USER MOD reduce.3.24.130724 H: found=0, std=0, add=769, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 768 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 94 HIS : no HD1:sc= -5.16 X(o=-12,f=-13!) USER MOD Set 1.2: A 96 ASN : amide:sc= -3.63! C(o=-12!,f=-13!) USER MOD Set 1.3: A 99 SER OG : rot 100:sc= -3.5! USER MOD Set 2.1: A 69 THR OG1 : rot -117:sc= -0.451! USER MOD Set 2.2: A 74 SER OG : rot -77:sc= 1.97! USER MOD Set 3.1: A 52 LYS NZ :NH3+ 137:sc= 1.2 (180deg=-0.275) USER MOD Set 3.2: A 91 ASN : amide:sc= -4.05! C(o=-2.8!,f=-9.7!) USER MOD Single : A 62 THR OG1 : rot -66:sc= 0.653 USER MOD Single : A 63 ASN :FLIP amide:sc= 0.403 F(o=-5.8!,f=0.4) USER MOD Single : A 67 CYS SG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.138) USER MOD Single : A 73 GLN : amide:sc= -4.11! C(o=-4.1!,f=-5.7!) USER MOD Single : A 78 GLN : amide:sc= -1.81! C(o=-1.8!,f=-1.7!) USER MOD Single : A 79 ASN : amide:sc= -0.0408 K(o=-0.041,f=-1.6!) USER MOD Single : A 80 GLN : amide:sc= 0 K(o=0,f=-0.68) USER MOD Single : A 82 GLN :FLIP amide:sc= -0.257 F(o=-1.4,f=-0.26) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= -0.011 (180deg=-0.011) USER MOD Single : A 92 TYR OH : rot -67:sc= -1.84 USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 ASN :FLIP amide:sc= -1.85! C(o=-7.5!,f=-1.9!) USER MOD Single : A 97 MET CE :methyl -135:sc= -0.0996 (180deg=-2.2) USER MOD Single : A 103 GLN : amide:sc= -0.166 X(o=-0.17,f=0) USER MOD Single : A 105 ASN :FLIP amide:sc= -0.606 F(o=-3.8!,f=-0.61) USER MOD Single : A 106 MET CE :methyl -153:sc= 0 (180deg=-0.00621) USER MOD Single : A 107 TYR OH : rot 180:sc= -0.117 USER MOD Single : A 110 HIS : no HD1:sc= -0.107 X(o=-0.11,f=-0.03) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD Single : A 131 HIS : no HD1:sc= -1.68 K(o=-1.7,f=-6.9!) USER MOD Single : A 135 LYS NZ :NH3+ -119:sc= -4.39! (180deg=-9.56!) USER MOD Single : A 137 ASN : amide:sc= -0.338 X(o=-0.34,f=-0.00025) USER MOD Single : A 138 SER OG : rot 6:sc= 0.494 USER MOD Single : A 144 GLN :FLIP amide:sc= -11.3! C(o=-22!,f=-11!) USER MOD Single : A 146 LYS NZ :NH3+ -161:sc= -0.0266 (180deg=-0.607) USER MOD Single : A 148 LYS NZ :NH3+ -161:sc= -0.127 (180deg=-0.872) USER MOD ----------------------------------------------------------------- ATOM 26 N VAL A 46 17.778 1.275 -0.960 1.00 0.00 N ATOM 27 CA VAL A 46 16.444 1.104 -0.318 1.00 0.00 C ATOM 28 C VAL A 46 16.355 -0.327 0.261 1.00 0.00 C ATOM 29 O VAL A 46 16.720 -1.263 -0.423 1.00 0.00 O ATOM 30 CB VAL A 46 15.357 1.291 -1.384 1.00 0.00 C ATOM 31 CG1 VAL A 46 13.969 1.233 -0.739 1.00 0.00 C ATOM 32 CG2 VAL A 46 15.543 2.649 -2.064 1.00 0.00 C ATOM 0 HA VAL A 46 16.307 1.835 0.479 1.00 0.00 H new ATOM 0 HB VAL A 46 15.440 0.492 -2.121 1.00 0.00 H new ATOM 0 HG11 VAL A 46 13.206 1.367 -1.506 1.00 0.00 H new ATOM 0 HG12 VAL A 46 13.832 0.265 -0.256 1.00 0.00 H new ATOM 0 HG13 VAL A 46 13.880 2.025 0.004 1.00 0.00 H new ATOM 0 HG21 VAL A 46 14.772 2.785 -2.822 1.00 0.00 H new ATOM 0 HG22 VAL A 46 15.464 3.442 -1.320 1.00 0.00 H new ATOM 0 HG23 VAL A 46 16.525 2.689 -2.534 1.00 0.00 H new ATOM 42 N PRO A 47 15.876 -0.494 1.489 1.00 0.00 N ATOM 43 CA PRO A 47 15.769 -1.845 2.076 1.00 0.00 C ATOM 44 C PRO A 47 14.912 -2.736 1.166 1.00 0.00 C ATOM 45 O PRO A 47 14.410 -2.301 0.149 1.00 0.00 O ATOM 46 CB PRO A 47 15.105 -1.634 3.459 1.00 0.00 C ATOM 47 CG PRO A 47 14.854 -0.108 3.628 1.00 0.00 C ATOM 48 CD PRO A 47 15.413 0.600 2.374 1.00 0.00 C ATOM 0 HA PRO A 47 16.734 -2.341 2.179 1.00 0.00 H new ATOM 0 HB2 PRO A 47 14.167 -2.186 3.523 1.00 0.00 H new ATOM 0 HB3 PRO A 47 15.749 -2.007 4.255 1.00 0.00 H new ATOM 0 HG2 PRO A 47 13.789 0.095 3.739 1.00 0.00 H new ATOM 0 HG3 PRO A 47 15.345 0.263 4.528 1.00 0.00 H new ATOM 0 HD2 PRO A 47 14.647 1.204 1.887 1.00 0.00 H new ATOM 0 HD3 PRO A 47 16.232 1.272 2.632 1.00 0.00 H new ATOM 56 N ALA A 48 14.740 -3.980 1.526 1.00 0.00 N ATOM 57 CA ALA A 48 13.918 -4.891 0.682 1.00 0.00 C ATOM 58 C ALA A 48 12.434 -4.634 0.948 1.00 0.00 C ATOM 59 O ALA A 48 11.656 -4.435 0.038 1.00 0.00 O ATOM 60 CB ALA A 48 14.250 -6.345 1.024 1.00 0.00 C ATOM 0 H ALA A 48 15.133 -4.403 2.367 1.00 0.00 H new ATOM 0 HA ALA A 48 14.138 -4.705 -0.369 1.00 0.00 H new ATOM 0 HB1 ALA A 48 13.648 -7.011 0.406 1.00 0.00 H new ATOM 0 HB2 ALA A 48 15.307 -6.531 0.835 1.00 0.00 H new ATOM 0 HB3 ALA A 48 14.032 -6.530 2.076 1.00 0.00 H new ATOM 66 N PHE A 49 12.035 -4.644 2.192 1.00 0.00 N ATOM 67 CA PHE A 49 10.600 -4.408 2.522 1.00 0.00 C ATOM 68 C PHE A 49 10.072 -3.195 1.750 1.00 0.00 C ATOM 69 O PHE A 49 9.249 -3.319 0.864 1.00 0.00 O ATOM 70 CB PHE A 49 10.458 -4.151 4.023 1.00 0.00 C ATOM 71 CG PHE A 49 9.015 -3.842 4.343 1.00 0.00 C ATOM 72 CD1 PHE A 49 8.122 -4.887 4.643 1.00 0.00 C ATOM 73 CD2 PHE A 49 8.563 -2.508 4.334 1.00 0.00 C ATOM 74 CE1 PHE A 49 6.775 -4.598 4.934 1.00 0.00 C ATOM 75 CE2 PHE A 49 7.216 -2.220 4.626 1.00 0.00 C ATOM 76 CZ PHE A 49 6.322 -3.266 4.926 1.00 0.00 C ATOM 0 H PHE A 49 12.643 -4.806 2.995 1.00 0.00 H new ATOM 0 HA PHE A 49 10.023 -5.289 2.241 1.00 0.00 H new ATOM 0 HB2 PHE A 49 10.788 -5.024 4.586 1.00 0.00 H new ATOM 0 HB3 PHE A 49 11.095 -3.319 4.323 1.00 0.00 H new ATOM 0 HD1 PHE A 49 8.469 -5.910 4.650 1.00 0.00 H new ATOM 0 HD2 PHE A 49 9.249 -1.707 4.103 1.00 0.00 H new ATOM 0 HE1 PHE A 49 6.089 -5.400 5.164 1.00 0.00 H new ATOM 0 HE2 PHE A 49 6.869 -1.197 4.620 1.00 0.00 H new ATOM 0 HZ PHE A 49 5.289 -3.046 5.150 1.00 0.00 H new ATOM 86 N LEU A 50 10.529 -2.021 2.084 1.00 0.00 N ATOM 87 CA LEU A 50 10.042 -0.806 1.375 1.00 0.00 C ATOM 88 C LEU A 50 10.194 -1.006 -0.137 1.00 0.00 C ATOM 89 O LEU A 50 9.311 -0.685 -0.910 1.00 0.00 O ATOM 90 CB LEU A 50 10.860 0.415 1.835 1.00 0.00 C ATOM 91 CG LEU A 50 10.035 1.710 1.665 1.00 0.00 C ATOM 92 CD1 LEU A 50 9.140 1.932 2.890 1.00 0.00 C ATOM 93 CD2 LEU A 50 10.978 2.911 1.516 1.00 0.00 C ATOM 0 H LEU A 50 11.218 -1.850 2.817 1.00 0.00 H new ATOM 0 HA LEU A 50 8.991 -0.637 1.607 1.00 0.00 H new ATOM 0 HB2 LEU A 50 11.149 0.295 2.879 1.00 0.00 H new ATOM 0 HB3 LEU A 50 11.780 0.484 1.255 1.00 0.00 H new ATOM 0 HG LEU A 50 9.415 1.612 0.774 1.00 0.00 H new ATOM 0 HD11 LEU A 50 8.564 2.848 2.758 1.00 0.00 H new ATOM 0 HD12 LEU A 50 8.460 1.088 3.001 1.00 0.00 H new ATOM 0 HD13 LEU A 50 9.760 2.019 3.782 1.00 0.00 H new ATOM 0 HD21 LEU A 50 10.391 3.822 1.396 1.00 0.00 H new ATOM 0 HD22 LEU A 50 11.602 2.996 2.405 1.00 0.00 H new ATOM 0 HD23 LEU A 50 11.611 2.770 0.640 1.00 0.00 H new ATOM 105 N ALA A 51 11.305 -1.540 -0.562 1.00 0.00 N ATOM 106 CA ALA A 51 11.509 -1.765 -2.020 1.00 0.00 C ATOM 107 C ALA A 51 10.559 -2.863 -2.500 1.00 0.00 C ATOM 108 O ALA A 51 10.295 -2.999 -3.678 1.00 0.00 O ATOM 109 CB ALA A 51 12.956 -2.190 -2.277 1.00 0.00 C ATOM 0 H ALA A 51 12.079 -1.830 0.036 1.00 0.00 H new ATOM 0 HA ALA A 51 11.304 -0.842 -2.563 1.00 0.00 H new ATOM 0 HB1 ALA A 51 13.103 -2.354 -3.345 1.00 0.00 H new ATOM 0 HB2 ALA A 51 13.632 -1.407 -1.934 1.00 0.00 H new ATOM 0 HB3 ALA A 51 13.166 -3.113 -1.736 1.00 0.00 H new ATOM 115 N LYS A 52 10.036 -3.645 -1.594 1.00 0.00 N ATOM 116 CA LYS A 52 9.098 -4.728 -2.002 1.00 0.00 C ATOM 117 C LYS A 52 7.807 -4.083 -2.519 1.00 0.00 C ATOM 118 O LYS A 52 7.178 -4.573 -3.433 1.00 0.00 O ATOM 119 CB LYS A 52 8.802 -5.635 -0.782 1.00 0.00 C ATOM 120 CG LYS A 52 8.816 -7.119 -1.193 1.00 0.00 C ATOM 121 CD LYS A 52 10.260 -7.635 -1.265 1.00 0.00 C ATOM 122 CE LYS A 52 10.251 -9.155 -1.433 1.00 0.00 C ATOM 123 NZ LYS A 52 9.591 -9.510 -2.721 1.00 0.00 N ATOM 0 H LYS A 52 10.218 -3.580 -0.592 1.00 0.00 H new ATOM 0 HA LYS A 52 9.537 -5.340 -2.790 1.00 0.00 H new ATOM 0 HB2 LYS A 52 9.545 -5.461 -0.004 1.00 0.00 H new ATOM 0 HB3 LYS A 52 7.831 -5.379 -0.359 1.00 0.00 H new ATOM 0 HG2 LYS A 52 8.247 -7.708 -0.474 1.00 0.00 H new ATOM 0 HG3 LYS A 52 8.330 -7.241 -2.161 1.00 0.00 H new ATOM 0 HD2 LYS A 52 10.783 -7.169 -2.101 1.00 0.00 H new ATOM 0 HD3 LYS A 52 10.801 -7.362 -0.359 1.00 0.00 H new ATOM 0 HE2 LYS A 52 11.271 -9.539 -1.417 1.00 0.00 H new ATOM 0 HE3 LYS A 52 9.722 -9.620 -0.601 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 10.136 -10.257 -3.196 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 8.626 -9.851 -2.534 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 9.549 -8.670 -3.333 1.00 0.00 H new ATOM 137 N LEU A 53 7.414 -2.982 -1.938 1.00 0.00 N ATOM 138 CA LEU A 53 6.171 -2.302 -2.396 1.00 0.00 C ATOM 139 C LEU A 53 6.424 -1.660 -3.761 1.00 0.00 C ATOM 140 O LEU A 53 5.601 -1.723 -4.652 1.00 0.00 O ATOM 141 CB LEU A 53 5.776 -1.213 -1.393 1.00 0.00 C ATOM 142 CG LEU A 53 5.785 -1.781 0.031 1.00 0.00 C ATOM 143 CD1 LEU A 53 5.527 -0.648 1.028 1.00 0.00 C ATOM 144 CD2 LEU A 53 4.688 -2.844 0.173 1.00 0.00 C ATOM 0 H LEU A 53 7.900 -2.525 -1.167 1.00 0.00 H new ATOM 0 HA LEU A 53 5.366 -3.033 -2.472 1.00 0.00 H new ATOM 0 HB2 LEU A 53 6.469 -0.375 -1.463 1.00 0.00 H new ATOM 0 HB3 LEU A 53 4.785 -0.828 -1.633 1.00 0.00 H new ATOM 0 HG LEU A 53 6.755 -2.236 0.233 1.00 0.00 H new ATOM 0 HD11 LEU A 53 5.533 -1.047 2.042 1.00 0.00 H new ATOM 0 HD12 LEU A 53 6.307 0.107 0.931 1.00 0.00 H new ATOM 0 HD13 LEU A 53 4.557 -0.196 0.822 1.00 0.00 H new ATOM 0 HD21 LEU A 53 4.699 -3.245 1.187 1.00 0.00 H new ATOM 0 HD22 LEU A 53 3.716 -2.393 -0.029 1.00 0.00 H new ATOM 0 HD23 LEU A 53 4.869 -3.650 -0.538 1.00 0.00 H new ATOM 156 N TRP A 54 7.557 -1.039 -3.930 1.00 0.00 N ATOM 157 CA TRP A 54 7.862 -0.389 -5.236 1.00 0.00 C ATOM 158 C TRP A 54 7.695 -1.408 -6.370 1.00 0.00 C ATOM 159 O TRP A 54 7.227 -1.082 -7.443 1.00 0.00 O ATOM 160 CB TRP A 54 9.303 0.132 -5.223 1.00 0.00 C ATOM 161 CG TRP A 54 9.500 1.103 -6.345 1.00 0.00 C ATOM 162 CD1 TRP A 54 9.217 2.426 -6.286 1.00 0.00 C ATOM 163 CD2 TRP A 54 10.013 0.851 -7.686 1.00 0.00 C ATOM 164 NE1 TRP A 54 9.524 3.005 -7.505 1.00 0.00 N ATOM 165 CE2 TRP A 54 10.017 2.078 -8.402 1.00 0.00 C ATOM 166 CE3 TRP A 54 10.471 -0.311 -8.347 1.00 0.00 C ATOM 167 CZ2 TRP A 54 10.462 2.150 -9.730 1.00 0.00 C ATOM 168 CZ3 TRP A 54 10.920 -0.245 -9.683 1.00 0.00 C ATOM 169 CH2 TRP A 54 10.915 0.985 -10.373 1.00 0.00 C ATOM 0 H TRP A 54 8.285 -0.953 -3.221 1.00 0.00 H new ATOM 0 HA TRP A 54 7.176 0.443 -5.395 1.00 0.00 H new ATOM 0 HB2 TRP A 54 9.516 0.615 -4.270 1.00 0.00 H new ATOM 0 HB3 TRP A 54 10.001 -0.699 -5.322 1.00 0.00 H new ATOM 0 HD1 TRP A 54 8.817 2.945 -5.427 1.00 0.00 H new ATOM 0 HE1 TRP A 54 9.401 3.996 -7.715 1.00 0.00 H new ATOM 0 HE3 TRP A 54 10.477 -1.257 -7.826 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 10.457 3.094 -10.255 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 11.269 -1.139 -10.179 1.00 0.00 H new ATOM 0 HH2 TRP A 54 11.259 1.032 -11.396 1.00 0.00 H new ATOM 180 N ARG A 55 8.078 -2.637 -6.142 1.00 0.00 N ATOM 181 CA ARG A 55 7.946 -3.678 -7.207 1.00 0.00 C ATOM 182 C ARG A 55 6.607 -4.406 -7.057 1.00 0.00 C ATOM 183 O ARG A 55 5.811 -4.455 -7.973 1.00 0.00 O ATOM 184 CB ARG A 55 9.086 -4.690 -7.072 1.00 0.00 C ATOM 185 CG ARG A 55 10.411 -4.020 -7.437 1.00 0.00 C ATOM 186 CD ARG A 55 11.512 -5.078 -7.522 1.00 0.00 C ATOM 187 NE ARG A 55 12.803 -4.425 -7.879 1.00 0.00 N ATOM 188 CZ ARG A 55 13.926 -5.069 -7.720 1.00 0.00 C ATOM 189 NH1 ARG A 55 13.919 -6.288 -7.253 1.00 0.00 N ATOM 190 NH2 ARG A 55 15.057 -4.497 -8.030 1.00 0.00 N ATOM 0 H ARG A 55 8.477 -2.966 -5.263 1.00 0.00 H new ATOM 0 HA ARG A 55 7.991 -3.199 -8.185 1.00 0.00 H new ATOM 0 HB2 ARG A 55 9.128 -5.071 -6.052 1.00 0.00 H new ATOM 0 HB3 ARG A 55 8.907 -5.544 -7.725 1.00 0.00 H new ATOM 0 HG2 ARG A 55 10.317 -3.500 -8.390 1.00 0.00 H new ATOM 0 HG3 ARG A 55 10.670 -3.270 -6.689 1.00 0.00 H new ATOM 0 HD2 ARG A 55 11.606 -5.597 -6.568 1.00 0.00 H new ATOM 0 HD3 ARG A 55 11.253 -5.828 -8.269 1.00 0.00 H new ATOM 0 HE ARG A 55 12.808 -3.474 -8.248 1.00 0.00 H new ATOM 0 HH11 ARG A 55 13.035 -6.737 -7.012 1.00 0.00 H new ATOM 0 HH12 ARG A 55 14.797 -6.792 -7.129 1.00 0.00 H new ATOM 0 HH21 ARG A 55 15.063 -3.545 -8.397 1.00 0.00 H new ATOM 0 HH22 ARG A 55 15.935 -5.001 -7.905 1.00 0.00 H new ATOM 204 N LEU A 56 6.357 -4.977 -5.908 1.00 0.00 N ATOM 205 CA LEU A 56 5.075 -5.711 -5.692 1.00 0.00 C ATOM 206 C LEU A 56 3.905 -4.880 -6.230 1.00 0.00 C ATOM 207 O LEU A 56 2.858 -5.401 -6.551 1.00 0.00 O ATOM 208 CB LEU A 56 4.887 -5.971 -4.186 1.00 0.00 C ATOM 209 CG LEU A 56 3.666 -6.903 -3.930 1.00 0.00 C ATOM 210 CD1 LEU A 56 3.974 -7.875 -2.785 1.00 0.00 C ATOM 211 CD2 LEU A 56 2.432 -6.073 -3.544 1.00 0.00 C ATOM 0 H LEU A 56 6.988 -4.967 -5.107 1.00 0.00 H new ATOM 0 HA LEU A 56 5.104 -6.663 -6.223 1.00 0.00 H new ATOM 0 HB2 LEU A 56 5.789 -6.426 -3.776 1.00 0.00 H new ATOM 0 HB3 LEU A 56 4.742 -5.025 -3.665 1.00 0.00 H new ATOM 0 HG LEU A 56 3.466 -7.458 -4.847 1.00 0.00 H new ATOM 0 HD11 LEU A 56 3.113 -8.522 -2.615 1.00 0.00 H new ATOM 0 HD12 LEU A 56 4.839 -8.484 -3.048 1.00 0.00 H new ATOM 0 HD13 LEU A 56 4.189 -7.311 -1.877 1.00 0.00 H new ATOM 0 HD21 LEU A 56 1.587 -6.738 -3.368 1.00 0.00 H new ATOM 0 HD22 LEU A 56 2.643 -5.507 -2.637 1.00 0.00 H new ATOM 0 HD23 LEU A 56 2.189 -5.384 -4.353 1.00 0.00 H new ATOM 223 N VAL A 57 4.075 -3.588 -6.336 1.00 0.00 N ATOM 224 CA VAL A 57 2.973 -2.728 -6.860 1.00 0.00 C ATOM 225 C VAL A 57 3.103 -2.611 -8.380 1.00 0.00 C ATOM 226 O VAL A 57 2.122 -2.550 -9.094 1.00 0.00 O ATOM 227 CB VAL A 57 3.066 -1.336 -6.226 1.00 0.00 C ATOM 228 CG1 VAL A 57 2.004 -0.423 -6.842 1.00 0.00 C ATOM 229 CG2 VAL A 57 2.831 -1.444 -4.714 1.00 0.00 C ATOM 0 H VAL A 57 4.929 -3.091 -6.082 1.00 0.00 H new ATOM 0 HA VAL A 57 2.010 -3.173 -6.611 1.00 0.00 H new ATOM 0 HB VAL A 57 4.056 -0.919 -6.411 1.00 0.00 H new ATOM 0 HG11 VAL A 57 2.070 0.567 -6.391 1.00 0.00 H new ATOM 0 HG12 VAL A 57 2.170 -0.345 -7.916 1.00 0.00 H new ATOM 0 HG13 VAL A 57 1.014 -0.840 -6.658 1.00 0.00 H new ATOM 0 HG21 VAL A 57 2.897 -0.454 -4.264 1.00 0.00 H new ATOM 0 HG22 VAL A 57 1.841 -1.861 -4.529 1.00 0.00 H new ATOM 0 HG23 VAL A 57 3.587 -2.094 -4.274 1.00 0.00 H new ATOM 239 N ASP A 58 4.310 -2.585 -8.883 1.00 0.00 N ATOM 240 CA ASP A 58 4.512 -2.476 -10.360 1.00 0.00 C ATOM 241 C ASP A 58 4.689 -3.877 -10.953 1.00 0.00 C ATOM 242 O ASP A 58 4.952 -4.035 -12.128 1.00 0.00 O ATOM 243 CB ASP A 58 5.765 -1.645 -10.642 1.00 0.00 C ATOM 244 CG ASP A 58 5.797 -1.254 -12.120 1.00 0.00 C ATOM 245 OD1 ASP A 58 4.988 -1.777 -12.869 1.00 0.00 O ATOM 246 OD2 ASP A 58 6.629 -0.437 -12.478 1.00 0.00 O ATOM 0 H ASP A 58 5.168 -2.635 -8.333 1.00 0.00 H new ATOM 0 HA ASP A 58 3.645 -1.994 -10.812 1.00 0.00 H new ATOM 0 HB2 ASP A 58 5.769 -0.751 -10.018 1.00 0.00 H new ATOM 0 HB3 ASP A 58 6.658 -2.216 -10.387 1.00 0.00 H new ATOM 251 N ASP A 59 4.548 -4.894 -10.147 1.00 0.00 N ATOM 252 CA ASP A 59 4.712 -6.284 -10.663 1.00 0.00 C ATOM 253 C ASP A 59 3.431 -6.720 -11.379 1.00 0.00 C ATOM 254 O ASP A 59 2.341 -6.325 -11.016 1.00 0.00 O ATOM 255 CB ASP A 59 4.991 -7.232 -9.495 1.00 0.00 C ATOM 256 CG ASP A 59 5.336 -8.621 -10.035 1.00 0.00 C ATOM 257 OD1 ASP A 59 4.415 -9.379 -10.296 1.00 0.00 O ATOM 258 OD2 ASP A 59 6.513 -8.902 -10.180 1.00 0.00 O ATOM 0 H ASP A 59 4.326 -4.823 -9.154 1.00 0.00 H new ATOM 0 HA ASP A 59 5.547 -6.314 -11.364 1.00 0.00 H new ATOM 0 HB2 ASP A 59 5.815 -6.850 -8.892 1.00 0.00 H new ATOM 0 HB3 ASP A 59 4.119 -7.290 -8.844 1.00 0.00 H new ATOM 263 N ALA A 60 3.556 -7.531 -12.395 1.00 0.00 N ATOM 264 CA ALA A 60 2.348 -7.995 -13.136 1.00 0.00 C ATOM 265 C ALA A 60 1.730 -9.190 -12.408 1.00 0.00 C ATOM 266 O ALA A 60 0.526 -9.304 -12.291 1.00 0.00 O ATOM 267 CB ALA A 60 2.748 -8.414 -14.551 1.00 0.00 C ATOM 0 H ALA A 60 4.444 -7.893 -12.744 1.00 0.00 H new ATOM 0 HA ALA A 60 1.621 -7.185 -13.188 1.00 0.00 H new ATOM 0 HB1 ALA A 60 1.865 -8.753 -15.093 1.00 0.00 H new ATOM 0 HB2 ALA A 60 3.189 -7.564 -15.071 1.00 0.00 H new ATOM 0 HB3 ALA A 60 3.475 -9.224 -14.499 1.00 0.00 H new ATOM 273 N ASP A 61 2.546 -10.081 -11.917 1.00 0.00 N ATOM 274 CA ASP A 61 2.007 -11.270 -11.197 1.00 0.00 C ATOM 275 C ASP A 61 1.008 -10.811 -10.132 1.00 0.00 C ATOM 276 O ASP A 61 0.294 -11.605 -9.553 1.00 0.00 O ATOM 277 CB ASP A 61 3.157 -12.023 -10.525 1.00 0.00 C ATOM 278 CG ASP A 61 2.668 -13.400 -10.070 1.00 0.00 C ATOM 279 OD1 ASP A 61 2.189 -14.144 -10.910 1.00 0.00 O ATOM 280 OD2 ASP A 61 2.782 -13.687 -8.890 1.00 0.00 O ATOM 0 H ASP A 61 3.563 -10.038 -11.983 1.00 0.00 H new ATOM 0 HA ASP A 61 1.506 -11.929 -11.906 1.00 0.00 H new ATOM 0 HB2 ASP A 61 3.990 -12.132 -11.220 1.00 0.00 H new ATOM 0 HB3 ASP A 61 3.527 -11.456 -9.671 1.00 0.00 H new ATOM 285 N THR A 62 0.954 -9.530 -9.869 1.00 0.00 N ATOM 286 CA THR A 62 0.004 -9.003 -8.843 1.00 0.00 C ATOM 287 C THR A 62 -1.229 -8.434 -9.545 1.00 0.00 C ATOM 288 O THR A 62 -1.998 -9.156 -10.147 1.00 0.00 O ATOM 289 CB THR A 62 0.698 -7.900 -8.040 1.00 0.00 C ATOM 290 OG1 THR A 62 1.125 -6.872 -8.924 1.00 0.00 O ATOM 291 CG2 THR A 62 1.908 -8.486 -7.310 1.00 0.00 C ATOM 0 H THR A 62 1.531 -8.822 -10.324 1.00 0.00 H new ATOM 0 HA THR A 62 -0.302 -9.804 -8.170 1.00 0.00 H new ATOM 0 HB THR A 62 0.003 -7.485 -7.310 1.00 0.00 H new ATOM 0 HG1 THR A 62 1.824 -7.219 -9.516 1.00 0.00 H new ATOM 0 HG21 THR A 62 2.403 -7.701 -6.738 1.00 0.00 H new ATOM 0 HG22 THR A 62 1.578 -9.275 -6.634 1.00 0.00 H new ATOM 0 HG23 THR A 62 2.606 -8.900 -8.037 1.00 0.00 H new ATOM 299 N ASN A 63 -1.425 -7.146 -9.473 1.00 0.00 N ATOM 300 CA ASN A 63 -2.613 -6.535 -10.135 1.00 0.00 C ATOM 301 C ASN A 63 -3.870 -7.298 -9.700 1.00 0.00 C ATOM 302 O ASN A 63 -3.797 -8.245 -8.944 1.00 0.00 O ATOM 303 CB ASN A 63 -2.444 -6.623 -11.661 1.00 0.00 C ATOM 304 CG ASN A 63 -3.313 -5.567 -12.356 1.00 0.00 C ATOM 305 OD1 ASN A 63 -4.112 -4.816 -11.648 1.00 0.00 O flip ATOM 306 ND2 ASN A 63 -3.262 -5.425 -13.562 1.00 0.00 N flip ATOM 0 H ASN A 63 -0.815 -6.491 -8.985 1.00 0.00 H new ATOM 0 HA ASN A 63 -2.707 -5.488 -9.848 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -1.397 -6.474 -11.927 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -2.723 -7.618 -12.008 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -2.639 -6.010 -14.118 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -3.842 -4.721 -14.018 1.00 0.00 H new ATOM 313 N ARG A 64 -5.023 -6.897 -10.166 1.00 0.00 N ATOM 314 CA ARG A 64 -6.280 -7.603 -9.778 1.00 0.00 C ATOM 315 C ARG A 64 -6.538 -7.419 -8.269 1.00 0.00 C ATOM 316 O ARG A 64 -7.646 -7.591 -7.801 1.00 0.00 O ATOM 317 CB ARG A 64 -6.158 -9.102 -10.174 1.00 0.00 C ATOM 318 CG ARG A 64 -6.220 -10.031 -8.954 1.00 0.00 C ATOM 319 CD ARG A 64 -6.038 -11.467 -9.428 1.00 0.00 C ATOM 320 NE ARG A 64 -5.838 -12.361 -8.254 1.00 0.00 N ATOM 321 CZ ARG A 64 -5.961 -13.654 -8.389 1.00 0.00 C ATOM 322 NH1 ARG A 64 -6.262 -14.162 -9.553 1.00 0.00 N ATOM 323 NH2 ARG A 64 -5.784 -14.438 -7.362 1.00 0.00 N ATOM 0 H ARG A 64 -5.149 -6.108 -10.801 1.00 0.00 H new ATOM 0 HA ARG A 64 -7.135 -7.181 -10.305 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -6.960 -9.360 -10.866 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -5.218 -9.261 -10.702 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -5.442 -9.767 -8.238 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -7.176 -9.920 -8.442 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -6.912 -11.786 -9.996 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -5.181 -11.533 -10.098 1.00 0.00 H new ATOM 0 HE ARG A 64 -5.605 -11.963 -7.344 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -6.401 -13.549 -10.356 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -6.358 -15.172 -9.659 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -5.549 -14.041 -6.452 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -5.880 -15.448 -7.469 1.00 0.00 H new ATOM 337 N LEU A 65 -5.527 -7.081 -7.510 1.00 0.00 N ATOM 338 CA LEU A 65 -5.706 -6.896 -6.036 1.00 0.00 C ATOM 339 C LEU A 65 -4.904 -5.671 -5.576 1.00 0.00 C ATOM 340 O LEU A 65 -5.016 -5.235 -4.449 1.00 0.00 O ATOM 341 CB LEU A 65 -5.194 -8.152 -5.314 1.00 0.00 C ATOM 342 CG LEU A 65 -6.232 -9.290 -5.424 1.00 0.00 C ATOM 343 CD1 LEU A 65 -5.527 -10.649 -5.309 1.00 0.00 C ATOM 344 CD2 LEU A 65 -7.281 -9.170 -4.301 1.00 0.00 C ATOM 0 H LEU A 65 -4.578 -6.924 -7.850 1.00 0.00 H new ATOM 0 HA LEU A 65 -6.760 -6.742 -5.803 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -4.247 -8.470 -5.750 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -5.002 -7.925 -4.265 1.00 0.00 H new ATOM 0 HG LEU A 65 -6.730 -9.212 -6.390 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -6.263 -11.449 -5.387 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -4.796 -10.749 -6.112 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -5.020 -10.716 -4.346 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -8.006 -9.979 -4.392 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -6.786 -9.234 -3.332 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -7.794 -8.212 -4.384 1.00 0.00 H new ATOM 356 N ILE A 66 -4.097 -5.110 -6.441 1.00 0.00 N ATOM 357 CA ILE A 66 -3.295 -3.914 -6.050 1.00 0.00 C ATOM 358 C ILE A 66 -2.834 -3.176 -7.311 1.00 0.00 C ATOM 359 O ILE A 66 -2.390 -3.782 -8.266 1.00 0.00 O ATOM 360 CB ILE A 66 -2.073 -4.363 -5.240 1.00 0.00 C ATOM 361 CG1 ILE A 66 -1.364 -3.129 -4.667 1.00 0.00 C ATOM 362 CG2 ILE A 66 -1.108 -5.139 -6.141 1.00 0.00 C ATOM 363 CD1 ILE A 66 -0.051 -3.545 -3.990 1.00 0.00 C ATOM 0 H ILE A 66 -3.960 -5.429 -7.400 1.00 0.00 H new ATOM 0 HA ILE A 66 -3.906 -3.246 -5.443 1.00 0.00 H new ATOM 0 HB ILE A 66 -2.397 -5.010 -4.425 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -1.161 -2.413 -5.464 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -2.012 -2.629 -3.947 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -0.242 -5.455 -5.560 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -1.613 -6.016 -6.545 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -0.781 -4.499 -6.960 1.00 0.00 H new ATOM 0 HD11 ILE A 66 0.446 -2.663 -3.586 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -0.264 -4.244 -3.181 1.00 0.00 H new ATOM 0 HD13 ILE A 66 0.599 -4.025 -4.721 1.00 0.00 H new ATOM 375 N CYS A 67 -2.932 -1.873 -7.326 1.00 0.00 N ATOM 376 CA CYS A 67 -2.494 -1.110 -8.533 1.00 0.00 C ATOM 377 C CYS A 67 -2.238 0.354 -8.160 1.00 0.00 C ATOM 378 O CYS A 67 -2.603 0.808 -7.095 1.00 0.00 O ATOM 379 CB CYS A 67 -3.587 -1.178 -9.600 1.00 0.00 C ATOM 380 SG CYS A 67 -5.173 -0.695 -8.872 1.00 0.00 S ATOM 0 H CYS A 67 -3.294 -1.306 -6.559 1.00 0.00 H new ATOM 0 HA CYS A 67 -1.574 -1.548 -8.920 1.00 0.00 H new ATOM 0 HB2 CYS A 67 -3.340 -0.517 -10.431 1.00 0.00 H new ATOM 0 HB3 CYS A 67 -3.653 -2.188 -10.004 1.00 0.00 H new ATOM 0 HG CYS A 67 -6.102 -0.751 -9.780 1.00 0.00 H new ATOM 386 N TRP A 68 -1.612 1.095 -9.037 1.00 0.00 N ATOM 387 CA TRP A 68 -1.332 2.531 -8.744 1.00 0.00 C ATOM 388 C TRP A 68 -2.631 3.332 -8.845 1.00 0.00 C ATOM 389 O TRP A 68 -3.636 2.839 -9.318 1.00 0.00 O ATOM 390 CB TRP A 68 -0.333 3.076 -9.769 1.00 0.00 C ATOM 391 CG TRP A 68 1.031 2.529 -9.493 1.00 0.00 C ATOM 392 CD1 TRP A 68 1.612 1.514 -10.175 1.00 0.00 C ATOM 393 CD2 TRP A 68 1.996 2.954 -8.488 1.00 0.00 C ATOM 394 NE1 TRP A 68 2.874 1.286 -9.651 1.00 0.00 N ATOM 395 CE2 TRP A 68 3.158 2.145 -8.609 1.00 0.00 C ATOM 396 CE3 TRP A 68 1.978 3.953 -7.487 1.00 0.00 C ATOM 397 CZ2 TRP A 68 4.265 2.321 -7.768 1.00 0.00 C ATOM 398 CZ3 TRP A 68 3.091 4.134 -6.638 1.00 0.00 C ATOM 399 CH2 TRP A 68 4.231 3.319 -6.778 1.00 0.00 C ATOM 0 H TRP A 68 -1.282 0.767 -9.945 1.00 0.00 H new ATOM 0 HA TRP A 68 -0.917 2.620 -7.740 1.00 0.00 H new ATOM 0 HB2 TRP A 68 -0.647 2.802 -10.776 1.00 0.00 H new ATOM 0 HB3 TRP A 68 -0.313 4.165 -9.726 1.00 0.00 H new ATOM 0 HD1 TRP A 68 1.165 0.971 -10.994 1.00 0.00 H new ATOM 0 HE1 TRP A 68 3.515 0.570 -9.994 1.00 0.00 H new ATOM 0 HE3 TRP A 68 1.107 4.581 -7.372 1.00 0.00 H new ATOM 0 HZ2 TRP A 68 5.138 1.695 -7.879 1.00 0.00 H new ATOM 0 HZ3 TRP A 68 3.068 4.901 -5.878 1.00 0.00 H new ATOM 0 HH2 TRP A 68 5.079 3.461 -6.125 1.00 0.00 H new ATOM 410 N THR A 69 -2.615 4.571 -8.410 1.00 0.00 N ATOM 411 CA THR A 69 -3.845 5.428 -8.483 1.00 0.00 C ATOM 412 C THR A 69 -3.566 6.625 -9.394 1.00 0.00 C ATOM 413 O THR A 69 -2.430 6.974 -9.643 1.00 0.00 O ATOM 414 CB THR A 69 -4.198 5.937 -7.085 1.00 0.00 C ATOM 415 OG1 THR A 69 -3.152 6.773 -6.614 1.00 0.00 O ATOM 416 CG2 THR A 69 -4.379 4.753 -6.133 1.00 0.00 C ATOM 0 H THR A 69 -1.798 5.029 -8.005 1.00 0.00 H new ATOM 0 HA THR A 69 -4.675 4.842 -8.878 1.00 0.00 H new ATOM 0 HB THR A 69 -5.128 6.504 -7.129 1.00 0.00 H new ATOM 0 HG1 THR A 69 -2.748 6.373 -5.815 1.00 0.00 H new ATOM 0 HG21 THR A 69 -4.630 5.121 -5.138 1.00 0.00 H new ATOM 0 HG22 THR A 69 -5.183 4.113 -6.497 1.00 0.00 H new ATOM 0 HG23 THR A 69 -3.453 4.180 -6.085 1.00 0.00 H new ATOM 424 N LYS A 70 -4.594 7.257 -9.892 1.00 0.00 N ATOM 425 CA LYS A 70 -4.387 8.433 -10.784 1.00 0.00 C ATOM 426 C LYS A 70 -3.417 8.054 -11.907 1.00 0.00 C ATOM 427 O LYS A 70 -3.820 7.612 -12.965 1.00 0.00 O ATOM 428 CB LYS A 70 -3.805 9.596 -9.971 1.00 0.00 C ATOM 429 CG LYS A 70 -4.917 10.275 -9.165 1.00 0.00 C ATOM 430 CD LYS A 70 -5.489 9.289 -8.139 1.00 0.00 C ATOM 431 CE LYS A 70 -6.273 10.056 -7.072 1.00 0.00 C ATOM 432 NZ LYS A 70 -7.439 10.736 -7.706 1.00 0.00 N ATOM 0 H LYS A 70 -5.568 7.010 -9.720 1.00 0.00 H new ATOM 0 HA LYS A 70 -5.341 8.737 -11.215 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -3.029 9.229 -9.299 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -3.334 10.318 -10.638 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -4.525 11.156 -8.657 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -5.707 10.617 -9.834 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -6.139 8.569 -8.635 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -4.682 8.723 -7.675 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -6.615 9.372 -6.295 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -5.628 10.790 -6.589 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -8.073 11.100 -6.966 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -7.103 11.526 -8.293 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -7.955 10.057 -8.301 1.00 0.00 H new ATOM 446 N ASP A 71 -2.139 8.224 -11.688 1.00 0.00 N ATOM 447 CA ASP A 71 -1.145 7.874 -12.745 1.00 0.00 C ATOM 448 C ASP A 71 0.206 7.560 -12.097 1.00 0.00 C ATOM 449 O ASP A 71 1.083 6.991 -12.715 1.00 0.00 O ATOM 450 CB ASP A 71 -0.988 9.056 -13.705 1.00 0.00 C ATOM 451 CG ASP A 71 -0.081 8.650 -14.868 1.00 0.00 C ATOM 452 OD1 ASP A 71 1.125 8.661 -14.685 1.00 0.00 O ATOM 453 OD2 ASP A 71 -0.608 8.335 -15.923 1.00 0.00 O ATOM 0 H ASP A 71 -1.741 8.590 -10.823 1.00 0.00 H new ATOM 0 HA ASP A 71 -1.493 7.000 -13.295 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -1.963 9.365 -14.081 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -0.563 9.911 -13.180 1.00 0.00 H new ATOM 458 N GLY A 72 0.381 7.926 -10.856 1.00 0.00 N ATOM 459 CA GLY A 72 1.677 7.646 -10.174 1.00 0.00 C ATOM 460 C GLY A 72 1.718 8.375 -8.830 1.00 0.00 C ATOM 461 O GLY A 72 2.742 8.883 -8.418 1.00 0.00 O ATOM 0 H GLY A 72 -0.316 8.406 -10.286 1.00 0.00 H new ATOM 0 HA2 GLY A 72 1.795 6.573 -10.021 1.00 0.00 H new ATOM 0 HA3 GLY A 72 2.507 7.971 -10.801 1.00 0.00 H new ATOM 465 N GLN A 73 0.608 8.431 -8.139 1.00 0.00 N ATOM 466 CA GLN A 73 0.571 9.127 -6.816 1.00 0.00 C ATOM 467 C GLN A 73 -0.338 8.349 -5.860 1.00 0.00 C ATOM 468 O GLN A 73 -1.546 8.393 -5.970 1.00 0.00 O ATOM 469 CB GLN A 73 0.015 10.545 -6.996 1.00 0.00 C ATOM 470 CG GLN A 73 0.961 11.369 -7.879 1.00 0.00 C ATOM 471 CD GLN A 73 0.733 11.020 -9.351 1.00 0.00 C ATOM 472 OE1 GLN A 73 -0.377 10.732 -9.755 1.00 0.00 O ATOM 473 NE2 GLN A 73 1.744 11.035 -10.177 1.00 0.00 N ATOM 0 H GLN A 73 -0.279 8.023 -8.435 1.00 0.00 H new ATOM 0 HA GLN A 73 1.580 9.180 -6.407 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -0.975 10.502 -7.450 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -0.101 11.026 -6.025 1.00 0.00 H new ATOM 0 HG2 GLN A 73 0.789 12.433 -7.717 1.00 0.00 H new ATOM 0 HG3 GLN A 73 1.997 11.168 -7.604 1.00 0.00 H new ATOM 0 HE21 GLN A 73 2.675 11.277 -9.839 1.00 0.00 H new ATOM 0 HE22 GLN A 73 1.602 10.805 -11.161 1.00 0.00 H new ATOM 482 N SER A 74 0.242 7.639 -4.926 1.00 0.00 N ATOM 483 CA SER A 74 -0.565 6.846 -3.944 1.00 0.00 C ATOM 484 C SER A 74 -1.012 5.533 -4.586 1.00 0.00 C ATOM 485 O SER A 74 -1.366 5.487 -5.747 1.00 0.00 O ATOM 486 CB SER A 74 -1.798 7.647 -3.497 1.00 0.00 C ATOM 487 OG SER A 74 -2.893 7.346 -4.351 1.00 0.00 O ATOM 0 H SER A 74 1.252 7.573 -4.799 1.00 0.00 H new ATOM 0 HA SER A 74 0.053 6.633 -3.072 1.00 0.00 H new ATOM 0 HB2 SER A 74 -2.050 7.402 -2.465 1.00 0.00 H new ATOM 0 HB3 SER A 74 -1.582 8.715 -3.528 1.00 0.00 H new ATOM 0 HG SER A 74 -2.781 7.816 -5.204 1.00 0.00 H new ATOM 493 N PHE A 75 -1.003 4.462 -3.827 1.00 0.00 N ATOM 494 CA PHE A 75 -1.432 3.131 -4.369 1.00 0.00 C ATOM 495 C PHE A 75 -2.774 2.756 -3.742 1.00 0.00 C ATOM 496 O PHE A 75 -3.255 3.426 -2.850 1.00 0.00 O ATOM 497 CB PHE A 75 -0.377 2.066 -4.035 1.00 0.00 C ATOM 498 CG PHE A 75 0.056 2.183 -2.588 1.00 0.00 C ATOM 499 CD1 PHE A 75 0.840 3.277 -2.172 1.00 0.00 C ATOM 500 CD2 PHE A 75 -0.314 1.191 -1.657 1.00 0.00 C ATOM 501 CE1 PHE A 75 1.249 3.383 -0.830 1.00 0.00 C ATOM 502 CE2 PHE A 75 0.097 1.296 -0.313 1.00 0.00 C ATOM 503 CZ PHE A 75 0.876 2.393 0.101 1.00 0.00 C ATOM 0 H PHE A 75 -0.715 4.452 -2.849 1.00 0.00 H new ATOM 0 HA PHE A 75 -1.536 3.187 -5.453 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -0.784 1.072 -4.220 1.00 0.00 H new ATOM 0 HB3 PHE A 75 0.487 2.183 -4.690 1.00 0.00 H new ATOM 0 HD1 PHE A 75 1.128 4.036 -2.885 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -0.913 0.350 -1.974 1.00 0.00 H new ATOM 0 HE1 PHE A 75 1.849 4.223 -0.513 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -0.186 0.535 0.399 1.00 0.00 H new ATOM 0 HZ PHE A 75 1.188 2.476 1.132 1.00 0.00 H new ATOM 513 N VAL A 76 -3.397 1.702 -4.206 1.00 0.00 N ATOM 514 CA VAL A 76 -4.721 1.308 -3.634 1.00 0.00 C ATOM 515 C VAL A 76 -4.864 -0.211 -3.629 1.00 0.00 C ATOM 516 O VAL A 76 -4.093 -0.928 -4.237 1.00 0.00 O ATOM 517 CB VAL A 76 -5.834 1.927 -4.480 1.00 0.00 C ATOM 518 CG1 VAL A 76 -5.680 1.489 -5.937 1.00 0.00 C ATOM 519 CG2 VAL A 76 -7.205 1.485 -3.960 1.00 0.00 C ATOM 0 H VAL A 76 -3.049 1.100 -4.952 1.00 0.00 H new ATOM 0 HA VAL A 76 -4.791 1.668 -2.608 1.00 0.00 H new ATOM 0 HB VAL A 76 -5.760 3.012 -4.414 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -6.475 1.932 -6.536 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -4.713 1.819 -6.316 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -5.742 0.403 -5.999 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -7.988 1.933 -4.572 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -7.281 0.399 -4.012 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -7.323 1.808 -2.926 1.00 0.00 H new ATOM 529 N ILE A 77 -5.852 -0.700 -2.931 1.00 0.00 N ATOM 530 CA ILE A 77 -6.078 -2.176 -2.852 1.00 0.00 C ATOM 531 C ILE A 77 -7.591 -2.430 -2.757 1.00 0.00 C ATOM 532 O ILE A 77 -8.120 -2.726 -1.704 1.00 0.00 O ATOM 533 CB ILE A 77 -5.349 -2.741 -1.606 1.00 0.00 C ATOM 534 CG1 ILE A 77 -4.109 -1.886 -1.301 1.00 0.00 C ATOM 535 CG2 ILE A 77 -4.915 -4.185 -1.856 1.00 0.00 C ATOM 536 CD1 ILE A 77 -3.335 -2.490 -0.126 1.00 0.00 C ATOM 0 H ILE A 77 -6.520 -0.136 -2.406 1.00 0.00 H new ATOM 0 HA ILE A 77 -5.683 -2.674 -3.737 1.00 0.00 H new ATOM 0 HB ILE A 77 -6.033 -2.715 -0.758 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -3.468 -1.833 -2.181 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -4.410 -0.866 -1.063 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -4.404 -4.569 -0.973 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -5.792 -4.798 -2.063 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -4.238 -4.219 -2.710 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -2.457 -1.879 0.084 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -3.976 -2.520 0.755 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -3.020 -3.502 -0.380 1.00 0.00 H new ATOM 548 N GLN A 78 -8.284 -2.289 -3.859 1.00 0.00 N ATOM 549 CA GLN A 78 -9.770 -2.488 -3.878 1.00 0.00 C ATOM 550 C GLN A 78 -10.192 -3.615 -2.923 1.00 0.00 C ATOM 551 O GLN A 78 -10.815 -3.378 -1.908 1.00 0.00 O ATOM 552 CB GLN A 78 -10.214 -2.837 -5.309 1.00 0.00 C ATOM 553 CG GLN A 78 -9.326 -2.106 -6.319 1.00 0.00 C ATOM 554 CD GLN A 78 -9.927 -2.243 -7.719 1.00 0.00 C ATOM 555 OE1 GLN A 78 -10.800 -1.487 -8.094 1.00 0.00 O ATOM 556 NE2 GLN A 78 -9.493 -3.185 -8.512 1.00 0.00 N ATOM 0 H GLN A 78 -7.878 -2.041 -4.761 1.00 0.00 H new ATOM 0 HA GLN A 78 -10.247 -1.565 -3.548 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -10.151 -3.914 -5.467 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -11.256 -2.554 -5.456 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -9.241 -1.053 -6.050 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -8.319 -2.522 -6.302 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -8.760 -3.820 -8.196 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -9.887 -3.286 -9.447 1.00 0.00 H new ATOM 565 N ASN A 79 -9.870 -4.836 -3.249 1.00 0.00 N ATOM 566 CA ASN A 79 -10.265 -5.978 -2.369 1.00 0.00 C ATOM 567 C ASN A 79 -9.171 -6.234 -1.330 1.00 0.00 C ATOM 568 O ASN A 79 -8.008 -6.365 -1.656 1.00 0.00 O ATOM 569 CB ASN A 79 -10.464 -7.233 -3.225 1.00 0.00 C ATOM 570 CG ASN A 79 -11.792 -7.133 -3.979 1.00 0.00 C ATOM 571 OD1 ASN A 79 -12.749 -6.579 -3.476 1.00 0.00 O ATOM 572 ND2 ASN A 79 -11.892 -7.652 -5.172 1.00 0.00 N ATOM 0 H ASN A 79 -9.350 -5.095 -4.087 1.00 0.00 H new ATOM 0 HA ASN A 79 -11.195 -5.734 -1.856 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -9.640 -7.339 -3.931 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -10.459 -8.121 -2.593 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -12.773 -7.592 -5.682 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -11.089 -8.117 -5.595 1.00 0.00 H new ATOM 579 N GLN A 80 -9.542 -6.307 -0.076 1.00 0.00 N ATOM 580 CA GLN A 80 -8.537 -6.556 1.003 1.00 0.00 C ATOM 581 C GLN A 80 -8.583 -8.032 1.413 1.00 0.00 C ATOM 582 O GLN A 80 -7.900 -8.455 2.325 1.00 0.00 O ATOM 583 CB GLN A 80 -8.876 -5.686 2.216 1.00 0.00 C ATOM 584 CG GLN A 80 -8.963 -4.221 1.784 1.00 0.00 C ATOM 585 CD GLN A 80 -9.461 -3.372 2.955 1.00 0.00 C ATOM 586 OE1 GLN A 80 -9.178 -3.667 4.098 1.00 0.00 O ATOM 587 NE2 GLN A 80 -10.195 -2.319 2.716 1.00 0.00 N ATOM 0 H GLN A 80 -10.504 -6.204 0.248 1.00 0.00 H new ATOM 0 HA GLN A 80 -7.540 -6.310 0.638 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -9.823 -6.005 2.652 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -8.114 -5.805 2.986 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -7.985 -3.869 1.456 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -9.639 -4.121 0.935 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -10.433 -2.071 1.756 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -10.530 -1.745 3.489 1.00 0.00 H new ATOM 596 N ALA A 81 -9.395 -8.818 0.754 1.00 0.00 N ATOM 597 CA ALA A 81 -9.499 -10.262 1.111 1.00 0.00 C ATOM 598 C ALA A 81 -8.417 -11.067 0.386 1.00 0.00 C ATOM 599 O ALA A 81 -7.341 -11.287 0.905 1.00 0.00 O ATOM 600 CB ALA A 81 -10.877 -10.786 0.702 1.00 0.00 C ATOM 0 H ALA A 81 -9.991 -8.520 -0.018 1.00 0.00 H new ATOM 0 HA ALA A 81 -9.363 -10.372 2.187 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -10.957 -11.842 0.962 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -11.650 -10.224 1.226 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -11.007 -10.666 -0.373 1.00 0.00 H new ATOM 606 N GLN A 82 -8.698 -11.517 -0.807 1.00 0.00 N ATOM 607 CA GLN A 82 -7.691 -12.319 -1.564 1.00 0.00 C ATOM 608 C GLN A 82 -6.391 -11.537 -1.680 1.00 0.00 C ATOM 609 O GLN A 82 -5.401 -12.030 -2.180 1.00 0.00 O ATOM 610 CB GLN A 82 -8.215 -12.625 -2.969 1.00 0.00 C ATOM 611 CG GLN A 82 -9.680 -13.039 -2.890 1.00 0.00 C ATOM 612 CD GLN A 82 -9.832 -14.206 -1.915 1.00 0.00 C ATOM 613 OE1 GLN A 82 -8.868 -15.080 -1.807 1.00 0.00 O flip ATOM 614 NE2 GLN A 82 -10.838 -14.326 -1.243 1.00 0.00 N flip ATOM 0 H GLN A 82 -9.582 -11.364 -1.292 1.00 0.00 H new ATOM 0 HA GLN A 82 -7.513 -13.252 -1.030 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -8.109 -11.747 -3.607 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -7.625 -13.422 -3.422 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -10.289 -12.197 -2.562 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -10.040 -13.328 -3.877 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -11.592 -13.644 -1.327 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -10.928 -15.109 -0.596 1.00 0.00 H new ATOM 623 N PHE A 83 -6.386 -10.318 -1.238 1.00 0.00 N ATOM 624 CA PHE A 83 -5.152 -9.505 -1.343 1.00 0.00 C ATOM 625 C PHE A 83 -4.162 -9.941 -0.257 1.00 0.00 C ATOM 626 O PHE A 83 -2.997 -9.601 -0.300 1.00 0.00 O ATOM 627 CB PHE A 83 -5.521 -8.022 -1.186 1.00 0.00 C ATOM 628 CG PHE A 83 -4.311 -7.213 -0.776 1.00 0.00 C ATOM 629 CD1 PHE A 83 -3.384 -6.767 -1.737 1.00 0.00 C ATOM 630 CD2 PHE A 83 -4.110 -6.923 0.584 1.00 0.00 C ATOM 631 CE1 PHE A 83 -2.256 -6.028 -1.331 1.00 0.00 C ATOM 632 CE2 PHE A 83 -2.985 -6.184 0.991 1.00 0.00 C ATOM 633 CZ PHE A 83 -2.057 -5.736 0.034 1.00 0.00 C ATOM 0 H PHE A 83 -7.183 -9.849 -0.808 1.00 0.00 H new ATOM 0 HA PHE A 83 -4.681 -9.651 -2.315 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -5.920 -7.639 -2.126 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -6.307 -7.914 -0.439 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -3.537 -6.991 -2.782 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -4.822 -7.269 1.319 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -1.543 -5.685 -2.066 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -2.834 -5.961 2.037 1.00 0.00 H new ATOM 0 HZ PHE A 83 -1.192 -5.168 0.344 1.00 0.00 H new ATOM 643 N ALA A 84 -4.622 -10.682 0.717 1.00 0.00 N ATOM 644 CA ALA A 84 -3.718 -11.140 1.817 1.00 0.00 C ATOM 645 C ALA A 84 -3.433 -12.636 1.670 1.00 0.00 C ATOM 646 O ALA A 84 -2.327 -13.089 1.886 1.00 0.00 O ATOM 647 CB ALA A 84 -4.403 -10.891 3.163 1.00 0.00 C ATOM 0 H ALA A 84 -5.590 -10.992 0.799 1.00 0.00 H new ATOM 0 HA ALA A 84 -2.779 -10.588 1.765 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -3.750 -11.222 3.970 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -4.608 -9.826 3.276 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -5.340 -11.447 3.203 1.00 0.00 H new ATOM 653 N LYS A 85 -4.430 -13.404 1.324 1.00 0.00 N ATOM 654 CA LYS A 85 -4.240 -14.876 1.189 1.00 0.00 C ATOM 655 C LYS A 85 -3.615 -15.232 -0.167 1.00 0.00 C ATOM 656 O LYS A 85 -3.688 -16.364 -0.601 1.00 0.00 O ATOM 657 CB LYS A 85 -5.607 -15.569 1.310 1.00 0.00 C ATOM 658 CG LYS A 85 -6.073 -15.611 2.795 1.00 0.00 C ATOM 659 CD LYS A 85 -7.518 -15.100 2.917 1.00 0.00 C ATOM 660 CE LYS A 85 -7.533 -13.567 2.849 1.00 0.00 C ATOM 661 NZ LYS A 85 -7.285 -13.008 4.208 1.00 0.00 N ATOM 0 H LYS A 85 -5.374 -13.072 1.128 1.00 0.00 H new ATOM 0 HA LYS A 85 -3.567 -15.213 1.978 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -6.344 -15.038 0.707 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -5.543 -16.583 0.915 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -6.008 -16.631 3.175 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -5.411 -14.999 3.408 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -8.129 -15.515 2.116 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -7.954 -15.436 3.858 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -6.770 -13.215 2.155 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -8.494 -13.218 2.470 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -7.295 -11.969 4.163 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -8.028 -13.334 4.858 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -6.358 -13.331 4.552 1.00 0.00 H new ATOM 675 N GLU A 86 -3.009 -14.296 -0.851 1.00 0.00 N ATOM 676 CA GLU A 86 -2.405 -14.637 -2.177 1.00 0.00 C ATOM 677 C GLU A 86 -1.280 -13.659 -2.527 1.00 0.00 C ATOM 678 O GLU A 86 -0.830 -13.610 -3.655 1.00 0.00 O ATOM 679 CB GLU A 86 -3.482 -14.564 -3.267 1.00 0.00 C ATOM 680 CG GLU A 86 -4.483 -15.712 -3.097 1.00 0.00 C ATOM 681 CD GLU A 86 -5.329 -15.841 -4.366 1.00 0.00 C ATOM 682 OE1 GLU A 86 -4.757 -16.100 -5.412 1.00 0.00 O ATOM 683 OE2 GLU A 86 -6.534 -15.680 -4.270 1.00 0.00 O ATOM 0 H GLU A 86 -2.906 -13.325 -0.556 1.00 0.00 H new ATOM 0 HA GLU A 86 -1.996 -15.646 -2.119 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -4.001 -13.607 -3.212 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -3.018 -14.619 -4.252 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -3.954 -16.645 -2.903 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -5.125 -15.525 -2.236 1.00 0.00 H new ATOM 690 N LEU A 87 -0.818 -12.876 -1.584 1.00 0.00 N ATOM 691 CA LEU A 87 0.283 -11.905 -1.892 1.00 0.00 C ATOM 692 C LEU A 87 1.253 -11.808 -0.710 1.00 0.00 C ATOM 693 O LEU A 87 2.414 -11.498 -0.884 1.00 0.00 O ATOM 694 CB LEU A 87 -0.315 -10.521 -2.170 1.00 0.00 C ATOM 695 CG LEU A 87 -1.046 -10.516 -3.524 1.00 0.00 C ATOM 696 CD1 LEU A 87 -1.781 -9.182 -3.686 1.00 0.00 C ATOM 697 CD2 LEU A 87 -0.040 -10.701 -4.684 1.00 0.00 C ATOM 0 H LEU A 87 -1.151 -12.865 -0.620 1.00 0.00 H new ATOM 0 HA LEU A 87 0.825 -12.257 -2.770 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -1.009 -10.251 -1.374 1.00 0.00 H new ATOM 0 HB3 LEU A 87 0.475 -9.770 -2.173 1.00 0.00 H new ATOM 0 HG LEU A 87 -1.758 -11.341 -3.551 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -2.303 -9.168 -4.643 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -2.502 -9.064 -2.878 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -1.062 -8.364 -3.653 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -0.575 -10.695 -5.634 1.00 0.00 H new ATOM 0 HD22 LEU A 87 0.685 -9.887 -4.670 1.00 0.00 H new ATOM 0 HD23 LEU A 87 0.480 -11.652 -4.566 1.00 0.00 H new ATOM 709 N LEU A 88 0.800 -12.062 0.491 1.00 0.00 N ATOM 710 CA LEU A 88 1.722 -11.972 1.666 1.00 0.00 C ATOM 711 C LEU A 88 2.457 -13.305 1.948 1.00 0.00 C ATOM 712 O LEU A 88 3.564 -13.268 2.445 1.00 0.00 O ATOM 713 CB LEU A 88 0.932 -11.551 2.909 1.00 0.00 C ATOM 714 CG LEU A 88 0.126 -10.283 2.602 1.00 0.00 C ATOM 715 CD1 LEU A 88 -0.767 -9.954 3.802 1.00 0.00 C ATOM 716 CD2 LEU A 88 1.073 -9.103 2.327 1.00 0.00 C ATOM 0 H LEU A 88 -0.161 -12.326 0.709 1.00 0.00 H new ATOM 0 HA LEU A 88 2.480 -11.226 1.426 1.00 0.00 H new ATOM 0 HB2 LEU A 88 0.262 -12.354 3.216 1.00 0.00 H new ATOM 0 HB3 LEU A 88 1.613 -11.369 3.740 1.00 0.00 H new ATOM 0 HG LEU A 88 -0.488 -10.454 1.717 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -1.343 -9.053 3.591 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -1.448 -10.785 3.988 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -0.147 -9.789 4.683 1.00 0.00 H new ATOM 0 HD21 LEU A 88 0.488 -8.209 2.111 1.00 0.00 H new ATOM 0 HD22 LEU A 88 1.696 -8.925 3.203 1.00 0.00 H new ATOM 0 HD23 LEU A 88 1.707 -9.337 1.472 1.00 0.00 H new ATOM 728 N PRO A 89 1.857 -14.449 1.655 1.00 0.00 N ATOM 729 CA PRO A 89 2.524 -15.739 1.924 1.00 0.00 C ATOM 730 C PRO A 89 3.746 -15.899 1.007 1.00 0.00 C ATOM 731 O PRO A 89 4.850 -16.124 1.461 1.00 0.00 O ATOM 732 CB PRO A 89 1.448 -16.814 1.634 1.00 0.00 C ATOM 733 CG PRO A 89 0.153 -16.067 1.203 1.00 0.00 C ATOM 734 CD PRO A 89 0.512 -14.573 1.058 1.00 0.00 C ATOM 0 HA PRO A 89 2.895 -15.818 2.946 1.00 0.00 H new ATOM 0 HB2 PRO A 89 1.782 -17.490 0.847 1.00 0.00 H new ATOM 0 HB3 PRO A 89 1.264 -17.423 2.519 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -0.225 -16.465 0.261 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -0.634 -16.203 1.945 1.00 0.00 H new ATOM 0 HD2 PRO A 89 0.514 -14.266 0.012 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -0.210 -13.941 1.575 1.00 0.00 H new ATOM 742 N LEU A 90 3.552 -15.788 -0.280 1.00 0.00 N ATOM 743 CA LEU A 90 4.698 -15.936 -1.224 1.00 0.00 C ATOM 744 C LEU A 90 5.462 -14.613 -1.313 1.00 0.00 C ATOM 745 O LEU A 90 6.036 -14.285 -2.332 1.00 0.00 O ATOM 746 CB LEU A 90 4.175 -16.311 -2.614 1.00 0.00 C ATOM 747 CG LEU A 90 3.188 -17.480 -2.505 1.00 0.00 C ATOM 748 CD1 LEU A 90 2.591 -17.766 -3.885 1.00 0.00 C ATOM 749 CD2 LEU A 90 3.919 -18.729 -1.995 1.00 0.00 C ATOM 0 H LEU A 90 2.650 -15.601 -0.718 1.00 0.00 H new ATOM 0 HA LEU A 90 5.363 -16.720 -0.861 1.00 0.00 H new ATOM 0 HB2 LEU A 90 3.685 -15.452 -3.071 1.00 0.00 H new ATOM 0 HB3 LEU A 90 5.007 -16.586 -3.263 1.00 0.00 H new ATOM 0 HG LEU A 90 2.392 -17.220 -1.807 1.00 0.00 H new ATOM 0 HD11 LEU A 90 1.889 -18.596 -3.813 1.00 0.00 H new ATOM 0 HD12 LEU A 90 2.069 -16.880 -4.246 1.00 0.00 H new ATOM 0 HD13 LEU A 90 3.389 -18.026 -4.580 1.00 0.00 H new ATOM 0 HD21 LEU A 90 3.214 -19.557 -1.919 1.00 0.00 H new ATOM 0 HD22 LEU A 90 4.716 -18.993 -2.690 1.00 0.00 H new ATOM 0 HD23 LEU A 90 4.346 -18.525 -1.013 1.00 0.00 H new ATOM 761 N ASN A 91 5.474 -13.845 -0.254 1.00 0.00 N ATOM 762 CA ASN A 91 6.201 -12.538 -0.281 1.00 0.00 C ATOM 763 C ASN A 91 6.708 -12.190 1.123 1.00 0.00 C ATOM 764 O ASN A 91 7.667 -11.461 1.280 1.00 0.00 O ATOM 765 CB ASN A 91 5.250 -11.439 -0.762 1.00 0.00 C ATOM 766 CG ASN A 91 6.057 -10.197 -1.146 1.00 0.00 C ATOM 767 OD1 ASN A 91 7.120 -10.304 -1.725 1.00 0.00 O ATOM 768 ND2 ASN A 91 5.593 -9.015 -0.846 1.00 0.00 N ATOM 0 H ASN A 91 5.012 -14.065 0.628 1.00 0.00 H new ATOM 0 HA ASN A 91 7.051 -12.616 -0.959 1.00 0.00 H new ATOM 0 HB2 ASN A 91 4.674 -11.791 -1.618 1.00 0.00 H new ATOM 0 HB3 ASN A 91 4.535 -11.193 0.023 1.00 0.00 H new ATOM 0 HD21 ASN A 91 6.123 -8.180 -1.098 1.00 0.00 H new ATOM 0 HD22 ASN A 91 4.701 -8.926 -0.360 1.00 0.00 H new ATOM 775 N TYR A 92 6.073 -12.698 2.147 1.00 0.00 N ATOM 776 CA TYR A 92 6.518 -12.388 3.539 1.00 0.00 C ATOM 777 C TYR A 92 6.204 -13.575 4.454 1.00 0.00 C ATOM 778 O TYR A 92 6.124 -13.432 5.655 1.00 0.00 O ATOM 779 CB TYR A 92 5.778 -11.144 4.046 1.00 0.00 C ATOM 780 CG TYR A 92 6.379 -9.902 3.428 1.00 0.00 C ATOM 781 CD1 TYR A 92 7.630 -9.431 3.871 1.00 0.00 C ATOM 782 CD2 TYR A 92 5.689 -9.215 2.408 1.00 0.00 C ATOM 783 CE1 TYR A 92 8.192 -8.275 3.297 1.00 0.00 C ATOM 784 CE2 TYR A 92 6.252 -8.058 1.835 1.00 0.00 C ATOM 785 CZ TYR A 92 7.502 -7.589 2.279 1.00 0.00 C ATOM 786 OH TYR A 92 8.053 -6.456 1.717 1.00 0.00 O ATOM 0 H TYR A 92 5.264 -13.315 2.080 1.00 0.00 H new ATOM 0 HA TYR A 92 7.592 -12.201 3.543 1.00 0.00 H new ATOM 0 HB2 TYR A 92 4.720 -11.211 3.793 1.00 0.00 H new ATOM 0 HB3 TYR A 92 5.843 -11.089 5.133 1.00 0.00 H new ATOM 0 HD1 TYR A 92 8.159 -9.957 4.652 1.00 0.00 H new ATOM 0 HD2 TYR A 92 4.730 -9.576 2.067 1.00 0.00 H new ATOM 0 HE1 TYR A 92 9.152 -7.915 3.637 1.00 0.00 H new ATOM 0 HE2 TYR A 92 5.724 -7.531 1.054 1.00 0.00 H new ATOM 0 HH TYR A 92 8.085 -5.741 2.387 1.00 0.00 H new ATOM 796 N LYS A 93 6.032 -14.743 3.889 1.00 0.00 N ATOM 797 CA LYS A 93 5.725 -15.959 4.712 1.00 0.00 C ATOM 798 C LYS A 93 4.422 -15.742 5.503 1.00 0.00 C ATOM 799 O LYS A 93 3.397 -16.310 5.184 1.00 0.00 O ATOM 800 CB LYS A 93 6.901 -16.252 5.682 1.00 0.00 C ATOM 801 CG LYS A 93 7.854 -17.305 5.085 1.00 0.00 C ATOM 802 CD LYS A 93 8.570 -16.745 3.841 1.00 0.00 C ATOM 803 CE LYS A 93 9.792 -15.914 4.255 1.00 0.00 C ATOM 804 NZ LYS A 93 10.561 -15.528 3.038 1.00 0.00 N ATOM 0 H LYS A 93 6.091 -14.911 2.885 1.00 0.00 H new ATOM 0 HA LYS A 93 5.595 -16.815 4.050 1.00 0.00 H new ATOM 0 HB2 LYS A 93 7.449 -15.332 5.884 1.00 0.00 H new ATOM 0 HB3 LYS A 93 6.511 -16.607 6.636 1.00 0.00 H new ATOM 0 HG2 LYS A 93 8.590 -17.602 5.832 1.00 0.00 H new ATOM 0 HG3 LYS A 93 7.293 -18.200 4.816 1.00 0.00 H new ATOM 0 HD2 LYS A 93 8.882 -17.565 3.194 1.00 0.00 H new ATOM 0 HD3 LYS A 93 7.881 -16.128 3.264 1.00 0.00 H new ATOM 0 HE2 LYS A 93 9.474 -15.023 4.796 1.00 0.00 H new ATOM 0 HE3 LYS A 93 10.424 -16.489 4.932 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 11.390 -14.965 3.315 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 10.876 -16.385 2.540 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 9.955 -14.965 2.408 1.00 0.00 H new ATOM 818 N HIS A 94 4.461 -14.944 6.539 1.00 0.00 N ATOM 819 CA HIS A 94 3.236 -14.705 7.362 1.00 0.00 C ATOM 820 C HIS A 94 2.008 -14.515 6.461 1.00 0.00 C ATOM 821 O HIS A 94 2.121 -14.329 5.265 1.00 0.00 O ATOM 822 CB HIS A 94 3.441 -13.452 8.228 1.00 0.00 C ATOM 823 CG HIS A 94 3.370 -12.212 7.374 1.00 0.00 C ATOM 824 ND1 HIS A 94 3.017 -10.976 7.893 1.00 0.00 N ATOM 825 CD2 HIS A 94 3.593 -12.006 6.035 1.00 0.00 C ATOM 826 CE1 HIS A 94 3.036 -10.090 6.879 1.00 0.00 C ATOM 827 NE2 HIS A 94 3.381 -10.666 5.725 1.00 0.00 N ATOM 0 H HIS A 94 5.293 -14.445 6.852 1.00 0.00 H new ATOM 0 HA HIS A 94 3.066 -15.572 8.001 1.00 0.00 H new ATOM 0 HB2 HIS A 94 2.679 -13.410 9.006 1.00 0.00 H new ATOM 0 HB3 HIS A 94 4.407 -13.502 8.730 1.00 0.00 H new ATOM 0 HD2 HIS A 94 3.888 -12.768 5.329 1.00 0.00 H new ATOM 0 HE1 HIS A 94 2.801 -9.041 6.986 1.00 0.00 H new ATOM 0 HE2 HIS A 94 3.470 -10.220 4.812 1.00 0.00 H new ATOM 835 N ASN A 95 0.834 -14.556 7.035 1.00 0.00 N ATOM 836 CA ASN A 95 -0.413 -14.375 6.233 1.00 0.00 C ATOM 837 C ASN A 95 -1.467 -13.680 7.098 1.00 0.00 C ATOM 838 O ASN A 95 -2.038 -14.273 7.992 1.00 0.00 O ATOM 839 CB ASN A 95 -0.938 -15.742 5.788 1.00 0.00 C ATOM 840 CG ASN A 95 -0.899 -16.712 6.970 1.00 0.00 C ATOM 841 OD1 ASN A 95 -0.624 -16.260 8.163 1.00 0.00 O flip ATOM 842 ND2 ASN A 95 -1.119 -17.896 6.807 1.00 0.00 N flip ATOM 0 H ASN A 95 0.684 -14.708 8.032 1.00 0.00 H new ATOM 0 HA ASN A 95 -0.200 -13.768 5.353 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -1.958 -15.648 5.414 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -0.332 -16.127 4.968 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -1.334 -18.251 5.875 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -1.089 -18.535 7.602 1.00 0.00 H new ATOM 849 N ASN A 96 -1.725 -12.426 6.845 1.00 0.00 N ATOM 850 CA ASN A 96 -2.735 -11.693 7.659 1.00 0.00 C ATOM 851 C ASN A 96 -3.178 -10.434 6.906 1.00 0.00 C ATOM 852 O ASN A 96 -2.894 -10.267 5.736 1.00 0.00 O ATOM 853 CB ASN A 96 -2.108 -11.304 9.004 1.00 0.00 C ATOM 854 CG ASN A 96 -0.637 -10.945 8.793 1.00 0.00 C ATOM 855 OD1 ASN A 96 -0.258 -10.481 7.736 1.00 0.00 O ATOM 856 ND2 ASN A 96 0.215 -11.141 9.762 1.00 0.00 N ATOM 0 H ASN A 96 -1.280 -11.877 6.109 1.00 0.00 H new ATOM 0 HA ASN A 96 -3.603 -12.328 7.834 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -2.642 -10.458 9.436 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -2.195 -12.129 9.711 1.00 0.00 H new ATOM 0 HD21 ASN A 96 1.199 -10.905 9.632 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -0.103 -11.530 10.650 1.00 0.00 H new ATOM 863 N MET A 97 -3.875 -9.547 7.567 1.00 0.00 N ATOM 864 CA MET A 97 -4.340 -8.296 6.894 1.00 0.00 C ATOM 865 C MET A 97 -4.303 -7.142 7.895 1.00 0.00 C ATOM 866 O MET A 97 -3.412 -6.316 7.870 1.00 0.00 O ATOM 867 CB MET A 97 -5.773 -8.491 6.392 1.00 0.00 C ATOM 868 CG MET A 97 -6.174 -7.304 5.513 1.00 0.00 C ATOM 869 SD MET A 97 -5.226 -7.348 3.970 1.00 0.00 S ATOM 870 CE MET A 97 -5.120 -5.560 3.712 1.00 0.00 C ATOM 0 H MET A 97 -4.143 -9.635 8.547 1.00 0.00 H new ATOM 0 HA MET A 97 -3.688 -8.069 6.050 1.00 0.00 H new ATOM 0 HB2 MET A 97 -5.847 -9.419 5.824 1.00 0.00 H new ATOM 0 HB3 MET A 97 -6.456 -8.579 7.237 1.00 0.00 H new ATOM 0 HG2 MET A 97 -7.242 -7.342 5.297 1.00 0.00 H new ATOM 0 HG3 MET A 97 -5.988 -6.368 6.040 1.00 0.00 H new ATOM 0 HE1 MET A 97 -5.340 -5.329 2.670 1.00 0.00 H new ATOM 0 HE2 MET A 97 -5.841 -5.056 4.355 1.00 0.00 H new ATOM 0 HE3 MET A 97 -4.115 -5.216 3.955 1.00 0.00 H new ATOM 880 N ALA A 98 -5.260 -7.075 8.782 1.00 0.00 N ATOM 881 CA ALA A 98 -5.269 -5.972 9.784 1.00 0.00 C ATOM 882 C ALA A 98 -3.884 -5.857 10.422 1.00 0.00 C ATOM 883 O ALA A 98 -3.480 -4.802 10.866 1.00 0.00 O ATOM 884 CB ALA A 98 -6.309 -6.272 10.867 1.00 0.00 C ATOM 0 H ALA A 98 -6.034 -7.735 8.855 1.00 0.00 H new ATOM 0 HA ALA A 98 -5.522 -5.033 9.291 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -6.315 -5.465 11.599 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -7.296 -6.355 10.411 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -6.058 -7.210 11.363 1.00 0.00 H new ATOM 890 N SER A 99 -3.145 -6.934 10.459 1.00 0.00 N ATOM 891 CA SER A 99 -1.782 -6.872 11.055 1.00 0.00 C ATOM 892 C SER A 99 -0.868 -6.121 10.090 1.00 0.00 C ATOM 893 O SER A 99 0.003 -5.375 10.493 1.00 0.00 O ATOM 894 CB SER A 99 -1.250 -8.292 11.274 1.00 0.00 C ATOM 895 OG SER A 99 -0.521 -8.705 10.126 1.00 0.00 O ATOM 0 H SER A 99 -3.426 -7.848 10.104 1.00 0.00 H new ATOM 0 HA SER A 99 -1.815 -6.357 12.015 1.00 0.00 H new ATOM 0 HB2 SER A 99 -0.609 -8.320 12.155 1.00 0.00 H new ATOM 0 HB3 SER A 99 -2.077 -8.978 11.459 1.00 0.00 H new ATOM 0 HG SER A 99 0.439 -8.599 10.292 1.00 0.00 H new ATOM 901 N PHE A 100 -1.071 -6.300 8.812 1.00 0.00 N ATOM 902 CA PHE A 100 -0.226 -5.586 7.820 1.00 0.00 C ATOM 903 C PHE A 100 -0.595 -4.103 7.837 1.00 0.00 C ATOM 904 O PHE A 100 0.257 -3.241 7.895 1.00 0.00 O ATOM 905 CB PHE A 100 -0.467 -6.157 6.421 1.00 0.00 C ATOM 906 CG PHE A 100 0.289 -5.321 5.412 1.00 0.00 C ATOM 907 CD1 PHE A 100 1.695 -5.267 5.465 1.00 0.00 C ATOM 908 CD2 PHE A 100 -0.408 -4.585 4.434 1.00 0.00 C ATOM 909 CE1 PHE A 100 2.404 -4.476 4.542 1.00 0.00 C ATOM 910 CE2 PHE A 100 0.302 -3.796 3.508 1.00 0.00 C ATOM 911 CZ PHE A 100 1.710 -3.741 3.564 1.00 0.00 C ATOM 0 H PHE A 100 -1.786 -6.910 8.415 1.00 0.00 H new ATOM 0 HA PHE A 100 0.826 -5.713 8.076 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -0.135 -7.194 6.375 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -1.532 -6.153 6.191 1.00 0.00 H new ATOM 0 HD1 PHE A 100 2.229 -5.833 6.214 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -1.486 -4.626 4.394 1.00 0.00 H new ATOM 0 HE1 PHE A 100 3.482 -4.433 4.585 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -0.231 -3.234 2.756 1.00 0.00 H new ATOM 0 HZ PHE A 100 2.255 -3.135 2.856 1.00 0.00 H new ATOM 921 N ILE A 101 -1.861 -3.794 7.793 1.00 0.00 N ATOM 922 CA ILE A 101 -2.265 -2.364 7.817 1.00 0.00 C ATOM 923 C ILE A 101 -1.845 -1.775 9.162 1.00 0.00 C ATOM 924 O ILE A 101 -1.397 -0.649 9.243 1.00 0.00 O ATOM 925 CB ILE A 101 -3.786 -2.256 7.602 1.00 0.00 C ATOM 926 CG1 ILE A 101 -4.094 -2.688 6.159 1.00 0.00 C ATOM 927 CG2 ILE A 101 -4.275 -0.813 7.826 1.00 0.00 C ATOM 928 CD1 ILE A 101 -5.550 -2.377 5.803 1.00 0.00 C ATOM 0 H ILE A 101 -2.627 -4.465 7.742 1.00 0.00 H new ATOM 0 HA ILE A 101 -1.779 -1.805 7.017 1.00 0.00 H new ATOM 0 HB ILE A 101 -4.300 -2.897 8.318 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -3.427 -2.172 5.469 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -3.906 -3.756 6.045 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -5.352 -0.765 7.668 1.00 0.00 H new ATOM 0 HG22 ILE A 101 -4.044 -0.505 8.846 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -3.775 -0.146 7.123 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -5.749 -2.690 4.778 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -6.213 -2.914 6.481 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -5.726 -1.305 5.896 1.00 0.00 H new ATOM 940 N ARG A 102 -1.962 -2.528 10.216 1.00 0.00 N ATOM 941 CA ARG A 102 -1.542 -2.002 11.539 1.00 0.00 C ATOM 942 C ARG A 102 -0.072 -1.591 11.436 1.00 0.00 C ATOM 943 O ARG A 102 0.384 -0.698 12.122 1.00 0.00 O ATOM 944 CB ARG A 102 -1.743 -3.092 12.606 1.00 0.00 C ATOM 945 CG ARG A 102 -0.903 -2.792 13.867 1.00 0.00 C ATOM 946 CD ARG A 102 0.570 -3.251 13.692 1.00 0.00 C ATOM 947 NE ARG A 102 1.012 -4.034 14.893 1.00 0.00 N ATOM 948 CZ ARG A 102 0.788 -3.603 16.108 1.00 0.00 C ATOM 949 NH1 ARG A 102 0.238 -2.437 16.304 1.00 0.00 N ATOM 950 NH2 ARG A 102 1.138 -4.335 17.130 1.00 0.00 N ATOM 0 H ARG A 102 -2.328 -3.480 10.219 1.00 0.00 H new ATOM 0 HA ARG A 102 -2.138 -1.137 11.828 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -2.798 -3.154 12.873 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -1.460 -4.062 12.198 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -0.929 -1.723 14.077 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -1.343 -3.297 14.727 1.00 0.00 H new ATOM 0 HD2 ARG A 102 0.664 -3.862 12.795 1.00 0.00 H new ATOM 0 HD3 ARG A 102 1.216 -2.383 13.556 1.00 0.00 H new ATOM 0 HE ARG A 102 1.497 -4.921 14.760 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -0.021 -1.855 15.507 1.00 0.00 H new ATOM 0 HH12 ARG A 102 0.066 -2.107 17.254 1.00 0.00 H new ATOM 0 HH21 ARG A 102 1.585 -5.240 16.980 1.00 0.00 H new ATOM 0 HH22 ARG A 102 0.965 -4.002 18.079 1.00 0.00 H new ATOM 964 N GLN A 103 0.669 -2.222 10.560 1.00 0.00 N ATOM 965 CA GLN A 103 2.100 -1.855 10.390 1.00 0.00 C ATOM 966 C GLN A 103 2.187 -0.650 9.449 1.00 0.00 C ATOM 967 O GLN A 103 3.156 0.082 9.452 1.00 0.00 O ATOM 968 CB GLN A 103 2.872 -3.033 9.791 1.00 0.00 C ATOM 969 CG GLN A 103 3.086 -4.107 10.860 1.00 0.00 C ATOM 970 CD GLN A 103 4.003 -5.201 10.308 1.00 0.00 C ATOM 971 OE1 GLN A 103 5.106 -5.384 10.784 1.00 0.00 O ATOM 972 NE2 GLN A 103 3.589 -5.943 9.316 1.00 0.00 N ATOM 0 H GLN A 103 0.340 -2.976 9.956 1.00 0.00 H new ATOM 0 HA GLN A 103 2.535 -1.606 11.358 1.00 0.00 H new ATOM 0 HB2 GLN A 103 2.321 -3.450 8.948 1.00 0.00 H new ATOM 0 HB3 GLN A 103 3.833 -2.692 9.407 1.00 0.00 H new ATOM 0 HG2 GLN A 103 3.527 -3.664 11.753 1.00 0.00 H new ATOM 0 HG3 GLN A 103 2.129 -4.536 11.157 1.00 0.00 H new ATOM 0 HE21 GLN A 103 2.663 -5.790 8.916 1.00 0.00 H new ATOM 0 HE22 GLN A 103 4.191 -6.676 8.941 1.00 0.00 H new ATOM 981 N LEU A 104 1.175 -0.426 8.650 1.00 0.00 N ATOM 982 CA LEU A 104 1.216 0.747 7.733 1.00 0.00 C ATOM 983 C LEU A 104 1.061 2.017 8.572 1.00 0.00 C ATOM 984 O LEU A 104 1.747 2.995 8.364 1.00 0.00 O ATOM 985 CB LEU A 104 0.082 0.664 6.692 1.00 0.00 C ATOM 986 CG LEU A 104 0.461 -0.280 5.533 1.00 0.00 C ATOM 987 CD1 LEU A 104 -0.727 -0.378 4.568 1.00 0.00 C ATOM 988 CD2 LEU A 104 1.699 0.254 4.769 1.00 0.00 C ATOM 0 H LEU A 104 0.333 -0.998 8.594 1.00 0.00 H new ATOM 0 HA LEU A 104 2.165 0.759 7.197 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -0.830 0.309 7.171 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -0.130 1.659 6.300 1.00 0.00 H new ATOM 0 HG LEU A 104 0.704 -1.261 5.940 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -0.472 -1.043 3.743 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -1.594 -0.773 5.097 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -0.961 0.612 4.177 1.00 0.00 H new ATOM 0 HD21 LEU A 104 1.947 -0.429 3.956 1.00 0.00 H new ATOM 0 HD22 LEU A 104 1.477 1.240 4.360 1.00 0.00 H new ATOM 0 HD23 LEU A 104 2.545 0.327 5.453 1.00 0.00 H new ATOM 1000 N ASN A 105 0.179 2.006 9.533 1.00 0.00 N ATOM 1001 CA ASN A 105 0.011 3.213 10.386 1.00 0.00 C ATOM 1002 C ASN A 105 1.216 3.320 11.321 1.00 0.00 C ATOM 1003 O ASN A 105 1.371 4.278 12.052 1.00 0.00 O ATOM 1004 CB ASN A 105 -1.271 3.089 11.212 1.00 0.00 C ATOM 1005 CG ASN A 105 -2.478 3.015 10.275 1.00 0.00 C ATOM 1006 OD1 ASN A 105 -2.291 2.771 9.008 1.00 0.00 O flip ATOM 1007 ND2 ASN A 105 -3.604 3.179 10.703 1.00 0.00 N flip ATOM 0 H ASN A 105 -0.428 1.219 9.763 1.00 0.00 H new ATOM 0 HA ASN A 105 -0.057 4.103 9.761 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -1.228 2.198 11.838 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -1.369 3.944 11.881 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -3.750 3.370 11.694 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -4.403 3.126 10.071 1.00 0.00 H new ATOM 1014 N MET A 106 2.073 2.335 11.294 1.00 0.00 N ATOM 1015 CA MET A 106 3.279 2.360 12.169 1.00 0.00 C ATOM 1016 C MET A 106 4.380 3.173 11.486 1.00 0.00 C ATOM 1017 O MET A 106 5.126 3.885 12.128 1.00 0.00 O ATOM 1018 CB MET A 106 3.774 0.927 12.389 1.00 0.00 C ATOM 1019 CG MET A 106 4.822 0.889 13.511 1.00 0.00 C ATOM 1020 SD MET A 106 3.994 0.649 15.101 1.00 0.00 S ATOM 1021 CE MET A 106 3.886 -1.154 15.016 1.00 0.00 C ATOM 0 H MET A 106 1.988 1.510 10.700 1.00 0.00 H new ATOM 0 HA MET A 106 3.027 2.813 13.128 1.00 0.00 H new ATOM 0 HB2 MET A 106 2.934 0.281 12.645 1.00 0.00 H new ATOM 0 HB3 MET A 106 4.205 0.539 11.466 1.00 0.00 H new ATOM 0 HG2 MET A 106 5.532 0.081 13.333 1.00 0.00 H new ATOM 0 HG3 MET A 106 5.392 1.818 13.522 1.00 0.00 H new ATOM 0 HE1 MET A 106 3.034 -1.496 15.604 1.00 0.00 H new ATOM 0 HE2 MET A 106 3.758 -1.462 13.978 1.00 0.00 H new ATOM 0 HE3 MET A 106 4.801 -1.592 15.415 1.00 0.00 H new ATOM 1031 N TYR A 107 4.491 3.067 10.189 1.00 0.00 N ATOM 1032 CA TYR A 107 5.548 3.827 9.469 1.00 0.00 C ATOM 1033 C TYR A 107 5.097 5.278 9.277 1.00 0.00 C ATOM 1034 O TYR A 107 5.842 6.202 9.541 1.00 0.00 O ATOM 1035 CB TYR A 107 5.807 3.176 8.108 1.00 0.00 C ATOM 1036 CG TYR A 107 5.907 1.669 8.266 1.00 0.00 C ATOM 1037 CD1 TYR A 107 6.825 1.110 9.178 1.00 0.00 C ATOM 1038 CD2 TYR A 107 5.082 0.824 7.497 1.00 0.00 C ATOM 1039 CE1 TYR A 107 6.915 -0.288 9.320 1.00 0.00 C ATOM 1040 CE2 TYR A 107 5.172 -0.574 7.639 1.00 0.00 C ATOM 1041 CZ TYR A 107 6.089 -1.130 8.551 1.00 0.00 C ATOM 1042 OH TYR A 107 6.179 -2.499 8.690 1.00 0.00 O ATOM 0 H TYR A 107 3.895 2.487 9.599 1.00 0.00 H new ATOM 0 HA TYR A 107 6.468 3.815 10.053 1.00 0.00 H new ATOM 0 HB2 TYR A 107 5.002 3.425 7.417 1.00 0.00 H new ATOM 0 HB3 TYR A 107 6.729 3.567 7.678 1.00 0.00 H new ATOM 0 HD1 TYR A 107 7.460 1.754 9.768 1.00 0.00 H new ATOM 0 HD2 TYR A 107 4.379 1.250 6.797 1.00 0.00 H new ATOM 0 HE1 TYR A 107 7.618 -0.715 10.020 1.00 0.00 H new ATOM 0 HE2 TYR A 107 4.538 -1.219 7.049 1.00 0.00 H new ATOM 0 HH TYR A 107 5.539 -2.932 8.087 1.00 0.00 H new ATOM 1052 N GLY A 108 3.882 5.498 8.830 1.00 0.00 N ATOM 1053 CA GLY A 108 3.400 6.903 8.640 1.00 0.00 C ATOM 1054 C GLY A 108 2.474 6.990 7.422 1.00 0.00 C ATOM 1055 O GLY A 108 2.418 8.002 6.751 1.00 0.00 O ATOM 0 H GLY A 108 3.208 4.771 8.590 1.00 0.00 H new ATOM 0 HA2 GLY A 108 2.870 7.236 9.532 1.00 0.00 H new ATOM 0 HA3 GLY A 108 4.251 7.571 8.506 1.00 0.00 H new ATOM 1059 N PHE A 109 1.743 5.949 7.129 1.00 0.00 N ATOM 1060 CA PHE A 109 0.820 5.991 5.957 1.00 0.00 C ATOM 1061 C PHE A 109 -0.529 6.566 6.397 1.00 0.00 C ATOM 1062 O PHE A 109 -0.799 6.710 7.573 1.00 0.00 O ATOM 1063 CB PHE A 109 0.614 4.572 5.427 1.00 0.00 C ATOM 1064 CG PHE A 109 1.834 4.126 4.655 1.00 0.00 C ATOM 1065 CD1 PHE A 109 2.940 3.592 5.339 1.00 0.00 C ATOM 1066 CD2 PHE A 109 1.861 4.231 3.250 1.00 0.00 C ATOM 1067 CE1 PHE A 109 4.072 3.159 4.622 1.00 0.00 C ATOM 1068 CE2 PHE A 109 2.995 3.802 2.535 1.00 0.00 C ATOM 1069 CZ PHE A 109 4.099 3.264 3.221 1.00 0.00 C ATOM 0 H PHE A 109 1.744 5.072 7.649 1.00 0.00 H new ATOM 0 HA PHE A 109 1.248 6.617 5.174 1.00 0.00 H new ATOM 0 HB2 PHE A 109 0.428 3.889 6.256 1.00 0.00 H new ATOM 0 HB3 PHE A 109 -0.265 4.539 4.784 1.00 0.00 H new ATOM 0 HD1 PHE A 109 2.921 3.514 6.416 1.00 0.00 H new ATOM 0 HD2 PHE A 109 1.012 4.640 2.722 1.00 0.00 H new ATOM 0 HE1 PHE A 109 4.920 2.746 5.149 1.00 0.00 H new ATOM 0 HE2 PHE A 109 3.018 3.886 1.459 1.00 0.00 H new ATOM 0 HZ PHE A 109 4.967 2.932 2.671 1.00 0.00 H new ATOM 1079 N HIS A 110 -1.384 6.891 5.461 1.00 0.00 N ATOM 1080 CA HIS A 110 -2.720 7.453 5.826 1.00 0.00 C ATOM 1081 C HIS A 110 -3.743 7.082 4.749 1.00 0.00 C ATOM 1082 O HIS A 110 -3.738 7.627 3.662 1.00 0.00 O ATOM 1083 CB HIS A 110 -2.621 8.976 5.932 1.00 0.00 C ATOM 1084 CG HIS A 110 -3.964 9.541 6.310 1.00 0.00 C ATOM 1085 ND1 HIS A 110 -4.603 9.198 7.491 1.00 0.00 N ATOM 1086 CD2 HIS A 110 -4.799 10.425 5.675 1.00 0.00 C ATOM 1087 CE1 HIS A 110 -5.771 9.867 7.529 1.00 0.00 C ATOM 1088 NE2 HIS A 110 -5.940 10.630 6.446 1.00 0.00 N ATOM 0 H HIS A 110 -1.215 6.792 4.460 1.00 0.00 H new ATOM 0 HA HIS A 110 -3.037 7.041 6.784 1.00 0.00 H new ATOM 0 HB2 HIS A 110 -1.876 9.252 6.678 1.00 0.00 H new ATOM 0 HB3 HIS A 110 -2.292 9.397 4.982 1.00 0.00 H new ATOM 0 HD2 HIS A 110 -4.601 10.891 4.721 1.00 0.00 H new ATOM 0 HE1 HIS A 110 -6.484 9.795 8.337 1.00 0.00 H new ATOM 0 HE2 HIS A 110 -6.734 11.233 6.230 1.00 0.00 H new ATOM 1096 N LYS A 111 -4.624 6.161 5.039 1.00 0.00 N ATOM 1097 CA LYS A 111 -5.644 5.761 4.031 1.00 0.00 C ATOM 1098 C LYS A 111 -6.780 6.788 4.025 1.00 0.00 C ATOM 1099 O LYS A 111 -7.278 7.185 5.060 1.00 0.00 O ATOM 1100 CB LYS A 111 -6.189 4.376 4.385 1.00 0.00 C ATOM 1101 CG LYS A 111 -6.810 4.401 5.791 1.00 0.00 C ATOM 1102 CD LYS A 111 -6.951 2.971 6.348 1.00 0.00 C ATOM 1103 CE LYS A 111 -8.188 2.294 5.751 1.00 0.00 C ATOM 1104 NZ LYS A 111 -8.156 0.837 6.066 1.00 0.00 N ATOM 0 H LYS A 111 -4.680 5.670 5.931 1.00 0.00 H new ATOM 0 HA LYS A 111 -5.192 5.724 3.040 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -6.937 4.072 3.653 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -5.387 3.639 4.345 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -6.188 4.997 6.459 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -7.788 4.881 5.754 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -6.059 2.391 6.111 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -7.032 3.002 7.435 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -9.094 2.745 6.156 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -8.213 2.443 4.672 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -8.996 0.376 5.661 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -7.298 0.413 5.659 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -8.152 0.705 7.098 1.00 0.00 H new ATOM 1118 N ILE A 112 -7.183 7.233 2.863 1.00 0.00 N ATOM 1119 CA ILE A 112 -8.275 8.248 2.780 1.00 0.00 C ATOM 1120 C ILE A 112 -9.638 7.550 2.748 1.00 0.00 C ATOM 1121 O ILE A 112 -10.387 7.677 1.800 1.00 0.00 O ATOM 1122 CB ILE A 112 -8.099 9.073 1.498 1.00 0.00 C ATOM 1123 CG1 ILE A 112 -6.617 9.466 1.325 1.00 0.00 C ATOM 1124 CG2 ILE A 112 -8.989 10.327 1.548 1.00 0.00 C ATOM 1125 CD1 ILE A 112 -6.041 10.027 2.632 1.00 0.00 C ATOM 0 H ILE A 112 -6.801 6.936 1.965 1.00 0.00 H new ATOM 0 HA ILE A 112 -8.227 8.900 3.653 1.00 0.00 H new ATOM 0 HB ILE A 112 -8.402 8.470 0.642 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -6.040 8.595 1.013 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -6.524 10.210 0.534 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -8.856 10.904 0.633 1.00 0.00 H new ATOM 0 HG22 ILE A 112 -10.033 10.029 1.640 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -8.709 10.938 2.407 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -4.995 10.296 2.483 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -6.605 10.912 2.928 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -6.113 9.272 3.415 1.00 0.00 H new ATOM 1137 N THR A 113 -9.972 6.819 3.777 1.00 0.00 N ATOM 1138 CA THR A 113 -11.292 6.126 3.798 1.00 0.00 C ATOM 1139 C THR A 113 -11.660 5.765 5.238 1.00 0.00 C ATOM 1140 O THR A 113 -10.920 6.030 6.163 1.00 0.00 O ATOM 1141 CB THR A 113 -11.212 4.850 2.954 1.00 0.00 C ATOM 1142 OG1 THR A 113 -12.379 4.068 3.173 1.00 0.00 O ATOM 1143 CG2 THR A 113 -9.974 4.042 3.347 1.00 0.00 C ATOM 0 H THR A 113 -9.390 6.672 4.602 1.00 0.00 H new ATOM 0 HA THR A 113 -12.055 6.787 3.386 1.00 0.00 H new ATOM 0 HB THR A 113 -11.142 5.119 1.900 1.00 0.00 H new ATOM 0 HG1 THR A 113 -12.332 3.252 2.633 1.00 0.00 H new ATOM 0 HG21 THR A 113 -9.924 3.136 2.743 1.00 0.00 H new ATOM 0 HG22 THR A 113 -9.079 4.641 3.178 1.00 0.00 H new ATOM 0 HG23 THR A 113 -10.035 3.772 4.401 1.00 0.00 H new ATOM 1332 N GLU A 126 -11.922 3.133 -2.428 1.00 0.00 N ATOM 1333 CA GLU A 126 -11.020 1.954 -2.312 1.00 0.00 C ATOM 1334 C GLU A 126 -9.818 2.291 -1.413 1.00 0.00 C ATOM 1335 O GLU A 126 -9.175 3.301 -1.581 1.00 0.00 O ATOM 1336 CB GLU A 126 -10.556 1.554 -3.713 1.00 0.00 C ATOM 1337 CG GLU A 126 -11.713 0.883 -4.460 1.00 0.00 C ATOM 1338 CD GLU A 126 -11.287 0.578 -5.897 1.00 0.00 C ATOM 1339 OE1 GLU A 126 -10.245 1.068 -6.302 1.00 0.00 O ATOM 1340 OE2 GLU A 126 -12.009 -0.140 -6.568 1.00 0.00 O ATOM 0 HA GLU A 126 -11.553 1.120 -1.856 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -10.216 2.433 -4.260 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -9.708 0.873 -3.646 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -12.002 -0.037 -3.952 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -12.586 1.535 -4.459 1.00 0.00 H new ATOM 1347 N ILE A 127 -9.527 1.440 -0.455 1.00 0.00 N ATOM 1348 CA ILE A 127 -8.374 1.675 0.486 1.00 0.00 C ATOM 1349 C ILE A 127 -7.195 2.330 -0.257 1.00 0.00 C ATOM 1350 O ILE A 127 -6.304 1.671 -0.747 1.00 0.00 O ATOM 1351 CB ILE A 127 -7.959 0.316 1.093 1.00 0.00 C ATOM 1352 CG1 ILE A 127 -6.723 0.467 2.006 1.00 0.00 C ATOM 1353 CG2 ILE A 127 -7.650 -0.693 -0.021 1.00 0.00 C ATOM 1354 CD1 ILE A 127 -6.210 -0.924 2.417 1.00 0.00 C ATOM 0 H ILE A 127 -10.045 0.579 -0.280 1.00 0.00 H new ATOM 0 HA ILE A 127 -8.674 2.356 1.283 1.00 0.00 H new ATOM 0 HB ILE A 127 -8.793 -0.048 1.693 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -5.938 1.015 1.485 1.00 0.00 H new ATOM 0 HG13 ILE A 127 -6.982 1.046 2.892 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -7.359 -1.646 0.421 1.00 0.00 H new ATOM 0 HG22 ILE A 127 -8.537 -0.836 -0.639 1.00 0.00 H new ATOM 0 HG23 ILE A 127 -6.835 -0.315 -0.638 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -5.338 -0.814 3.061 1.00 0.00 H new ATOM 0 HD12 ILE A 127 -6.994 -1.457 2.955 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -5.934 -1.488 1.526 1.00 0.00 H new ATOM 1366 N GLU A 128 -7.193 3.635 -0.342 1.00 0.00 N ATOM 1367 CA GLU A 128 -6.091 4.353 -1.055 1.00 0.00 C ATOM 1368 C GLU A 128 -5.064 4.872 -0.043 1.00 0.00 C ATOM 1369 O GLU A 128 -5.320 5.794 0.703 1.00 0.00 O ATOM 1370 CB GLU A 128 -6.683 5.530 -1.842 1.00 0.00 C ATOM 1371 CG GLU A 128 -7.802 6.186 -1.029 1.00 0.00 C ATOM 1372 CD GLU A 128 -8.287 7.444 -1.753 1.00 0.00 C ATOM 1373 OE1 GLU A 128 -7.446 8.225 -2.169 1.00 0.00 O ATOM 1374 OE2 GLU A 128 -9.489 7.605 -1.880 1.00 0.00 O ATOM 0 H GLU A 128 -7.912 4.240 0.055 1.00 0.00 H new ATOM 0 HA GLU A 128 -5.595 3.666 -1.740 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -5.905 6.261 -2.062 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -7.072 5.181 -2.798 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -8.628 5.487 -0.898 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -7.440 6.443 -0.033 1.00 0.00 H new ATOM 1381 N PHE A 129 -3.895 4.291 -0.026 1.00 0.00 N ATOM 1382 CA PHE A 129 -2.843 4.756 0.923 1.00 0.00 C ATOM 1383 C PHE A 129 -2.101 5.937 0.298 1.00 0.00 C ATOM 1384 O PHE A 129 -1.558 5.833 -0.787 1.00 0.00 O ATOM 1385 CB PHE A 129 -1.854 3.617 1.185 1.00 0.00 C ATOM 1386 CG PHE A 129 -2.452 2.631 2.164 1.00 0.00 C ATOM 1387 CD1 PHE A 129 -2.727 3.032 3.486 1.00 0.00 C ATOM 1388 CD2 PHE A 129 -2.730 1.311 1.757 1.00 0.00 C ATOM 1389 CE1 PHE A 129 -3.280 2.116 4.400 1.00 0.00 C ATOM 1390 CE2 PHE A 129 -3.282 0.395 2.672 1.00 0.00 C ATOM 1391 CZ PHE A 129 -3.558 0.798 3.993 1.00 0.00 C ATOM 0 H PHE A 129 -3.623 3.514 -0.628 1.00 0.00 H new ATOM 0 HA PHE A 129 -3.301 5.061 1.864 1.00 0.00 H new ATOM 0 HB2 PHE A 129 -1.611 3.112 0.250 1.00 0.00 H new ATOM 0 HB3 PHE A 129 -0.922 4.018 1.583 1.00 0.00 H new ATOM 0 HD1 PHE A 129 -2.513 4.043 3.798 1.00 0.00 H new ATOM 0 HD2 PHE A 129 -2.520 1.002 0.744 1.00 0.00 H new ATOM 0 HE1 PHE A 129 -3.491 2.424 5.413 1.00 0.00 H new ATOM 0 HE2 PHE A 129 -3.494 -0.617 2.361 1.00 0.00 H new ATOM 0 HZ PHE A 129 -3.983 0.095 4.694 1.00 0.00 H new ATOM 1401 N SER A 130 -2.078 7.061 0.974 1.00 0.00 N ATOM 1402 CA SER A 130 -1.378 8.270 0.433 1.00 0.00 C ATOM 1403 C SER A 130 -0.209 8.641 1.339 1.00 0.00 C ATOM 1404 O SER A 130 -0.369 9.317 2.336 1.00 0.00 O ATOM 1405 CB SER A 130 -2.361 9.439 0.371 1.00 0.00 C ATOM 1406 OG SER A 130 -1.773 10.508 -0.358 1.00 0.00 O ATOM 0 H SER A 130 -2.518 7.194 1.885 1.00 0.00 H new ATOM 0 HA SER A 130 -1.003 8.050 -0.566 1.00 0.00 H new ATOM 0 HB2 SER A 130 -3.289 9.124 -0.107 1.00 0.00 H new ATOM 0 HB3 SER A 130 -2.617 9.768 1.378 1.00 0.00 H new ATOM 0 HG SER A 130 -2.401 11.259 -0.401 1.00 0.00 H new ATOM 1412 N HIS A 131 0.973 8.210 0.990 1.00 0.00 N ATOM 1413 CA HIS A 131 2.171 8.540 1.813 1.00 0.00 C ATOM 1414 C HIS A 131 2.826 9.813 1.228 1.00 0.00 C ATOM 1415 O HIS A 131 3.041 9.866 0.033 1.00 0.00 O ATOM 1416 CB HIS A 131 3.162 7.374 1.723 1.00 0.00 C ATOM 1417 CG HIS A 131 4.148 7.451 2.855 1.00 0.00 C ATOM 1418 ND1 HIS A 131 5.051 8.494 2.983 1.00 0.00 N ATOM 1419 CD2 HIS A 131 4.382 6.618 3.916 1.00 0.00 C ATOM 1420 CE1 HIS A 131 5.782 8.261 4.090 1.00 0.00 C ATOM 1421 NE2 HIS A 131 5.414 7.130 4.696 1.00 0.00 N ATOM 0 H HIS A 131 1.161 7.640 0.165 1.00 0.00 H new ATOM 0 HA HIS A 131 1.891 8.707 2.853 1.00 0.00 H new ATOM 0 HB2 HIS A 131 2.626 6.426 1.761 1.00 0.00 H new ATOM 0 HB3 HIS A 131 3.688 7.405 0.769 1.00 0.00 H new ATOM 0 HD2 HIS A 131 3.846 5.702 4.117 1.00 0.00 H new ATOM 0 HE1 HIS A 131 6.569 8.910 4.444 1.00 0.00 H new ATOM 0 HE2 HIS A 131 5.805 6.728 5.548 1.00 0.00 H new ATOM 1429 N PRO A 132 3.133 10.811 2.043 1.00 0.00 N ATOM 1430 CA PRO A 132 3.758 12.041 1.518 1.00 0.00 C ATOM 1431 C PRO A 132 5.136 11.727 0.910 1.00 0.00 C ATOM 1432 O PRO A 132 5.883 12.623 0.570 1.00 0.00 O ATOM 1433 CB PRO A 132 3.890 12.978 2.744 1.00 0.00 C ATOM 1434 CG PRO A 132 3.474 12.160 3.999 1.00 0.00 C ATOM 1435 CD PRO A 132 2.898 10.815 3.506 1.00 0.00 C ATOM 0 HA PRO A 132 3.169 12.498 0.723 1.00 0.00 H new ATOM 0 HB2 PRO A 132 4.914 13.339 2.843 1.00 0.00 H new ATOM 0 HB3 PRO A 132 3.252 13.854 2.628 1.00 0.00 H new ATOM 0 HG2 PRO A 132 4.332 11.994 4.650 1.00 0.00 H new ATOM 0 HG3 PRO A 132 2.732 12.704 4.583 1.00 0.00 H new ATOM 0 HD2 PRO A 132 3.394 9.973 3.988 1.00 0.00 H new ATOM 0 HD3 PRO A 132 1.836 10.733 3.735 1.00 0.00 H new ATOM 1443 N PHE A 133 5.492 10.472 0.779 1.00 0.00 N ATOM 1444 CA PHE A 133 6.835 10.144 0.203 1.00 0.00 C ATOM 1445 C PHE A 133 6.806 8.791 -0.527 1.00 0.00 C ATOM 1446 O PHE A 133 7.680 7.968 -0.341 1.00 0.00 O ATOM 1447 CB PHE A 133 7.864 10.082 1.337 1.00 0.00 C ATOM 1448 CG PHE A 133 8.197 11.482 1.804 1.00 0.00 C ATOM 1449 CD1 PHE A 133 7.370 12.125 2.744 1.00 0.00 C ATOM 1450 CD2 PHE A 133 9.334 12.141 1.299 1.00 0.00 C ATOM 1451 CE1 PHE A 133 7.680 13.428 3.180 1.00 0.00 C ATOM 1452 CE2 PHE A 133 9.645 13.443 1.735 1.00 0.00 C ATOM 1453 CZ PHE A 133 8.818 14.087 2.675 1.00 0.00 C ATOM 0 H PHE A 133 4.920 9.670 1.042 1.00 0.00 H new ATOM 0 HA PHE A 133 7.105 10.919 -0.515 1.00 0.00 H new ATOM 0 HB2 PHE A 133 7.469 9.496 2.167 1.00 0.00 H new ATOM 0 HB3 PHE A 133 8.768 9.579 0.993 1.00 0.00 H new ATOM 0 HD1 PHE A 133 6.498 11.619 3.131 1.00 0.00 H new ATOM 0 HD2 PHE A 133 9.968 11.648 0.577 1.00 0.00 H new ATOM 0 HE1 PHE A 133 7.045 13.922 3.901 1.00 0.00 H new ATOM 0 HE2 PHE A 133 10.518 13.948 1.348 1.00 0.00 H new ATOM 0 HZ PHE A 133 9.056 15.086 3.009 1.00 0.00 H new ATOM 1463 N PHE A 134 5.829 8.551 -1.365 1.00 0.00 N ATOM 1464 CA PHE A 134 5.788 7.247 -2.104 1.00 0.00 C ATOM 1465 C PHE A 134 5.075 7.432 -3.447 1.00 0.00 C ATOM 1466 O PHE A 134 4.163 6.700 -3.778 1.00 0.00 O ATOM 1467 CB PHE A 134 5.045 6.202 -1.269 1.00 0.00 C ATOM 1468 CG PHE A 134 5.301 4.824 -1.832 1.00 0.00 C ATOM 1469 CD1 PHE A 134 6.521 4.171 -1.566 1.00 0.00 C ATOM 1470 CD2 PHE A 134 4.321 4.188 -2.620 1.00 0.00 C ATOM 1471 CE1 PHE A 134 6.760 2.885 -2.088 1.00 0.00 C ATOM 1472 CE2 PHE A 134 4.560 2.902 -3.141 1.00 0.00 C ATOM 1473 CZ PHE A 134 5.780 2.251 -2.875 1.00 0.00 C ATOM 0 H PHE A 134 5.064 9.193 -1.570 1.00 0.00 H new ATOM 0 HA PHE A 134 6.808 6.907 -2.283 1.00 0.00 H new ATOM 0 HB2 PHE A 134 5.376 6.249 -0.232 1.00 0.00 H new ATOM 0 HB3 PHE A 134 3.976 6.414 -1.272 1.00 0.00 H new ATOM 0 HD1 PHE A 134 7.273 4.657 -0.962 1.00 0.00 H new ATOM 0 HD2 PHE A 134 3.386 4.688 -2.825 1.00 0.00 H new ATOM 0 HE1 PHE A 134 7.695 2.385 -1.884 1.00 0.00 H new ATOM 0 HE2 PHE A 134 3.808 2.415 -3.744 1.00 0.00 H new ATOM 0 HZ PHE A 134 5.964 1.265 -3.275 1.00 0.00 H new ATOM 1483 N LYS A 135 5.483 8.403 -4.226 1.00 0.00 N ATOM 1484 CA LYS A 135 4.829 8.637 -5.554 1.00 0.00 C ATOM 1485 C LYS A 135 5.684 8.013 -6.663 1.00 0.00 C ATOM 1486 O LYS A 135 6.196 6.919 -6.525 1.00 0.00 O ATOM 1487 CB LYS A 135 4.694 10.152 -5.802 1.00 0.00 C ATOM 1488 CG LYS A 135 4.403 10.880 -4.486 1.00 0.00 C ATOM 1489 CD LYS A 135 3.123 10.333 -3.851 1.00 0.00 C ATOM 1490 CE LYS A 135 2.815 11.132 -2.586 1.00 0.00 C ATOM 1491 NZ LYS A 135 4.034 11.195 -1.729 1.00 0.00 N ATOM 0 H LYS A 135 6.242 9.046 -4.000 1.00 0.00 H new ATOM 0 HA LYS A 135 3.840 8.179 -5.556 1.00 0.00 H new ATOM 0 HB2 LYS A 135 5.612 10.539 -6.245 1.00 0.00 H new ATOM 0 HB3 LYS A 135 3.892 10.341 -6.516 1.00 0.00 H new ATOM 0 HG2 LYS A 135 5.240 10.754 -3.800 1.00 0.00 H new ATOM 0 HG3 LYS A 135 4.298 11.949 -4.669 1.00 0.00 H new ATOM 0 HD2 LYS A 135 2.293 10.406 -4.554 1.00 0.00 H new ATOM 0 HD3 LYS A 135 3.244 9.277 -3.609 1.00 0.00 H new ATOM 0 HE2 LYS A 135 2.490 12.139 -2.849 1.00 0.00 H new ATOM 0 HE3 LYS A 135 1.996 10.665 -2.038 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 3.837 10.745 -0.812 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 4.815 10.695 -2.199 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 4.301 12.189 -1.577 1.00 0.00 H new ATOM 1505 N ARG A 136 5.844 8.709 -7.759 1.00 0.00 N ATOM 1506 CA ARG A 136 6.666 8.182 -8.891 1.00 0.00 C ATOM 1507 C ARG A 136 7.522 9.322 -9.450 1.00 0.00 C ATOM 1508 O ARG A 136 7.496 10.430 -8.952 1.00 0.00 O ATOM 1509 CB ARG A 136 5.733 7.643 -9.991 1.00 0.00 C ATOM 1510 CG ARG A 136 5.298 6.200 -9.664 1.00 0.00 C ATOM 1511 CD ARG A 136 6.338 5.203 -10.192 1.00 0.00 C ATOM 1512 NE ARG A 136 6.492 5.376 -11.664 1.00 0.00 N ATOM 1513 CZ ARG A 136 7.522 4.860 -12.278 1.00 0.00 C ATOM 1514 NH1 ARG A 136 8.419 4.197 -11.603 1.00 0.00 N ATOM 1515 NH2 ARG A 136 7.655 5.011 -13.567 1.00 0.00 N ATOM 0 H ARG A 136 5.436 9.630 -7.920 1.00 0.00 H new ATOM 0 HA ARG A 136 7.311 7.375 -8.543 1.00 0.00 H new ATOM 0 HB2 ARG A 136 4.855 8.284 -10.079 1.00 0.00 H new ATOM 0 HB3 ARG A 136 6.243 7.667 -10.954 1.00 0.00 H new ATOM 0 HG2 ARG A 136 5.184 6.082 -8.586 1.00 0.00 H new ATOM 0 HG3 ARG A 136 4.326 5.995 -10.112 1.00 0.00 H new ATOM 0 HD2 ARG A 136 7.295 5.362 -9.695 1.00 0.00 H new ATOM 0 HD3 ARG A 136 6.027 4.183 -9.966 1.00 0.00 H new ATOM 0 HE ARG A 136 5.792 5.898 -12.192 1.00 0.00 H new ATOM 0 HH11 ARG A 136 8.316 4.081 -10.595 1.00 0.00 H new ATOM 0 HH12 ARG A 136 9.224 3.794 -12.083 1.00 0.00 H new ATOM 0 HH21 ARG A 136 6.954 5.532 -14.094 1.00 0.00 H new ATOM 0 HH22 ARG A 136 8.460 4.608 -14.047 1.00 0.00 H new ATOM 1529 N ASN A 137 8.285 9.062 -10.478 1.00 0.00 N ATOM 1530 CA ASN A 137 9.141 10.134 -11.060 1.00 0.00 C ATOM 1531 C ASN A 137 9.905 10.839 -9.937 1.00 0.00 C ATOM 1532 O ASN A 137 10.279 11.989 -10.050 1.00 0.00 O ATOM 1533 CB ASN A 137 8.261 11.149 -11.793 1.00 0.00 C ATOM 1534 CG ASN A 137 7.633 10.488 -13.021 1.00 0.00 C ATOM 1535 OD1 ASN A 137 6.441 10.584 -13.235 1.00 0.00 O ATOM 1536 ND2 ASN A 137 8.391 9.814 -13.843 1.00 0.00 N ATOM 0 H ASN A 137 8.352 8.154 -10.939 1.00 0.00 H new ATOM 0 HA ASN A 137 9.849 9.694 -11.762 1.00 0.00 H new ATOM 0 HB2 ASN A 137 7.481 11.518 -11.127 1.00 0.00 H new ATOM 0 HB3 ASN A 137 8.856 12.011 -12.095 1.00 0.00 H new ATOM 0 HD21 ASN A 137 7.982 9.368 -14.664 1.00 0.00 H new ATOM 0 HD22 ASN A 137 9.392 9.733 -13.664 1.00 0.00 H new ATOM 1543 N SER A 138 10.137 10.153 -8.850 1.00 0.00 N ATOM 1544 CA SER A 138 10.873 10.771 -7.710 1.00 0.00 C ATOM 1545 C SER A 138 11.569 9.668 -6.899 1.00 0.00 C ATOM 1546 O SER A 138 11.141 9.354 -5.808 1.00 0.00 O ATOM 1547 CB SER A 138 9.881 11.512 -6.813 1.00 0.00 C ATOM 1548 OG SER A 138 9.387 12.652 -7.501 1.00 0.00 O ATOM 0 H SER A 138 9.847 9.186 -8.702 1.00 0.00 H new ATOM 0 HA SER A 138 11.618 11.471 -8.088 1.00 0.00 H new ATOM 0 HB2 SER A 138 9.057 10.853 -6.540 1.00 0.00 H new ATOM 0 HB3 SER A 138 10.368 11.815 -5.886 1.00 0.00 H new ATOM 0 HG SER A 138 9.727 12.652 -8.420 1.00 0.00 H new ATOM 1554 N PRO A 139 12.617 9.100 -7.456 1.00 0.00 N ATOM 1555 CA PRO A 139 13.364 8.020 -6.783 1.00 0.00 C ATOM 1556 C PRO A 139 14.115 8.569 -5.555 1.00 0.00 C ATOM 1557 O PRO A 139 15.178 8.091 -5.212 1.00 0.00 O ATOM 1558 CB PRO A 139 14.352 7.496 -7.857 1.00 0.00 C ATOM 1559 CG PRO A 139 14.216 8.417 -9.106 1.00 0.00 C ATOM 1560 CD PRO A 139 13.130 9.469 -8.794 1.00 0.00 C ATOM 0 HA PRO A 139 12.712 7.229 -6.412 1.00 0.00 H new ATOM 0 HB2 PRO A 139 15.374 7.512 -7.478 1.00 0.00 H new ATOM 0 HB3 PRO A 139 14.124 6.462 -8.116 1.00 0.00 H new ATOM 0 HG2 PRO A 139 15.166 8.902 -9.329 1.00 0.00 H new ATOM 0 HG3 PRO A 139 13.942 7.833 -9.985 1.00 0.00 H new ATOM 0 HD2 PRO A 139 13.545 10.477 -8.794 1.00 0.00 H new ATOM 0 HD3 PRO A 139 12.336 9.451 -9.541 1.00 0.00 H new ATOM 1568 N PHE A 140 13.569 9.563 -4.892 1.00 0.00 N ATOM 1569 CA PHE A 140 14.248 10.141 -3.684 1.00 0.00 C ATOM 1570 C PHE A 140 13.254 10.207 -2.516 1.00 0.00 C ATOM 1571 O PHE A 140 13.490 10.874 -1.529 1.00 0.00 O ATOM 1572 CB PHE A 140 14.785 11.548 -4.021 1.00 0.00 C ATOM 1573 CG PHE A 140 13.691 12.589 -3.900 1.00 0.00 C ATOM 1574 CD1 PHE A 140 12.832 12.846 -4.987 1.00 0.00 C ATOM 1575 CD2 PHE A 140 13.536 13.304 -2.697 1.00 0.00 C ATOM 1576 CE1 PHE A 140 11.818 13.816 -4.868 1.00 0.00 C ATOM 1577 CE2 PHE A 140 12.522 14.273 -2.579 1.00 0.00 C ATOM 1578 CZ PHE A 140 11.663 14.530 -3.663 1.00 0.00 C ATOM 0 H PHE A 140 12.680 10.000 -5.136 1.00 0.00 H new ATOM 0 HA PHE A 140 15.085 9.507 -3.392 1.00 0.00 H new ATOM 0 HB2 PHE A 140 15.606 11.798 -3.349 1.00 0.00 H new ATOM 0 HB3 PHE A 140 15.188 11.555 -5.034 1.00 0.00 H new ATOM 0 HD1 PHE A 140 12.951 12.299 -5.911 1.00 0.00 H new ATOM 0 HD2 PHE A 140 14.196 13.109 -1.864 1.00 0.00 H new ATOM 0 HE1 PHE A 140 11.159 14.013 -5.701 1.00 0.00 H new ATOM 0 HE2 PHE A 140 12.403 14.820 -1.655 1.00 0.00 H new ATOM 0 HZ PHE A 140 10.885 15.274 -3.572 1.00 0.00 H new ATOM 1588 N LEU A 141 12.144 9.518 -2.623 1.00 0.00 N ATOM 1589 CA LEU A 141 11.129 9.529 -1.521 1.00 0.00 C ATOM 1590 C LEU A 141 11.224 8.220 -0.730 1.00 0.00 C ATOM 1591 O LEU A 141 10.533 8.024 0.250 1.00 0.00 O ATOM 1592 CB LEU A 141 9.720 9.644 -2.114 1.00 0.00 C ATOM 1593 CG LEU A 141 9.671 10.752 -3.169 1.00 0.00 C ATOM 1594 CD1 LEU A 141 8.278 10.781 -3.805 1.00 0.00 C ATOM 1595 CD2 LEU A 141 9.950 12.106 -2.512 1.00 0.00 C ATOM 0 H LEU A 141 11.895 8.946 -3.430 1.00 0.00 H new ATOM 0 HA LEU A 141 11.323 10.379 -0.866 1.00 0.00 H new ATOM 0 HB2 LEU A 141 9.429 8.694 -2.562 1.00 0.00 H new ATOM 0 HB3 LEU A 141 9.002 9.856 -1.322 1.00 0.00 H new ATOM 0 HG LEU A 141 10.425 10.557 -3.932 1.00 0.00 H new ATOM 0 HD11 LEU A 141 8.238 11.569 -4.557 1.00 0.00 H new ATOM 0 HD12 LEU A 141 8.073 9.819 -4.275 1.00 0.00 H new ATOM 0 HD13 LEU A 141 7.531 10.976 -3.036 1.00 0.00 H new ATOM 0 HD21 LEU A 141 9.914 12.891 -3.267 1.00 0.00 H new ATOM 0 HD22 LEU A 141 9.197 12.302 -1.749 1.00 0.00 H new ATOM 0 HD23 LEU A 141 10.938 12.090 -2.052 1.00 0.00 H new ATOM 1607 N LEU A 142 12.065 7.318 -1.158 1.00 0.00 N ATOM 1608 CA LEU A 142 12.202 6.013 -0.450 1.00 0.00 C ATOM 1609 C LEU A 142 13.262 6.116 0.650 1.00 0.00 C ATOM 1610 O LEU A 142 13.095 5.598 1.735 1.00 0.00 O ATOM 1611 CB LEU A 142 12.631 4.952 -1.462 1.00 0.00 C ATOM 1612 CG LEU A 142 11.574 4.820 -2.567 1.00 0.00 C ATOM 1613 CD1 LEU A 142 12.121 3.926 -3.682 1.00 0.00 C ATOM 1614 CD2 LEU A 142 10.280 4.208 -2.001 1.00 0.00 C ATOM 0 H LEU A 142 12.667 7.430 -1.974 1.00 0.00 H new ATOM 0 HA LEU A 142 11.248 5.744 0.003 1.00 0.00 H new ATOM 0 HB2 LEU A 142 13.593 5.222 -1.898 1.00 0.00 H new ATOM 0 HB3 LEU A 142 12.766 3.994 -0.961 1.00 0.00 H new ATOM 0 HG LEU A 142 11.347 5.810 -2.964 1.00 0.00 H new ATOM 0 HD11 LEU A 142 11.374 3.829 -4.470 1.00 0.00 H new ATOM 0 HD12 LEU A 142 13.027 4.371 -4.094 1.00 0.00 H new ATOM 0 HD13 LEU A 142 12.352 2.941 -3.278 1.00 0.00 H new ATOM 0 HD21 LEU A 142 9.540 4.121 -2.797 1.00 0.00 H new ATOM 0 HD22 LEU A 142 10.493 3.220 -1.594 1.00 0.00 H new ATOM 0 HD23 LEU A 142 9.889 4.850 -1.211 1.00 0.00 H new ATOM 1626 N ASP A 143 14.358 6.764 0.370 1.00 0.00 N ATOM 1627 CA ASP A 143 15.440 6.888 1.388 1.00 0.00 C ATOM 1628 C ASP A 143 15.040 7.883 2.486 1.00 0.00 C ATOM 1629 O ASP A 143 15.832 8.703 2.904 1.00 0.00 O ATOM 1630 CB ASP A 143 16.720 7.374 0.706 1.00 0.00 C ATOM 1631 CG ASP A 143 16.463 8.731 0.048 1.00 0.00 C ATOM 1632 OD1 ASP A 143 16.577 9.732 0.735 1.00 0.00 O ATOM 1633 OD2 ASP A 143 16.158 8.746 -1.133 1.00 0.00 O ATOM 0 H ASP A 143 14.552 7.215 -0.524 1.00 0.00 H new ATOM 0 HA ASP A 143 15.605 5.912 1.845 1.00 0.00 H new ATOM 0 HB2 ASP A 143 17.525 7.459 1.437 1.00 0.00 H new ATOM 0 HB3 ASP A 143 17.044 6.650 -0.042 1.00 0.00 H new ATOM 1638 N GLN A 144 13.828 7.811 2.970 1.00 0.00 N ATOM 1639 CA GLN A 144 13.399 8.745 4.051 1.00 0.00 C ATOM 1640 C GLN A 144 12.185 8.152 4.780 1.00 0.00 C ATOM 1641 O GLN A 144 11.342 8.868 5.286 1.00 0.00 O ATOM 1642 CB GLN A 144 13.041 10.120 3.450 1.00 0.00 C ATOM 1643 CG GLN A 144 12.424 9.952 2.043 1.00 0.00 C ATOM 1644 CD GLN A 144 13.514 10.066 0.970 1.00 0.00 C ATOM 1645 OE1 GLN A 144 13.669 9.102 0.107 1.00 0.00 O flip ATOM 1646 NE2 GLN A 144 14.231 11.046 0.918 1.00 0.00 N flip ATOM 0 H GLN A 144 13.118 7.146 2.664 1.00 0.00 H new ATOM 0 HA GLN A 144 14.215 8.879 4.761 1.00 0.00 H new ATOM 0 HB2 GLN A 144 12.337 10.637 4.103 1.00 0.00 H new ATOM 0 HB3 GLN A 144 13.935 10.741 3.390 1.00 0.00 H new ATOM 0 HG2 GLN A 144 11.929 8.984 1.968 1.00 0.00 H new ATOM 0 HG3 GLN A 144 11.661 10.713 1.879 1.00 0.00 H new ATOM 0 HE21 GLN A 144 14.111 11.802 1.592 1.00 0.00 H new ATOM 0 HE22 GLN A 144 14.952 11.113 0.200 1.00 0.00 H new ATOM 1655 N ILE A 145 12.095 6.846 4.841 1.00 0.00 N ATOM 1656 CA ILE A 145 10.944 6.186 5.540 1.00 0.00 C ATOM 1657 C ILE A 145 11.482 5.078 6.451 1.00 0.00 C ATOM 1658 O ILE A 145 12.215 4.209 6.022 1.00 0.00 O ATOM 1659 CB ILE A 145 9.989 5.577 4.498 1.00 0.00 C ATOM 1660 CG1 ILE A 145 9.275 6.707 3.720 1.00 0.00 C ATOM 1661 CG2 ILE A 145 8.947 4.697 5.210 1.00 0.00 C ATOM 1662 CD1 ILE A 145 8.861 6.214 2.325 1.00 0.00 C ATOM 0 H ILE A 145 12.774 6.203 4.434 1.00 0.00 H new ATOM 0 HA ILE A 145 10.404 6.922 6.135 1.00 0.00 H new ATOM 0 HB ILE A 145 10.559 4.967 3.797 1.00 0.00 H new ATOM 0 HG12 ILE A 145 8.395 7.038 4.272 1.00 0.00 H new ATOM 0 HG13 ILE A 145 9.936 7.568 3.627 1.00 0.00 H new ATOM 0 HG21 ILE A 145 8.270 4.265 4.472 1.00 0.00 H new ATOM 0 HG22 ILE A 145 9.454 3.897 5.749 1.00 0.00 H new ATOM 0 HG23 ILE A 145 8.377 5.304 5.913 1.00 0.00 H new ATOM 0 HD11 ILE A 145 8.360 7.019 1.788 1.00 0.00 H new ATOM 0 HD12 ILE A 145 9.747 5.905 1.770 1.00 0.00 H new ATOM 0 HD13 ILE A 145 8.182 5.367 2.425 1.00 0.00 H new ATOM 1674 N LYS A 146 11.122 5.102 7.708 1.00 0.00 N ATOM 1675 CA LYS A 146 11.608 4.050 8.652 1.00 0.00 C ATOM 1676 C LYS A 146 10.569 3.829 9.756 1.00 0.00 C ATOM 1677 O LYS A 146 9.593 4.545 9.856 1.00 0.00 O ATOM 1678 CB LYS A 146 12.953 4.482 9.263 1.00 0.00 C ATOM 1679 CG LYS A 146 12.754 5.601 10.299 1.00 0.00 C ATOM 1680 CD LYS A 146 11.950 6.752 9.687 1.00 0.00 C ATOM 1681 CE LYS A 146 12.122 8.012 10.539 1.00 0.00 C ATOM 1682 NZ LYS A 146 12.120 7.640 11.982 1.00 0.00 N ATOM 0 H LYS A 146 10.511 5.806 8.123 1.00 0.00 H new ATOM 0 HA LYS A 146 11.752 3.115 8.111 1.00 0.00 H new ATOM 0 HB2 LYS A 146 13.434 3.625 9.736 1.00 0.00 H new ATOM 0 HB3 LYS A 146 13.621 4.827 8.474 1.00 0.00 H new ATOM 0 HG2 LYS A 146 12.234 5.209 11.173 1.00 0.00 H new ATOM 0 HG3 LYS A 146 13.722 5.966 10.641 1.00 0.00 H new ATOM 0 HD2 LYS A 146 12.287 6.942 8.668 1.00 0.00 H new ATOM 0 HD3 LYS A 146 10.896 6.482 9.629 1.00 0.00 H new ATOM 0 HE2 LYS A 146 13.056 8.512 10.283 1.00 0.00 H new ATOM 0 HE3 LYS A 146 11.316 8.716 10.333 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 11.913 8.482 12.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 11.393 6.917 12.153 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 13.053 7.262 12.244 1.00 0.00 H new ATOM 1696 N ARG A 147 10.770 2.838 10.583 1.00 0.00 N ATOM 1697 CA ARG A 147 9.795 2.563 11.682 1.00 0.00 C ATOM 1698 C ARG A 147 10.173 3.406 12.904 1.00 0.00 C ATOM 1699 O ARG A 147 11.266 3.303 13.425 1.00 0.00 O ATOM 1700 CB ARG A 147 9.851 1.059 12.031 1.00 0.00 C ATOM 1701 CG ARG A 147 8.531 0.570 12.706 1.00 0.00 C ATOM 1702 CD ARG A 147 8.698 0.401 14.228 1.00 0.00 C ATOM 1703 NE ARG A 147 8.592 1.725 14.901 1.00 0.00 N ATOM 1704 CZ ARG A 147 8.379 1.780 16.188 1.00 0.00 C ATOM 1705 NH1 ARG A 147 8.286 0.678 16.881 1.00 0.00 N ATOM 1706 NH2 ARG A 147 8.260 2.936 16.783 1.00 0.00 N ATOM 0 H ARG A 147 11.569 2.205 10.546 1.00 0.00 H new ATOM 0 HA ARG A 147 8.783 2.822 11.370 1.00 0.00 H new ATOM 0 HB2 ARG A 147 10.031 0.482 11.124 1.00 0.00 H new ATOM 0 HB3 ARG A 147 10.692 0.872 12.699 1.00 0.00 H new ATOM 0 HG2 ARG A 147 7.733 1.285 12.505 1.00 0.00 H new ATOM 0 HG3 ARG A 147 8.227 -0.380 12.266 1.00 0.00 H new ATOM 0 HD2 ARG A 147 7.934 -0.274 14.613 1.00 0.00 H new ATOM 0 HD3 ARG A 147 9.665 -0.052 14.448 1.00 0.00 H new ATOM 0 HE ARG A 147 8.685 2.584 14.360 1.00 0.00 H new ATOM 0 HH11 ARG A 147 8.380 -0.226 16.417 1.00 0.00 H new ATOM 0 HH12 ARG A 147 8.120 0.720 17.886 1.00 0.00 H new ATOM 0 HH21 ARG A 147 8.333 3.798 16.242 1.00 0.00 H new ATOM 0 HH22 ARG A 147 8.094 2.977 17.788 1.00 0.00 H new ATOM 1720 N LYS A 148 9.281 4.247 13.357 1.00 0.00 N ATOM 1721 CA LYS A 148 9.586 5.107 14.539 1.00 0.00 C ATOM 1722 C LYS A 148 10.260 4.270 15.632 1.00 0.00 C ATOM 1723 O LYS A 148 11.304 4.622 16.143 1.00 0.00 O ATOM 1724 CB LYS A 148 8.282 5.706 15.084 1.00 0.00 C ATOM 1725 CG LYS A 148 7.800 6.852 14.173 1.00 0.00 C ATOM 1726 CD LYS A 148 8.478 8.171 14.570 1.00 0.00 C ATOM 1727 CE LYS A 148 7.881 9.317 13.750 1.00 0.00 C ATOM 1728 NZ LYS A 148 7.685 8.871 12.342 1.00 0.00 N ATOM 0 H LYS A 148 8.351 4.376 12.958 1.00 0.00 H new ATOM 0 HA LYS A 148 10.259 5.909 14.236 1.00 0.00 H new ATOM 0 HB2 LYS A 148 7.516 4.933 15.144 1.00 0.00 H new ATOM 0 HB3 LYS A 148 8.440 6.078 16.096 1.00 0.00 H new ATOM 0 HG2 LYS A 148 8.026 6.618 13.133 1.00 0.00 H new ATOM 0 HG3 LYS A 148 6.717 6.955 14.249 1.00 0.00 H new ATOM 0 HD2 LYS A 148 8.337 8.359 15.634 1.00 0.00 H new ATOM 0 HD3 LYS A 148 9.552 8.107 14.397 1.00 0.00 H new ATOM 0 HE2 LYS A 148 6.929 9.628 14.180 1.00 0.00 H new ATOM 0 HE3 LYS A 148 8.543 10.183 13.780 1.00 0.00 H new ATOM 0 HZ1 LYS A 148 7.593 9.702 11.724 1.00 0.00 H new ATOM 0 HZ2 LYS A 148 8.503 8.304 12.040 1.00 0.00 H new ATOM 0 HZ3 LYS A 148 6.822 8.294 12.277 1.00 0.00 H new