USER MOD reduce.3.24.130724 H: found=0, std=0, add=867, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 865 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 137 ASN :FLIP amide:sc= -2.29! C(o=-4.3!,f=-3.5!) USER MOD Set 1.2: A 138 SER OG : rot 41:sc= -1.16! USER MOD Set 2.1: A 103 GLN : amide:sc=-0.000587 K(o=-0.33,f=-1.7!) USER MOD Set 2.2: A 107 TYR OH : rot 30:sc= -0.334 USER MOD Set 3.1: A 63 ASN : amide:sc= -0.25 X(o=-0.66,f=-0.6) USER MOD Set 3.2: A 67 CYS SG : rot -14:sc= -0.408 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ 166:sc= 0 (180deg=-0.119) USER MOD Single : A 62 THR OG1 : rot -160:sc= -1.41 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 GLN :FLIP amide:sc= -0.0439 F(o=-0.77,f=-0.044) USER MOD Single : A 74 SER OG : rot 88:sc= 0.166! USER MOD Single : A 78 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 79 ASN : amide:sc= -5.66! C(o=-5.7!,f=-11!) USER MOD Single : A 80 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 82 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 ASN : amide:sc= -1.66! C(o=-1.7!,f=-8.1!) USER MOD Single : A 92 TYR OH : rot -6:sc= -0.0662! USER MOD Single : A 93 LYS NZ :NH3+ 159:sc= -0.113 (180deg=-0.815) USER MOD Single : A 94 HIS : no HD1:sc= -6.88! C(o=-6.9!,f=-8.1!) USER MOD Single : A 95 ASN : amide:sc= -3.35 X(o=-3.4,f=-3.3!) USER MOD Single : A 96 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 97 MET CE :methyl -122:sc= -0.119 (180deg=-2.35) USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 105 ASN : amide:sc= -1.74! C(o=-1.7!,f=-2.3!) USER MOD Single : A 106 MET CE :methyl -160:sc= -0.832 (180deg=-1.79!) USER MOD Single : A 110 HIS :FLIP no HD1:sc= -0.0713 F(o=-0.98,f=-0.071) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 THR OG1 : rot 20:sc= 0.558 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 117 ASN : amide:sc= -0.248 X(o=-0.25,f=0) USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD Single : A 131 HIS : no HD1:sc= -2.04 K(o=-2,f=-4.2!) USER MOD Single : A 135 LYS NZ :NH3+ -132:sc= -10.3! (180deg=-13.5!) USER MOD Single : A 144 GLN :FLIP amide:sc=-0.00218 F(o=-1.6!,f=-0.0022) USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 148 LYS NZ :NH3+ -139:sc= -0.0258 (180deg=-0.519) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 43 18.086 1.102 -5.828 1.00 0.00 N ATOM 2 CA GLY A 43 19.463 0.662 -5.464 1.00 0.00 C ATOM 3 C GLY A 43 19.941 1.440 -4.237 1.00 0.00 C ATOM 4 O GLY A 43 19.313 1.427 -3.197 1.00 0.00 O ATOM 0 HA2 GLY A 43 19.471 -0.408 -5.255 1.00 0.00 H new ATOM 0 HA3 GLY A 43 20.142 0.828 -6.300 1.00 0.00 H new ATOM 8 N SER A 44 21.051 2.119 -4.349 1.00 0.00 N ATOM 9 CA SER A 44 21.568 2.897 -3.188 1.00 0.00 C ATOM 10 C SER A 44 21.623 1.995 -1.954 1.00 0.00 C ATOM 11 O SER A 44 22.614 1.341 -1.696 1.00 0.00 O ATOM 12 CB SER A 44 20.639 4.081 -2.913 1.00 0.00 C ATOM 13 OG SER A 44 20.644 4.951 -4.038 1.00 0.00 O ATOM 0 H SER A 44 21.621 2.168 -5.193 1.00 0.00 H new ATOM 0 HA SER A 44 22.569 3.265 -3.414 1.00 0.00 H new ATOM 0 HB2 SER A 44 19.627 3.727 -2.717 1.00 0.00 H new ATOM 0 HB3 SER A 44 20.967 4.617 -2.022 1.00 0.00 H new ATOM 0 HG SER A 44 20.049 5.710 -3.867 1.00 0.00 H new ATOM 19 N GLY A 45 20.567 1.955 -1.190 1.00 0.00 N ATOM 20 CA GLY A 45 20.559 1.095 0.027 1.00 0.00 C ATOM 21 C GLY A 45 19.122 0.919 0.519 1.00 0.00 C ATOM 22 O GLY A 45 18.858 0.919 1.705 1.00 0.00 O ATOM 0 H GLY A 45 19.709 2.481 -1.356 1.00 0.00 H new ATOM 0 HA2 GLY A 45 20.999 0.123 -0.199 1.00 0.00 H new ATOM 0 HA3 GLY A 45 21.169 1.547 0.809 1.00 0.00 H new ATOM 26 N VAL A 46 18.189 0.770 -0.382 1.00 0.00 N ATOM 27 CA VAL A 46 16.771 0.595 0.039 1.00 0.00 C ATOM 28 C VAL A 46 16.604 -0.809 0.667 1.00 0.00 C ATOM 29 O VAL A 46 17.014 -1.776 0.057 1.00 0.00 O ATOM 30 CB VAL A 46 15.869 0.698 -1.194 1.00 0.00 C ATOM 31 CG1 VAL A 46 14.402 0.626 -0.766 1.00 0.00 C ATOM 32 CG2 VAL A 46 16.125 2.027 -1.905 1.00 0.00 C ATOM 0 H VAL A 46 18.348 0.762 -1.390 1.00 0.00 H new ATOM 0 HA VAL A 46 16.500 1.363 0.764 1.00 0.00 H new ATOM 0 HB VAL A 46 16.090 -0.127 -1.871 1.00 0.00 H new ATOM 0 HG11 VAL A 46 13.762 0.700 -1.646 1.00 0.00 H new ATOM 0 HG12 VAL A 46 14.217 -0.322 -0.261 1.00 0.00 H new ATOM 0 HG13 VAL A 46 14.180 1.449 -0.086 1.00 0.00 H new ATOM 0 HG21 VAL A 46 15.483 2.100 -2.783 1.00 0.00 H new ATOM 0 HG22 VAL A 46 15.906 2.851 -1.226 1.00 0.00 H new ATOM 0 HG23 VAL A 46 17.169 2.079 -2.214 1.00 0.00 H new ATOM 42 N PRO A 47 16.010 -0.918 1.848 1.00 0.00 N ATOM 43 CA PRO A 47 15.824 -2.244 2.471 1.00 0.00 C ATOM 44 C PRO A 47 14.968 -3.124 1.549 1.00 0.00 C ATOM 45 O PRO A 47 14.461 -2.671 0.541 1.00 0.00 O ATOM 46 CB PRO A 47 15.108 -1.965 3.814 1.00 0.00 C ATOM 47 CG PRO A 47 14.844 -0.434 3.893 1.00 0.00 C ATOM 48 CD PRO A 47 15.486 0.216 2.647 1.00 0.00 C ATOM 0 HA PRO A 47 16.763 -2.774 2.633 1.00 0.00 H new ATOM 0 HB2 PRO A 47 14.171 -2.519 3.872 1.00 0.00 H new ATOM 0 HB3 PRO A 47 15.724 -2.292 4.652 1.00 0.00 H new ATOM 0 HG2 PRO A 47 13.773 -0.231 3.922 1.00 0.00 H new ATOM 0 HG3 PRO A 47 15.272 -0.018 4.805 1.00 0.00 H new ATOM 0 HD2 PRO A 47 14.754 0.792 2.081 1.00 0.00 H new ATOM 0 HD3 PRO A 47 16.284 0.903 2.928 1.00 0.00 H new ATOM 56 N ALA A 48 14.805 -4.372 1.885 1.00 0.00 N ATOM 57 CA ALA A 48 13.983 -5.270 1.026 1.00 0.00 C ATOM 58 C ALA A 48 12.499 -4.960 1.239 1.00 0.00 C ATOM 59 O ALA A 48 11.703 -5.034 0.326 1.00 0.00 O ATOM 60 CB ALA A 48 14.257 -6.728 1.399 1.00 0.00 C ATOM 0 H ALA A 48 15.204 -4.809 2.716 1.00 0.00 H new ATOM 0 HA ALA A 48 14.243 -5.109 -0.020 1.00 0.00 H new ATOM 0 HB1 ALA A 48 13.655 -7.384 0.770 1.00 0.00 H new ATOM 0 HB2 ALA A 48 15.313 -6.950 1.248 1.00 0.00 H new ATOM 0 HB3 ALA A 48 13.998 -6.891 2.445 1.00 0.00 H new ATOM 66 N PHE A 49 12.124 -4.616 2.439 1.00 0.00 N ATOM 67 CA PHE A 49 10.692 -4.307 2.715 1.00 0.00 C ATOM 68 C PHE A 49 10.204 -3.198 1.778 1.00 0.00 C ATOM 69 O PHE A 49 9.260 -3.372 1.034 1.00 0.00 O ATOM 70 CB PHE A 49 10.542 -3.846 4.168 1.00 0.00 C ATOM 71 CG PHE A 49 9.097 -3.498 4.442 1.00 0.00 C ATOM 72 CD1 PHE A 49 8.580 -2.255 4.027 1.00 0.00 C ATOM 73 CD2 PHE A 49 8.266 -4.415 5.112 1.00 0.00 C ATOM 74 CE1 PHE A 49 7.237 -1.930 4.279 1.00 0.00 C ATOM 75 CE2 PHE A 49 6.919 -4.089 5.364 1.00 0.00 C ATOM 76 CZ PHE A 49 6.404 -2.846 4.948 1.00 0.00 C ATOM 0 H PHE A 49 12.748 -4.535 3.242 1.00 0.00 H new ATOM 0 HA PHE A 49 10.095 -5.204 2.549 1.00 0.00 H new ATOM 0 HB2 PHE A 49 10.872 -4.633 4.846 1.00 0.00 H new ATOM 0 HB3 PHE A 49 11.177 -2.979 4.353 1.00 0.00 H new ATOM 0 HD1 PHE A 49 9.218 -1.550 3.514 1.00 0.00 H new ATOM 0 HD2 PHE A 49 8.661 -5.368 5.433 1.00 0.00 H new ATOM 0 HE1 PHE A 49 6.843 -0.977 3.959 1.00 0.00 H new ATOM 0 HE2 PHE A 49 6.280 -4.793 5.877 1.00 0.00 H new ATOM 0 HZ PHE A 49 5.371 -2.596 5.142 1.00 0.00 H new ATOM 86 N LEU A 50 10.829 -2.052 1.817 1.00 0.00 N ATOM 87 CA LEU A 50 10.383 -0.935 0.936 1.00 0.00 C ATOM 88 C LEU A 50 10.605 -1.335 -0.527 1.00 0.00 C ATOM 89 O LEU A 50 9.882 -0.915 -1.409 1.00 0.00 O ATOM 90 CB LEU A 50 11.187 0.354 1.248 1.00 0.00 C ATOM 91 CG LEU A 50 10.642 1.138 2.478 1.00 0.00 C ATOM 92 CD1 LEU A 50 9.121 1.386 2.363 1.00 0.00 C ATOM 93 CD2 LEU A 50 10.994 0.404 3.808 1.00 0.00 C ATOM 0 H LEU A 50 11.626 -1.842 2.418 1.00 0.00 H new ATOM 0 HA LEU A 50 9.326 -0.738 1.114 1.00 0.00 H new ATOM 0 HB2 LEU A 50 12.229 0.089 1.427 1.00 0.00 H new ATOM 0 HB3 LEU A 50 11.169 1.005 0.374 1.00 0.00 H new ATOM 0 HG LEU A 50 11.131 2.112 2.492 1.00 0.00 H new ATOM 0 HD11 LEU A 50 8.775 1.935 3.238 1.00 0.00 H new ATOM 0 HD12 LEU A 50 8.914 1.967 1.464 1.00 0.00 H new ATOM 0 HD13 LEU A 50 8.600 0.430 2.305 1.00 0.00 H new ATOM 0 HD21 LEU A 50 10.602 0.972 4.652 1.00 0.00 H new ATOM 0 HD22 LEU A 50 10.550 -0.591 3.803 1.00 0.00 H new ATOM 0 HD23 LEU A 50 12.077 0.317 3.900 1.00 0.00 H new ATOM 105 N ALA A 51 11.593 -2.142 -0.795 1.00 0.00 N ATOM 106 CA ALA A 51 11.843 -2.559 -2.204 1.00 0.00 C ATOM 107 C ALA A 51 10.746 -3.528 -2.648 1.00 0.00 C ATOM 108 O ALA A 51 10.381 -3.578 -3.806 1.00 0.00 O ATOM 109 CB ALA A 51 13.208 -3.244 -2.305 1.00 0.00 C ATOM 0 H ALA A 51 12.236 -2.530 -0.104 1.00 0.00 H new ATOM 0 HA ALA A 51 11.835 -1.681 -2.850 1.00 0.00 H new ATOM 0 HB1 ALA A 51 13.387 -3.548 -3.336 1.00 0.00 H new ATOM 0 HB2 ALA A 51 13.987 -2.550 -1.990 1.00 0.00 H new ATOM 0 HB3 ALA A 51 13.223 -4.123 -1.660 1.00 0.00 H new ATOM 115 N LYS A 52 10.212 -4.296 -1.737 1.00 0.00 N ATOM 116 CA LYS A 52 9.133 -5.255 -2.112 1.00 0.00 C ATOM 117 C LYS A 52 7.945 -4.472 -2.674 1.00 0.00 C ATOM 118 O LYS A 52 7.409 -4.800 -3.713 1.00 0.00 O ATOM 119 CB LYS A 52 8.693 -6.047 -0.872 1.00 0.00 C ATOM 120 CG LYS A 52 9.712 -7.162 -0.562 1.00 0.00 C ATOM 121 CD LYS A 52 9.384 -8.424 -1.370 1.00 0.00 C ATOM 122 CE LYS A 52 10.332 -9.553 -0.956 1.00 0.00 C ATOM 123 NZ LYS A 52 9.912 -10.094 0.368 1.00 0.00 N ATOM 0 H LYS A 52 10.475 -4.301 -0.752 1.00 0.00 H new ATOM 0 HA LYS A 52 9.503 -5.951 -2.865 1.00 0.00 H new ATOM 0 HB2 LYS A 52 8.604 -5.377 -0.017 1.00 0.00 H new ATOM 0 HB3 LYS A 52 7.708 -6.482 -1.040 1.00 0.00 H new ATOM 0 HG2 LYS A 52 10.719 -6.820 -0.802 1.00 0.00 H new ATOM 0 HG3 LYS A 52 9.698 -7.391 0.504 1.00 0.00 H new ATOM 0 HD2 LYS A 52 8.350 -8.721 -1.197 1.00 0.00 H new ATOM 0 HD3 LYS A 52 9.484 -8.223 -2.437 1.00 0.00 H new ATOM 0 HE2 LYS A 52 10.320 -10.345 -1.705 1.00 0.00 H new ATOM 0 HE3 LYS A 52 11.355 -9.181 -0.901 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 10.394 -10.999 0.542 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 10.166 -9.418 1.116 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 8.883 -10.243 0.371 1.00 0.00 H new ATOM 137 N LEU A 53 7.530 -3.436 -1.995 1.00 0.00 N ATOM 138 CA LEU A 53 6.379 -2.630 -2.495 1.00 0.00 C ATOM 139 C LEU A 53 6.722 -2.065 -3.873 1.00 0.00 C ATOM 140 O LEU A 53 6.024 -2.285 -4.842 1.00 0.00 O ATOM 141 CB LEU A 53 6.099 -1.469 -1.534 1.00 0.00 C ATOM 142 CG LEU A 53 5.966 -1.989 -0.098 1.00 0.00 C ATOM 143 CD1 LEU A 53 5.943 -0.803 0.868 1.00 0.00 C ATOM 144 CD2 LEU A 53 4.666 -2.791 0.053 1.00 0.00 C ATOM 0 H LEU A 53 7.938 -3.114 -1.117 1.00 0.00 H new ATOM 0 HA LEU A 53 5.497 -3.266 -2.561 1.00 0.00 H new ATOM 0 HB2 LEU A 53 6.906 -0.738 -1.590 1.00 0.00 H new ATOM 0 HB3 LEU A 53 5.183 -0.956 -1.829 1.00 0.00 H new ATOM 0 HG LEU A 53 6.813 -2.636 0.128 1.00 0.00 H new ATOM 0 HD11 LEU A 53 5.848 -1.168 1.891 1.00 0.00 H new ATOM 0 HD12 LEU A 53 6.868 -0.236 0.770 1.00 0.00 H new ATOM 0 HD13 LEU A 53 5.096 -0.159 0.633 1.00 0.00 H new ATOM 0 HD21 LEU A 53 4.581 -3.156 1.076 1.00 0.00 H new ATOM 0 HD22 LEU A 53 3.814 -2.150 -0.176 1.00 0.00 H new ATOM 0 HD23 LEU A 53 4.678 -3.637 -0.634 1.00 0.00 H new ATOM 156 N TRP A 54 7.796 -1.335 -3.964 1.00 0.00 N ATOM 157 CA TRP A 54 8.197 -0.746 -5.272 1.00 0.00 C ATOM 158 C TRP A 54 8.286 -1.851 -6.329 1.00 0.00 C ATOM 159 O TRP A 54 8.204 -1.592 -7.513 1.00 0.00 O ATOM 160 CB TRP A 54 9.566 -0.078 -5.118 1.00 0.00 C ATOM 161 CG TRP A 54 10.024 0.453 -6.439 1.00 0.00 C ATOM 162 CD1 TRP A 54 10.485 -0.301 -7.466 1.00 0.00 C ATOM 163 CD2 TRP A 54 10.084 1.838 -6.889 1.00 0.00 C ATOM 164 NE1 TRP A 54 10.819 0.533 -8.521 1.00 0.00 N ATOM 165 CE2 TRP A 54 10.592 1.858 -8.216 1.00 0.00 C ATOM 166 CE3 TRP A 54 9.748 3.070 -6.281 1.00 0.00 C ATOM 167 CZ2 TRP A 54 10.761 3.062 -8.916 1.00 0.00 C ATOM 168 CZ3 TRP A 54 9.917 4.282 -6.983 1.00 0.00 C ATOM 169 CH2 TRP A 54 10.423 4.277 -8.298 1.00 0.00 C ATOM 0 H TRP A 54 8.418 -1.119 -3.185 1.00 0.00 H new ATOM 0 HA TRP A 54 7.457 -0.009 -5.585 1.00 0.00 H new ATOM 0 HB2 TRP A 54 9.505 0.732 -4.392 1.00 0.00 H new ATOM 0 HB3 TRP A 54 10.290 -0.797 -4.734 1.00 0.00 H new ATOM 0 HD1 TRP A 54 10.577 -1.377 -7.463 1.00 0.00 H new ATOM 0 HE1 TRP A 54 11.188 0.206 -9.414 1.00 0.00 H new ATOM 0 HE3 TRP A 54 9.360 3.083 -5.273 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 11.149 3.055 -9.924 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 9.657 5.218 -6.510 1.00 0.00 H new ATOM 0 HH2 TRP A 54 10.551 5.208 -8.831 1.00 0.00 H new ATOM 180 N ARG A 55 8.465 -3.077 -5.907 1.00 0.00 N ATOM 181 CA ARG A 55 8.576 -4.212 -6.880 1.00 0.00 C ATOM 182 C ARG A 55 7.283 -5.033 -6.886 1.00 0.00 C ATOM 183 O ARG A 55 7.068 -5.851 -7.756 1.00 0.00 O ATOM 184 CB ARG A 55 9.743 -5.109 -6.461 1.00 0.00 C ATOM 185 CG ARG A 55 9.877 -6.280 -7.448 1.00 0.00 C ATOM 186 CD ARG A 55 11.245 -6.991 -7.279 1.00 0.00 C ATOM 187 NE ARG A 55 11.050 -8.477 -7.159 1.00 0.00 N ATOM 188 CZ ARG A 55 10.262 -8.997 -6.254 1.00 0.00 C ATOM 189 NH1 ARG A 55 9.688 -8.236 -5.363 1.00 0.00 N ATOM 190 NH2 ARG A 55 10.070 -10.287 -6.226 1.00 0.00 N ATOM 0 H ARG A 55 8.540 -3.344 -4.925 1.00 0.00 H new ATOM 0 HA ARG A 55 8.746 -3.814 -7.881 1.00 0.00 H new ATOM 0 HB2 ARG A 55 10.668 -4.532 -6.438 1.00 0.00 H new ATOM 0 HB3 ARG A 55 9.579 -5.488 -5.452 1.00 0.00 H new ATOM 0 HG2 ARG A 55 9.069 -6.993 -7.284 1.00 0.00 H new ATOM 0 HG3 ARG A 55 9.777 -5.913 -8.470 1.00 0.00 H new ATOM 0 HD2 ARG A 55 11.886 -6.769 -8.133 1.00 0.00 H new ATOM 0 HD3 ARG A 55 11.753 -6.611 -6.392 1.00 0.00 H new ATOM 0 HE ARG A 55 11.546 -9.096 -7.801 1.00 0.00 H new ATOM 0 HH11 ARG A 55 9.853 -7.229 -5.370 1.00 0.00 H new ATOM 0 HH12 ARG A 55 9.074 -8.648 -4.660 1.00 0.00 H new ATOM 0 HH21 ARG A 55 10.534 -10.887 -6.908 1.00 0.00 H new ATOM 0 HH22 ARG A 55 9.456 -10.696 -5.522 1.00 0.00 H new ATOM 204 N LEU A 56 6.423 -4.833 -5.922 1.00 0.00 N ATOM 205 CA LEU A 56 5.147 -5.617 -5.872 1.00 0.00 C ATOM 206 C LEU A 56 4.012 -4.800 -6.496 1.00 0.00 C ATOM 207 O LEU A 56 3.169 -5.325 -7.195 1.00 0.00 O ATOM 208 CB LEU A 56 4.813 -5.931 -4.402 1.00 0.00 C ATOM 209 CG LEU A 56 3.599 -6.900 -4.302 1.00 0.00 C ATOM 210 CD1 LEU A 56 3.788 -7.856 -3.117 1.00 0.00 C ATOM 211 CD2 LEU A 56 2.297 -6.112 -4.083 1.00 0.00 C ATOM 0 H LEU A 56 6.547 -4.161 -5.165 1.00 0.00 H new ATOM 0 HA LEU A 56 5.263 -6.545 -6.431 1.00 0.00 H new ATOM 0 HB2 LEU A 56 5.680 -6.377 -3.915 1.00 0.00 H new ATOM 0 HB3 LEU A 56 4.590 -5.006 -3.870 1.00 0.00 H new ATOM 0 HG LEU A 56 3.537 -7.461 -5.234 1.00 0.00 H new ATOM 0 HD11 LEU A 56 2.934 -8.531 -3.054 1.00 0.00 H new ATOM 0 HD12 LEU A 56 4.699 -8.437 -3.260 1.00 0.00 H new ATOM 0 HD13 LEU A 56 3.865 -7.281 -2.194 1.00 0.00 H new ATOM 0 HD21 LEU A 56 1.459 -6.806 -4.015 1.00 0.00 H new ATOM 0 HD22 LEU A 56 2.369 -5.539 -3.158 1.00 0.00 H new ATOM 0 HD23 LEU A 56 2.138 -5.432 -4.920 1.00 0.00 H new ATOM 223 N VAL A 57 3.980 -3.523 -6.241 1.00 0.00 N ATOM 224 CA VAL A 57 2.894 -2.672 -6.807 1.00 0.00 C ATOM 225 C VAL A 57 2.737 -2.941 -8.307 1.00 0.00 C ATOM 226 O VAL A 57 1.795 -2.492 -8.928 1.00 0.00 O ATOM 227 CB VAL A 57 3.239 -1.196 -6.583 1.00 0.00 C ATOM 228 CG1 VAL A 57 2.199 -0.311 -7.277 1.00 0.00 C ATOM 229 CG2 VAL A 57 3.242 -0.897 -5.080 1.00 0.00 C ATOM 0 H VAL A 57 4.660 -3.029 -5.664 1.00 0.00 H new ATOM 0 HA VAL A 57 1.956 -2.911 -6.307 1.00 0.00 H new ATOM 0 HB VAL A 57 4.224 -0.988 -7.000 1.00 0.00 H new ATOM 0 HG11 VAL A 57 2.448 0.738 -7.115 1.00 0.00 H new ATOM 0 HG12 VAL A 57 2.196 -0.523 -8.346 1.00 0.00 H new ATOM 0 HG13 VAL A 57 1.212 -0.518 -6.864 1.00 0.00 H new ATOM 0 HG21 VAL A 57 3.487 0.153 -4.918 1.00 0.00 H new ATOM 0 HG22 VAL A 57 2.256 -1.107 -4.665 1.00 0.00 H new ATOM 0 HG23 VAL A 57 3.985 -1.523 -4.586 1.00 0.00 H new ATOM 239 N ASP A 58 3.648 -3.668 -8.903 1.00 0.00 N ATOM 240 CA ASP A 58 3.534 -3.949 -10.368 1.00 0.00 C ATOM 241 C ASP A 58 4.155 -5.313 -10.690 1.00 0.00 C ATOM 242 O ASP A 58 4.484 -6.082 -9.809 1.00 0.00 O ATOM 243 CB ASP A 58 4.271 -2.857 -11.150 1.00 0.00 C ATOM 244 CG ASP A 58 3.853 -2.909 -12.621 1.00 0.00 C ATOM 245 OD1 ASP A 58 2.688 -3.163 -12.878 1.00 0.00 O ATOM 246 OD2 ASP A 58 4.706 -2.694 -13.466 1.00 0.00 O ATOM 0 H ASP A 58 4.461 -4.077 -8.443 1.00 0.00 H new ATOM 0 HA ASP A 58 2.481 -3.961 -10.651 1.00 0.00 H new ATOM 0 HB2 ASP A 58 4.042 -1.877 -10.731 1.00 0.00 H new ATOM 0 HB3 ASP A 58 5.348 -2.997 -11.062 1.00 0.00 H new ATOM 251 N ASP A 59 4.312 -5.613 -11.952 1.00 0.00 N ATOM 252 CA ASP A 59 4.909 -6.921 -12.355 1.00 0.00 C ATOM 253 C ASP A 59 4.115 -8.068 -11.710 1.00 0.00 C ATOM 254 O ASP A 59 3.041 -7.871 -11.177 1.00 0.00 O ATOM 255 CB ASP A 59 6.403 -6.955 -11.936 1.00 0.00 C ATOM 256 CG ASP A 59 6.618 -7.782 -10.658 1.00 0.00 C ATOM 257 OD1 ASP A 59 6.545 -7.210 -9.587 1.00 0.00 O ATOM 258 OD2 ASP A 59 6.853 -8.973 -10.781 1.00 0.00 O ATOM 0 H ASP A 59 4.050 -5.004 -12.727 1.00 0.00 H new ATOM 0 HA ASP A 59 4.857 -7.042 -13.437 1.00 0.00 H new ATOM 0 HB2 ASP A 59 6.998 -7.376 -12.746 1.00 0.00 H new ATOM 0 HB3 ASP A 59 6.759 -5.937 -11.775 1.00 0.00 H new ATOM 263 N ALA A 60 4.642 -9.261 -11.757 1.00 0.00 N ATOM 264 CA ALA A 60 3.928 -10.419 -11.149 1.00 0.00 C ATOM 265 C ALA A 60 2.498 -10.481 -11.684 1.00 0.00 C ATOM 266 O ALA A 60 2.256 -10.306 -12.863 1.00 0.00 O ATOM 267 CB ALA A 60 3.897 -10.257 -9.629 1.00 0.00 C ATOM 0 H ALA A 60 5.538 -9.484 -12.191 1.00 0.00 H new ATOM 0 HA ALA A 60 4.450 -11.341 -11.407 1.00 0.00 H new ATOM 0 HB1 ALA A 60 3.375 -11.104 -9.183 1.00 0.00 H new ATOM 0 HB2 ALA A 60 4.917 -10.218 -9.246 1.00 0.00 H new ATOM 0 HB3 ALA A 60 3.377 -9.334 -9.372 1.00 0.00 H new ATOM 273 N ASP A 61 1.546 -10.730 -10.826 1.00 0.00 N ATOM 274 CA ASP A 61 0.126 -10.806 -11.273 1.00 0.00 C ATOM 275 C ASP A 61 -0.781 -10.323 -10.142 1.00 0.00 C ATOM 276 O ASP A 61 -1.771 -10.947 -9.816 1.00 0.00 O ATOM 277 CB ASP A 61 -0.222 -12.253 -11.627 1.00 0.00 C ATOM 278 CG ASP A 61 -1.618 -12.305 -12.251 1.00 0.00 C ATOM 279 OD1 ASP A 61 -2.343 -11.333 -12.113 1.00 0.00 O ATOM 280 OD2 ASP A 61 -1.939 -13.316 -12.854 1.00 0.00 O ATOM 0 H ASP A 61 1.692 -10.885 -9.828 1.00 0.00 H new ATOM 0 HA ASP A 61 -0.017 -10.177 -12.152 1.00 0.00 H new ATOM 0 HB2 ASP A 61 0.514 -12.655 -12.323 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -0.189 -12.875 -10.733 1.00 0.00 H new ATOM 285 N THR A 62 -0.447 -9.211 -9.540 1.00 0.00 N ATOM 286 CA THR A 62 -1.283 -8.671 -8.422 1.00 0.00 C ATOM 287 C THR A 62 -2.198 -7.570 -8.954 1.00 0.00 C ATOM 288 O THR A 62 -2.799 -6.831 -8.200 1.00 0.00 O ATOM 289 CB THR A 62 -0.368 -8.087 -7.342 1.00 0.00 C ATOM 290 OG1 THR A 62 0.002 -6.764 -7.706 1.00 0.00 O ATOM 291 CG2 THR A 62 0.888 -8.950 -7.207 1.00 0.00 C ATOM 0 H THR A 62 0.372 -8.650 -9.774 1.00 0.00 H new ATOM 0 HA THR A 62 -1.886 -9.474 -8.000 1.00 0.00 H new ATOM 0 HB THR A 62 -0.896 -8.071 -6.389 1.00 0.00 H new ATOM 0 HG1 THR A 62 0.809 -6.503 -7.215 1.00 0.00 H new ATOM 0 HG21 THR A 62 1.536 -8.531 -6.438 1.00 0.00 H new ATOM 0 HG22 THR A 62 0.604 -9.965 -6.929 1.00 0.00 H new ATOM 0 HG23 THR A 62 1.420 -8.970 -8.158 1.00 0.00 H new ATOM 299 N ASN A 63 -2.318 -7.454 -10.249 1.00 0.00 N ATOM 300 CA ASN A 63 -3.205 -6.402 -10.819 1.00 0.00 C ATOM 301 C ASN A 63 -4.570 -6.474 -10.132 1.00 0.00 C ATOM 302 O ASN A 63 -4.982 -7.518 -9.673 1.00 0.00 O ATOM 303 CB ASN A 63 -3.375 -6.632 -12.322 1.00 0.00 C ATOM 304 CG ASN A 63 -4.203 -5.495 -12.923 1.00 0.00 C ATOM 305 OD1 ASN A 63 -5.336 -5.693 -13.314 1.00 0.00 O ATOM 306 ND2 ASN A 63 -3.682 -4.302 -13.014 1.00 0.00 N ATOM 0 H ASN A 63 -1.842 -8.040 -10.934 1.00 0.00 H new ATOM 0 HA ASN A 63 -2.762 -5.420 -10.655 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -2.399 -6.680 -12.806 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -3.867 -7.588 -12.501 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -4.226 -3.537 -13.413 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -2.731 -4.135 -12.686 1.00 0.00 H new ATOM 313 N ARG A 64 -5.271 -5.373 -10.059 1.00 0.00 N ATOM 314 CA ARG A 64 -6.612 -5.359 -9.399 1.00 0.00 C ATOM 315 C ARG A 64 -6.429 -5.465 -7.876 1.00 0.00 C ATOM 316 O ARG A 64 -7.109 -4.801 -7.120 1.00 0.00 O ATOM 317 CB ARG A 64 -7.506 -6.498 -9.972 1.00 0.00 C ATOM 318 CG ARG A 64 -7.859 -7.554 -8.910 1.00 0.00 C ATOM 319 CD ARG A 64 -8.825 -8.575 -9.509 1.00 0.00 C ATOM 320 NE ARG A 64 -8.062 -9.573 -10.310 1.00 0.00 N ATOM 321 CZ ARG A 64 -8.630 -10.693 -10.668 1.00 0.00 C ATOM 322 NH1 ARG A 64 -9.866 -10.936 -10.330 1.00 0.00 N ATOM 323 NH2 ARG A 64 -7.959 -11.569 -11.366 1.00 0.00 N ATOM 0 H ARG A 64 -4.969 -4.473 -10.432 1.00 0.00 H new ATOM 0 HA ARG A 64 -7.125 -4.420 -9.609 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -8.424 -6.069 -10.374 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -6.989 -6.980 -10.802 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -6.954 -8.053 -8.563 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -8.311 -7.075 -8.042 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -9.378 -9.077 -8.715 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -9.558 -8.071 -10.139 1.00 0.00 H new ATOM 0 HE ARG A 64 -7.097 -9.382 -10.579 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -10.390 -10.251 -9.786 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -10.309 -11.811 -10.610 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -6.993 -11.378 -11.631 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -8.401 -12.444 -11.646 1.00 0.00 H new ATOM 337 N LEU A 65 -5.525 -6.289 -7.412 1.00 0.00 N ATOM 338 CA LEU A 65 -5.335 -6.408 -5.939 1.00 0.00 C ATOM 339 C LEU A 65 -4.509 -5.218 -5.456 1.00 0.00 C ATOM 340 O LEU A 65 -4.657 -4.757 -4.342 1.00 0.00 O ATOM 341 CB LEU A 65 -4.616 -7.725 -5.596 1.00 0.00 C ATOM 342 CG LEU A 65 -5.576 -8.921 -5.769 1.00 0.00 C ATOM 343 CD1 LEU A 65 -4.766 -10.206 -5.988 1.00 0.00 C ATOM 344 CD2 LEU A 65 -6.472 -9.087 -4.522 1.00 0.00 C ATOM 0 H LEU A 65 -4.918 -6.877 -7.983 1.00 0.00 H new ATOM 0 HA LEU A 65 -6.306 -6.412 -5.443 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -3.747 -7.851 -6.242 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -4.249 -7.690 -4.570 1.00 0.00 H new ATOM 0 HG LEU A 65 -6.211 -8.732 -6.635 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -5.446 -11.049 -6.110 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -4.153 -10.102 -6.884 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -4.122 -10.381 -5.126 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -7.141 -9.936 -4.665 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -5.847 -9.261 -3.646 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -7.061 -8.182 -4.374 1.00 0.00 H new ATOM 356 N ILE A 66 -3.657 -4.699 -6.294 1.00 0.00 N ATOM 357 CA ILE A 66 -2.840 -3.518 -5.899 1.00 0.00 C ATOM 358 C ILE A 66 -2.316 -2.830 -7.160 1.00 0.00 C ATOM 359 O ILE A 66 -1.517 -3.379 -7.893 1.00 0.00 O ATOM 360 CB ILE A 66 -1.663 -3.951 -5.014 1.00 0.00 C ATOM 361 CG1 ILE A 66 -0.782 -2.723 -4.728 1.00 0.00 C ATOM 362 CG2 ILE A 66 -0.843 -5.048 -5.716 1.00 0.00 C ATOM 363 CD1 ILE A 66 0.195 -3.034 -3.593 1.00 0.00 C ATOM 0 H ILE A 66 -3.490 -5.043 -7.240 1.00 0.00 H new ATOM 0 HA ILE A 66 -3.461 -2.826 -5.331 1.00 0.00 H new ATOM 0 HB ILE A 66 -2.039 -4.359 -4.075 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -0.232 -2.443 -5.626 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -1.407 -1.872 -4.458 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -0.011 -5.346 -5.077 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -1.480 -5.911 -5.908 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -0.456 -4.665 -6.660 1.00 0.00 H new ATOM 0 HD11 ILE A 66 0.815 -2.159 -3.397 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -0.363 -3.292 -2.693 1.00 0.00 H new ATOM 0 HD13 ILE A 66 0.830 -3.872 -3.879 1.00 0.00 H new ATOM 375 N CYS A 67 -2.768 -1.632 -7.428 1.00 0.00 N ATOM 376 CA CYS A 67 -2.303 -0.909 -8.652 1.00 0.00 C ATOM 377 C CYS A 67 -2.192 0.588 -8.359 1.00 0.00 C ATOM 378 O CYS A 67 -2.911 1.126 -7.540 1.00 0.00 O ATOM 379 CB CYS A 67 -3.308 -1.131 -9.783 1.00 0.00 C ATOM 380 SG CYS A 67 -3.524 -2.907 -10.059 1.00 0.00 S ATOM 0 H CYS A 67 -3.439 -1.122 -6.853 1.00 0.00 H new ATOM 0 HA CYS A 67 -1.326 -1.291 -8.947 1.00 0.00 H new ATOM 0 HB2 CYS A 67 -4.264 -0.673 -9.530 1.00 0.00 H new ATOM 0 HB3 CYS A 67 -2.956 -0.650 -10.696 1.00 0.00 H new ATOM 0 HG CYS A 67 -2.575 -3.559 -9.454 1.00 0.00 H new ATOM 386 N TRP A 68 -1.298 1.264 -9.026 1.00 0.00 N ATOM 387 CA TRP A 68 -1.137 2.727 -8.794 1.00 0.00 C ATOM 388 C TRP A 68 -2.496 3.416 -8.937 1.00 0.00 C ATOM 389 O TRP A 68 -3.440 2.848 -9.450 1.00 0.00 O ATOM 390 CB TRP A 68 -0.164 3.302 -9.828 1.00 0.00 C ATOM 391 CG TRP A 68 1.237 2.914 -9.477 1.00 0.00 C ATOM 392 CD1 TRP A 68 1.843 1.760 -9.849 1.00 0.00 C ATOM 393 CD2 TRP A 68 2.218 3.658 -8.698 1.00 0.00 C ATOM 394 NE1 TRP A 68 3.133 1.749 -9.349 1.00 0.00 N ATOM 395 CE2 TRP A 68 3.414 2.895 -8.631 1.00 0.00 C ATOM 396 CE3 TRP A 68 2.187 4.913 -8.046 1.00 0.00 C ATOM 397 CZ2 TRP A 68 4.543 3.359 -7.940 1.00 0.00 C ATOM 398 CZ3 TRP A 68 3.321 5.385 -7.350 1.00 0.00 C ATOM 399 CH2 TRP A 68 4.496 4.608 -7.298 1.00 0.00 C ATOM 0 H TRP A 68 -0.670 0.865 -9.724 1.00 0.00 H new ATOM 0 HA TRP A 68 -0.745 2.897 -7.791 1.00 0.00 H new ATOM 0 HB2 TRP A 68 -0.415 2.932 -10.822 1.00 0.00 H new ATOM 0 HB3 TRP A 68 -0.253 4.388 -9.860 1.00 0.00 H new ATOM 0 HD1 TRP A 68 1.392 0.976 -10.440 1.00 0.00 H new ATOM 0 HE1 TRP A 68 3.796 0.987 -9.493 1.00 0.00 H new ATOM 0 HE3 TRP A 68 1.290 5.514 -8.081 1.00 0.00 H new ATOM 0 HZ2 TRP A 68 5.441 2.761 -7.902 1.00 0.00 H new ATOM 0 HZ3 TRP A 68 3.288 6.345 -6.856 1.00 0.00 H new ATOM 0 HH2 TRP A 68 5.361 4.973 -6.764 1.00 0.00 H new ATOM 410 N THR A 69 -2.602 4.638 -8.491 1.00 0.00 N ATOM 411 CA THR A 69 -3.900 5.363 -8.606 1.00 0.00 C ATOM 412 C THR A 69 -4.052 5.903 -10.029 1.00 0.00 C ATOM 413 O THR A 69 -3.371 5.477 -10.941 1.00 0.00 O ATOM 414 CB THR A 69 -3.926 6.533 -7.613 1.00 0.00 C ATOM 415 OG1 THR A 69 -2.915 7.466 -7.968 1.00 0.00 O ATOM 416 CG2 THR A 69 -3.678 6.036 -6.176 1.00 0.00 C ATOM 0 H THR A 69 -1.847 5.165 -8.052 1.00 0.00 H new ATOM 0 HA THR A 69 -4.719 4.680 -8.382 1.00 0.00 H new ATOM 0 HB THR A 69 -4.907 7.006 -7.653 1.00 0.00 H new ATOM 0 HG1 THR A 69 -2.927 8.217 -7.339 1.00 0.00 H new ATOM 0 HG21 THR A 69 -3.701 6.882 -5.489 1.00 0.00 H new ATOM 0 HG22 THR A 69 -4.454 5.323 -5.899 1.00 0.00 H new ATOM 0 HG23 THR A 69 -2.703 5.551 -6.122 1.00 0.00 H new ATOM 424 N LYS A 70 -4.939 6.839 -10.226 1.00 0.00 N ATOM 425 CA LYS A 70 -5.130 7.406 -11.591 1.00 0.00 C ATOM 426 C LYS A 70 -3.948 8.318 -11.926 1.00 0.00 C ATOM 427 O LYS A 70 -3.259 8.123 -12.908 1.00 0.00 O ATOM 428 CB LYS A 70 -6.434 8.212 -11.627 1.00 0.00 C ATOM 429 CG LYS A 70 -6.707 8.735 -13.049 1.00 0.00 C ATOM 430 CD LYS A 70 -7.013 7.563 -14.025 1.00 0.00 C ATOM 431 CE LYS A 70 -5.834 7.326 -14.983 1.00 0.00 C ATOM 432 NZ LYS A 70 -5.917 5.946 -15.540 1.00 0.00 N ATOM 0 H LYS A 70 -5.539 7.235 -9.502 1.00 0.00 H new ATOM 0 HA LYS A 70 -5.185 6.600 -12.323 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -7.264 7.587 -11.298 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -6.370 9.049 -10.932 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -7.549 9.427 -13.030 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -5.843 9.295 -13.407 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -7.214 6.654 -13.457 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -7.913 7.787 -14.598 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -5.855 8.058 -15.791 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -4.890 7.461 -14.455 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -5.120 5.785 -16.188 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -5.877 5.255 -14.764 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -6.812 5.834 -16.057 1.00 0.00 H new ATOM 446 N ASP A 71 -3.706 9.313 -11.117 1.00 0.00 N ATOM 447 CA ASP A 71 -2.568 10.236 -11.390 1.00 0.00 C ATOM 448 C ASP A 71 -1.249 9.469 -11.270 1.00 0.00 C ATOM 449 O ASP A 71 -0.956 8.592 -12.058 1.00 0.00 O ATOM 450 CB ASP A 71 -2.591 11.384 -10.377 1.00 0.00 C ATOM 451 CG ASP A 71 -3.951 12.083 -10.428 1.00 0.00 C ATOM 452 OD1 ASP A 71 -4.925 11.418 -10.738 1.00 0.00 O ATOM 453 OD2 ASP A 71 -3.994 13.271 -10.156 1.00 0.00 O ATOM 0 H ASP A 71 -4.247 9.527 -10.279 1.00 0.00 H new ATOM 0 HA ASP A 71 -2.659 10.641 -12.398 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -2.404 11.001 -9.374 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -1.796 12.096 -10.600 1.00 0.00 H new ATOM 458 N GLY A 72 -0.448 9.792 -10.289 1.00 0.00 N ATOM 459 CA GLY A 72 0.851 9.081 -10.121 1.00 0.00 C ATOM 460 C GLY A 72 1.533 9.562 -8.839 1.00 0.00 C ATOM 461 O GLY A 72 2.667 9.997 -8.854 1.00 0.00 O ATOM 0 H GLY A 72 -0.638 10.517 -9.598 1.00 0.00 H new ATOM 0 HA2 GLY A 72 0.686 8.005 -10.076 1.00 0.00 H new ATOM 0 HA3 GLY A 72 1.494 9.269 -10.981 1.00 0.00 H new ATOM 465 N GLN A 73 0.846 9.493 -7.730 1.00 0.00 N ATOM 466 CA GLN A 73 1.449 9.949 -6.442 1.00 0.00 C ATOM 467 C GLN A 73 0.848 9.143 -5.288 1.00 0.00 C ATOM 468 O GLN A 73 0.647 9.652 -4.203 1.00 0.00 O ATOM 469 CB GLN A 73 1.142 11.434 -6.239 1.00 0.00 C ATOM 470 CG GLN A 73 1.821 12.251 -7.339 1.00 0.00 C ATOM 471 CD GLN A 73 1.788 13.735 -6.969 1.00 0.00 C ATOM 472 OE1 GLN A 73 2.061 14.096 -5.744 1.00 0.00 O flip ATOM 473 NE2 GLN A 73 1.510 14.575 -7.802 1.00 0.00 N flip ATOM 0 H GLN A 73 -0.108 9.140 -7.660 1.00 0.00 H new ATOM 0 HA GLN A 73 2.528 9.799 -6.468 1.00 0.00 H new ATOM 0 HB2 GLN A 73 0.065 11.600 -6.261 1.00 0.00 H new ATOM 0 HB3 GLN A 73 1.495 11.759 -5.260 1.00 0.00 H new ATOM 0 HG2 GLN A 73 2.852 11.921 -7.468 1.00 0.00 H new ATOM 0 HG3 GLN A 73 1.314 12.091 -8.290 1.00 0.00 H new ATOM 0 HE21 GLN A 73 1.297 14.293 -8.759 1.00 0.00 H new ATOM 0 HE22 GLN A 73 1.490 15.562 -7.544 1.00 0.00 H new ATOM 482 N SER A 74 0.559 7.888 -5.511 1.00 0.00 N ATOM 483 CA SER A 74 -0.030 7.058 -4.422 1.00 0.00 C ATOM 484 C SER A 74 -0.423 5.684 -4.977 1.00 0.00 C ATOM 485 O SER A 74 -0.242 5.400 -6.145 1.00 0.00 O ATOM 486 CB SER A 74 -1.271 7.765 -3.866 1.00 0.00 C ATOM 487 OG SER A 74 -2.197 6.793 -3.398 1.00 0.00 O ATOM 0 H SER A 74 0.705 7.404 -6.397 1.00 0.00 H new ATOM 0 HA SER A 74 0.702 6.925 -3.626 1.00 0.00 H new ATOM 0 HB2 SER A 74 -0.988 8.435 -3.054 1.00 0.00 H new ATOM 0 HB3 SER A 74 -1.731 8.379 -4.640 1.00 0.00 H new ATOM 0 HG SER A 74 -1.996 6.572 -2.465 1.00 0.00 H new ATOM 493 N PHE A 75 -0.959 4.827 -4.144 1.00 0.00 N ATOM 494 CA PHE A 75 -1.364 3.464 -4.612 1.00 0.00 C ATOM 495 C PHE A 75 -2.644 3.040 -3.885 1.00 0.00 C ATOM 496 O PHE A 75 -2.988 3.588 -2.856 1.00 0.00 O ATOM 497 CB PHE A 75 -0.242 2.463 -4.308 1.00 0.00 C ATOM 498 CG PHE A 75 0.106 2.510 -2.835 1.00 0.00 C ATOM 499 CD1 PHE A 75 0.796 3.620 -2.307 1.00 0.00 C ATOM 500 CD2 PHE A 75 -0.255 1.441 -1.990 1.00 0.00 C ATOM 501 CE1 PHE A 75 1.121 3.662 -0.938 1.00 0.00 C ATOM 502 CE2 PHE A 75 0.071 1.484 -0.619 1.00 0.00 C ATOM 503 CZ PHE A 75 0.759 2.595 -0.093 1.00 0.00 C ATOM 0 H PHE A 75 -1.134 5.013 -3.156 1.00 0.00 H new ATOM 0 HA PHE A 75 -1.545 3.484 -5.687 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -0.556 1.456 -4.584 1.00 0.00 H new ATOM 0 HB3 PHE A 75 0.638 2.698 -4.906 1.00 0.00 H new ATOM 0 HD1 PHE A 75 1.076 4.439 -2.953 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -0.782 0.589 -2.393 1.00 0.00 H new ATOM 0 HE1 PHE A 75 1.649 4.514 -0.535 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -0.207 0.665 0.028 1.00 0.00 H new ATOM 0 HZ PHE A 75 1.009 2.629 0.957 1.00 0.00 H new ATOM 513 N VAL A 76 -3.356 2.073 -4.415 1.00 0.00 N ATOM 514 CA VAL A 76 -4.625 1.613 -3.757 1.00 0.00 C ATOM 515 C VAL A 76 -4.671 0.090 -3.713 1.00 0.00 C ATOM 516 O VAL A 76 -3.968 -0.594 -4.430 1.00 0.00 O ATOM 517 CB VAL A 76 -5.845 2.100 -4.563 1.00 0.00 C ATOM 518 CG1 VAL A 76 -7.140 1.587 -3.902 1.00 0.00 C ATOM 519 CG2 VAL A 76 -5.855 3.652 -4.684 1.00 0.00 C ATOM 0 H VAL A 76 -3.114 1.581 -5.275 1.00 0.00 H new ATOM 0 HA VAL A 76 -4.650 2.021 -2.747 1.00 0.00 H new ATOM 0 HB VAL A 76 -5.782 1.697 -5.574 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -8.002 1.932 -4.473 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -7.131 0.497 -3.882 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -7.204 1.968 -2.883 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -6.727 3.967 -5.258 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -5.897 4.094 -3.689 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -4.949 3.983 -5.191 1.00 0.00 H new ATOM 529 N ILE A 77 -5.534 -0.437 -2.888 1.00 0.00 N ATOM 530 CA ILE A 77 -5.698 -1.914 -2.786 1.00 0.00 C ATOM 531 C ILE A 77 -7.205 -2.165 -2.702 1.00 0.00 C ATOM 532 O ILE A 77 -7.714 -2.708 -1.742 1.00 0.00 O ATOM 533 CB ILE A 77 -4.972 -2.430 -1.530 1.00 0.00 C ATOM 534 CG1 ILE A 77 -3.690 -1.612 -1.316 1.00 0.00 C ATOM 535 CG2 ILE A 77 -4.611 -3.909 -1.699 1.00 0.00 C ATOM 536 CD1 ILE A 77 -2.889 -2.200 -0.150 1.00 0.00 C ATOM 0 H ILE A 77 -6.141 0.102 -2.271 1.00 0.00 H new ATOM 0 HA ILE A 77 -5.269 -2.438 -3.640 1.00 0.00 H new ATOM 0 HB ILE A 77 -5.629 -2.323 -0.667 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -3.087 -1.619 -2.224 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -3.941 -0.572 -1.109 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -4.098 -4.263 -0.805 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -5.520 -4.491 -1.850 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -3.957 -4.028 -2.563 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -1.980 -1.616 -0.002 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -3.492 -2.169 0.758 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -2.624 -3.233 -0.375 1.00 0.00 H new ATOM 548 N GLN A 78 -7.910 -1.704 -3.706 1.00 0.00 N ATOM 549 CA GLN A 78 -9.396 -1.817 -3.749 1.00 0.00 C ATOM 550 C GLN A 78 -9.882 -3.133 -3.113 1.00 0.00 C ATOM 551 O GLN A 78 -10.993 -3.209 -2.630 1.00 0.00 O ATOM 552 CB GLN A 78 -9.861 -1.734 -5.208 1.00 0.00 C ATOM 553 CG GLN A 78 -9.225 -2.856 -6.038 1.00 0.00 C ATOM 554 CD GLN A 78 -9.219 -2.467 -7.520 1.00 0.00 C ATOM 555 OE1 GLN A 78 -8.255 -1.913 -8.010 1.00 0.00 O ATOM 556 NE2 GLN A 78 -10.260 -2.739 -8.258 1.00 0.00 N ATOM 0 H GLN A 78 -7.502 -1.242 -4.519 1.00 0.00 H new ATOM 0 HA GLN A 78 -9.824 -0.997 -3.172 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -10.947 -1.810 -5.255 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -9.591 -0.765 -5.628 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -8.206 -3.040 -5.697 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -9.780 -3.783 -5.898 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -11.069 -3.204 -7.847 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -10.265 -2.487 -9.246 1.00 0.00 H new ATOM 565 N ASN A 79 -9.068 -4.170 -3.096 1.00 0.00 N ATOM 566 CA ASN A 79 -9.497 -5.469 -2.468 1.00 0.00 C ATOM 567 C ASN A 79 -8.524 -5.792 -1.327 1.00 0.00 C ATOM 568 O ASN A 79 -7.332 -5.891 -1.532 1.00 0.00 O ATOM 569 CB ASN A 79 -9.492 -6.617 -3.517 1.00 0.00 C ATOM 570 CG ASN A 79 -9.190 -6.062 -4.909 1.00 0.00 C ATOM 571 OD1 ASN A 79 -8.274 -5.285 -5.078 1.00 0.00 O ATOM 572 ND2 ASN A 79 -9.929 -6.431 -5.920 1.00 0.00 N ATOM 0 H ASN A 79 -8.127 -4.173 -3.489 1.00 0.00 H new ATOM 0 HA ASN A 79 -10.513 -5.374 -2.085 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -8.745 -7.363 -3.246 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -10.459 -7.120 -3.520 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -9.736 -6.066 -6.853 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -10.699 -7.084 -5.777 1.00 0.00 H new ATOM 579 N GLN A 80 -9.028 -5.951 -0.130 1.00 0.00 N ATOM 580 CA GLN A 80 -8.145 -6.269 1.036 1.00 0.00 C ATOM 581 C GLN A 80 -8.294 -7.750 1.390 1.00 0.00 C ATOM 582 O GLN A 80 -7.596 -8.270 2.237 1.00 0.00 O ATOM 583 CB GLN A 80 -8.563 -5.414 2.235 1.00 0.00 C ATOM 584 CG GLN A 80 -10.074 -5.529 2.444 1.00 0.00 C ATOM 585 CD GLN A 80 -10.461 -4.857 3.762 1.00 0.00 C ATOM 586 OE1 GLN A 80 -10.168 -5.366 4.826 1.00 0.00 O ATOM 587 NE2 GLN A 80 -11.113 -3.727 3.737 1.00 0.00 N ATOM 0 H GLN A 80 -10.020 -5.874 0.093 1.00 0.00 H new ATOM 0 HA GLN A 80 -7.107 -6.056 0.781 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -8.036 -5.743 3.131 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -8.287 -4.373 2.066 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -10.603 -5.059 1.615 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -10.371 -6.578 2.458 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -11.359 -3.300 2.844 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -11.377 -3.271 4.610 1.00 0.00 H new ATOM 596 N ALA A 81 -9.205 -8.430 0.747 1.00 0.00 N ATOM 597 CA ALA A 81 -9.408 -9.875 1.044 1.00 0.00 C ATOM 598 C ALA A 81 -8.326 -10.704 0.350 1.00 0.00 C ATOM 599 O ALA A 81 -7.280 -10.969 0.908 1.00 0.00 O ATOM 600 CB ALA A 81 -10.783 -10.311 0.536 1.00 0.00 C ATOM 0 H ALA A 81 -9.818 -8.045 0.028 1.00 0.00 H new ATOM 0 HA ALA A 81 -9.347 -10.032 2.121 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -10.932 -11.369 0.753 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -11.557 -9.726 1.033 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -10.841 -10.150 -0.540 1.00 0.00 H new ATOM 606 N GLN A 82 -8.573 -11.119 -0.862 1.00 0.00 N ATOM 607 CA GLN A 82 -7.565 -11.937 -1.598 1.00 0.00 C ATOM 608 C GLN A 82 -6.191 -11.262 -1.495 1.00 0.00 C ATOM 609 O GLN A 82 -5.168 -11.911 -1.465 1.00 0.00 O ATOM 610 CB GLN A 82 -8.004 -12.059 -3.081 1.00 0.00 C ATOM 611 CG GLN A 82 -8.246 -13.528 -3.453 1.00 0.00 C ATOM 612 CD GLN A 82 -8.785 -13.613 -4.882 1.00 0.00 C ATOM 613 OE1 GLN A 82 -9.925 -13.276 -5.135 1.00 0.00 O ATOM 614 NE2 GLN A 82 -8.008 -14.051 -5.835 1.00 0.00 N ATOM 0 H GLN A 82 -9.432 -10.927 -1.377 1.00 0.00 H new ATOM 0 HA GLN A 82 -7.496 -12.935 -1.164 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -8.914 -11.482 -3.245 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -7.237 -11.636 -3.729 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -7.317 -14.093 -3.370 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -8.956 -13.977 -2.758 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -7.051 -14.334 -5.623 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -8.358 -14.110 -6.791 1.00 0.00 H new ATOM 623 N PHE A 83 -6.170 -9.963 -1.447 1.00 0.00 N ATOM 624 CA PHE A 83 -4.875 -9.232 -1.358 1.00 0.00 C ATOM 625 C PHE A 83 -4.110 -9.675 -0.103 1.00 0.00 C ATOM 626 O PHE A 83 -3.025 -9.200 0.165 1.00 0.00 O ATOM 627 CB PHE A 83 -5.181 -7.729 -1.303 1.00 0.00 C ATOM 628 CG PHE A 83 -3.975 -6.953 -0.840 1.00 0.00 C ATOM 629 CD1 PHE A 83 -3.785 -6.734 0.532 1.00 0.00 C ATOM 630 CD2 PHE A 83 -3.048 -6.451 -1.773 1.00 0.00 C ATOM 631 CE1 PHE A 83 -2.666 -6.012 0.982 1.00 0.00 C ATOM 632 CE2 PHE A 83 -1.928 -5.727 -1.325 1.00 0.00 C ATOM 633 CZ PHE A 83 -1.735 -5.508 0.054 1.00 0.00 C ATOM 0 H PHE A 83 -6.999 -9.370 -1.466 1.00 0.00 H new ATOM 0 HA PHE A 83 -4.252 -9.451 -2.225 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -5.487 -7.379 -2.289 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -6.017 -7.548 -0.627 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -4.499 -7.121 1.244 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -3.196 -6.621 -2.829 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -2.521 -5.844 2.039 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -1.216 -5.339 -2.038 1.00 0.00 H new ATOM 0 HZ PHE A 83 -0.874 -4.954 0.398 1.00 0.00 H new ATOM 643 N ALA A 84 -4.663 -10.579 0.667 1.00 0.00 N ATOM 644 CA ALA A 84 -3.969 -11.044 1.909 1.00 0.00 C ATOM 645 C ALA A 84 -3.329 -12.420 1.685 1.00 0.00 C ATOM 646 O ALA A 84 -2.163 -12.526 1.369 1.00 0.00 O ATOM 647 CB ALA A 84 -4.988 -11.140 3.048 1.00 0.00 C ATOM 0 H ALA A 84 -5.567 -11.016 0.489 1.00 0.00 H new ATOM 0 HA ALA A 84 -3.186 -10.330 2.164 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -4.488 -11.478 3.956 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -5.432 -10.160 3.222 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -5.770 -11.850 2.778 1.00 0.00 H new ATOM 653 N LYS A 85 -4.078 -13.473 1.877 1.00 0.00 N ATOM 654 CA LYS A 85 -3.513 -14.843 1.710 1.00 0.00 C ATOM 655 C LYS A 85 -3.136 -15.126 0.249 1.00 0.00 C ATOM 656 O LYS A 85 -3.116 -16.265 -0.175 1.00 0.00 O ATOM 657 CB LYS A 85 -4.522 -15.895 2.221 1.00 0.00 C ATOM 658 CG LYS A 85 -5.738 -16.069 1.274 1.00 0.00 C ATOM 659 CD LYS A 85 -6.641 -14.821 1.261 1.00 0.00 C ATOM 660 CE LYS A 85 -7.127 -14.486 2.680 1.00 0.00 C ATOM 661 NZ LYS A 85 -8.434 -13.776 2.598 1.00 0.00 N ATOM 0 H LYS A 85 -5.062 -13.442 2.144 1.00 0.00 H new ATOM 0 HA LYS A 85 -2.599 -14.905 2.301 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -4.015 -16.853 2.334 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -4.876 -15.603 3.210 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -5.384 -16.271 0.263 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -6.321 -16.935 1.587 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -6.092 -13.974 0.850 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -7.498 -14.993 0.609 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -7.232 -15.399 3.266 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -6.393 -13.863 3.191 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -8.766 -13.548 3.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -8.318 -12.898 2.053 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -9.132 -14.386 2.126 1.00 0.00 H new ATOM 675 N GLU A 86 -2.828 -14.112 -0.526 1.00 0.00 N ATOM 676 CA GLU A 86 -2.450 -14.339 -1.958 1.00 0.00 C ATOM 677 C GLU A 86 -1.187 -13.540 -2.302 1.00 0.00 C ATOM 678 O GLU A 86 -0.546 -13.793 -3.302 1.00 0.00 O ATOM 679 CB GLU A 86 -3.603 -13.877 -2.854 1.00 0.00 C ATOM 680 CG GLU A 86 -3.452 -14.487 -4.247 1.00 0.00 C ATOM 681 CD GLU A 86 -3.844 -15.965 -4.207 1.00 0.00 C ATOM 682 OE1 GLU A 86 -2.981 -16.780 -3.924 1.00 0.00 O ATOM 683 OE2 GLU A 86 -5.001 -16.258 -4.460 1.00 0.00 O ATOM 0 H GLU A 86 -2.822 -13.136 -0.228 1.00 0.00 H new ATOM 0 HA GLU A 86 -2.252 -15.399 -2.117 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -4.557 -14.175 -2.418 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -3.610 -12.789 -2.922 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -4.081 -13.953 -4.959 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -2.423 -14.383 -4.591 1.00 0.00 H new ATOM 690 N LEU A 87 -0.827 -12.573 -1.490 1.00 0.00 N ATOM 691 CA LEU A 87 0.395 -11.749 -1.782 1.00 0.00 C ATOM 692 C LEU A 87 1.286 -11.661 -0.540 1.00 0.00 C ATOM 693 O LEU A 87 2.488 -11.517 -0.648 1.00 0.00 O ATOM 694 CB LEU A 87 -0.032 -10.336 -2.193 1.00 0.00 C ATOM 695 CG LEU A 87 -1.009 -10.405 -3.373 1.00 0.00 C ATOM 696 CD1 LEU A 87 -1.632 -9.026 -3.591 1.00 0.00 C ATOM 697 CD2 LEU A 87 -0.273 -10.837 -4.650 1.00 0.00 C ATOM 0 H LEU A 87 -1.325 -12.317 -0.637 1.00 0.00 H new ATOM 0 HA LEU A 87 0.954 -12.221 -2.590 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -0.502 -9.830 -1.350 1.00 0.00 H new ATOM 0 HB3 LEU A 87 0.844 -9.749 -2.469 1.00 0.00 H new ATOM 0 HG LEU A 87 -1.786 -11.135 -3.149 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -2.328 -9.069 -4.429 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -2.167 -8.722 -2.691 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -0.847 -8.302 -3.809 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -0.979 -10.882 -5.479 1.00 0.00 H new ATOM 0 HD22 LEU A 87 0.511 -10.116 -4.880 1.00 0.00 H new ATOM 0 HD23 LEU A 87 0.172 -11.821 -4.499 1.00 0.00 H new ATOM 709 N LEU A 88 0.725 -11.737 0.637 1.00 0.00 N ATOM 710 CA LEU A 88 1.581 -11.646 1.854 1.00 0.00 C ATOM 711 C LEU A 88 2.430 -12.923 2.042 1.00 0.00 C ATOM 712 O LEU A 88 3.553 -12.825 2.493 1.00 0.00 O ATOM 713 CB LEU A 88 0.727 -11.393 3.108 1.00 0.00 C ATOM 714 CG LEU A 88 -0.320 -10.316 2.815 1.00 0.00 C ATOM 715 CD1 LEU A 88 -1.226 -10.144 4.037 1.00 0.00 C ATOM 716 CD2 LEU A 88 0.379 -8.986 2.506 1.00 0.00 C ATOM 0 H LEU A 88 -0.274 -11.856 0.807 1.00 0.00 H new ATOM 0 HA LEU A 88 2.257 -10.803 1.713 1.00 0.00 H new ATOM 0 HB2 LEU A 88 0.236 -12.316 3.417 1.00 0.00 H new ATOM 0 HB3 LEU A 88 1.364 -11.079 3.935 1.00 0.00 H new ATOM 0 HG LEU A 88 -0.918 -10.617 1.955 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -1.973 -9.377 3.831 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -1.726 -11.088 4.255 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -0.625 -9.844 4.896 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -0.369 -8.221 2.298 1.00 0.00 H new ATOM 0 HD22 LEU A 88 0.979 -8.682 3.364 1.00 0.00 H new ATOM 0 HD23 LEU A 88 1.025 -9.108 1.636 1.00 0.00 H new ATOM 728 N PRO A 89 1.902 -14.091 1.715 1.00 0.00 N ATOM 729 CA PRO A 89 2.667 -15.339 1.884 1.00 0.00 C ATOM 730 C PRO A 89 3.645 -15.510 0.710 1.00 0.00 C ATOM 731 O PRO A 89 3.809 -14.627 -0.109 1.00 0.00 O ATOM 732 CB PRO A 89 1.593 -16.450 1.872 1.00 0.00 C ATOM 733 CG PRO A 89 0.272 -15.804 1.356 1.00 0.00 C ATOM 734 CD PRO A 89 0.539 -14.292 1.176 1.00 0.00 C ATOM 0 HA PRO A 89 3.263 -15.356 2.797 1.00 0.00 H new ATOM 0 HB2 PRO A 89 1.897 -17.273 1.226 1.00 0.00 H new ATOM 0 HB3 PRO A 89 1.455 -16.863 2.871 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -0.033 -16.255 0.412 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -0.539 -15.969 2.065 1.00 0.00 H new ATOM 0 HD2 PRO A 89 0.480 -14.000 0.127 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -0.194 -13.692 1.716 1.00 0.00 H new ATOM 742 N LEU A 90 4.272 -16.652 0.622 1.00 0.00 N ATOM 743 CA LEU A 90 5.225 -16.928 -0.497 1.00 0.00 C ATOM 744 C LEU A 90 6.416 -15.959 -0.477 1.00 0.00 C ATOM 745 O LEU A 90 7.450 -16.240 -1.048 1.00 0.00 O ATOM 746 CB LEU A 90 4.500 -16.809 -1.845 1.00 0.00 C ATOM 747 CG LEU A 90 3.146 -17.527 -1.782 1.00 0.00 C ATOM 748 CD1 LEU A 90 2.447 -17.412 -3.139 1.00 0.00 C ATOM 749 CD2 LEU A 90 3.362 -19.007 -1.444 1.00 0.00 C ATOM 0 H LEU A 90 4.164 -17.418 1.287 1.00 0.00 H new ATOM 0 HA LEU A 90 5.604 -17.941 -0.364 1.00 0.00 H new ATOM 0 HB2 LEU A 90 4.352 -15.759 -2.095 1.00 0.00 H new ATOM 0 HB3 LEU A 90 5.113 -17.242 -2.636 1.00 0.00 H new ATOM 0 HG LEU A 90 2.528 -17.067 -1.011 1.00 0.00 H new ATOM 0 HD11 LEU A 90 1.484 -17.922 -3.097 1.00 0.00 H new ATOM 0 HD12 LEU A 90 2.291 -16.360 -3.380 1.00 0.00 H new ATOM 0 HD13 LEU A 90 3.068 -17.872 -3.908 1.00 0.00 H new ATOM 0 HD21 LEU A 90 2.398 -19.515 -1.400 1.00 0.00 H new ATOM 0 HD22 LEU A 90 3.981 -19.469 -2.213 1.00 0.00 H new ATOM 0 HD23 LEU A 90 3.861 -19.091 -0.478 1.00 0.00 H new ATOM 761 N ASN A 91 6.297 -14.822 0.158 1.00 0.00 N ATOM 762 CA ASN A 91 7.447 -13.864 0.177 1.00 0.00 C ATOM 763 C ASN A 91 7.418 -13.031 1.460 1.00 0.00 C ATOM 764 O ASN A 91 8.422 -12.855 2.119 1.00 0.00 O ATOM 765 CB ASN A 91 7.349 -12.935 -1.034 1.00 0.00 C ATOM 766 CG ASN A 91 5.918 -12.410 -1.161 1.00 0.00 C ATOM 767 OD1 ASN A 91 5.444 -11.690 -0.304 1.00 0.00 O ATOM 768 ND2 ASN A 91 5.205 -12.743 -2.200 1.00 0.00 N ATOM 0 H ASN A 91 5.463 -14.516 0.660 1.00 0.00 H new ATOM 0 HA ASN A 91 8.381 -14.425 0.140 1.00 0.00 H new ATOM 0 HB2 ASN A 91 8.044 -12.103 -0.924 1.00 0.00 H new ATOM 0 HB3 ASN A 91 7.633 -13.470 -1.940 1.00 0.00 H new ATOM 0 HD21 ASN A 91 4.249 -12.399 -2.294 1.00 0.00 H new ATOM 0 HD22 ASN A 91 5.603 -13.347 -2.919 1.00 0.00 H new ATOM 775 N TYR A 92 6.275 -12.510 1.818 1.00 0.00 N ATOM 776 CA TYR A 92 6.182 -11.680 3.056 1.00 0.00 C ATOM 777 C TYR A 92 5.877 -12.601 4.246 1.00 0.00 C ATOM 778 O TYR A 92 5.802 -12.167 5.378 1.00 0.00 O ATOM 779 CB TYR A 92 5.055 -10.630 2.869 1.00 0.00 C ATOM 780 CG TYR A 92 5.619 -9.220 2.882 1.00 0.00 C ATOM 781 CD1 TYR A 92 6.071 -8.653 4.089 1.00 0.00 C ATOM 782 CD2 TYR A 92 5.688 -8.477 1.686 1.00 0.00 C ATOM 783 CE1 TYR A 92 6.592 -7.344 4.101 1.00 0.00 C ATOM 784 CE2 TYR A 92 6.209 -7.169 1.699 1.00 0.00 C ATOM 785 CZ TYR A 92 6.660 -6.603 2.905 1.00 0.00 C ATOM 786 OH TYR A 92 7.169 -5.320 2.915 1.00 0.00 O ATOM 0 H TYR A 92 5.400 -12.623 1.306 1.00 0.00 H new ATOM 0 HA TYR A 92 7.120 -11.159 3.246 1.00 0.00 H new ATOM 0 HB2 TYR A 92 4.538 -10.810 1.927 1.00 0.00 H new ATOM 0 HB3 TYR A 92 4.317 -10.738 3.664 1.00 0.00 H new ATOM 0 HD1 TYR A 92 6.018 -9.222 5.006 1.00 0.00 H new ATOM 0 HD2 TYR A 92 5.341 -8.911 0.760 1.00 0.00 H new ATOM 0 HE1 TYR A 92 6.939 -6.909 5.027 1.00 0.00 H new ATOM 0 HE2 TYR A 92 6.262 -6.600 0.783 1.00 0.00 H new ATOM 0 HH TYR A 92 7.352 -5.048 3.838 1.00 0.00 H new ATOM 796 N LYS A 93 5.712 -13.874 3.997 1.00 0.00 N ATOM 797 CA LYS A 93 5.426 -14.821 5.112 1.00 0.00 C ATOM 798 C LYS A 93 4.141 -14.387 5.836 1.00 0.00 C ATOM 799 O LYS A 93 3.492 -13.438 5.448 1.00 0.00 O ATOM 800 CB LYS A 93 6.621 -14.820 6.090 1.00 0.00 C ATOM 801 CG LYS A 93 6.822 -16.218 6.706 1.00 0.00 C ATOM 802 CD LYS A 93 7.658 -17.096 5.765 1.00 0.00 C ATOM 803 CE LYS A 93 7.948 -18.438 6.440 1.00 0.00 C ATOM 804 NZ LYS A 93 6.720 -18.922 7.131 1.00 0.00 N ATOM 0 H LYS A 93 5.763 -14.297 3.070 1.00 0.00 H new ATOM 0 HA LYS A 93 5.283 -15.828 4.721 1.00 0.00 H new ATOM 0 HB2 LYS A 93 7.526 -14.515 5.565 1.00 0.00 H new ATOM 0 HB3 LYS A 93 6.449 -14.090 6.881 1.00 0.00 H new ATOM 0 HG2 LYS A 93 7.320 -16.130 7.671 1.00 0.00 H new ATOM 0 HG3 LYS A 93 5.854 -16.686 6.888 1.00 0.00 H new ATOM 0 HD2 LYS A 93 7.123 -17.256 4.829 1.00 0.00 H new ATOM 0 HD3 LYS A 93 8.592 -16.593 5.516 1.00 0.00 H new ATOM 0 HE2 LYS A 93 8.272 -19.168 5.698 1.00 0.00 H new ATOM 0 HE3 LYS A 93 8.762 -18.328 7.156 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 6.786 -19.949 7.278 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 6.629 -18.446 8.051 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 5.886 -18.709 6.547 1.00 0.00 H new ATOM 818 N HIS A 94 3.782 -15.085 6.883 1.00 0.00 N ATOM 819 CA HIS A 94 2.547 -14.741 7.651 1.00 0.00 C ATOM 820 C HIS A 94 1.384 -14.464 6.693 1.00 0.00 C ATOM 821 O HIS A 94 1.491 -14.649 5.497 1.00 0.00 O ATOM 822 CB HIS A 94 2.806 -13.514 8.539 1.00 0.00 C ATOM 823 CG HIS A 94 2.915 -12.271 7.696 1.00 0.00 C ATOM 824 ND1 HIS A 94 1.804 -11.648 7.152 1.00 0.00 N ATOM 825 CD2 HIS A 94 3.996 -11.522 7.302 1.00 0.00 C ATOM 826 CE1 HIS A 94 2.238 -10.573 6.467 1.00 0.00 C ATOM 827 NE2 HIS A 94 3.567 -10.451 6.526 1.00 0.00 N ATOM 0 H HIS A 94 4.298 -15.888 7.243 1.00 0.00 H new ATOM 0 HA HIS A 94 2.281 -15.587 8.285 1.00 0.00 H new ATOM 0 HB2 HIS A 94 1.997 -13.402 9.261 1.00 0.00 H new ATOM 0 HB3 HIS A 94 3.724 -13.657 9.109 1.00 0.00 H new ATOM 0 HD2 HIS A 94 5.024 -11.733 7.556 1.00 0.00 H new ATOM 0 HE1 HIS A 94 1.590 -9.892 5.935 1.00 0.00 H new ATOM 0 HE2 HIS A 94 4.143 -9.728 6.095 1.00 0.00 H new ATOM 835 N ASN A 95 0.266 -14.034 7.215 1.00 0.00 N ATOM 836 CA ASN A 95 -0.913 -13.753 6.344 1.00 0.00 C ATOM 837 C ASN A 95 -1.763 -12.649 6.980 1.00 0.00 C ATOM 838 O ASN A 95 -1.347 -11.511 7.079 1.00 0.00 O ATOM 839 CB ASN A 95 -1.748 -15.027 6.198 1.00 0.00 C ATOM 840 CG ASN A 95 -0.862 -16.160 5.676 1.00 0.00 C ATOM 841 OD1 ASN A 95 -0.146 -16.783 6.433 1.00 0.00 O ATOM 842 ND2 ASN A 95 -0.882 -16.453 4.405 1.00 0.00 N ATOM 0 H ASN A 95 0.118 -13.865 8.210 1.00 0.00 H new ATOM 0 HA ASN A 95 -0.575 -13.426 5.361 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -2.181 -15.303 7.159 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -2.578 -14.854 5.512 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -0.296 -17.206 4.046 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -1.484 -15.929 3.770 1.00 0.00 H new ATOM 849 N ASN A 96 -2.951 -12.975 7.415 1.00 0.00 N ATOM 850 CA ASN A 96 -3.827 -11.948 8.049 1.00 0.00 C ATOM 851 C ASN A 96 -3.935 -10.725 7.134 1.00 0.00 C ATOM 852 O ASN A 96 -3.462 -10.729 6.015 1.00 0.00 O ATOM 853 CB ASN A 96 -3.230 -11.528 9.394 1.00 0.00 C ATOM 854 CG ASN A 96 -3.447 -12.641 10.420 1.00 0.00 C ATOM 855 OD1 ASN A 96 -2.678 -13.579 10.489 1.00 0.00 O ATOM 856 ND2 ASN A 96 -4.470 -12.577 11.228 1.00 0.00 N ATOM 0 H ASN A 96 -3.353 -13.911 7.358 1.00 0.00 H new ATOM 0 HA ASN A 96 -4.820 -12.369 8.206 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -2.165 -11.324 9.283 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -3.697 -10.605 9.739 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -4.623 -13.314 11.916 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -5.116 -11.790 11.171 1.00 0.00 H new ATOM 863 N MET A 97 -4.557 -9.677 7.607 1.00 0.00 N ATOM 864 CA MET A 97 -4.705 -8.442 6.779 1.00 0.00 C ATOM 865 C MET A 97 -4.617 -7.219 7.694 1.00 0.00 C ATOM 866 O MET A 97 -3.662 -6.469 7.652 1.00 0.00 O ATOM 867 CB MET A 97 -6.067 -8.464 6.072 1.00 0.00 C ATOM 868 CG MET A 97 -6.230 -7.218 5.191 1.00 0.00 C ATOM 869 SD MET A 97 -4.978 -7.224 3.881 1.00 0.00 S ATOM 870 CE MET A 97 -4.895 -5.434 3.617 1.00 0.00 C ATOM 0 H MET A 97 -4.972 -9.623 8.537 1.00 0.00 H new ATOM 0 HA MET A 97 -3.914 -8.397 6.031 1.00 0.00 H new ATOM 0 HB2 MET A 97 -6.153 -9.363 5.462 1.00 0.00 H new ATOM 0 HB3 MET A 97 -6.867 -8.503 6.811 1.00 0.00 H new ATOM 0 HG2 MET A 97 -7.228 -7.199 4.753 1.00 0.00 H new ATOM 0 HG3 MET A 97 -6.131 -6.317 5.797 1.00 0.00 H new ATOM 0 HE1 MET A 97 -5.131 -5.208 2.577 1.00 0.00 H new ATOM 0 HE2 MET A 97 -5.614 -4.936 4.268 1.00 0.00 H new ATOM 0 HE3 MET A 97 -3.891 -5.079 3.847 1.00 0.00 H new ATOM 880 N ALA A 98 -5.602 -7.015 8.528 1.00 0.00 N ATOM 881 CA ALA A 98 -5.567 -5.843 9.449 1.00 0.00 C ATOM 882 C ALA A 98 -4.210 -5.798 10.153 1.00 0.00 C ATOM 883 O ALA A 98 -3.837 -4.805 10.745 1.00 0.00 O ATOM 884 CB ALA A 98 -6.678 -5.977 10.491 1.00 0.00 C ATOM 0 H ALA A 98 -6.428 -7.608 8.611 1.00 0.00 H new ATOM 0 HA ALA A 98 -5.716 -4.926 8.880 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -6.651 -5.120 11.164 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -7.645 -6.015 9.989 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -6.531 -6.892 11.064 1.00 0.00 H new ATOM 890 N SER A 99 -3.461 -6.866 10.083 1.00 0.00 N ATOM 891 CA SER A 99 -2.124 -6.880 10.735 1.00 0.00 C ATOM 892 C SER A 99 -1.136 -6.143 9.836 1.00 0.00 C ATOM 893 O SER A 99 -0.441 -5.242 10.263 1.00 0.00 O ATOM 894 CB SER A 99 -1.663 -8.325 10.931 1.00 0.00 C ATOM 895 OG SER A 99 -2.565 -8.991 11.806 1.00 0.00 O ATOM 0 H SER A 99 -3.719 -7.728 9.602 1.00 0.00 H new ATOM 0 HA SER A 99 -2.178 -6.391 11.708 1.00 0.00 H new ATOM 0 HB2 SER A 99 -1.623 -8.840 9.971 1.00 0.00 H new ATOM 0 HB3 SER A 99 -0.655 -8.344 11.345 1.00 0.00 H new ATOM 0 HG SER A 99 -2.274 -9.918 11.933 1.00 0.00 H new ATOM 901 N PHE A 100 -1.075 -6.506 8.586 1.00 0.00 N ATOM 902 CA PHE A 100 -0.139 -5.809 7.669 1.00 0.00 C ATOM 903 C PHE A 100 -0.426 -4.308 7.735 1.00 0.00 C ATOM 904 O PHE A 100 0.470 -3.501 7.878 1.00 0.00 O ATOM 905 CB PHE A 100 -0.340 -6.315 6.236 1.00 0.00 C ATOM 906 CG PHE A 100 0.480 -5.465 5.286 1.00 0.00 C ATOM 907 CD1 PHE A 100 1.880 -5.398 5.433 1.00 0.00 C ATOM 908 CD2 PHE A 100 -0.155 -4.729 4.266 1.00 0.00 C ATOM 909 CE1 PHE A 100 2.642 -4.595 4.564 1.00 0.00 C ATOM 910 CE2 PHE A 100 0.608 -3.930 3.394 1.00 0.00 C ATOM 911 CZ PHE A 100 2.008 -3.863 3.545 1.00 0.00 C ATOM 0 H PHE A 100 -1.630 -7.251 8.164 1.00 0.00 H new ATOM 0 HA PHE A 100 0.891 -6.006 7.966 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -0.038 -7.360 6.161 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -1.395 -6.268 5.966 1.00 0.00 H new ATOM 0 HD1 PHE A 100 2.368 -5.963 6.213 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -1.228 -4.778 4.153 1.00 0.00 H new ATOM 0 HE1 PHE A 100 3.714 -4.541 4.680 1.00 0.00 H new ATOM 0 HE2 PHE A 100 0.121 -3.369 2.610 1.00 0.00 H new ATOM 0 HZ PHE A 100 2.594 -3.249 2.877 1.00 0.00 H new ATOM 921 N ILE A 101 -1.673 -3.930 7.646 1.00 0.00 N ATOM 922 CA ILE A 101 -2.010 -2.483 7.721 1.00 0.00 C ATOM 923 C ILE A 101 -1.457 -1.927 9.032 1.00 0.00 C ATOM 924 O ILE A 101 -1.046 -0.786 9.104 1.00 0.00 O ATOM 925 CB ILE A 101 -3.536 -2.306 7.638 1.00 0.00 C ATOM 926 CG1 ILE A 101 -3.995 -2.793 6.255 1.00 0.00 C ATOM 927 CG2 ILE A 101 -3.922 -0.828 7.824 1.00 0.00 C ATOM 928 CD1 ILE A 101 -5.463 -2.427 6.012 1.00 0.00 C ATOM 0 H ILE A 101 -2.467 -4.558 7.525 1.00 0.00 H new ATOM 0 HA ILE A 101 -1.565 -1.938 6.889 1.00 0.00 H new ATOM 0 HB ILE A 101 -4.018 -2.882 8.428 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -3.371 -2.346 5.481 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -3.868 -3.873 6.184 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -5.005 -0.724 7.762 1.00 0.00 H new ATOM 0 HG22 ILE A 101 -3.580 -0.483 8.800 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -3.455 -0.229 7.042 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -5.768 -2.781 5.027 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -6.086 -2.895 6.775 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -5.581 -1.345 6.061 1.00 0.00 H new ATOM 940 N ARG A 102 -1.415 -2.726 10.067 1.00 0.00 N ATOM 941 CA ARG A 102 -0.855 -2.226 11.354 1.00 0.00 C ATOM 942 C ARG A 102 0.522 -1.629 11.064 1.00 0.00 C ATOM 943 O ARG A 102 0.890 -0.592 11.580 1.00 0.00 O ATOM 944 CB ARG A 102 -0.720 -3.388 12.354 1.00 0.00 C ATOM 945 CG ARG A 102 -0.600 -2.841 13.790 1.00 0.00 C ATOM 946 CD ARG A 102 -1.993 -2.638 14.395 1.00 0.00 C ATOM 947 NE ARG A 102 -1.863 -1.967 15.719 1.00 0.00 N ATOM 948 CZ ARG A 102 -2.912 -1.436 16.288 1.00 0.00 C ATOM 949 NH1 ARG A 102 -4.075 -1.499 15.699 1.00 0.00 N ATOM 950 NH2 ARG A 102 -2.797 -0.844 17.445 1.00 0.00 N ATOM 0 H ARG A 102 -1.741 -3.692 10.076 1.00 0.00 H new ATOM 0 HA ARG A 102 -1.514 -1.474 11.788 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -1.586 -4.045 12.278 1.00 0.00 H new ATOM 0 HB3 ARG A 102 0.157 -3.987 12.111 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -0.026 -3.534 14.405 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -0.057 -1.896 13.783 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -2.607 -2.034 13.727 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -2.496 -3.598 14.509 1.00 0.00 H new ATOM 0 HE ARG A 102 -0.955 -1.922 16.181 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -4.164 -1.963 14.795 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -4.895 -1.085 16.143 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -1.888 -0.796 17.905 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -3.616 -0.429 17.889 1.00 0.00 H new ATOM 964 N GLN A 103 1.275 -2.278 10.217 1.00 0.00 N ATOM 965 CA GLN A 103 2.619 -1.759 9.857 1.00 0.00 C ATOM 966 C GLN A 103 2.453 -0.453 9.081 1.00 0.00 C ATOM 967 O GLN A 103 3.206 0.485 9.253 1.00 0.00 O ATOM 968 CB GLN A 103 3.340 -2.793 8.988 1.00 0.00 C ATOM 969 CG GLN A 103 3.121 -4.191 9.570 1.00 0.00 C ATOM 970 CD GLN A 103 4.104 -5.172 8.925 1.00 0.00 C ATOM 971 OE1 GLN A 103 4.771 -4.839 7.966 1.00 0.00 O ATOM 972 NE2 GLN A 103 4.221 -6.377 9.414 1.00 0.00 N ATOM 0 H GLN A 103 1.012 -3.150 9.758 1.00 0.00 H new ATOM 0 HA GLN A 103 3.206 -1.575 10.757 1.00 0.00 H new ATOM 0 HB2 GLN A 103 2.964 -2.750 7.966 1.00 0.00 H new ATOM 0 HB3 GLN A 103 4.406 -2.568 8.945 1.00 0.00 H new ATOM 0 HG2 GLN A 103 3.264 -4.173 10.650 1.00 0.00 H new ATOM 0 HG3 GLN A 103 2.096 -4.515 9.390 1.00 0.00 H new ATOM 0 HE21 GLN A 103 3.661 -6.657 10.219 1.00 0.00 H new ATOM 0 HE22 GLN A 103 4.872 -7.038 8.991 1.00 0.00 H new ATOM 981 N LEU A 104 1.466 -0.383 8.229 1.00 0.00 N ATOM 982 CA LEU A 104 1.244 0.863 7.446 1.00 0.00 C ATOM 983 C LEU A 104 0.834 1.990 8.396 1.00 0.00 C ATOM 984 O LEU A 104 1.209 3.131 8.219 1.00 0.00 O ATOM 985 CB LEU A 104 0.140 0.632 6.403 1.00 0.00 C ATOM 986 CG LEU A 104 0.583 -0.407 5.357 1.00 0.00 C ATOM 987 CD1 LEU A 104 -0.529 -0.562 4.317 1.00 0.00 C ATOM 988 CD2 LEU A 104 1.881 0.049 4.653 1.00 0.00 C ATOM 0 H LEU A 104 0.804 -1.136 8.042 1.00 0.00 H new ATOM 0 HA LEU A 104 2.164 1.139 6.931 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -0.769 0.291 6.899 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -0.101 1.573 5.908 1.00 0.00 H new ATOM 0 HG LEU A 104 0.774 -1.357 5.855 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -0.228 -1.296 3.569 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -1.442 -0.898 4.808 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -0.710 0.397 3.832 1.00 0.00 H new ATOM 0 HD21 LEU A 104 2.178 -0.699 3.917 1.00 0.00 H new ATOM 0 HD22 LEU A 104 1.708 1.002 4.153 1.00 0.00 H new ATOM 0 HD23 LEU A 104 2.674 0.166 5.392 1.00 0.00 H new ATOM 1000 N ASN A 105 0.076 1.689 9.409 1.00 0.00 N ATOM 1001 CA ASN A 105 -0.340 2.759 10.358 1.00 0.00 C ATOM 1002 C ASN A 105 0.806 3.061 11.326 1.00 0.00 C ATOM 1003 O ASN A 105 0.802 4.067 12.008 1.00 0.00 O ATOM 1004 CB ASN A 105 -1.568 2.297 11.144 1.00 0.00 C ATOM 1005 CG ASN A 105 -2.190 3.491 11.869 1.00 0.00 C ATOM 1006 OD1 ASN A 105 -1.529 4.481 12.111 1.00 0.00 O ATOM 1007 ND2 ASN A 105 -3.444 3.439 12.230 1.00 0.00 N ATOM 0 H ASN A 105 -0.273 0.755 9.622 1.00 0.00 H new ATOM 0 HA ASN A 105 -0.587 3.662 9.799 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -2.297 1.848 10.469 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -1.284 1.529 11.863 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -3.868 4.230 12.715 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -3.999 2.608 12.027 1.00 0.00 H new ATOM 1014 N MET A 106 1.789 2.201 11.395 1.00 0.00 N ATOM 1015 CA MET A 106 2.933 2.452 12.323 1.00 0.00 C ATOM 1016 C MET A 106 4.020 3.249 11.590 1.00 0.00 C ATOM 1017 O MET A 106 4.760 3.996 12.199 1.00 0.00 O ATOM 1018 CB MET A 106 3.504 1.109 12.822 1.00 0.00 C ATOM 1019 CG MET A 106 2.658 0.578 13.993 1.00 0.00 C ATOM 1020 SD MET A 106 3.511 -0.810 14.789 1.00 0.00 S ATOM 1021 CE MET A 106 3.268 -2.054 13.496 1.00 0.00 C ATOM 0 H MET A 106 1.850 1.340 10.852 1.00 0.00 H new ATOM 0 HA MET A 106 2.586 3.027 13.182 1.00 0.00 H new ATOM 0 HB2 MET A 106 3.510 0.383 12.009 1.00 0.00 H new ATOM 0 HB3 MET A 106 4.538 1.240 13.140 1.00 0.00 H new ATOM 0 HG2 MET A 106 2.484 1.373 14.718 1.00 0.00 H new ATOM 0 HG3 MET A 106 1.681 0.257 13.631 1.00 0.00 H new ATOM 0 HE1 MET A 106 3.397 -3.050 13.920 1.00 0.00 H new ATOM 0 HE2 MET A 106 2.262 -1.961 13.086 1.00 0.00 H new ATOM 0 HE3 MET A 106 3.999 -1.901 12.702 1.00 0.00 H new ATOM 1031 N TYR A 107 4.124 3.114 10.291 1.00 0.00 N ATOM 1032 CA TYR A 107 5.163 3.889 9.557 1.00 0.00 C ATOM 1033 C TYR A 107 4.667 5.324 9.344 1.00 0.00 C ATOM 1034 O TYR A 107 5.418 6.267 9.501 1.00 0.00 O ATOM 1035 CB TYR A 107 5.462 3.243 8.197 1.00 0.00 C ATOM 1036 CG TYR A 107 5.803 1.766 8.347 1.00 0.00 C ATOM 1037 CD1 TYR A 107 6.768 1.335 9.288 1.00 0.00 C ATOM 1038 CD2 TYR A 107 5.157 0.815 7.531 1.00 0.00 C ATOM 1039 CE1 TYR A 107 7.074 -0.035 9.406 1.00 0.00 C ATOM 1040 CE2 TYR A 107 5.463 -0.551 7.650 1.00 0.00 C ATOM 1041 CZ TYR A 107 6.422 -0.977 8.588 1.00 0.00 C ATOM 1042 OH TYR A 107 6.723 -2.319 8.707 1.00 0.00 O ATOM 0 H TYR A 107 3.540 2.507 9.715 1.00 0.00 H new ATOM 0 HA TYR A 107 6.079 3.895 10.147 1.00 0.00 H new ATOM 0 HB2 TYR A 107 4.598 3.354 7.542 1.00 0.00 H new ATOM 0 HB3 TYR A 107 6.293 3.763 7.720 1.00 0.00 H new ATOM 0 HD1 TYR A 107 7.270 2.056 9.916 1.00 0.00 H new ATOM 0 HD2 TYR A 107 4.422 1.139 6.809 1.00 0.00 H new ATOM 0 HE1 TYR A 107 7.810 -0.363 10.125 1.00 0.00 H new ATOM 0 HE2 TYR A 107 4.963 -1.274 7.022 1.00 0.00 H new ATOM 0 HH TYR A 107 6.992 -2.513 9.629 1.00 0.00 H new ATOM 1052 N GLY A 108 3.408 5.509 9.006 1.00 0.00 N ATOM 1053 CA GLY A 108 2.883 6.902 8.808 1.00 0.00 C ATOM 1054 C GLY A 108 1.967 6.970 7.580 1.00 0.00 C ATOM 1055 O GLY A 108 1.782 8.021 7.000 1.00 0.00 O ATOM 0 H GLY A 108 2.728 4.763 8.860 1.00 0.00 H new ATOM 0 HA2 GLY A 108 2.334 7.218 9.695 1.00 0.00 H new ATOM 0 HA3 GLY A 108 3.715 7.595 8.685 1.00 0.00 H new ATOM 1059 N PHE A 109 1.384 5.875 7.179 1.00 0.00 N ATOM 1060 CA PHE A 109 0.479 5.914 5.994 1.00 0.00 C ATOM 1061 C PHE A 109 -0.889 6.450 6.426 1.00 0.00 C ATOM 1062 O PHE A 109 -1.174 6.577 7.601 1.00 0.00 O ATOM 1063 CB PHE A 109 0.310 4.501 5.432 1.00 0.00 C ATOM 1064 CG PHE A 109 1.540 4.098 4.649 1.00 0.00 C ATOM 1065 CD1 PHE A 109 2.639 3.520 5.312 1.00 0.00 C ATOM 1066 CD2 PHE A 109 1.585 4.292 3.255 1.00 0.00 C ATOM 1067 CE1 PHE A 109 3.780 3.135 4.583 1.00 0.00 C ATOM 1068 CE2 PHE A 109 2.730 3.909 2.527 1.00 0.00 C ATOM 1069 CZ PHE A 109 3.826 3.330 3.192 1.00 0.00 C ATOM 0 H PHE A 109 1.493 4.960 7.616 1.00 0.00 H new ATOM 0 HA PHE A 109 0.907 6.561 5.229 1.00 0.00 H new ATOM 0 HB2 PHE A 109 0.141 3.796 6.246 1.00 0.00 H new ATOM 0 HB3 PHE A 109 -0.569 4.461 4.788 1.00 0.00 H new ATOM 0 HD1 PHE A 109 2.607 3.372 6.381 1.00 0.00 H new ATOM 0 HD2 PHE A 109 0.743 4.734 2.744 1.00 0.00 H new ATOM 0 HE1 PHE A 109 4.621 2.689 5.093 1.00 0.00 H new ATOM 0 HE2 PHE A 109 2.766 4.060 1.458 1.00 0.00 H new ATOM 0 HZ PHE A 109 4.702 3.035 2.634 1.00 0.00 H new ATOM 1079 N HIS A 110 -1.740 6.759 5.485 1.00 0.00 N ATOM 1080 CA HIS A 110 -3.097 7.280 5.833 1.00 0.00 C ATOM 1081 C HIS A 110 -4.084 6.879 4.735 1.00 0.00 C ATOM 1082 O HIS A 110 -4.126 7.481 3.680 1.00 0.00 O ATOM 1083 CB HIS A 110 -3.045 8.806 5.941 1.00 0.00 C ATOM 1084 CG HIS A 110 -4.430 9.340 6.187 1.00 0.00 C ATOM 1085 ND1 HIS A 110 -5.478 9.593 5.338 1.00 0.00 N flip ATOM 1086 CD2 HIS A 110 -4.876 9.684 7.453 1.00 0.00 C flip ATOM 1087 CE1 HIS A 110 -6.559 10.087 6.063 1.00 0.00 C flip ATOM 1088 NE2 HIS A 110 -6.143 10.121 7.332 1.00 0.00 N flip ATOM 0 H HIS A 110 -1.554 6.673 4.486 1.00 0.00 H new ATOM 0 HA HIS A 110 -3.419 6.861 6.787 1.00 0.00 H new ATOM 0 HB2 HIS A 110 -2.381 9.101 6.753 1.00 0.00 H new ATOM 0 HB3 HIS A 110 -2.637 9.232 5.024 1.00 0.00 H new ATOM 0 HD2 HIS A 110 -4.310 9.614 8.370 1.00 0.00 H new ATOM 0 HE1 HIS A 110 -7.526 10.380 5.681 1.00 0.00 H new ATOM 0 HE2 HIS A 110 -6.716 10.439 8.114 1.00 0.00 H new ATOM 1096 N LYS A 111 -4.872 5.862 4.963 1.00 0.00 N ATOM 1097 CA LYS A 111 -5.837 5.427 3.919 1.00 0.00 C ATOM 1098 C LYS A 111 -7.056 6.351 3.910 1.00 0.00 C ATOM 1099 O LYS A 111 -7.144 7.290 4.675 1.00 0.00 O ATOM 1100 CB LYS A 111 -6.273 3.972 4.187 1.00 0.00 C ATOM 1101 CG LYS A 111 -7.162 3.854 5.467 1.00 0.00 C ATOM 1102 CD LYS A 111 -8.344 2.898 5.227 1.00 0.00 C ATOM 1103 CE LYS A 111 -7.858 1.447 5.238 1.00 0.00 C ATOM 1104 NZ LYS A 111 -7.756 0.969 6.646 1.00 0.00 N ATOM 0 H LYS A 111 -4.887 5.317 5.825 1.00 0.00 H new ATOM 0 HA LYS A 111 -5.354 5.479 2.943 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -6.825 3.594 3.326 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -5.390 3.344 4.300 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -6.560 3.493 6.301 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -7.536 4.839 5.747 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -9.101 3.042 5.998 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -8.816 3.124 4.271 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -8.548 0.817 4.678 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -6.888 1.373 4.746 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -7.426 -0.017 6.655 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -7.081 1.565 7.167 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -8.690 1.025 7.100 1.00 0.00 H new ATOM 1118 N ILE A 112 -8.006 6.067 3.061 1.00 0.00 N ATOM 1119 CA ILE A 112 -9.243 6.896 2.994 1.00 0.00 C ATOM 1120 C ILE A 112 -10.437 5.963 2.791 1.00 0.00 C ATOM 1121 O ILE A 112 -11.195 6.107 1.853 1.00 0.00 O ATOM 1122 CB ILE A 112 -9.158 7.884 1.818 1.00 0.00 C ATOM 1123 CG1 ILE A 112 -7.786 8.609 1.822 1.00 0.00 C ATOM 1124 CG2 ILE A 112 -10.285 8.918 1.952 1.00 0.00 C ATOM 1125 CD1 ILE A 112 -6.754 7.819 0.992 1.00 0.00 C ATOM 0 H ILE A 112 -7.977 5.287 2.404 1.00 0.00 H new ATOM 0 HA ILE A 112 -9.356 7.464 3.917 1.00 0.00 H new ATOM 0 HB ILE A 112 -9.262 7.337 0.881 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -7.898 9.613 1.413 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -7.430 8.719 2.846 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -10.233 9.623 1.122 1.00 0.00 H new ATOM 0 HG22 ILE A 112 -11.249 8.410 1.936 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -10.175 9.457 2.893 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -5.798 8.343 1.006 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -6.629 6.824 1.419 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -7.104 7.731 -0.036 1.00 0.00 H new ATOM 1137 N THR A 113 -10.608 4.995 3.666 1.00 0.00 N ATOM 1138 CA THR A 113 -11.753 4.039 3.528 1.00 0.00 C ATOM 1139 C THR A 113 -12.391 3.793 4.902 1.00 0.00 C ATOM 1140 O THR A 113 -11.899 4.244 5.918 1.00 0.00 O ATOM 1141 CB THR A 113 -11.253 2.726 2.875 1.00 0.00 C ATOM 1142 OG1 THR A 113 -12.131 2.379 1.815 1.00 0.00 O ATOM 1143 CG2 THR A 113 -11.191 1.552 3.870 1.00 0.00 C ATOM 0 H THR A 113 -10.002 4.828 4.469 1.00 0.00 H new ATOM 0 HA THR A 113 -12.521 4.462 2.881 1.00 0.00 H new ATOM 0 HB THR A 113 -10.240 2.905 2.514 1.00 0.00 H new ATOM 0 HG1 THR A 113 -12.634 3.172 1.535 1.00 0.00 H new ATOM 0 HG21 THR A 113 -10.834 0.659 3.357 1.00 0.00 H new ATOM 0 HG22 THR A 113 -10.509 1.800 4.683 1.00 0.00 H new ATOM 0 HG23 THR A 113 -12.186 1.365 4.275 1.00 0.00 H new ATOM 1151 N SER A 114 -13.485 3.082 4.933 1.00 0.00 N ATOM 1152 CA SER A 114 -14.163 2.803 6.229 1.00 0.00 C ATOM 1153 C SER A 114 -13.131 2.361 7.271 1.00 0.00 C ATOM 1154 O SER A 114 -12.296 1.516 7.015 1.00 0.00 O ATOM 1155 CB SER A 114 -15.194 1.691 6.032 1.00 0.00 C ATOM 1156 OG SER A 114 -15.480 1.089 7.288 1.00 0.00 O ATOM 0 H SER A 114 -13.940 2.681 4.113 1.00 0.00 H new ATOM 0 HA SER A 114 -14.660 3.708 6.578 1.00 0.00 H new ATOM 0 HB2 SER A 114 -16.106 2.098 5.594 1.00 0.00 H new ATOM 0 HB3 SER A 114 -14.812 0.944 5.336 1.00 0.00 H new ATOM 0 HG SER A 114 -16.142 0.377 7.166 1.00 0.00 H new ATOM 1162 N ILE A 115 -13.189 2.927 8.446 1.00 0.00 N ATOM 1163 CA ILE A 115 -12.223 2.552 9.521 1.00 0.00 C ATOM 1164 C ILE A 115 -12.963 2.537 10.861 1.00 0.00 C ATOM 1165 O ILE A 115 -12.464 2.052 11.858 1.00 0.00 O ATOM 1166 CB ILE A 115 -11.085 3.577 9.564 1.00 0.00 C ATOM 1167 CG1 ILE A 115 -10.005 3.105 10.544 1.00 0.00 C ATOM 1168 CG2 ILE A 115 -11.632 4.935 10.014 1.00 0.00 C ATOM 1169 CD1 ILE A 115 -8.790 4.034 10.460 1.00 0.00 C ATOM 0 H ILE A 115 -13.870 3.639 8.710 1.00 0.00 H new ATOM 0 HA ILE A 115 -11.803 1.566 9.322 1.00 0.00 H new ATOM 0 HB ILE A 115 -10.651 3.676 8.569 1.00 0.00 H new ATOM 0 HG12 ILE A 115 -10.400 3.098 11.560 1.00 0.00 H new ATOM 0 HG13 ILE A 115 -9.710 2.082 10.310 1.00 0.00 H new ATOM 0 HG21 ILE A 115 -10.821 5.662 10.044 1.00 0.00 H new ATOM 0 HG22 ILE A 115 -12.395 5.271 9.312 1.00 0.00 H new ATOM 0 HG23 ILE A 115 -12.070 4.840 11.007 1.00 0.00 H new ATOM 0 HD11 ILE A 115 -8.024 3.696 11.158 1.00 0.00 H new ATOM 0 HD12 ILE A 115 -8.389 4.018 9.446 1.00 0.00 H new ATOM 0 HD13 ILE A 115 -9.090 5.050 10.716 1.00 0.00 H new ATOM 1181 N ASP A 116 -14.158 3.063 10.884 1.00 0.00 N ATOM 1182 CA ASP A 116 -14.949 3.084 12.147 1.00 0.00 C ATOM 1183 C ASP A 116 -16.438 3.152 11.802 1.00 0.00 C ATOM 1184 O ASP A 116 -17.284 2.751 12.576 1.00 0.00 O ATOM 1185 CB ASP A 116 -14.558 4.311 12.973 1.00 0.00 C ATOM 1186 CG ASP A 116 -14.485 5.538 12.062 1.00 0.00 C ATOM 1187 OD1 ASP A 116 -14.915 5.433 10.925 1.00 0.00 O ATOM 1188 OD2 ASP A 116 -14.001 6.562 12.516 1.00 0.00 O ATOM 0 H ASP A 116 -14.622 3.481 10.078 1.00 0.00 H new ATOM 0 HA ASP A 116 -14.746 2.182 12.725 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -15.288 4.476 13.766 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -13.595 4.146 13.456 1.00 0.00 H new ATOM 1193 N ASN A 117 -16.762 3.658 10.643 1.00 0.00 N ATOM 1194 CA ASN A 117 -18.195 3.753 10.240 1.00 0.00 C ATOM 1195 C ASN A 117 -18.285 4.222 8.787 1.00 0.00 C ATOM 1196 O ASN A 117 -18.065 5.377 8.482 1.00 0.00 O ATOM 1197 CB ASN A 117 -18.914 4.758 11.145 1.00 0.00 C ATOM 1198 CG ASN A 117 -20.351 4.948 10.656 1.00 0.00 C ATOM 1199 OD1 ASN A 117 -20.841 6.058 10.593 1.00 0.00 O ATOM 1200 ND2 ASN A 117 -21.051 3.905 10.304 1.00 0.00 N ATOM 0 H ASN A 117 -16.095 4.010 9.956 1.00 0.00 H new ATOM 0 HA ASN A 117 -18.666 2.775 10.337 1.00 0.00 H new ATOM 0 HB2 ASN A 117 -18.913 4.401 12.175 1.00 0.00 H new ATOM 0 HB3 ASN A 117 -18.387 5.712 11.138 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -22.010 4.021 9.976 1.00 0.00 H new ATOM 0 HD22 ASN A 117 -20.640 2.973 10.357 1.00 0.00 H new ATOM 1207 N GLY A 118 -18.605 3.334 7.886 1.00 0.00 N ATOM 1208 CA GLY A 118 -18.707 3.733 6.454 1.00 0.00 C ATOM 1209 C GLY A 118 -19.049 2.511 5.599 1.00 0.00 C ATOM 1210 O GLY A 118 -18.917 1.382 6.029 1.00 0.00 O ATOM 0 H GLY A 118 -18.800 2.352 8.079 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -19.474 4.498 6.334 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -17.766 4.170 6.121 1.00 0.00 H new ATOM 1214 N GLY A 119 -19.491 2.728 4.389 1.00 0.00 N ATOM 1215 CA GLY A 119 -19.844 1.581 3.502 1.00 0.00 C ATOM 1216 C GLY A 119 -20.818 2.054 2.420 1.00 0.00 C ATOM 1217 O GLY A 119 -22.012 2.125 2.638 1.00 0.00 O ATOM 0 H GLY A 119 -19.623 3.651 3.976 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -18.944 1.172 3.043 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -20.295 0.780 4.088 1.00 0.00 H new ATOM 1221 N LEU A 120 -20.322 2.381 1.253 1.00 0.00 N ATOM 1222 CA LEU A 120 -21.227 2.850 0.159 1.00 0.00 C ATOM 1223 C LEU A 120 -20.649 2.452 -1.203 1.00 0.00 C ATOM 1224 O LEU A 120 -20.621 1.291 -1.560 1.00 0.00 O ATOM 1225 CB LEU A 120 -21.377 4.379 0.224 1.00 0.00 C ATOM 1226 CG LEU A 120 -19.994 5.058 0.403 1.00 0.00 C ATOM 1227 CD1 LEU A 120 -19.979 6.414 -0.312 1.00 0.00 C ATOM 1228 CD2 LEU A 120 -19.695 5.289 1.893 1.00 0.00 C ATOM 0 H LEU A 120 -19.332 2.344 1.011 1.00 0.00 H new ATOM 0 HA LEU A 120 -22.205 2.385 0.286 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -21.851 4.742 -0.688 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -22.031 4.650 1.053 1.00 0.00 H new ATOM 0 HG LEU A 120 -19.237 4.400 -0.024 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -19.004 6.884 -0.181 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -20.171 6.267 -1.375 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -20.751 7.057 0.111 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -18.721 5.766 1.999 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -20.463 5.932 2.323 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -19.689 4.332 2.415 1.00 0.00 H new ATOM 1240 N ARG A 121 -20.204 3.408 -1.975 1.00 0.00 N ATOM 1241 CA ARG A 121 -19.648 3.087 -3.322 1.00 0.00 C ATOM 1242 C ARG A 121 -18.219 2.549 -3.196 1.00 0.00 C ATOM 1243 O ARG A 121 -17.408 2.719 -4.084 1.00 0.00 O ATOM 1244 CB ARG A 121 -19.637 4.352 -4.181 1.00 0.00 C ATOM 1245 CG ARG A 121 -21.071 4.688 -4.621 1.00 0.00 C ATOM 1246 CD ARG A 121 -21.069 5.874 -5.616 1.00 0.00 C ATOM 1247 NE ARG A 121 -21.886 5.541 -6.832 1.00 0.00 N ATOM 1248 CZ ARG A 121 -21.646 4.475 -7.553 1.00 0.00 C ATOM 1249 NH1 ARG A 121 -20.629 3.707 -7.275 1.00 0.00 N ATOM 1250 NH2 ARG A 121 -22.414 4.193 -8.569 1.00 0.00 N ATOM 0 H ARG A 121 -20.202 4.398 -1.731 1.00 0.00 H new ATOM 0 HA ARG A 121 -20.273 2.325 -3.788 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -19.215 5.183 -3.617 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -19.003 4.205 -5.055 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -21.529 3.815 -5.087 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -21.676 4.938 -3.749 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -21.472 6.763 -5.132 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -20.046 6.108 -5.911 1.00 0.00 H new ATOM 0 HE ARG A 121 -22.648 6.162 -7.103 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -20.016 3.936 -6.492 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -20.447 2.878 -7.840 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -23.199 4.802 -8.800 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -22.230 3.363 -9.133 1.00 0.00 H new ATOM 1264 N PHE A 122 -17.901 1.898 -2.111 1.00 0.00 N ATOM 1265 CA PHE A 122 -16.520 1.353 -1.957 1.00 0.00 C ATOM 1266 C PHE A 122 -16.409 0.042 -2.745 1.00 0.00 C ATOM 1267 O PHE A 122 -17.232 -0.255 -3.587 1.00 0.00 O ATOM 1268 CB PHE A 122 -16.229 1.096 -0.471 1.00 0.00 C ATOM 1269 CG PHE A 122 -15.884 2.400 0.219 1.00 0.00 C ATOM 1270 CD1 PHE A 122 -14.726 3.112 -0.155 1.00 0.00 C ATOM 1271 CD2 PHE A 122 -16.715 2.902 1.240 1.00 0.00 C ATOM 1272 CE1 PHE A 122 -14.402 4.321 0.489 1.00 0.00 C ATOM 1273 CE2 PHE A 122 -16.390 4.111 1.884 1.00 0.00 C ATOM 1274 CZ PHE A 122 -15.235 4.821 1.509 1.00 0.00 C ATOM 0 H PHE A 122 -18.531 1.720 -1.329 1.00 0.00 H new ATOM 0 HA PHE A 122 -15.795 2.071 -2.340 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -17.097 0.641 0.005 1.00 0.00 H new ATOM 0 HB3 PHE A 122 -15.404 0.391 -0.369 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -14.087 2.729 -0.937 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -17.602 2.359 1.529 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -13.515 4.865 0.201 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -17.028 4.494 2.667 1.00 0.00 H new ATOM 0 HZ PHE A 122 -14.987 5.749 2.003 1.00 0.00 H new ATOM 1284 N ASP A 123 -15.395 -0.740 -2.483 1.00 0.00 N ATOM 1285 CA ASP A 123 -15.231 -2.027 -3.222 1.00 0.00 C ATOM 1286 C ASP A 123 -15.093 -1.739 -4.719 1.00 0.00 C ATOM 1287 O ASP A 123 -15.636 -2.441 -5.549 1.00 0.00 O ATOM 1288 CB ASP A 123 -16.449 -2.923 -2.974 1.00 0.00 C ATOM 1289 CG ASP A 123 -16.855 -2.836 -1.502 1.00 0.00 C ATOM 1290 OD1 ASP A 123 -17.609 -1.937 -1.167 1.00 0.00 O ATOM 1291 OD2 ASP A 123 -16.405 -3.671 -0.734 1.00 0.00 O ATOM 0 H ASP A 123 -14.673 -0.543 -1.789 1.00 0.00 H new ATOM 0 HA ASP A 123 -14.336 -2.539 -2.869 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -17.278 -2.612 -3.610 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -16.215 -3.954 -3.237 1.00 0.00 H new ATOM 1296 N ARG A 124 -14.364 -0.712 -5.064 1.00 0.00 N ATOM 1297 CA ARG A 124 -14.173 -0.361 -6.499 1.00 0.00 C ATOM 1298 C ARG A 124 -13.174 0.783 -6.558 1.00 0.00 C ATOM 1299 O ARG A 124 -13.222 1.633 -7.419 1.00 0.00 O ATOM 1300 CB ARG A 124 -15.494 0.092 -7.115 1.00 0.00 C ATOM 1301 CG ARG A 124 -15.349 0.146 -8.652 1.00 0.00 C ATOM 1302 CD ARG A 124 -16.127 1.338 -9.219 1.00 0.00 C ATOM 1303 NE ARG A 124 -15.289 2.566 -9.128 1.00 0.00 N ATOM 1304 CZ ARG A 124 -15.615 3.631 -9.809 1.00 0.00 C ATOM 1305 NH1 ARG A 124 -16.676 3.620 -10.568 1.00 0.00 N ATOM 1306 NH2 ARG A 124 -14.879 4.706 -9.732 1.00 0.00 N ATOM 0 H ARG A 124 -13.888 -0.096 -4.405 1.00 0.00 H new ATOM 0 HA ARG A 124 -13.815 -1.228 -7.054 1.00 0.00 H new ATOM 0 HB2 ARG A 124 -16.293 -0.596 -6.838 1.00 0.00 H new ATOM 0 HB3 ARG A 124 -15.771 1.073 -6.730 1.00 0.00 H new ATOM 0 HG2 ARG A 124 -14.296 0.229 -8.922 1.00 0.00 H new ATOM 0 HG3 ARG A 124 -15.719 -0.780 -9.092 1.00 0.00 H new ATOM 0 HD2 ARG A 124 -16.400 1.147 -10.257 1.00 0.00 H new ATOM 0 HD3 ARG A 124 -17.056 1.477 -8.665 1.00 0.00 H new ATOM 0 HE ARG A 124 -14.460 2.575 -8.533 1.00 0.00 H new ATOM 0 HH11 ARG A 124 -17.251 2.779 -10.629 1.00 0.00 H new ATOM 0 HH12 ARG A 124 -16.931 4.452 -11.100 1.00 0.00 H new ATOM 0 HH21 ARG A 124 -14.049 4.714 -9.140 1.00 0.00 H new ATOM 0 HH22 ARG A 124 -15.134 5.538 -10.264 1.00 0.00 H new ATOM 1320 N ASP A 125 -12.299 0.772 -5.601 1.00 0.00 N ATOM 1321 CA ASP A 125 -11.225 1.799 -5.424 1.00 0.00 C ATOM 1322 C ASP A 125 -11.162 2.120 -3.927 1.00 0.00 C ATOM 1323 O ASP A 125 -11.157 3.264 -3.520 1.00 0.00 O ATOM 1324 CB ASP A 125 -11.500 3.085 -6.231 1.00 0.00 C ATOM 1325 CG ASP A 125 -10.523 4.189 -5.814 1.00 0.00 C ATOM 1326 OD1 ASP A 125 -9.361 3.879 -5.614 1.00 0.00 O ATOM 1327 OD2 ASP A 125 -10.956 5.324 -5.700 1.00 0.00 O ATOM 0 H ASP A 125 -12.280 0.046 -4.884 1.00 0.00 H new ATOM 0 HA ASP A 125 -10.279 1.404 -5.795 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -11.398 2.883 -7.297 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -12.526 3.415 -6.065 1.00 0.00 H new ATOM 1332 N GLU A 126 -11.144 1.099 -3.096 1.00 0.00 N ATOM 1333 CA GLU A 126 -11.112 1.329 -1.616 1.00 0.00 C ATOM 1334 C GLU A 126 -9.687 1.198 -1.071 1.00 0.00 C ATOM 1335 O GLU A 126 -8.793 0.749 -1.747 1.00 0.00 O ATOM 1336 CB GLU A 126 -12.045 0.346 -0.902 1.00 0.00 C ATOM 1337 CG GLU A 126 -11.823 -1.061 -1.431 1.00 0.00 C ATOM 1338 CD GLU A 126 -12.807 -2.021 -0.759 1.00 0.00 C ATOM 1339 OE1 GLU A 126 -13.848 -1.560 -0.322 1.00 0.00 O ATOM 1340 OE2 GLU A 126 -12.500 -3.200 -0.692 1.00 0.00 O ATOM 0 H GLU A 126 -11.150 0.120 -3.381 1.00 0.00 H new ATOM 0 HA GLU A 126 -11.458 2.345 -1.425 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -11.861 0.372 0.172 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -13.083 0.641 -1.055 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -11.961 -1.080 -2.512 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -10.799 -1.377 -1.235 1.00 0.00 H new ATOM 1347 N ILE A 127 -9.488 1.623 0.152 1.00 0.00 N ATOM 1348 CA ILE A 127 -8.142 1.596 0.799 1.00 0.00 C ATOM 1349 C ILE A 127 -7.132 2.220 -0.164 1.00 0.00 C ATOM 1350 O ILE A 127 -6.225 1.593 -0.669 1.00 0.00 O ATOM 1351 CB ILE A 127 -7.757 0.170 1.279 1.00 0.00 C ATOM 1352 CG1 ILE A 127 -6.344 0.183 1.888 1.00 0.00 C ATOM 1353 CG2 ILE A 127 -7.804 -0.861 0.157 1.00 0.00 C ATOM 1354 CD1 ILE A 127 -6.067 -1.136 2.644 1.00 0.00 C ATOM 0 H ILE A 127 -10.227 1.999 0.746 1.00 0.00 H new ATOM 0 HA ILE A 127 -8.151 2.192 1.712 1.00 0.00 H new ATOM 0 HB ILE A 127 -8.495 -0.119 2.028 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -5.603 0.319 1.100 1.00 0.00 H new ATOM 0 HG13 ILE A 127 -6.243 1.028 2.570 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -7.526 -1.839 0.550 1.00 0.00 H new ATOM 0 HG22 ILE A 127 -8.813 -0.908 -0.252 1.00 0.00 H new ATOM 0 HG23 ILE A 127 -7.107 -0.574 -0.630 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -5.063 -1.109 3.068 1.00 0.00 H new ATOM 0 HD12 ILE A 127 -6.796 -1.256 3.445 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -6.146 -1.975 1.953 1.00 0.00 H new ATOM 1366 N GLU A 128 -7.324 3.492 -0.410 1.00 0.00 N ATOM 1367 CA GLU A 128 -6.439 4.260 -1.329 1.00 0.00 C ATOM 1368 C GLU A 128 -5.262 4.840 -0.536 1.00 0.00 C ATOM 1369 O GLU A 128 -5.183 6.032 -0.316 1.00 0.00 O ATOM 1370 CB GLU A 128 -7.247 5.413 -1.939 1.00 0.00 C ATOM 1371 CG GLU A 128 -8.635 4.908 -2.359 1.00 0.00 C ATOM 1372 CD GLU A 128 -9.251 5.872 -3.376 1.00 0.00 C ATOM 1373 OE1 GLU A 128 -8.764 5.912 -4.494 1.00 0.00 O ATOM 1374 OE2 GLU A 128 -10.196 6.554 -3.019 1.00 0.00 O ATOM 0 H GLU A 128 -8.079 4.041 0.001 1.00 0.00 H new ATOM 0 HA GLU A 128 -6.062 3.605 -2.115 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -7.348 6.222 -1.215 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -6.721 5.821 -2.802 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -8.554 3.911 -2.792 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -9.281 4.824 -1.485 1.00 0.00 H new ATOM 1381 N PHE A 129 -4.352 4.014 -0.095 1.00 0.00 N ATOM 1382 CA PHE A 129 -3.194 4.534 0.690 1.00 0.00 C ATOM 1383 C PHE A 129 -2.596 5.755 -0.010 1.00 0.00 C ATOM 1384 O PHE A 129 -2.500 5.808 -1.221 1.00 0.00 O ATOM 1385 CB PHE A 129 -2.128 3.442 0.816 1.00 0.00 C ATOM 1386 CG PHE A 129 -2.540 2.452 1.883 1.00 0.00 C ATOM 1387 CD1 PHE A 129 -2.640 2.868 3.226 1.00 0.00 C ATOM 1388 CD2 PHE A 129 -2.822 1.116 1.539 1.00 0.00 C ATOM 1389 CE1 PHE A 129 -3.024 1.951 4.221 1.00 0.00 C ATOM 1390 CE2 PHE A 129 -3.205 0.199 2.534 1.00 0.00 C ATOM 1391 CZ PHE A 129 -3.307 0.618 3.876 1.00 0.00 C ATOM 0 H PHE A 129 -4.359 3.005 -0.243 1.00 0.00 H new ATOM 0 HA PHE A 129 -3.537 4.824 1.683 1.00 0.00 H new ATOM 0 HB2 PHE A 129 -2.001 2.931 -0.139 1.00 0.00 H new ATOM 0 HB3 PHE A 129 -1.166 3.887 1.070 1.00 0.00 H new ATOM 0 HD1 PHE A 129 -2.422 3.892 3.491 1.00 0.00 H new ATOM 0 HD2 PHE A 129 -2.744 0.795 0.511 1.00 0.00 H new ATOM 0 HE1 PHE A 129 -3.101 2.271 5.250 1.00 0.00 H new ATOM 0 HE2 PHE A 129 -3.421 -0.826 2.270 1.00 0.00 H new ATOM 0 HZ PHE A 129 -3.603 -0.086 4.640 1.00 0.00 H new ATOM 1401 N SER A 130 -2.188 6.740 0.750 1.00 0.00 N ATOM 1402 CA SER A 130 -1.591 7.967 0.144 1.00 0.00 C ATOM 1403 C SER A 130 -0.465 8.480 1.041 1.00 0.00 C ATOM 1404 O SER A 130 -0.681 9.258 1.949 1.00 0.00 O ATOM 1405 CB SER A 130 -2.666 9.044 0.006 1.00 0.00 C ATOM 1406 OG SER A 130 -2.080 10.229 -0.517 1.00 0.00 O ATOM 0 H SER A 130 -2.243 6.746 1.768 1.00 0.00 H new ATOM 0 HA SER A 130 -1.191 7.728 -0.841 1.00 0.00 H new ATOM 0 HB2 SER A 130 -3.462 8.697 -0.653 1.00 0.00 H new ATOM 0 HB3 SER A 130 -3.120 9.247 0.976 1.00 0.00 H new ATOM 0 HG SER A 130 -2.768 10.921 -0.608 1.00 0.00 H new ATOM 1412 N HIS A 131 0.740 8.043 0.789 1.00 0.00 N ATOM 1413 CA HIS A 131 1.902 8.489 1.613 1.00 0.00 C ATOM 1414 C HIS A 131 2.637 9.624 0.862 1.00 0.00 C ATOM 1415 O HIS A 131 2.988 9.432 -0.281 1.00 0.00 O ATOM 1416 CB HIS A 131 2.853 7.295 1.777 1.00 0.00 C ATOM 1417 CG HIS A 131 3.735 7.486 2.980 1.00 0.00 C ATOM 1418 ND1 HIS A 131 4.503 8.624 3.165 1.00 0.00 N ATOM 1419 CD2 HIS A 131 3.986 6.683 4.062 1.00 0.00 C ATOM 1420 CE1 HIS A 131 5.175 8.475 4.322 1.00 0.00 C ATOM 1421 NE2 HIS A 131 4.895 7.309 4.910 1.00 0.00 N ATOM 0 H HIS A 131 0.971 7.390 0.040 1.00 0.00 H new ATOM 0 HA HIS A 131 1.571 8.848 2.588 1.00 0.00 H new ATOM 0 HB2 HIS A 131 2.277 6.376 1.883 1.00 0.00 H new ATOM 0 HB3 HIS A 131 3.466 7.185 0.883 1.00 0.00 H new ATOM 0 HD2 HIS A 131 3.545 5.712 4.231 1.00 0.00 H new ATOM 0 HE1 HIS A 131 5.857 9.209 4.725 1.00 0.00 H new ATOM 0 HE2 HIS A 131 5.267 6.954 5.791 1.00 0.00 H new ATOM 1429 N PRO A 132 2.871 10.770 1.484 1.00 0.00 N ATOM 1430 CA PRO A 132 3.579 11.867 0.791 1.00 0.00 C ATOM 1431 C PRO A 132 5.017 11.441 0.430 1.00 0.00 C ATOM 1432 O PRO A 132 5.847 12.267 0.107 1.00 0.00 O ATOM 1433 CB PRO A 132 3.584 13.042 1.799 1.00 0.00 C ATOM 1434 CG PRO A 132 2.975 12.517 3.131 1.00 0.00 C ATOM 1435 CD PRO A 132 2.465 11.081 2.875 1.00 0.00 C ATOM 0 HA PRO A 132 3.096 12.141 -0.147 1.00 0.00 H new ATOM 0 HB2 PRO A 132 4.599 13.406 1.959 1.00 0.00 H new ATOM 0 HB3 PRO A 132 3.002 13.879 1.415 1.00 0.00 H new ATOM 0 HG2 PRO A 132 3.724 12.522 3.923 1.00 0.00 H new ATOM 0 HG3 PRO A 132 2.159 13.161 3.459 1.00 0.00 H new ATOM 0 HD2 PRO A 132 2.903 10.375 3.581 1.00 0.00 H new ATOM 0 HD3 PRO A 132 1.383 11.020 2.993 1.00 0.00 H new ATOM 1443 N PHE A 133 5.326 10.166 0.487 1.00 0.00 N ATOM 1444 CA PHE A 133 6.715 9.715 0.154 1.00 0.00 C ATOM 1445 C PHE A 133 6.674 8.345 -0.532 1.00 0.00 C ATOM 1446 O PHE A 133 7.224 7.375 -0.048 1.00 0.00 O ATOM 1447 CB PHE A 133 7.538 9.623 1.444 1.00 0.00 C ATOM 1448 CG PHE A 133 7.966 11.009 1.868 1.00 0.00 C ATOM 1449 CD1 PHE A 133 7.071 11.841 2.566 1.00 0.00 C ATOM 1450 CD2 PHE A 133 9.263 11.466 1.565 1.00 0.00 C ATOM 1451 CE1 PHE A 133 7.472 13.132 2.962 1.00 0.00 C ATOM 1452 CE2 PHE A 133 9.665 12.757 1.960 1.00 0.00 C ATOM 1453 CZ PHE A 133 8.769 13.590 2.659 1.00 0.00 C ATOM 0 H PHE A 133 4.679 9.422 0.749 1.00 0.00 H new ATOM 0 HA PHE A 133 7.174 10.434 -0.525 1.00 0.00 H new ATOM 0 HB2 PHE A 133 6.948 9.156 2.232 1.00 0.00 H new ATOM 0 HB3 PHE A 133 8.413 8.993 1.286 1.00 0.00 H new ATOM 0 HD1 PHE A 133 6.076 11.490 2.798 1.00 0.00 H new ATOM 0 HD2 PHE A 133 9.950 10.827 1.030 1.00 0.00 H new ATOM 0 HE1 PHE A 133 6.785 13.770 3.498 1.00 0.00 H new ATOM 0 HE2 PHE A 133 10.659 13.108 1.727 1.00 0.00 H new ATOM 0 HZ PHE A 133 9.077 14.580 2.962 1.00 0.00 H new ATOM 1463 N PHE A 134 6.039 8.270 -1.669 1.00 0.00 N ATOM 1464 CA PHE A 134 5.967 6.983 -2.423 1.00 0.00 C ATOM 1465 C PHE A 134 5.842 7.316 -3.911 1.00 0.00 C ATOM 1466 O PHE A 134 5.112 6.685 -4.649 1.00 0.00 O ATOM 1467 CB PHE A 134 4.748 6.173 -1.953 1.00 0.00 C ATOM 1468 CG PHE A 134 4.938 4.711 -2.290 1.00 0.00 C ATOM 1469 CD1 PHE A 134 5.785 3.912 -1.498 1.00 0.00 C ATOM 1470 CD2 PHE A 134 4.270 4.147 -3.393 1.00 0.00 C ATOM 1471 CE1 PHE A 134 5.964 2.549 -1.809 1.00 0.00 C ATOM 1472 CE2 PHE A 134 4.448 2.785 -3.705 1.00 0.00 C ATOM 1473 CZ PHE A 134 5.295 1.987 -2.912 1.00 0.00 C ATOM 0 H PHE A 134 5.561 9.054 -2.114 1.00 0.00 H new ATOM 0 HA PHE A 134 6.861 6.385 -2.248 1.00 0.00 H new ATOM 0 HB2 PHE A 134 4.614 6.293 -0.878 1.00 0.00 H new ATOM 0 HB3 PHE A 134 3.844 6.550 -2.431 1.00 0.00 H new ATOM 0 HD1 PHE A 134 6.298 4.344 -0.651 1.00 0.00 H new ATOM 0 HD2 PHE A 134 3.620 4.759 -4.001 1.00 0.00 H new ATOM 0 HE1 PHE A 134 6.614 1.937 -1.201 1.00 0.00 H new ATOM 0 HE2 PHE A 134 3.935 2.353 -4.552 1.00 0.00 H new ATOM 0 HZ PHE A 134 5.431 0.943 -3.151 1.00 0.00 H new ATOM 1483 N LYS A 135 6.543 8.329 -4.340 1.00 0.00 N ATOM 1484 CA LYS A 135 6.482 8.760 -5.766 1.00 0.00 C ATOM 1485 C LYS A 135 7.547 8.015 -6.576 1.00 0.00 C ATOM 1486 O LYS A 135 8.567 7.608 -6.055 1.00 0.00 O ATOM 1487 CB LYS A 135 6.748 10.271 -5.835 1.00 0.00 C ATOM 1488 CG LYS A 135 5.484 11.064 -5.449 1.00 0.00 C ATOM 1489 CD LYS A 135 5.100 10.836 -3.960 1.00 0.00 C ATOM 1490 CE LYS A 135 3.895 9.886 -3.850 1.00 0.00 C ATOM 1491 NZ LYS A 135 3.863 9.276 -2.493 1.00 0.00 N ATOM 0 H LYS A 135 7.165 8.885 -3.754 1.00 0.00 H new ATOM 0 HA LYS A 135 5.499 8.535 -6.180 1.00 0.00 H new ATOM 0 HB2 LYS A 135 7.566 10.532 -5.164 1.00 0.00 H new ATOM 0 HB3 LYS A 135 7.062 10.545 -6.842 1.00 0.00 H new ATOM 0 HG2 LYS A 135 5.653 12.127 -5.624 1.00 0.00 H new ATOM 0 HG3 LYS A 135 4.655 10.763 -6.090 1.00 0.00 H new ATOM 0 HD2 LYS A 135 5.950 10.418 -3.420 1.00 0.00 H new ATOM 0 HD3 LYS A 135 4.862 11.790 -3.490 1.00 0.00 H new ATOM 0 HE2 LYS A 135 2.970 10.432 -4.036 1.00 0.00 H new ATOM 0 HE3 LYS A 135 3.963 9.106 -4.609 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 3.728 8.248 -2.577 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 4.761 9.468 -2.005 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 3.078 9.685 -1.947 1.00 0.00 H new ATOM 1505 N ARG A 136 7.315 7.838 -7.848 1.00 0.00 N ATOM 1506 CA ARG A 136 8.309 7.126 -8.698 1.00 0.00 C ATOM 1507 C ARG A 136 9.628 7.901 -8.672 1.00 0.00 C ATOM 1508 O ARG A 136 10.611 7.455 -8.115 1.00 0.00 O ATOM 1509 CB ARG A 136 7.770 7.042 -10.139 1.00 0.00 C ATOM 1510 CG ARG A 136 8.456 5.905 -10.930 1.00 0.00 C ATOM 1511 CD ARG A 136 9.790 6.382 -11.520 1.00 0.00 C ATOM 1512 NE ARG A 136 9.571 7.612 -12.334 1.00 0.00 N ATOM 1513 CZ ARG A 136 10.587 8.357 -12.679 1.00 0.00 C ATOM 1514 NH1 ARG A 136 11.794 8.024 -12.310 1.00 0.00 N ATOM 1515 NH2 ARG A 136 10.396 9.432 -13.392 1.00 0.00 N ATOM 0 H ARG A 136 6.478 8.157 -8.336 1.00 0.00 H new ATOM 0 HA ARG A 136 8.477 6.117 -8.321 1.00 0.00 H new ATOM 0 HB2 ARG A 136 6.693 6.875 -10.118 1.00 0.00 H new ATOM 0 HB3 ARG A 136 7.935 7.992 -10.647 1.00 0.00 H new ATOM 0 HG2 ARG A 136 8.627 5.051 -10.274 1.00 0.00 H new ATOM 0 HG3 ARG A 136 7.799 5.565 -11.731 1.00 0.00 H new ATOM 0 HD2 ARG A 136 10.500 6.587 -10.719 1.00 0.00 H new ATOM 0 HD3 ARG A 136 10.225 5.598 -12.139 1.00 0.00 H new ATOM 0 HE ARG A 136 8.627 7.872 -12.622 1.00 0.00 H new ATOM 0 HH11 ARG A 136 11.943 7.183 -11.753 1.00 0.00 H new ATOM 0 HH12 ARG A 136 12.588 8.605 -12.579 1.00 0.00 H new ATOM 0 HH21 ARG A 136 9.453 9.692 -13.681 1.00 0.00 H new ATOM 0 HH22 ARG A 136 11.190 10.013 -13.661 1.00 0.00 H new ATOM 1529 N ASN A 137 9.655 9.063 -9.268 1.00 0.00 N ATOM 1530 CA ASN A 137 10.909 9.867 -9.273 1.00 0.00 C ATOM 1531 C ASN A 137 11.435 9.989 -7.842 1.00 0.00 C ATOM 1532 O ASN A 137 10.808 9.543 -6.902 1.00 0.00 O ATOM 1533 CB ASN A 137 10.619 11.261 -9.833 1.00 0.00 C ATOM 1534 CG ASN A 137 11.918 12.066 -9.896 1.00 0.00 C ATOM 1535 OD1 ASN A 137 12.176 12.938 -8.961 1.00 0.00 O flip ATOM 1536 ND2 ASN A 137 12.706 11.900 -10.807 1.00 0.00 N flip ATOM 0 H ASN A 137 8.864 9.489 -9.751 1.00 0.00 H new ATOM 0 HA ASN A 137 11.657 9.376 -9.896 1.00 0.00 H new ATOM 0 HB2 ASN A 137 10.180 11.181 -10.827 1.00 0.00 H new ATOM 0 HB3 ASN A 137 9.891 11.773 -9.203 1.00 0.00 H new ATOM 0 HD21 ASN A 137 12.504 11.218 -11.538 1.00 0.00 H new ATOM 0 HD22 ASN A 137 13.569 12.443 -10.840 1.00 0.00 H new ATOM 1543 N SER A 138 12.582 10.589 -7.667 1.00 0.00 N ATOM 1544 CA SER A 138 13.144 10.737 -6.293 1.00 0.00 C ATOM 1545 C SER A 138 13.050 9.394 -5.549 1.00 0.00 C ATOM 1546 O SER A 138 12.277 9.264 -4.622 1.00 0.00 O ATOM 1547 CB SER A 138 12.341 11.800 -5.536 1.00 0.00 C ATOM 1548 OG SER A 138 10.959 11.640 -5.828 1.00 0.00 O ATOM 0 H SER A 138 13.153 10.982 -8.415 1.00 0.00 H new ATOM 0 HA SER A 138 14.189 11.040 -6.355 1.00 0.00 H new ATOM 0 HB2 SER A 138 12.511 11.706 -4.464 1.00 0.00 H new ATOM 0 HB3 SER A 138 12.673 12.797 -5.825 1.00 0.00 H new ATOM 0 HG SER A 138 10.735 10.686 -5.836 1.00 0.00 H new ATOM 1554 N PRO A 139 13.831 8.424 -5.978 1.00 0.00 N ATOM 1555 CA PRO A 139 13.821 7.090 -5.348 1.00 0.00 C ATOM 1556 C PRO A 139 14.349 7.175 -3.906 1.00 0.00 C ATOM 1557 O PRO A 139 14.450 6.178 -3.217 1.00 0.00 O ATOM 1558 CB PRO A 139 14.749 6.224 -6.236 1.00 0.00 C ATOM 1559 CG PRO A 139 15.358 7.158 -7.324 1.00 0.00 C ATOM 1560 CD PRO A 139 14.771 8.571 -7.111 1.00 0.00 C ATOM 0 HA PRO A 139 12.819 6.667 -5.282 1.00 0.00 H new ATOM 0 HB2 PRO A 139 15.537 5.768 -5.637 1.00 0.00 H new ATOM 0 HB3 PRO A 139 14.189 5.411 -6.698 1.00 0.00 H new ATOM 0 HG2 PRO A 139 16.445 7.179 -7.245 1.00 0.00 H new ATOM 0 HG3 PRO A 139 15.118 6.790 -8.322 1.00 0.00 H new ATOM 0 HD2 PRO A 139 15.554 9.294 -6.884 1.00 0.00 H new ATOM 0 HD3 PRO A 139 14.259 8.926 -8.006 1.00 0.00 H new ATOM 1568 N PHE A 140 14.692 8.350 -3.445 1.00 0.00 N ATOM 1569 CA PHE A 140 15.218 8.476 -2.052 1.00 0.00 C ATOM 1570 C PHE A 140 14.053 8.557 -1.059 1.00 0.00 C ATOM 1571 O PHE A 140 14.214 8.307 0.119 1.00 0.00 O ATOM 1572 CB PHE A 140 16.096 9.733 -1.942 1.00 0.00 C ATOM 1573 CG PHE A 140 15.240 10.982 -1.935 1.00 0.00 C ATOM 1574 CD1 PHE A 140 14.575 11.374 -0.756 1.00 0.00 C ATOM 1575 CD2 PHE A 140 15.112 11.756 -3.104 1.00 0.00 C ATOM 1576 CE1 PHE A 140 13.784 12.538 -0.747 1.00 0.00 C ATOM 1577 CE2 PHE A 140 14.320 12.921 -3.095 1.00 0.00 C ATOM 1578 CZ PHE A 140 13.656 13.311 -1.916 1.00 0.00 C ATOM 0 H PHE A 140 14.631 9.223 -3.969 1.00 0.00 H new ATOM 0 HA PHE A 140 15.821 7.599 -1.815 1.00 0.00 H new ATOM 0 HB2 PHE A 140 16.691 9.689 -1.030 1.00 0.00 H new ATOM 0 HB3 PHE A 140 16.795 9.769 -2.778 1.00 0.00 H new ATOM 0 HD1 PHE A 140 14.672 10.781 0.141 1.00 0.00 H new ATOM 0 HD2 PHE A 140 15.621 11.456 -4.008 1.00 0.00 H new ATOM 0 HE1 PHE A 140 13.275 12.838 0.157 1.00 0.00 H new ATOM 0 HE2 PHE A 140 14.222 13.515 -3.992 1.00 0.00 H new ATOM 0 HZ PHE A 140 13.048 14.204 -1.909 1.00 0.00 H new ATOM 1588 N LEU A 141 12.883 8.903 -1.522 1.00 0.00 N ATOM 1589 CA LEU A 141 11.716 8.997 -0.598 1.00 0.00 C ATOM 1590 C LEU A 141 11.625 7.714 0.233 1.00 0.00 C ATOM 1591 O LEU A 141 11.135 7.716 1.346 1.00 0.00 O ATOM 1592 CB LEU A 141 10.424 9.170 -1.408 1.00 0.00 C ATOM 1593 CG LEU A 141 10.535 10.397 -2.334 1.00 0.00 C ATOM 1594 CD1 LEU A 141 9.524 10.270 -3.476 1.00 0.00 C ATOM 1595 CD2 LEU A 141 10.237 11.681 -1.550 1.00 0.00 C ATOM 0 H LEU A 141 12.684 9.124 -2.498 1.00 0.00 H new ATOM 0 HA LEU A 141 11.845 9.856 0.061 1.00 0.00 H new ATOM 0 HB2 LEU A 141 10.235 8.275 -2.000 1.00 0.00 H new ATOM 0 HB3 LEU A 141 9.577 9.290 -0.733 1.00 0.00 H new ATOM 0 HG LEU A 141 11.548 10.443 -2.734 1.00 0.00 H new ATOM 0 HD11 LEU A 141 9.603 11.138 -4.130 1.00 0.00 H new ATOM 0 HD12 LEU A 141 9.732 9.365 -4.047 1.00 0.00 H new ATOM 0 HD13 LEU A 141 8.516 10.216 -3.065 1.00 0.00 H new ATOM 0 HD21 LEU A 141 10.319 12.541 -2.215 1.00 0.00 H new ATOM 0 HD22 LEU A 141 9.227 11.632 -1.142 1.00 0.00 H new ATOM 0 HD23 LEU A 141 10.953 11.784 -0.735 1.00 0.00 H new ATOM 1607 N LEU A 142 12.093 6.618 -0.300 1.00 0.00 N ATOM 1608 CA LEU A 142 12.035 5.333 0.451 1.00 0.00 C ATOM 1609 C LEU A 142 12.962 5.404 1.666 1.00 0.00 C ATOM 1610 O LEU A 142 12.582 5.069 2.770 1.00 0.00 O ATOM 1611 CB LEU A 142 12.492 4.196 -0.462 1.00 0.00 C ATOM 1612 CG LEU A 142 11.708 4.232 -1.779 1.00 0.00 C ATOM 1613 CD1 LEU A 142 12.122 3.038 -2.645 1.00 0.00 C ATOM 1614 CD2 LEU A 142 10.200 4.163 -1.492 1.00 0.00 C ATOM 0 H LEU A 142 12.514 6.558 -1.227 1.00 0.00 H new ATOM 0 HA LEU A 142 11.013 5.154 0.784 1.00 0.00 H new ATOM 0 HB2 LEU A 142 13.560 4.287 -0.662 1.00 0.00 H new ATOM 0 HB3 LEU A 142 12.341 3.237 0.034 1.00 0.00 H new ATOM 0 HG LEU A 142 11.927 5.161 -2.306 1.00 0.00 H new ATOM 0 HD11 LEU A 142 11.567 3.059 -3.583 1.00 0.00 H new ATOM 0 HD12 LEU A 142 13.190 3.093 -2.854 1.00 0.00 H new ATOM 0 HD13 LEU A 142 11.904 2.111 -2.115 1.00 0.00 H new ATOM 0 HD21 LEU A 142 9.649 4.189 -2.432 1.00 0.00 H new ATOM 0 HD22 LEU A 142 9.972 3.237 -0.963 1.00 0.00 H new ATOM 0 HD23 LEU A 142 9.907 5.014 -0.876 1.00 0.00 H new ATOM 1626 N ASP A 143 14.180 5.825 1.468 1.00 0.00 N ATOM 1627 CA ASP A 143 15.138 5.909 2.604 1.00 0.00 C ATOM 1628 C ASP A 143 14.745 7.058 3.538 1.00 0.00 C ATOM 1629 O ASP A 143 15.587 7.697 4.138 1.00 0.00 O ATOM 1630 CB ASP A 143 16.549 6.153 2.064 1.00 0.00 C ATOM 1631 CG ASP A 143 16.567 7.442 1.242 1.00 0.00 C ATOM 1632 OD1 ASP A 143 16.041 8.435 1.719 1.00 0.00 O ATOM 1633 OD2 ASP A 143 17.105 7.416 0.147 1.00 0.00 O ATOM 0 H ASP A 143 14.554 6.115 0.565 1.00 0.00 H new ATOM 0 HA ASP A 143 15.114 4.972 3.160 1.00 0.00 H new ATOM 0 HB2 ASP A 143 17.258 6.226 2.889 1.00 0.00 H new ATOM 0 HB3 ASP A 143 16.864 5.312 1.447 1.00 0.00 H new ATOM 1638 N GLN A 144 13.472 7.328 3.670 1.00 0.00 N ATOM 1639 CA GLN A 144 13.021 8.433 4.566 1.00 0.00 C ATOM 1640 C GLN A 144 11.705 8.029 5.238 1.00 0.00 C ATOM 1641 O GLN A 144 10.802 8.826 5.392 1.00 0.00 O ATOM 1642 CB GLN A 144 12.811 9.705 3.734 1.00 0.00 C ATOM 1643 CG GLN A 144 12.804 10.928 4.654 1.00 0.00 C ATOM 1644 CD GLN A 144 12.684 12.201 3.814 1.00 0.00 C ATOM 1645 OE1 GLN A 144 12.894 12.142 2.527 1.00 0.00 O flip ATOM 1646 NE2 GLN A 144 12.394 13.259 4.333 1.00 0.00 N flip ATOM 0 H GLN A 144 12.722 6.828 3.193 1.00 0.00 H new ATOM 0 HA GLN A 144 13.774 8.623 5.330 1.00 0.00 H new ATOM 0 HB2 GLN A 144 13.604 9.801 2.992 1.00 0.00 H new ATOM 0 HB3 GLN A 144 11.869 9.643 3.188 1.00 0.00 H new ATOM 0 HG2 GLN A 144 11.972 10.863 5.355 1.00 0.00 H new ATOM 0 HG3 GLN A 144 13.719 10.956 5.246 1.00 0.00 H new ATOM 0 HE21 GLN A 144 12.230 13.306 5.339 1.00 0.00 H new ATOM 0 HE22 GLN A 144 12.314 14.102 3.764 1.00 0.00 H new ATOM 1655 N ILE A 145 11.591 6.789 5.639 1.00 0.00 N ATOM 1656 CA ILE A 145 10.337 6.318 6.302 1.00 0.00 C ATOM 1657 C ILE A 145 10.693 5.321 7.407 1.00 0.00 C ATOM 1658 O ILE A 145 11.466 4.406 7.204 1.00 0.00 O ATOM 1659 CB ILE A 145 9.441 5.630 5.272 1.00 0.00 C ATOM 1660 CG1 ILE A 145 9.323 6.516 4.027 1.00 0.00 C ATOM 1661 CG2 ILE A 145 8.053 5.402 5.874 1.00 0.00 C ATOM 1662 CD1 ILE A 145 8.346 5.883 3.034 1.00 0.00 C ATOM 0 H ILE A 145 12.316 6.079 5.535 1.00 0.00 H new ATOM 0 HA ILE A 145 9.811 7.171 6.731 1.00 0.00 H new ATOM 0 HB ILE A 145 9.876 4.670 4.994 1.00 0.00 H new ATOM 0 HG12 ILE A 145 8.977 7.511 4.308 1.00 0.00 H new ATOM 0 HG13 ILE A 145 10.301 6.638 3.562 1.00 0.00 H new ATOM 0 HG21 ILE A 145 7.414 4.911 5.140 1.00 0.00 H new ATOM 0 HG22 ILE A 145 8.139 4.771 6.759 1.00 0.00 H new ATOM 0 HG23 ILE A 145 7.615 6.361 6.153 1.00 0.00 H new ATOM 0 HD11 ILE A 145 8.265 6.516 2.150 1.00 0.00 H new ATOM 0 HD12 ILE A 145 8.710 4.898 2.743 1.00 0.00 H new ATOM 0 HD13 ILE A 145 7.366 5.784 3.501 1.00 0.00 H new ATOM 1674 N LYS A 146 10.137 5.492 8.577 1.00 0.00 N ATOM 1675 CA LYS A 146 10.443 4.557 9.698 1.00 0.00 C ATOM 1676 C LYS A 146 9.240 4.473 10.641 1.00 0.00 C ATOM 1677 O LYS A 146 8.173 4.977 10.351 1.00 0.00 O ATOM 1678 CB LYS A 146 11.668 5.063 10.475 1.00 0.00 C ATOM 1679 CG LYS A 146 11.485 6.546 10.876 1.00 0.00 C ATOM 1680 CD LYS A 146 12.040 7.483 9.789 1.00 0.00 C ATOM 1681 CE LYS A 146 12.102 8.910 10.337 1.00 0.00 C ATOM 1682 NZ LYS A 146 12.417 9.854 9.227 1.00 0.00 N ATOM 0 H LYS A 146 9.483 6.241 8.805 1.00 0.00 H new ATOM 0 HA LYS A 146 10.655 3.568 9.292 1.00 0.00 H new ATOM 0 HB2 LYS A 146 11.816 4.455 11.368 1.00 0.00 H new ATOM 0 HB3 LYS A 146 12.564 4.954 9.863 1.00 0.00 H new ATOM 0 HG2 LYS A 146 10.427 6.755 11.036 1.00 0.00 H new ATOM 0 HG3 LYS A 146 11.995 6.737 11.821 1.00 0.00 H new ATOM 0 HD2 LYS A 146 13.033 7.155 9.482 1.00 0.00 H new ATOM 0 HD3 LYS A 146 11.405 7.448 8.904 1.00 0.00 H new ATOM 0 HE2 LYS A 146 11.150 9.176 10.796 1.00 0.00 H new ATOM 0 HE3 LYS A 146 12.862 8.980 11.115 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 12.459 10.825 9.598 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 13.335 9.603 8.808 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 11.676 9.794 8.499 1.00 0.00 H new ATOM 1696 N ARG A 147 9.408 3.841 11.770 1.00 0.00 N ATOM 1697 CA ARG A 147 8.282 3.719 12.739 1.00 0.00 C ATOM 1698 C ARG A 147 8.198 4.995 13.582 1.00 0.00 C ATOM 1699 O ARG A 147 9.052 5.265 14.404 1.00 0.00 O ATOM 1700 CB ARG A 147 8.530 2.508 13.647 1.00 0.00 C ATOM 1701 CG ARG A 147 8.090 1.220 12.927 1.00 0.00 C ATOM 1702 CD ARG A 147 8.827 0.011 13.512 1.00 0.00 C ATOM 1703 NE ARG A 147 10.155 -0.125 12.847 1.00 0.00 N ATOM 1704 CZ ARG A 147 11.075 -0.889 13.370 1.00 0.00 C ATOM 1705 NH1 ARG A 147 10.836 -1.532 14.480 1.00 0.00 N ATOM 1706 NH2 ARG A 147 12.233 -1.011 12.781 1.00 0.00 N ATOM 0 H ARG A 147 10.280 3.402 12.064 1.00 0.00 H new ATOM 0 HA ARG A 147 7.343 3.582 12.203 1.00 0.00 H new ATOM 0 HB2 ARG A 147 9.587 2.447 13.908 1.00 0.00 H new ATOM 0 HB3 ARG A 147 7.977 2.622 14.580 1.00 0.00 H new ATOM 0 HG2 ARG A 147 7.014 1.085 13.032 1.00 0.00 H new ATOM 0 HG3 ARG A 147 8.298 1.301 11.860 1.00 0.00 H new ATOM 0 HD2 ARG A 147 8.957 0.135 14.587 1.00 0.00 H new ATOM 0 HD3 ARG A 147 8.239 -0.895 13.364 1.00 0.00 H new ATOM 0 HE ARG A 147 10.345 0.380 11.981 1.00 0.00 H new ATOM 0 HH11 ARG A 147 9.930 -1.438 14.939 1.00 0.00 H new ATOM 0 HH12 ARG A 147 11.555 -2.129 14.889 1.00 0.00 H new ATOM 0 HH21 ARG A 147 12.419 -0.509 11.912 1.00 0.00 H new ATOM 0 HH22 ARG A 147 12.952 -1.608 13.189 1.00 0.00 H new ATOM 1720 N LYS A 148 7.171 5.779 13.386 1.00 0.00 N ATOM 1721 CA LYS A 148 7.022 7.036 14.173 1.00 0.00 C ATOM 1722 C LYS A 148 8.361 7.782 14.213 1.00 0.00 C ATOM 1723 O LYS A 148 8.408 8.985 14.378 1.00 0.00 O ATOM 1724 CB LYS A 148 6.577 6.682 15.598 1.00 0.00 C ATOM 1725 CG LYS A 148 5.063 6.397 15.632 1.00 0.00 C ATOM 1726 CD LYS A 148 4.276 7.705 15.796 1.00 0.00 C ATOM 1727 CE LYS A 148 2.790 7.387 15.963 1.00 0.00 C ATOM 1728 NZ LYS A 148 2.298 6.662 14.758 1.00 0.00 N ATOM 0 H LYS A 148 6.427 5.601 12.712 1.00 0.00 H new ATOM 0 HA LYS A 148 6.275 7.678 13.706 1.00 0.00 H new ATOM 0 HB2 LYS A 148 7.126 5.809 15.951 1.00 0.00 H new ATOM 0 HB3 LYS A 148 6.814 7.503 16.275 1.00 0.00 H new ATOM 0 HG2 LYS A 148 4.760 5.896 14.713 1.00 0.00 H new ATOM 0 HG3 LYS A 148 4.832 5.721 16.455 1.00 0.00 H new ATOM 0 HD2 LYS A 148 4.641 8.255 16.663 1.00 0.00 H new ATOM 0 HD3 LYS A 148 4.427 8.344 14.926 1.00 0.00 H new ATOM 0 HE2 LYS A 148 2.635 6.779 16.854 1.00 0.00 H new ATOM 0 HE3 LYS A 148 2.224 8.308 16.103 1.00 0.00 H new ATOM 0 HZ1 LYS A 148 1.356 7.018 14.499 1.00 0.00 H new ATOM 0 HZ2 LYS A 148 2.956 6.816 13.967 1.00 0.00 H new ATOM 0 HZ3 LYS A 148 2.238 5.645 14.965 1.00 0.00 H new TER 1742 LYS A 148