C ATOM 1897 CD2 LEU A 119 -8.958 -13.189 3.292 1.00 0.00 C ATOM 0 H LEU A 119 -8.095 -10.887 2.796 1.00 0.00 H new ATOM 0 HA LEU A 119 -10.760 -10.530 3.603 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -8.182 -11.223 5.027 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -9.688 -11.070 5.911 1.00 0.00 H new ATOM 0 HG LEU A 119 -9.218 -13.401 5.395 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -11.342 -14.000 4.296 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -11.559 -12.706 5.499 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -11.535 -12.313 3.763 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -9.216 -14.225 3.074 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -9.314 -12.549 2.485 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -7.875 -13.095 3.378 1.00 0.00 H new ATOM 1909 N ALA A 120 -8.659 -8.197 4.566 1.00 0.00 N ATOM 1910 CA ALA A 120 -8.570 -6.866 5.153 1.00 0.00 C ATOM 1911 C ALA A 120 -9.247 -5.841 4.254 1.00 0.00 C ATOM 1912 O ALA A 120 -9.807 -4.853 4.729 1.00 0.00 O ATOM 1913 CB ALA A 120 -7.116 -6.487 5.389 1.00 0.00 C ATOM 0 H ALA A 120 -7.789 -8.537 4.156 1.00 0.00 H new ATOM 0 HA ALA A 120 -9.086 -6.877 6.113 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -7.066 -5.490 5.828 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -6.658 -7.206 6.069 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -6.580 -6.493 4.440 1.00 0.00 H new ATOM 1919 N PHE A 121 -9.188 -6.088 2.951 1.00 0.00 N ATOM 1920 CA PHE A 121 -9.795 -5.199 1.968 1.00 0.00 C ATOM 1921 C PHE A 121 -11.304 -5.102 2.193 1.00 0.00 C ATOM 1922 O PHE A 121 -11.852 -4.008 2.362 1.00 0.00 O ATOM 1923 CB PHE A 121 -9.500 -5.719 0.558 1.00 0.00 C ATOM 1924 CG PHE A 121 -9.639 -4.687 -0.525 1.00 0.00 C ATOM 1925 CD1 PHE A 121 -9.008 -3.457 -0.418 1.00 0.00 C ATOM 1926 CD2 PHE A 121 -10.391 -4.955 -1.657 1.00 0.00 C ATOM 1927 CE1 PHE A 121 -9.129 -2.513 -1.420 1.00 0.00 C ATOM 1928 CE2 PHE A 121 -10.513 -4.016 -2.663 1.00 0.00 C ATOM 1929 CZ PHE A 121 -9.881 -2.793 -2.545 1.00 0.00 C ATOM 0 H PHE A 121 -8.723 -6.902 2.549 1.00 0.00 H new ATOM 0 HA PHE A 121 -9.369 -4.202 2.080 1.00 0.00 H new ATOM 0 HB2 PHE A 121 -8.486 -6.117 0.536 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -10.173 -6.548 0.341 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -8.416 -3.234 0.457 1.00 0.00 H new ATOM 0 HD2 PHE A 121 -10.888 -5.909 -1.754 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -8.636 -1.557 -1.324 1.00 0.00 H new ATOM 0 HE2 PHE A 121 -11.102 -4.238 -3.541 1.00 0.00 H new ATOM 0 HZ PHE A 121 -9.975 -2.057 -3.330 1.00 0.00 H new ATOM 1939 N LYS A 122 -11.967 -6.255 2.215 1.00 0.00 N ATOM 1940 CA LYS A 122 -13.409 -6.306 2.423 1.00 0.00 C ATOM 1941 C LYS A 122 -13.768 -5.846 3.832 1.00 0.00 C ATOM 1942 O LYS A 122 -14.787 -5.186 4.038 1.00 0.00 O ATOM 1943 CB LYS A 122 -13.932 -7.726 2.187 1.00 0.00 C ATOM 1944 CG LYS A 122 -15.427 -7.871 2.427 1.00 0.00 C ATOM 1945 CD LYS A 122 -15.888 -9.307 2.235 1.00 0.00 C ATOM 1946 CE LYS A 122 -17.375 -9.457 2.514 1.00 0.00 C ATOM 1947 NZ LYS A 122 -17.838 -10.861 2.324 1.00 0.00 N ATOM 0 H LYS A 122 -11.527 -7.167 2.091 1.00 0.00 H new ATOM 0 HA LYS A 122 -13.880 -5.632 1.707 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -13.706 -8.022 1.162 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -13.399 -8.414 2.842 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -15.667 -7.543 3.438 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -15.971 -7.219 1.743 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -15.674 -9.625 1.215 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -15.324 -9.963 2.898 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -17.586 -9.140 3.535 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -17.937 -8.797 1.853 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -18.857 -10.921 2.524 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -17.660 -11.155 1.343 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -17.321 -11.488 2.973 1.00 0.00 H new ATOM 1961 N GLU A 123 -12.926 -6.199 4.797 1.00 0.00 N ATOM 1962 CA GLU A 123 -13.155 -5.819 6.187 1.00 0.00 C ATOM 1963 C GLU A 123 -13.011 -4.312 6.366 1.00 0.00 C ATOM 1964 O GLU A 123 -13.634 -3.720 7.249 1.00 0.00 O ATOM 1965 CB GLU A 123 -12.175 -6.550 7.107 1.00 0.00 C ATOM 1966 CG GLU A 123 -12.442 -6.322 8.586 1.00 0.00 C ATOM 1967 CD GLU A 123 -11.492 -7.096 9.478 1.00 0.00 C ATOM 1968 OE1 GLU A 123 -11.785 -8.274 9.776 1.00 0.00 O ATOM 1969 OE2 GLU A 123 -10.457 -6.525 9.880 1.00 0.00 O ATOM 0 H GLU A 123 -12.080 -6.747 4.643 1.00 0.00 H new ATOM 0 HA GLU A 123 -14.172 -6.105 6.454 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -12.223 -7.619 6.898 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -11.161 -6.225 6.875 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -12.356 -5.258 8.807 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -13.467 -6.613 8.815 1.00 0.00 H new ATOM 1976 N MET A 124 -12.187 -3.697 5.523 1.00 0.00 N ATOM 1977 CA MET A 124 -11.960 -2.257 5.590 1.00 0.00 C ATOM 1978 C MET A 124 -13.205 -1.489 5.162 1.00 0.00 C ATOM 1979 O MET A 124 -13.629 -0.552 5.839 1.00 0.00 O ATOM 1980 CB MET A 124 -10.776 -1.861 4.705 1.00 0.00 C ATOM 1981 CG MET A 124 -10.431 -0.382 4.777 1.00 0.00 C ATOM 1982 SD MET A 124 -9.044 0.062 3.712 1.00 0.00 S ATOM 1983 CE MET A 124 -9.728 -0.302 2.096 1.00 0.00 C ATOM 0 H MET A 124 -11.666 -4.173 4.786 1.00 0.00 H new ATOM 0 HA MET A 124 -11.733 -2.001 6.625 1.00 0.00 H new ATOM 0 HB2 MET A 124 -9.903 -2.444 4.998 1.00 0.00 H new ATOM 0 HB3 MET A 124 -11.002 -2.123 3.671 1.00 0.00 H new ATOM 0 HG2 MET A 124 -11.304 0.205 4.493 1.00 0.00 H new ATOM 0 HG3 MET A 124 -10.192 -0.119 5.807 1.00 0.00 H new ATOM 0 HE1 MET A 124 -9.297 0.374 1.358 1.00 0.00 H new ATOM 0 HE2 MET A 124 -9.494 -1.332 1.825 1.00 0.00 H new ATOM 0 HE3 MET A 124 -10.810 -0.170 2.121 1.00 0.00 H new ATOM 1993 N PHE A 125 -13.789 -1.890 4.037 1.00 0.00 N ATOM 1994 CA PHE A 125 -14.988 -1.229 3.526 1.00 0.00 C ATOM 1995 C PHE A 125 -16.196 -1.511 4.414 1.00 0.00 C ATOM 1996 O PHE A 125 -17.008 -0.622 4.672 1.00 0.00 O ATOM 1997 CB PHE A 125 -15.277 -1.677 2.094 1.00 0.00 C ATOM 1998 CG PHE A 125 -14.180 -1.333 1.127 1.00 0.00 C ATOM 1999 CD1 PHE A 125 -13.796 -0.014 0.933 1.00 0.00 C ATOM 2000 CD2 PHE A 125 -13.530 -2.325 0.415 1.00 0.00 C ATOM 2001 CE1 PHE A 125 -12.786 0.305 0.048 1.00 0.00 C ATOM 2002 CE2 PHE A 125 -12.519 -2.013 -0.471 1.00 0.00 C ATOM 2003 CZ PHE A 125 -12.145 -0.696 -0.656 1.00 0.00 C ATOM 0 H PHE A 125 -13.455 -2.665 3.464 1.00 0.00 H new ATOM 0 HA PHE A 125 -14.803 -0.155 3.532 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -15.435 -2.755 2.084 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -16.205 -1.216 1.757 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -14.293 0.773 1.481 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -13.817 -3.357 0.554 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -12.497 1.336 -0.094 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -12.020 -2.798 -1.020 1.00 0.00 H new ATOM 0 HZ PHE A 125 -11.354 -0.450 -1.349 1.00 0.00 H new ATOM 2013 N LEU A 126 -16.309 -2.751 4.879 1.00 0.00 N ATOM 2014 CA LEU A 126 -17.422 -3.148 5.737 1.00 0.00 C ATOM 2015 C LEU A 126 -17.424 -2.354 7.040 1.00 0.00 C ATOM 2016 O LEU A 126 -18.475 -1.921 7.510 1.00 0.00 O ATOM 2017 CB LEU A 126 -17.354 -4.647 6.040 1.00 0.00 C ATOM 2018 CG LEU A 126 -18.332 -5.518 5.246 1.00 0.00 C ATOM 2019 CD1 LEU A 126 -18.007 -5.481 3.760 1.00 0.00 C ATOM 2020 CD2 LEU A 126 -18.306 -6.948 5.764 1.00 0.00 C ATOM 0 H LEU A 126 -15.645 -3.498 4.677 1.00 0.00 H new ATOM 0 HA LEU A 126 -18.348 -2.933 5.203 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -16.340 -4.995 5.843 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -17.541 -4.795 7.103 1.00 0.00 H new ATOM 0 HG LEU A 126 -19.336 -5.117 5.382 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -18.715 -6.107 3.217 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -18.077 -4.455 3.398 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -16.995 -5.854 3.599 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -19.006 -7.556 5.190 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -17.300 -7.355 5.658 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -18.593 -6.959 6.815 1.00 0.00 H new ATOM 2032 N ASP A 127 -16.241 -2.169 7.619 1.00 0.00 N ATOM 2033 CA ASP A 127 -16.110 -1.427 8.869 1.00 0.00 C ATOM 2034 C ASP A 127 -16.483 0.039 8.677 1.00 0.00 C ATOM 2035 O ASP A 127 -17.243 0.604 9.464 1.00 0.00 O ATOM 2036 CB ASP A 127 -14.682 -1.538 9.407 1.00 0.00 C ATOM 2037 CG ASP A 127 -14.502 -0.806 10.723 1.00 0.00 C ATOM 2038 OD1 ASP A 127 -14.216 0.409 10.692 1.00 0.00 O ATOM 2039 OD2 ASP A 127 -14.649 -1.447 11.784 1.00 0.00 O ATOM 0 H ASP A 127 -15.361 -2.522 7.243 1.00 0.00 H new ATOM 0 HA ASP A 127 -16.798 -1.864 9.593 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -14.428 -2.589 9.541 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -13.987 -1.134 8.671 1.00 0.00 H new ATOM 2044 N TYR A 128 -15.942 0.649 7.627 1.00 0.00 N ATOM 2045 CA TYR A 128 -16.217 2.052 7.327 1.00 0.00 C ATOM 2046 C TYR A 128 -17.713 2.285 7.139 1.00 0.00 C ATOM 2047 O TYR A 128 -18.238 3.337 7.504 1.00 0.00 O ATOM 2048 CB TYR A 128 -15.456 2.481 6.072 1.00 0.00 C ATOM 2049 CG TYR A 128 -15.651 3.936 5.706 1.00 0.00 C ATOM 2050 CD1 TYR A 128 -14.961 4.939 6.375 1.00 0.00 C ATOM 2051 CD2 TYR A 128 -16.523 4.303 4.689 1.00 0.00 C ATOM 2052 CE1 TYR A 128 -15.136 6.269 6.042 1.00 0.00 C ATOM 2053 CE2 TYR A 128 -16.702 5.631 4.348 1.00 0.00 C ATOM 2054 CZ TYR A 128 -16.008 6.609 5.028 1.00 0.00 C ATOM 2055 OH TYR A 128 -16.183 7.932 4.690 1.00 0.00 O ATOM 0 H TYR A 128 -15.310 0.194 6.968 1.00 0.00 H new ATOM 0 HA TYR A 128 -15.880 2.654 8.171 1.00 0.00 H new ATOM 0 HB2 TYR A 128 -14.393 2.293 6.221 1.00 0.00 H new ATOM 0 HB3 TYR A 128 -15.775 1.860 5.235 1.00 0.00 H new ATOM 0 HD1 TYR A 128 -14.277 4.675 7.168 1.00 0.00 H new ATOM 0 HD2 TYR A 128 -17.070 3.539 4.156 1.00 0.00 H new ATOM 0 HE1 TYR A 128 -14.593 7.038 6.572 1.00 0.00 H new ATOM 0 HE2 TYR A 128 -17.382 5.901 3.553 1.00 0.00 H new ATOM 0 HH TYR A 128 -16.829 7.999 3.956 1.00 0.00 H new ATOM 2065 N ARG A 129 -18.393 1.296 6.566 1.00 0.00 N ATOM 2066 CA ARG A 129 -19.830 1.390 6.329 1.00 0.00 C ATOM 2067 C ARG A 129 -20.605 1.308 7.640 1.00 0.00 C ATOM 2068 O ARG A 129 -21.578 2.034 7.845 1.00 0.00 O ATOM 2069 CB ARG A 129 -20.285 0.273 5.386 1.00 0.00 C ATOM 2070 CG ARG A 129 -21.764 0.332 5.037 1.00 0.00 C ATOM 2071 CD ARG A 129 -22.189 -0.873 4.213 1.00 0.00 C ATOM 2072 NE ARG A 129 -21.990 -2.126 4.938 1.00 0.00 N ATOM 2073 CZ ARG A 129 -21.841 -3.308 4.346 1.00 0.00 C ATOM 2074 NH1 ARG A 129 -21.867 -3.399 3.023 1.00 0.00 N ATOM 2075 NH2 ARG A 129 -21.666 -4.400 5.079 1.00 0.00 N ATOM 0 H ARG A 129 -17.972 0.420 6.257 1.00 0.00 H new ATOM 0 HA ARG A 129 -20.034 2.356 5.866 1.00 0.00 H new ATOM 0 HB2 ARG A 129 -19.702 0.325 4.467 1.00 0.00 H new ATOM 0 HB3 ARG A 129 -20.068 -0.691 5.847 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -22.354 0.375 5.953 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -21.972 1.246 4.481 1.00 0.00 H new ATOM 0 HD2 ARG A 129 -23.240 -0.774 3.940 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -21.620 -0.897 3.284 1.00 0.00 H new ATOM 0 HE ARG A 129 -21.964 -2.092 5.957 1.00 0.00 H new ATOM 0 HH11 ARG A 129 -22.001 -2.561 2.457 1.00 0.00 H new ATOM 0 HH12 ARG A 129 -21.752 -4.307 2.572 1.00 0.00 H new ATOM 0 HH21 ARG A 129 -21.646 -4.333 6.097 1.00 0.00 H new ATOM 0 HH22 ARG A 129 -21.552 -5.306 4.625 1.00 0.00 H new ATOM 2089 N ALA A 130 -20.168 0.414 8.522 1.00 0.00 N ATOM 2090 CA ALA A 130 -20.817 0.234 9.815 1.00 0.00 C ATOM 2091 C ALA A 130 -20.753 1.512 10.645 1.00 0.00 C ATOM 2092 O ALA A 130 -21.650 1.793 11.440 1.00 0.00 O ATOM 2093 CB ALA A 130 -20.177 -0.921 10.570 1.00 0.00 C ATOM 0 H ALA A 130 -19.367 -0.197 8.364 1.00 0.00 H new ATOM 0 HA ALA A 130 -21.867 0.000 9.637 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -20.671 -1.044 11.534 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -20.281 -1.837 9.989 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -19.119 -0.710 10.729 1.00 0.00 H new ATOM 2099 N GLU A 131 -19.685 2.284 10.454 1.00 0.00 N ATOM 2100 CA GLU A 131 -19.504 3.534 11.183 1.00 0.00 C ATOM 2101 C GLU A 131 -20.554 4.562 10.770 1.00 0.00 C ATOM 2102 O GLU A 131 -20.861 5.487 11.525 1.00 0.00 O ATOM 2103 CB GLU A 131 -18.102 4.097 10.933 1.00 0.00 C ATOM 2104 CG GLU A 131 -16.984 3.219 11.473 1.00 0.00 C ATOM 2105 CD GLU A 131 -15.609 3.795 11.199 1.00 0.00 C ATOM 2106 OE1 GLU A 131 -15.155 4.650 11.988 1.00 0.00 O ATOM 2107 OE2 GLU A 131 -14.985 3.392 10.194 1.00 0.00 O ATOM 0 H GLU A 131 -18.933 2.065 9.801 1.00 0.00 H new ATOM 0 HA GLU A 131 -19.622 3.325 12.246 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -17.960 4.231 9.861 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -18.030 5.084 11.390 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -17.113 3.092 12.548 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -17.055 2.228 11.024 1.00 0.00 H new ATOM 2114 N LYS A 132 -21.102 4.394 9.571 1.00 0.00 N ATOM 2115 CA LYS A 132 -22.115 5.309 9.057 1.00 0.00 C ATOM 2116 C LYS A 132 -23.439 5.137 9.797 1.00 0.00 C ATOM 2117 O LYS A 132 -24.334 5.975 9.687 1.00 0.00 O ATOM 2118 CB LYS A 132 -22.326 5.083 7.557 1.00 0.00 C ATOM 2119 CG LYS A 132 -21.087 5.356 6.717 1.00 0.00 C ATOM 2120 CD LYS A 132 -20.757 6.840 6.676 1.00 0.00 C ATOM 2121 CE LYS A 132 -19.558 7.120 5.784 1.00 0.00 C ATOM 2122 NZ LYS A 132 -19.272 8.578 5.682 1.00 0.00 N ATOM 0 H LYS A 132 -20.862 3.632 8.937 1.00 0.00 H new ATOM 0 HA LYS A 132 -21.759 6.326 9.220 1.00 0.00 H new ATOM 0 HB2 LYS A 132 -22.644 4.053 7.395 1.00 0.00 H new ATOM 0 HB3 LYS A 132 -23.137 5.725 7.212 1.00 0.00 H new ATOM 0 HG2 LYS A 132 -20.240 4.805 7.126 1.00 0.00 H new ATOM 0 HG3 LYS A 132 -21.246 4.989 5.703 1.00 0.00 H new ATOM 0 HD2 LYS A 132 -21.621 7.396 6.311 1.00 0.00 H new ATOM 0 HD3 LYS A 132 -20.552 7.196 7.686 1.00 0.00 H new ATOM 0 HE2 LYS A 132 -18.683 6.605 6.180 1.00 0.00 H new ATOM 0 HE3 LYS A 132 -19.743 6.716 4.789 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 -18.291 8.718 5.367 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 -19.921 9.012 4.995 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 -19.404 9.024 6.612 1.00 0.00 H new ATOM 2136 N GLU A 133 -23.559 4.048 10.551 1.00 0.00 N ATOM 2137 CA GLU A 133 -24.776 3.774 11.306 1.00 0.00 C ATOM 2138 C GLU A 133 -24.607 4.148 12.776 1.00 0.00 C ATOM 2139 O GLU A 133 -25.525 3.976 13.579 1.00 0.00 O ATOM 2140 CB GLU A 133 -25.159 2.297 11.182 1.00 0.00 C ATOM 2141 CG GLU A 133 -25.480 1.868 9.760 1.00 0.00 C ATOM 2142 CD GLU A 133 -25.945 0.427 9.678 1.00 0.00 C ATOM 2143 OE1 GLU A 133 -25.084 -0.470 9.554 1.00 0.00 O ATOM 2144 OE2 GLU A 133 -27.172 0.195 9.737 1.00 0.00 O ATOM 0 H GLU A 133 -22.830 3.343 10.655 1.00 0.00 H new ATOM 0 HA GLU A 133 -25.575 4.385 10.887 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -24.340 1.685 11.561 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -26.024 2.100 11.816 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -26.254 2.519 9.353 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -24.595 1.997 9.137 1.00 0.00 H new ATOM 2151 N GLY A 134 -23.430 4.658 13.121 1.00 0.00 N ATOM 2152 CA GLY A 134 -23.164 5.050 14.493 1.00 0.00 C ATOM 2153 C GLY A 134 -23.435 6.521 14.739 1.00 0.00 C ATOM 2154 O GLY A 134 -23.813 6.913 15.843 1.00 0.00 O ATOM 0 H GLY A 134 -22.655 4.807 12.475 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -23.781 4.453 15.164 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -22.124 4.830 14.735 1.00 0.00 H new ATOM 2158 N ARG A 135 -23.240 7.336 13.707 1.00 0.00 N ATOM 2159 CA ARG A 135 -23.464 8.773 13.814 1.00 0.00 C ATOM 2160 C ARG A 135 -24.872 9.142 13.361 1.00 0.00 C ATOM 2161 O ARG A 135 -25.489 8.426 12.571 1.00 0.00 O ATOM 2162 CB ARG A 135 -22.434 9.534 12.975 1.00 0.00 C ATOM 2163 CG ARG A 135 -20.999 9.316 13.422 1.00 0.00 C ATOM 2164 CD ARG A 135 -20.017 10.010 12.491 1.00 0.00 C ATOM 2165 NE ARG A 135 -18.634 9.846 12.929 1.00 0.00 N ATOM 2166 CZ ARG A 135 -17.592 10.365 12.287 1.00 0.00 C ATOM 2167 NH1 ARG A 135 -17.777 11.072 11.180 1.00 0.00 N ATOM 2168 NH2 ARG A 135 -16.364 10.177 12.750 1.00 0.00 N ATOM 0 H ARG A 135 -22.927 7.025 12.787 1.00 0.00 H new ATOM 0 HA ARG A 135 -23.353 9.054 14.861 1.00 0.00 H new ATOM 0 HB2 ARG A 135 -22.531 9.229 11.933 1.00 0.00 H new ATOM 0 HB3 ARG A 135 -22.660 10.599 13.017 1.00 0.00 H new ATOM 0 HG2 ARG A 135 -20.871 9.694 14.436 1.00 0.00 H new ATOM 0 HG3 ARG A 135 -20.783 8.248 13.450 1.00 0.00 H new ATOM 0 HD2 ARG A 135 -20.128 9.608 11.484 1.00 0.00 H new ATOM 0 HD3 ARG A 135 -20.257 11.072 12.439 1.00 0.00 H new ATOM 0 HE ARG A 135 -18.457 9.303 13.774 1.00 0.00 H new ATOM 0 HH11 ARG A 135 -18.720 11.218 10.820 1.00 0.00 H new ATOM 0 HH12 ARG A 135 -16.976 11.469 10.689 1.00 0.00 H new ATOM 0 HH21 ARG A 135 -16.217 9.633 13.600 1.00 0.00 H new ATOM 0 HH22 ARG A 135 -15.566 10.576 12.256 1.00 0.00 H new ATOM 2182 N GLY A 136 -25.374 10.264 13.866 1.00 0.00 N ATOM 2183 CA GLY A 136 -26.705 10.714 13.503 1.00 0.00 C ATOM 2184 C GLY A 136 -26.793 12.223 13.388 1.00 0.00 C ATOM 2185 O GLY A 136 -27.604 12.711 12.573 1.00 0.00 O ATOM 2186 OXT GLY A 136 -26.051 12.919 14.114 1.00 0.00 O ATOM 0 H GLY A 136 -24.882 10.871 14.522 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -26.992 10.263 12.553 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -27.419 10.367 14.250 1.00 0.00 H new TER 2190 GLY A 136