USER MOD reduce.3.24.130724 H: found=0, std=0, add=907, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 910 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 138 THR OG1 : rot -106:sc= 0.881! USER MOD Set 1.2: A 140 SER OG : rot 36:sc= -1.37 USER MOD Set 2.1: A 102 THR OG1 : rot -40:sc= 0.422 USER MOD Set 2.2: A 106 ASN :FLIP amide:sc= -1.18 F(o=-2.8,f=-0.76) USER MOD Set 3.1: A 56 TYR OH : rot 86:sc= -2.02! USER MOD Set 3.2: A 118 HIS : no HE2:sc= -8.34! C(o=-10!,f=-18!) USER MOD Single : A 41 GLN : amide:sc= -0.0937 X(o=-0.094,f=-0.019) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 THR OG1 : rot 180:sc= 0.364 USER MOD Single : A 51 SER OG : rot -74:sc= 0.946 USER MOD Single : A 55 ASN : amide:sc= -2.6 X(o=-2.6,f=-3) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 61 THR OG1 : rot 70:sc= 1.33 USER MOD Single : A 62 GLN :FLIP amide:sc=-0.00449 F(o=-0.76,f=-0.0045) USER MOD Single : A 65 GLN : amide:sc= -0.255 K(o=-0.26,f=-0.79) USER MOD Single : A 70 THR OG1 : rot 180:sc= -0.141 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot 130:sc= -0.784 USER MOD Single : A 82 ASN : amide:sc= -1.55 K(o=-1.5,f=-3.9!) USER MOD Single : A 85 SER OG : rot -12:sc= -0.111 USER MOD Single : A 86 ASN : amide:sc= -2.35 K(o=-2.3,f=-3.9!) USER MOD Single : A 87 ASN :FLIP amide:sc= -0.451 F(o=-2.7,f=-0.45) USER MOD Single : A 89 MET CE :methyl -161:sc= -0.278 (180deg=-0.628) USER MOD Single : A 90 MET CE :methyl 166:sc= -10.9! (180deg=-11.2!) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 HIS : no HD1:sc= -5.79! C(o=-5.8!,f=-7.4!) USER MOD Single : A 96 THR OG1 : rot 77:sc= 1.07 USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot -35:sc= -0.89 USER MOD Single : A 107 LYS NZ :NH3+ 174:sc= -3.42! (180deg=-3.88!) USER MOD Single : A 110 TYR OH : rot 180:sc= -1.56 USER MOD Single : A 111 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 SER OG : rot 180:sc= 0.0369 USER MOD Single : A 125 GLN : amide:sc= 0.263 K(o=0.26,f=-1.6!) USER MOD Single : A 126 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 ASN :FLIP amide:sc= -0.349 F(o=-1.5,f=-0.35) USER MOD Single : A 131 ASN : amide:sc= -5.49! C(o=-5.5!,f=-16!) USER MOD Single : A 132 THR OG1 : rot 180:sc= 0 USER MOD Single : A 137 HIS : no HE2:sc= -2.01 K(o=-2,f=-2.7) USER MOD Single : A 146 SER OG : rot 180:sc= -1.2 USER MOD Single : A 148 ASN :FLIP amide:sc= -1.92! C(o=-2.7!,f=-1.9!) USER MOD Single : A 150 HIS : no HD1:sc= -12.3! C(o=-12!,f=-13!) USER MOD Single : A 151 THR OG1 : rot 180:sc= -0.984 USER MOD Single : A 153 GLN : amide:sc= -6.08! C(o=-6.1!,f=-6.4!) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 36 4.553 -12.333 7.996 1.00 0.00 N ATOM 2 CA ALA A 36 4.339 -11.899 6.592 1.00 0.00 C ATOM 3 C ALA A 36 5.543 -11.123 6.070 1.00 0.00 C ATOM 4 O ALA A 36 5.873 -11.191 4.887 1.00 0.00 O ATOM 5 CB ALA A 36 3.081 -11.050 6.489 1.00 0.00 C ATOM 0 HA ALA A 36 4.216 -12.790 5.976 1.00 0.00 H new ATOM 0 HB1 ALA A 36 2.936 -10.739 5.455 1.00 0.00 H new ATOM 0 HB2 ALA A 36 2.220 -11.633 6.816 1.00 0.00 H new ATOM 0 HB3 ALA A 36 3.184 -10.169 7.122 1.00 0.00 H new ATOM 13 N PHE A 37 6.195 -10.385 6.962 1.00 0.00 N ATOM 14 CA PHE A 37 7.364 -9.594 6.595 1.00 0.00 C ATOM 15 C PHE A 37 8.634 -10.197 7.185 1.00 0.00 C ATOM 16 O PHE A 37 9.588 -9.482 7.494 1.00 0.00 O ATOM 17 CB PHE A 37 7.201 -8.152 7.080 1.00 0.00 C ATOM 18 CG PHE A 37 5.829 -7.579 6.846 1.00 0.00 C ATOM 19 CD1 PHE A 37 5.275 -6.693 7.756 1.00 0.00 C ATOM 20 CD2 PHE A 37 5.095 -7.923 5.720 1.00 0.00 C ATOM 21 CE1 PHE A 37 4.017 -6.162 7.551 1.00 0.00 C ATOM 22 CE2 PHE A 37 3.835 -7.394 5.510 1.00 0.00 C ATOM 23 CZ PHE A 37 3.295 -6.512 6.427 1.00 0.00 C ATOM 0 H PHE A 37 5.933 -10.318 7.946 1.00 0.00 H new ATOM 0 HA PHE A 37 7.449 -9.599 5.508 1.00 0.00 H new ATOM 0 HB2 PHE A 37 7.424 -8.111 8.146 1.00 0.00 H new ATOM 0 HB3 PHE A 37 7.936 -7.525 6.576 1.00 0.00 H new ATOM 0 HD1 PHE A 37 5.834 -6.414 8.637 1.00 0.00 H new ATOM 0 HD2 PHE A 37 5.512 -8.611 5.000 1.00 0.00 H new ATOM 0 HE1 PHE A 37 3.598 -5.473 8.269 1.00 0.00 H new ATOM 0 HE2 PHE A 37 3.273 -7.670 4.630 1.00 0.00 H new ATOM 0 HZ PHE A 37 2.311 -6.098 6.265 1.00 0.00 H new ATOM 33 N ALA A 38 8.638 -11.516 7.345 1.00 0.00 N ATOM 34 CA ALA A 38 9.788 -12.216 7.905 1.00 0.00 C ATOM 35 C ALA A 38 10.928 -12.322 6.897 1.00 0.00 C ATOM 36 O ALA A 38 12.094 -12.127 7.240 1.00 0.00 O ATOM 37 CB ALA A 38 9.379 -13.599 8.385 1.00 0.00 C ATOM 0 H ALA A 38 7.857 -12.122 7.094 1.00 0.00 H new ATOM 0 HA ALA A 38 10.149 -11.635 8.753 1.00 0.00 H new ATOM 0 HB1 ALA A 38 10.247 -14.111 8.801 1.00 0.00 H new ATOM 0 HB2 ALA A 38 8.611 -13.505 9.152 1.00 0.00 H new ATOM 0 HB3 ALA A 38 8.986 -14.174 7.546 1.00 0.00 H new ATOM 43 N ASP A 39 10.583 -12.639 5.655 1.00 0.00 N ATOM 44 CA ASP A 39 11.580 -12.781 4.597 1.00 0.00 C ATOM 45 C ASP A 39 11.350 -11.777 3.467 1.00 0.00 C ATOM 46 O ASP A 39 11.995 -11.853 2.422 1.00 0.00 O ATOM 47 CB ASP A 39 11.550 -14.202 4.036 1.00 0.00 C ATOM 48 CG ASP A 39 12.024 -15.231 5.044 1.00 0.00 C ATOM 49 OD1 ASP A 39 11.215 -16.101 5.429 1.00 0.00 O ATOM 50 OD2 ASP A 39 13.204 -15.166 5.447 1.00 0.00 O ATOM 0 H ASP A 39 9.622 -12.803 5.354 1.00 0.00 H new ATOM 0 HA ASP A 39 12.558 -12.579 5.035 1.00 0.00 H new ATOM 0 HB2 ASP A 39 10.535 -14.445 3.723 1.00 0.00 H new ATOM 0 HB3 ASP A 39 12.178 -14.252 3.147 1.00 0.00 H new ATOM 55 N ALA A 40 10.430 -10.842 3.679 1.00 0.00 N ATOM 56 CA ALA A 40 10.122 -9.831 2.673 1.00 0.00 C ATOM 57 C ALA A 40 11.377 -9.075 2.244 1.00 0.00 C ATOM 58 O ALA A 40 12.151 -8.611 3.082 1.00 0.00 O ATOM 59 CB ALA A 40 9.078 -8.863 3.208 1.00 0.00 C ATOM 0 H ALA A 40 9.885 -10.763 4.537 1.00 0.00 H new ATOM 0 HA ALA A 40 9.722 -10.338 1.795 1.00 0.00 H new ATOM 0 HB1 ALA A 40 8.855 -8.112 2.450 1.00 0.00 H new ATOM 0 HB2 ALA A 40 8.168 -9.410 3.456 1.00 0.00 H new ATOM 0 HB3 ALA A 40 9.461 -8.372 4.103 1.00 0.00 H new ATOM 65 N GLN A 41 11.570 -8.953 0.934 1.00 0.00 N ATOM 66 CA GLN A 41 12.729 -8.251 0.394 1.00 0.00 C ATOM 67 C GLN A 41 12.691 -6.776 0.776 1.00 0.00 C ATOM 68 O GLN A 41 11.716 -6.304 1.360 1.00 0.00 O ATOM 69 CB GLN A 41 12.780 -8.401 -1.129 1.00 0.00 C ATOM 70 CG GLN A 41 13.805 -9.417 -1.606 1.00 0.00 C ATOM 71 CD GLN A 41 14.237 -9.179 -3.039 1.00 0.00 C ATOM 72 OE1 GLN A 41 14.108 -10.057 -3.893 1.00 0.00 O ATOM 73 NE2 GLN A 41 14.753 -7.986 -3.312 1.00 0.00 N ATOM 0 H GLN A 41 10.939 -9.331 0.227 1.00 0.00 H new ATOM 0 HA GLN A 41 13.628 -8.695 0.821 1.00 0.00 H new ATOM 0 HB2 GLN A 41 11.794 -8.695 -1.490 1.00 0.00 H new ATOM 0 HB3 GLN A 41 13.007 -7.432 -1.574 1.00 0.00 H new ATOM 0 HG2 GLN A 41 14.679 -9.379 -0.956 1.00 0.00 H new ATOM 0 HG3 GLN A 41 13.386 -10.419 -1.518 1.00 0.00 H new ATOM 0 HE21 GLN A 41 14.842 -7.288 -2.574 1.00 0.00 H new ATOM 0 HE22 GLN A 41 15.061 -7.768 -4.260 1.00 0.00 H new ATOM 82 N THR A 42 13.755 -6.052 0.446 1.00 0.00 N ATOM 83 CA THR A 42 13.829 -4.631 0.765 1.00 0.00 C ATOM 84 C THR A 42 14.596 -3.856 -0.303 1.00 0.00 C ATOM 85 O THR A 42 15.594 -4.333 -0.843 1.00 0.00 O ATOM 86 CB THR A 42 14.485 -4.423 2.134 1.00 0.00 C ATOM 87 OG1 THR A 42 14.849 -5.665 2.713 1.00 0.00 O ATOM 88 CG2 THR A 42 13.592 -3.702 3.120 1.00 0.00 C ATOM 0 H THR A 42 14.573 -6.422 -0.039 1.00 0.00 H new ATOM 0 HA THR A 42 12.809 -4.247 0.794 1.00 0.00 H new ATOM 0 HB THR A 42 15.363 -3.806 1.942 1.00 0.00 H new ATOM 0 HG1 THR A 42 15.267 -5.509 3.585 1.00 0.00 H new ATOM 0 HG21 THR A 42 14.116 -3.587 4.069 1.00 0.00 H new ATOM 0 HG22 THR A 42 13.334 -2.719 2.726 1.00 0.00 H new ATOM 0 HG23 THR A 42 12.681 -4.280 3.276 1.00 0.00 H new ATOM 96 N ARG A 43 14.116 -2.653 -0.591 1.00 0.00 N ATOM 97 CA ARG A 43 14.736 -1.781 -1.583 1.00 0.00 C ATOM 98 C ARG A 43 14.500 -0.324 -1.192 1.00 0.00 C ATOM 99 O ARG A 43 13.502 -0.011 -0.554 1.00 0.00 O ATOM 100 CB ARG A 43 14.159 -2.076 -2.975 1.00 0.00 C ATOM 101 CG ARG A 43 14.339 -0.954 -3.987 1.00 0.00 C ATOM 102 CD ARG A 43 13.044 -0.186 -4.207 1.00 0.00 C ATOM 103 NE ARG A 43 12.545 -0.331 -5.572 1.00 0.00 N ATOM 104 CZ ARG A 43 13.185 0.119 -6.649 1.00 0.00 C ATOM 105 NH1 ARG A 43 14.348 0.748 -6.522 1.00 0.00 N ATOM 106 NH2 ARG A 43 12.662 -0.057 -7.853 1.00 0.00 N ATOM 0 H ARG A 43 13.289 -2.254 -0.146 1.00 0.00 H new ATOM 0 HA ARG A 43 15.810 -1.966 -1.616 1.00 0.00 H new ATOM 0 HB2 ARG A 43 14.630 -2.978 -3.365 1.00 0.00 H new ATOM 0 HB3 ARG A 43 13.095 -2.290 -2.875 1.00 0.00 H new ATOM 0 HG2 ARG A 43 15.114 -0.270 -3.639 1.00 0.00 H new ATOM 0 HG3 ARG A 43 14.682 -1.369 -4.935 1.00 0.00 H new ATOM 0 HD2 ARG A 43 12.289 -0.541 -3.506 1.00 0.00 H new ATOM 0 HD3 ARG A 43 13.208 0.870 -3.992 1.00 0.00 H new ATOM 0 HE ARG A 43 11.652 -0.806 -5.708 1.00 0.00 H new ATOM 0 HH11 ARG A 43 14.754 0.888 -5.597 1.00 0.00 H new ATOM 0 HH12 ARG A 43 14.835 1.091 -7.350 1.00 0.00 H new ATOM 0 HH21 ARG A 43 11.768 -0.538 -7.955 1.00 0.00 H new ATOM 0 HH22 ARG A 43 13.153 0.288 -8.678 1.00 0.00 H new ATOM 120 N LYS A 44 15.419 0.563 -1.554 1.00 0.00 N ATOM 121 CA LYS A 44 15.277 1.969 -1.202 1.00 0.00 C ATOM 122 C LYS A 44 14.355 2.701 -2.164 1.00 0.00 C ATOM 123 O LYS A 44 14.432 2.533 -3.381 1.00 0.00 O ATOM 124 CB LYS A 44 16.638 2.653 -1.148 1.00 0.00 C ATOM 125 CG LYS A 44 16.942 3.229 0.219 1.00 0.00 C ATOM 126 CD LYS A 44 18.228 4.041 0.214 1.00 0.00 C ATOM 127 CE LYS A 44 18.110 5.276 1.093 1.00 0.00 C ATOM 128 NZ LYS A 44 19.427 5.686 1.653 1.00 0.00 N ATOM 0 H LYS A 44 16.260 0.337 -2.085 1.00 0.00 H new ATOM 0 HA LYS A 44 14.824 2.011 -0.212 1.00 0.00 H new ATOM 0 HB2 LYS A 44 17.413 1.935 -1.417 1.00 0.00 H new ATOM 0 HB3 LYS A 44 16.670 3.450 -1.890 1.00 0.00 H new ATOM 0 HG2 LYS A 44 16.114 3.861 0.540 1.00 0.00 H new ATOM 0 HG3 LYS A 44 17.025 2.420 0.945 1.00 0.00 H new ATOM 0 HD2 LYS A 44 19.053 3.421 0.565 1.00 0.00 H new ATOM 0 HD3 LYS A 44 18.466 4.341 -0.806 1.00 0.00 H new ATOM 0 HE2 LYS A 44 17.691 6.097 0.511 1.00 0.00 H new ATOM 0 HE3 LYS A 44 17.415 5.076 1.909 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 19.304 6.531 2.246 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 19.815 4.912 2.229 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 20.083 5.901 0.875 1.00 0.00 H new ATOM 142 N LEU A 45 13.478 3.513 -1.589 1.00 0.00 N ATOM 143 CA LEU A 45 12.512 4.285 -2.353 1.00 0.00 C ATOM 144 C LEU A 45 13.173 5.471 -3.048 1.00 0.00 C ATOM 145 O LEU A 45 14.008 6.162 -2.464 1.00 0.00 O ATOM 146 CB LEU A 45 11.402 4.777 -1.419 1.00 0.00 C ATOM 147 CG LEU A 45 10.085 5.185 -2.093 1.00 0.00 C ATOM 148 CD1 LEU A 45 9.768 4.278 -3.273 1.00 0.00 C ATOM 149 CD2 LEU A 45 8.947 5.158 -1.084 1.00 0.00 C ATOM 0 H LEU A 45 13.418 3.654 -0.581 1.00 0.00 H new ATOM 0 HA LEU A 45 12.089 3.641 -3.124 1.00 0.00 H new ATOM 0 HB2 LEU A 45 11.188 3.990 -0.696 1.00 0.00 H new ATOM 0 HB3 LEU A 45 11.779 5.632 -0.858 1.00 0.00 H new ATOM 0 HG LEU A 45 10.199 6.201 -2.471 1.00 0.00 H new ATOM 0 HD11 LEU A 45 8.830 4.591 -3.731 1.00 0.00 H new ATOM 0 HD12 LEU A 45 10.570 4.344 -4.008 1.00 0.00 H new ATOM 0 HD13 LEU A 45 9.677 3.249 -2.926 1.00 0.00 H new ATOM 0 HD21 LEU A 45 8.018 5.449 -1.575 1.00 0.00 H new ATOM 0 HD22 LEU A 45 8.843 4.151 -0.680 1.00 0.00 H new ATOM 0 HD23 LEU A 45 9.163 5.854 -0.273 1.00 0.00 H new ATOM 161 N THR A 46 12.787 5.702 -4.299 1.00 0.00 N ATOM 162 CA THR A 46 13.333 6.809 -5.076 1.00 0.00 C ATOM 163 C THR A 46 12.566 8.096 -4.789 1.00 0.00 C ATOM 164 O THR A 46 11.401 8.056 -4.393 1.00 0.00 O ATOM 165 CB THR A 46 13.268 6.490 -6.572 1.00 0.00 C ATOM 166 OG1 THR A 46 11.955 6.687 -7.068 1.00 0.00 O ATOM 167 CG2 THR A 46 13.677 5.071 -6.904 1.00 0.00 C ATOM 0 H THR A 46 12.098 5.137 -4.796 1.00 0.00 H new ATOM 0 HA THR A 46 14.374 6.949 -4.786 1.00 0.00 H new ATOM 0 HB THR A 46 13.977 7.171 -7.043 1.00 0.00 H new ATOM 0 HG1 THR A 46 11.933 6.480 -8.026 1.00 0.00 H new ATOM 0 HG21 THR A 46 13.607 4.915 -7.980 1.00 0.00 H new ATOM 0 HG22 THR A 46 14.704 4.903 -6.579 1.00 0.00 H new ATOM 0 HG23 THR A 46 13.015 4.372 -6.392 1.00 0.00 H new ATOM 175 N PRO A 47 13.206 9.261 -4.989 1.00 0.00 N ATOM 176 CA PRO A 47 12.568 10.557 -4.751 1.00 0.00 C ATOM 177 C PRO A 47 11.290 10.718 -5.565 1.00 0.00 C ATOM 178 O PRO A 47 10.288 11.235 -5.072 1.00 0.00 O ATOM 179 CB PRO A 47 13.624 11.579 -5.195 1.00 0.00 C ATOM 180 CG PRO A 47 14.603 10.805 -6.014 1.00 0.00 C ATOM 181 CD PRO A 47 14.590 9.409 -5.463 1.00 0.00 C ATOM 0 HA PRO A 47 12.267 10.677 -3.710 1.00 0.00 H new ATOM 0 HB2 PRO A 47 13.173 12.383 -5.777 1.00 0.00 H new ATOM 0 HB3 PRO A 47 14.109 12.042 -4.336 1.00 0.00 H new ATOM 0 HG2 PRO A 47 14.322 10.812 -7.067 1.00 0.00 H new ATOM 0 HG3 PRO A 47 15.599 11.242 -5.947 1.00 0.00 H new ATOM 0 HD2 PRO A 47 14.838 8.671 -6.225 1.00 0.00 H new ATOM 0 HD3 PRO A 47 15.310 9.286 -4.654 1.00 0.00 H new ATOM 189 N GLU A 48 11.330 10.264 -6.813 1.00 0.00 N ATOM 190 CA GLU A 48 10.170 10.348 -7.691 1.00 0.00 C ATOM 191 C GLU A 48 9.034 9.486 -7.153 1.00 0.00 C ATOM 192 O GLU A 48 7.880 9.916 -7.107 1.00 0.00 O ATOM 193 CB GLU A 48 10.541 9.904 -9.108 1.00 0.00 C ATOM 194 CG GLU A 48 9.896 10.746 -10.197 1.00 0.00 C ATOM 195 CD GLU A 48 10.680 10.719 -11.494 1.00 0.00 C ATOM 196 OE1 GLU A 48 10.504 9.760 -12.274 1.00 0.00 O ATOM 197 OE2 GLU A 48 11.469 11.658 -11.731 1.00 0.00 O ATOM 0 H GLU A 48 12.152 9.835 -7.238 1.00 0.00 H new ATOM 0 HA GLU A 48 9.837 11.385 -7.725 1.00 0.00 H new ATOM 0 HB2 GLU A 48 11.624 9.946 -9.221 1.00 0.00 H new ATOM 0 HB3 GLU A 48 10.247 8.863 -9.243 1.00 0.00 H new ATOM 0 HG2 GLU A 48 8.884 10.384 -10.380 1.00 0.00 H new ATOM 0 HG3 GLU A 48 9.808 11.776 -9.851 1.00 0.00 H new ATOM 204 N GLU A 49 9.370 8.269 -6.740 1.00 0.00 N ATOM 205 CA GLU A 49 8.381 7.346 -6.196 1.00 0.00 C ATOM 206 C GLU A 49 7.809 7.883 -4.889 1.00 0.00 C ATOM 207 O GLU A 49 6.618 7.737 -4.613 1.00 0.00 O ATOM 208 CB GLU A 49 9.007 5.969 -5.968 1.00 0.00 C ATOM 209 CG GLU A 49 9.196 5.167 -7.245 1.00 0.00 C ATOM 210 CD GLU A 49 10.168 4.016 -7.074 1.00 0.00 C ATOM 211 OE1 GLU A 49 11.042 4.104 -6.185 1.00 0.00 O ATOM 212 OE2 GLU A 49 10.056 3.028 -7.827 1.00 0.00 O ATOM 0 H GLU A 49 10.320 7.899 -6.772 1.00 0.00 H new ATOM 0 HA GLU A 49 7.570 7.249 -6.917 1.00 0.00 H new ATOM 0 HB2 GLU A 49 9.974 6.095 -5.482 1.00 0.00 H new ATOM 0 HB3 GLU A 49 8.377 5.402 -5.283 1.00 0.00 H new ATOM 0 HG2 GLU A 49 8.232 4.777 -7.571 1.00 0.00 H new ATOM 0 HG3 GLU A 49 9.556 5.827 -8.034 1.00 0.00 H new ATOM 219 N ARG A 50 8.667 8.510 -4.091 1.00 0.00 N ATOM 220 CA ARG A 50 8.248 9.075 -2.814 1.00 0.00 C ATOM 221 C ARG A 50 7.322 10.268 -3.034 1.00 0.00 C ATOM 222 O ARG A 50 6.428 10.531 -2.230 1.00 0.00 O ATOM 223 CB ARG A 50 9.472 9.504 -1.999 1.00 0.00 C ATOM 224 CG ARG A 50 9.775 8.589 -0.822 1.00 0.00 C ATOM 225 CD ARG A 50 10.685 9.266 0.189 1.00 0.00 C ATOM 226 NE ARG A 50 12.078 8.845 0.042 1.00 0.00 N ATOM 227 CZ ARG A 50 13.125 9.625 0.305 1.00 0.00 C ATOM 228 NH1 ARG A 50 12.949 10.862 0.756 1.00 0.00 N ATOM 229 NH2 ARG A 50 14.355 9.165 0.123 1.00 0.00 N ATOM 0 H ARG A 50 9.656 8.639 -4.306 1.00 0.00 H new ATOM 0 HA ARG A 50 7.704 8.310 -2.260 1.00 0.00 H new ATOM 0 HB2 ARG A 50 10.341 9.536 -2.656 1.00 0.00 H new ATOM 0 HB3 ARG A 50 9.314 10.517 -1.629 1.00 0.00 H new ATOM 0 HG2 ARG A 50 8.843 8.298 -0.337 1.00 0.00 H new ATOM 0 HG3 ARG A 50 10.246 7.675 -1.182 1.00 0.00 H new ATOM 0 HD2 ARG A 50 10.619 10.347 0.069 1.00 0.00 H new ATOM 0 HD3 ARG A 50 10.341 9.035 1.197 1.00 0.00 H new ATOM 0 HE ARG A 50 12.259 7.895 -0.282 1.00 0.00 H new ATOM 0 HH11 ARG A 50 12.006 11.222 0.904 1.00 0.00 H new ATOM 0 HH12 ARG A 50 13.757 11.452 0.955 1.00 0.00 H new ATOM 0 HH21 ARG A 50 14.499 8.215 -0.218 1.00 0.00 H new ATOM 0 HH22 ARG A 50 15.158 9.762 0.324 1.00 0.00 H new ATOM 243 N SER A 51 7.548 10.987 -4.129 1.00 0.00 N ATOM 244 CA SER A 51 6.738 12.155 -4.458 1.00 0.00 C ATOM 245 C SER A 51 5.334 11.747 -4.887 1.00 0.00 C ATOM 246 O SER A 51 4.345 12.311 -4.421 1.00 0.00 O ATOM 247 CB SER A 51 7.406 12.969 -5.568 1.00 0.00 C ATOM 248 OG SER A 51 7.217 12.358 -6.833 1.00 0.00 O ATOM 0 H SER A 51 8.285 10.782 -4.803 1.00 0.00 H new ATOM 0 HA SER A 51 6.657 12.770 -3.562 1.00 0.00 H new ATOM 0 HB2 SER A 51 6.993 13.978 -5.582 1.00 0.00 H new ATOM 0 HB3 SER A 51 8.472 13.064 -5.362 1.00 0.00 H new ATOM 0 HG SER A 51 7.796 11.571 -6.906 1.00 0.00 H new ATOM 254 N ALA A 52 5.252 10.766 -5.772 1.00 0.00 N ATOM 255 CA ALA A 52 3.963 10.289 -6.256 1.00 0.00 C ATOM 256 C ALA A 52 3.148 9.696 -5.119 1.00 0.00 C ATOM 257 O ALA A 52 1.965 9.993 -4.967 1.00 0.00 O ATOM 258 CB ALA A 52 4.150 9.267 -7.361 1.00 0.00 C ATOM 0 H ALA A 52 6.059 10.285 -6.170 1.00 0.00 H new ATOM 0 HA ALA A 52 3.418 11.141 -6.663 1.00 0.00 H new ATOM 0 HB1 ALA A 52 3.175 8.924 -7.708 1.00 0.00 H new ATOM 0 HB2 ALA A 52 4.691 9.723 -8.190 1.00 0.00 H new ATOM 0 HB3 ALA A 52 4.719 8.419 -6.980 1.00 0.00 H new ATOM 264 N VAL A 53 3.797 8.866 -4.315 1.00 0.00 N ATOM 265 CA VAL A 53 3.145 8.239 -3.177 1.00 0.00 C ATOM 266 C VAL A 53 2.563 9.305 -2.263 1.00 0.00 C ATOM 267 O VAL A 53 1.362 9.328 -2.003 1.00 0.00 O ATOM 268 CB VAL A 53 4.133 7.361 -2.383 1.00 0.00 C ATOM 269 CG1 VAL A 53 3.495 6.836 -1.104 1.00 0.00 C ATOM 270 CG2 VAL A 53 4.627 6.211 -3.245 1.00 0.00 C ATOM 0 H VAL A 53 4.778 8.611 -4.431 1.00 0.00 H new ATOM 0 HA VAL A 53 2.345 7.602 -3.554 1.00 0.00 H new ATOM 0 HB VAL A 53 4.986 7.979 -2.102 1.00 0.00 H new ATOM 0 HG11 VAL A 53 4.215 6.220 -0.565 1.00 0.00 H new ATOM 0 HG12 VAL A 53 3.193 7.675 -0.477 1.00 0.00 H new ATOM 0 HG13 VAL A 53 2.620 6.236 -1.354 1.00 0.00 H new ATOM 0 HG21 VAL A 53 5.324 5.600 -2.672 1.00 0.00 H new ATOM 0 HG22 VAL A 53 3.780 5.600 -3.557 1.00 0.00 H new ATOM 0 HG23 VAL A 53 5.132 6.607 -4.126 1.00 0.00 H new ATOM 280 N GLU A 54 3.424 10.200 -1.799 1.00 0.00 N ATOM 281 CA GLU A 54 2.994 11.285 -0.926 1.00 0.00 C ATOM 282 C GLU A 54 1.857 12.069 -1.580 1.00 0.00 C ATOM 283 O GLU A 54 0.974 12.588 -0.898 1.00 0.00 O ATOM 284 CB GLU A 54 4.178 12.205 -0.584 1.00 0.00 C ATOM 285 CG GLU A 54 4.403 13.345 -1.567 1.00 0.00 C ATOM 286 CD GLU A 54 3.902 14.676 -1.041 1.00 0.00 C ATOM 287 OE1 GLU A 54 3.934 14.877 0.191 1.00 0.00 O ATOM 288 OE2 GLU A 54 3.477 15.518 -1.861 1.00 0.00 O ATOM 0 H GLU A 54 4.422 10.197 -2.011 1.00 0.00 H new ATOM 0 HA GLU A 54 2.622 10.860 0.006 1.00 0.00 H new ATOM 0 HB2 GLU A 54 4.018 12.626 0.409 1.00 0.00 H new ATOM 0 HB3 GLU A 54 5.085 11.603 -0.533 1.00 0.00 H new ATOM 0 HG2 GLU A 54 5.467 13.424 -1.789 1.00 0.00 H new ATOM 0 HG3 GLU A 54 3.898 13.116 -2.505 1.00 0.00 H new ATOM 295 N ASN A 55 1.881 12.128 -2.910 1.00 0.00 N ATOM 296 CA ASN A 55 0.847 12.825 -3.666 1.00 0.00 C ATOM 297 C ASN A 55 -0.439 12.007 -3.669 1.00 0.00 C ATOM 298 O ASN A 55 -1.542 12.555 -3.660 1.00 0.00 O ATOM 299 CB ASN A 55 1.313 13.063 -5.105 1.00 0.00 C ATOM 300 CG ASN A 55 2.421 14.092 -5.193 1.00 0.00 C ATOM 301 OD1 ASN A 55 2.473 15.036 -4.404 1.00 0.00 O ATOM 302 ND2 ASN A 55 3.317 13.913 -6.156 1.00 0.00 N ATOM 0 H ASN A 55 2.607 11.700 -3.485 1.00 0.00 H new ATOM 0 HA ASN A 55 0.657 13.788 -3.192 1.00 0.00 H new ATOM 0 HB2 ASN A 55 1.661 12.122 -5.531 1.00 0.00 H new ATOM 0 HB3 ASN A 55 0.467 13.393 -5.708 1.00 0.00 H new ATOM 0 HD21 ASN A 55 4.088 14.572 -6.264 1.00 0.00 H new ATOM 0 HD22 ASN A 55 3.235 13.116 -6.787 1.00 0.00 H new ATOM 309 N TYR A 56 -0.279 10.689 -3.679 1.00 0.00 N ATOM 310 CA TYR A 56 -1.405 9.768 -3.681 1.00 0.00 C ATOM 311 C TYR A 56 -2.080 9.744 -2.308 1.00 0.00 C ATOM 312 O TYR A 56 -3.302 9.872 -2.203 1.00 0.00 O ATOM 313 CB TYR A 56 -0.911 8.374 -4.099 1.00 0.00 C ATOM 314 CG TYR A 56 -1.753 7.221 -3.604 1.00 0.00 C ATOM 315 CD1 TYR A 56 -1.223 6.285 -2.726 1.00 0.00 C ATOM 316 CD2 TYR A 56 -3.070 7.065 -4.014 1.00 0.00 C ATOM 317 CE1 TYR A 56 -1.979 5.229 -2.268 1.00 0.00 C ATOM 318 CE2 TYR A 56 -3.836 6.007 -3.560 1.00 0.00 C ATOM 319 CZ TYR A 56 -3.284 5.093 -2.687 1.00 0.00 C ATOM 320 OH TYR A 56 -4.038 4.043 -2.226 1.00 0.00 O ATOM 0 H TYR A 56 0.633 10.231 -3.686 1.00 0.00 H new ATOM 0 HA TYR A 56 -2.155 10.100 -4.399 1.00 0.00 H new ATOM 0 HB2 TYR A 56 -0.869 8.332 -5.187 1.00 0.00 H new ATOM 0 HB3 TYR A 56 0.108 8.242 -3.735 1.00 0.00 H new ATOM 0 HD1 TYR A 56 -0.200 6.387 -2.396 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -3.503 7.780 -4.698 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -1.551 4.511 -1.584 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -4.859 5.897 -3.887 1.00 0.00 H new ATOM 0 HH TYR A 56 -4.444 4.284 -1.367 1.00 0.00 H new ATOM 330 N LEU A 57 -1.278 9.601 -1.255 1.00 0.00 N ATOM 331 CA LEU A 57 -1.807 9.583 0.108 1.00 0.00 C ATOM 332 C LEU A 57 -2.375 10.951 0.474 1.00 0.00 C ATOM 333 O LEU A 57 -3.383 11.052 1.172 1.00 0.00 O ATOM 334 CB LEU A 57 -0.713 9.205 1.111 1.00 0.00 C ATOM 335 CG LEU A 57 0.285 8.145 0.638 1.00 0.00 C ATOM 336 CD1 LEU A 57 1.220 7.753 1.771 1.00 0.00 C ATOM 337 CD2 LEU A 57 -0.444 6.925 0.103 1.00 0.00 C ATOM 0 H LEU A 57 -0.265 9.496 -1.318 1.00 0.00 H new ATOM 0 HA LEU A 57 -2.600 8.837 0.150 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -0.160 10.107 1.374 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -1.190 8.847 2.023 1.00 0.00 H new ATOM 0 HG LEU A 57 0.880 8.570 -0.170 1.00 0.00 H new ATOM 0 HD11 LEU A 57 1.923 6.999 1.418 1.00 0.00 H new ATOM 0 HD12 LEU A 57 1.770 8.631 2.109 1.00 0.00 H new ATOM 0 HD13 LEU A 57 0.638 7.348 2.599 1.00 0.00 H new ATOM 0 HD21 LEU A 57 0.283 6.183 -0.228 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -1.065 6.498 0.890 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -1.073 7.217 -0.738 1.00 0.00 H new ATOM 349 N GLU A 58 -1.715 12.004 -0.003 1.00 0.00 N ATOM 350 CA GLU A 58 -2.148 13.371 0.273 1.00 0.00 C ATOM 351 C GLU A 58 -3.516 13.634 -0.340 1.00 0.00 C ATOM 352 O GLU A 58 -4.424 14.125 0.329 1.00 0.00 O ATOM 353 CB GLU A 58 -1.131 14.377 -0.269 1.00 0.00 C ATOM 354 CG GLU A 58 0.001 14.681 0.700 1.00 0.00 C ATOM 355 CD GLU A 58 -0.038 16.108 1.212 1.00 0.00 C ATOM 356 OE1 GLU A 58 -0.277 16.297 2.423 1.00 0.00 O ATOM 357 OE2 GLU A 58 0.175 17.035 0.402 1.00 0.00 O ATOM 0 H GLU A 58 -0.878 11.936 -0.583 1.00 0.00 H new ATOM 0 HA GLU A 58 -2.219 13.492 1.354 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -0.710 13.991 -1.197 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -1.647 15.305 -0.515 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -0.054 13.994 1.545 1.00 0.00 H new ATOM 0 HG3 GLU A 58 0.956 14.502 0.205 1.00 0.00 H new ATOM 364 N SER A 59 -3.659 13.287 -1.612 1.00 0.00 N ATOM 365 CA SER A 59 -4.924 13.468 -2.310 1.00 0.00 C ATOM 366 C SER A 59 -5.985 12.562 -1.699 1.00 0.00 C ATOM 367 O SER A 59 -7.175 12.877 -1.710 1.00 0.00 O ATOM 368 CB SER A 59 -4.762 13.159 -3.800 1.00 0.00 C ATOM 369 OG SER A 59 -4.492 14.337 -4.539 1.00 0.00 O ATOM 0 H SER A 59 -2.916 12.880 -2.180 1.00 0.00 H new ATOM 0 HA SER A 59 -5.238 14.507 -2.205 1.00 0.00 H new ATOM 0 HB2 SER A 59 -3.951 12.444 -3.940 1.00 0.00 H new ATOM 0 HB3 SER A 59 -5.670 12.689 -4.178 1.00 0.00 H new ATOM 0 HG SER A 59 -4.391 14.112 -5.488 1.00 0.00 H new ATOM 375 N LEU A 60 -5.534 11.437 -1.158 1.00 0.00 N ATOM 376 CA LEU A 60 -6.421 10.472 -0.527 1.00 0.00 C ATOM 377 C LEU A 60 -7.100 11.073 0.699 1.00 0.00 C ATOM 378 O LEU A 60 -8.224 10.706 1.044 1.00 0.00 O ATOM 379 CB LEU A 60 -5.624 9.234 -0.126 1.00 0.00 C ATOM 380 CG LEU A 60 -5.448 8.199 -1.232 1.00 0.00 C ATOM 381 CD1 LEU A 60 -4.296 7.266 -0.904 1.00 0.00 C ATOM 382 CD2 LEU A 60 -6.736 7.416 -1.437 1.00 0.00 C ATOM 0 H LEU A 60 -4.550 11.170 -1.145 1.00 0.00 H new ATOM 0 HA LEU A 60 -7.196 10.194 -1.241 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -4.639 9.549 0.217 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -6.119 8.759 0.721 1.00 0.00 H new ATOM 0 HG LEU A 60 -5.214 8.718 -2.161 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -4.183 6.533 -1.703 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -3.376 7.843 -0.808 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -4.501 6.751 0.035 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -6.593 6.682 -2.230 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -7.002 6.904 -0.512 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -7.537 8.100 -1.716 1.00 0.00 H new ATOM 394 N THR A 61 -6.406 11.995 1.357 1.00 0.00 N ATOM 395 CA THR A 61 -6.935 12.646 2.551 1.00 0.00 C ATOM 396 C THR A 61 -7.925 13.749 2.188 1.00 0.00 C ATOM 397 O THR A 61 -8.950 13.918 2.848 1.00 0.00 O ATOM 398 CB THR A 61 -5.794 13.222 3.394 1.00 0.00 C ATOM 399 OG1 THR A 61 -4.586 13.253 2.654 1.00 0.00 O ATOM 400 CG2 THR A 61 -5.534 12.439 4.664 1.00 0.00 C ATOM 0 H THR A 61 -5.475 12.309 1.084 1.00 0.00 H new ATOM 0 HA THR A 61 -7.465 11.893 3.134 1.00 0.00 H new ATOM 0 HB THR A 61 -6.116 14.228 3.664 1.00 0.00 H new ATOM 0 HG1 THR A 61 -4.650 13.934 1.952 1.00 0.00 H new ATOM 0 HG21 THR A 61 -4.714 12.900 5.214 1.00 0.00 H new ATOM 0 HG22 THR A 61 -6.432 12.440 5.282 1.00 0.00 H new ATOM 0 HG23 THR A 61 -5.269 11.412 4.411 1.00 0.00 H new ATOM 408 N GLN A 62 -7.611 14.498 1.138 1.00 0.00 N ATOM 409 CA GLN A 62 -8.473 15.586 0.692 1.00 0.00 C ATOM 410 C GLN A 62 -9.621 15.059 -0.166 1.00 0.00 C ATOM 411 O GLN A 62 -10.712 15.630 -0.176 1.00 0.00 O ATOM 412 CB GLN A 62 -7.663 16.622 -0.091 1.00 0.00 C ATOM 413 CG GLN A 62 -7.082 16.089 -1.391 1.00 0.00 C ATOM 414 CD GLN A 62 -7.539 16.879 -2.602 1.00 0.00 C ATOM 415 OE1 GLN A 62 -8.828 16.800 -2.909 1.00 0.00 O flip ATOM 416 NE2 GLN A 62 -6.741 17.553 -3.255 1.00 0.00 N flip ATOM 0 H GLN A 62 -6.767 14.372 0.580 1.00 0.00 H new ATOM 0 HA GLN A 62 -8.897 16.063 1.575 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -8.301 17.477 -0.313 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -6.850 16.985 0.538 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -5.994 16.114 -1.335 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -7.371 15.045 -1.513 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -5.758 17.585 -2.983 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -7.063 18.079 -4.068 1.00 0.00 H new ATOM 425 N VAL A 63 -9.369 13.968 -0.881 1.00 0.00 N ATOM 426 CA VAL A 63 -10.384 13.364 -1.737 1.00 0.00 C ATOM 427 C VAL A 63 -11.181 12.308 -0.979 1.00 0.00 C ATOM 428 O VAL A 63 -10.721 11.179 -0.800 1.00 0.00 O ATOM 429 CB VAL A 63 -9.756 12.720 -2.989 1.00 0.00 C ATOM 430 CG1 VAL A 63 -10.836 12.203 -3.927 1.00 0.00 C ATOM 431 CG2 VAL A 63 -8.852 13.711 -3.704 1.00 0.00 C ATOM 0 H VAL A 63 -8.471 13.484 -0.885 1.00 0.00 H new ATOM 0 HA VAL A 63 -11.053 14.166 -2.050 1.00 0.00 H new ATOM 0 HB VAL A 63 -9.149 11.873 -2.670 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -10.371 11.753 -4.804 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -11.438 11.455 -3.411 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -11.473 13.030 -4.239 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -8.418 13.238 -4.585 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -9.434 14.580 -4.009 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -8.054 14.026 -3.032 1.00 0.00 H new ATOM 441 N LEU A 64 -12.377 12.679 -0.535 1.00 0.00 N ATOM 442 CA LEU A 64 -13.238 11.762 0.204 1.00 0.00 C ATOM 443 C LEU A 64 -14.677 11.844 -0.296 1.00 0.00 C ATOM 444 O LEU A 64 -15.169 12.924 -0.624 1.00 0.00 O ATOM 445 CB LEU A 64 -13.187 12.076 1.701 1.00 0.00 C ATOM 446 CG LEU A 64 -11.864 11.737 2.389 1.00 0.00 C ATOM 447 CD1 LEU A 64 -11.642 12.640 3.593 1.00 0.00 C ATOM 448 CD2 LEU A 64 -11.841 10.274 2.806 1.00 0.00 C ATOM 0 H LEU A 64 -12.773 13.609 -0.674 1.00 0.00 H new ATOM 0 HA LEU A 64 -12.873 10.748 0.040 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -13.390 13.138 1.841 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -13.988 11.530 2.199 1.00 0.00 H new ATOM 0 HG LEU A 64 -11.053 11.905 1.680 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -10.696 12.384 4.070 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -11.615 13.680 3.268 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -12.456 12.504 4.305 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -10.893 10.050 3.294 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -12.660 10.080 3.498 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -11.954 9.643 1.925 1.00 0.00 H new ATOM 460 N GLN A 65 -15.346 10.697 -0.351 1.00 0.00 N ATOM 461 CA GLN A 65 -16.728 10.641 -0.811 1.00 0.00 C ATOM 462 C GLN A 65 -17.655 11.358 0.166 1.00 0.00 C ATOM 463 O GLN A 65 -17.241 11.751 1.256 1.00 0.00 O ATOM 464 CB GLN A 65 -17.171 9.185 -0.984 1.00 0.00 C ATOM 465 CG GLN A 65 -17.435 8.799 -2.430 1.00 0.00 C ATOM 466 CD GLN A 65 -16.809 7.469 -2.804 1.00 0.00 C ATOM 467 OE1 GLN A 65 -17.503 6.468 -2.970 1.00 0.00 O ATOM 468 NE2 GLN A 65 -15.487 7.456 -2.937 1.00 0.00 N ATOM 0 H GLN A 65 -14.953 9.795 -0.083 1.00 0.00 H new ATOM 0 HA GLN A 65 -16.787 11.147 -1.775 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -16.402 8.529 -0.576 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -18.076 9.017 -0.400 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -18.511 8.750 -2.598 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -17.045 9.577 -3.086 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -14.951 8.311 -2.790 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -15.008 6.591 -3.187 1.00 0.00 H new ATOM 477 N VAL A 66 -18.912 11.524 -0.233 1.00 0.00 N ATOM 478 CA VAL A 66 -19.898 12.193 0.606 1.00 0.00 C ATOM 479 C VAL A 66 -21.203 11.401 0.662 1.00 0.00 C ATOM 480 O VAL A 66 -22.222 11.825 0.116 1.00 0.00 O ATOM 481 CB VAL A 66 -20.193 13.618 0.099 1.00 0.00 C ATOM 482 CG1 VAL A 66 -19.024 14.544 0.396 1.00 0.00 C ATOM 483 CG2 VAL A 66 -20.504 13.600 -1.390 1.00 0.00 C ATOM 0 H VAL A 66 -19.271 11.204 -1.132 1.00 0.00 H new ATOM 0 HA VAL A 66 -19.472 12.254 1.608 1.00 0.00 H new ATOM 0 HB VAL A 66 -21.069 13.998 0.626 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -19.251 15.545 0.031 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -18.853 14.580 1.472 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -18.129 14.171 -0.101 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -20.710 14.615 -1.731 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -19.649 13.200 -1.935 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -21.376 12.972 -1.572 1.00 0.00 H new ATOM 493 N PRO A 67 -21.187 10.233 1.326 1.00 0.00 N ATOM 494 CA PRO A 67 -22.373 9.380 1.452 1.00 0.00 C ATOM 495 C PRO A 67 -23.419 9.976 2.388 1.00 0.00 C ATOM 496 O PRO A 67 -24.614 9.712 2.250 1.00 0.00 O ATOM 497 CB PRO A 67 -21.816 8.080 2.033 1.00 0.00 C ATOM 498 CG PRO A 67 -20.590 8.493 2.772 1.00 0.00 C ATOM 499 CD PRO A 67 -20.014 9.652 2.006 1.00 0.00 C ATOM 0 HA PRO A 67 -22.885 9.251 0.498 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -22.536 7.602 2.697 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -21.582 7.363 1.246 1.00 0.00 H new ATOM 0 HG2 PRO A 67 -20.830 8.782 3.795 1.00 0.00 H new ATOM 0 HG3 PRO A 67 -19.876 7.672 2.832 1.00 0.00 H new ATOM 0 HD2 PRO A 67 -19.536 10.373 2.669 1.00 0.00 H new ATOM 0 HD3 PRO A 67 -19.258 9.325 1.292 1.00 0.00 H new ATOM 507 N GLY A 68 -22.962 10.781 3.341 1.00 0.00 N ATOM 508 CA GLY A 68 -23.870 11.402 4.286 1.00 0.00 C ATOM 509 C GLY A 68 -24.002 10.606 5.573 1.00 0.00 C ATOM 510 O GLY A 68 -25.097 10.162 5.919 1.00 0.00 O ATOM 0 H GLY A 68 -21.978 11.014 3.476 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -23.517 12.407 4.518 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -24.852 11.508 3.826 1.00 0.00 H new ATOM 514 N PRO A 69 -22.895 10.410 6.307 1.00 0.00 N ATOM 515 CA PRO A 69 -22.905 9.656 7.566 1.00 0.00 C ATOM 516 C PRO A 69 -23.622 10.408 8.684 1.00 0.00 C ATOM 517 O PRO A 69 -23.558 11.634 8.761 1.00 0.00 O ATOM 518 CB PRO A 69 -21.420 9.495 7.897 1.00 0.00 C ATOM 519 CG PRO A 69 -20.755 10.644 7.222 1.00 0.00 C ATOM 520 CD PRO A 69 -21.545 10.903 5.970 1.00 0.00 C ATOM 0 HA PRO A 69 -23.438 8.710 7.471 1.00 0.00 H new ATOM 0 HB2 PRO A 69 -21.250 9.516 8.973 1.00 0.00 H new ATOM 0 HB3 PRO A 69 -21.034 8.544 7.531 1.00 0.00 H new ATOM 0 HG2 PRO A 69 -20.746 11.523 7.866 1.00 0.00 H new ATOM 0 HG3 PRO A 69 -19.717 10.411 6.987 1.00 0.00 H new ATOM 0 HD2 PRO A 69 -21.557 11.963 5.715 1.00 0.00 H new ATOM 0 HD3 PRO A 69 -21.126 10.373 5.114 1.00 0.00 H new ATOM 528 N THR A 70 -24.303 9.663 9.548 1.00 0.00 N ATOM 529 CA THR A 70 -25.031 10.258 10.662 1.00 0.00 C ATOM 530 C THR A 70 -24.168 10.295 11.919 1.00 0.00 C ATOM 531 O THR A 70 -23.154 9.602 12.009 1.00 0.00 O ATOM 532 CB THR A 70 -26.315 9.473 10.936 1.00 0.00 C ATOM 533 OG1 THR A 70 -27.039 10.053 12.007 1.00 0.00 O ATOM 534 CG2 THR A 70 -26.068 8.021 11.280 1.00 0.00 C ATOM 0 H THR A 70 -24.366 8.646 9.498 1.00 0.00 H new ATOM 0 HA THR A 70 -25.289 11.281 10.389 1.00 0.00 H new ATOM 0 HB THR A 70 -26.883 9.516 10.007 1.00 0.00 H new ATOM 0 HG1 THR A 70 -27.857 9.538 12.166 1.00 0.00 H new ATOM 0 HG21 THR A 70 -27.020 7.523 11.462 1.00 0.00 H new ATOM 0 HG22 THR A 70 -25.556 7.533 10.451 1.00 0.00 H new ATOM 0 HG23 THR A 70 -25.449 7.959 12.175 1.00 0.00 H new ATOM 542 N GLY A 71 -24.575 11.109 12.888 1.00 0.00 N ATOM 543 CA GLY A 71 -23.827 11.221 14.127 1.00 0.00 C ATOM 544 C GLY A 71 -22.570 12.054 13.972 1.00 0.00 C ATOM 545 O GLY A 71 -22.639 13.278 13.854 1.00 0.00 O ATOM 0 H GLY A 71 -25.410 11.693 12.837 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -24.462 11.667 14.892 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -23.558 10.224 14.477 1.00 0.00 H new ATOM 549 N ALA A 72 -21.419 11.390 13.973 1.00 0.00 N ATOM 550 CA ALA A 72 -20.141 12.077 13.832 1.00 0.00 C ATOM 551 C ALA A 72 -19.880 12.457 12.379 1.00 0.00 C ATOM 552 O ALA A 72 -20.700 12.191 11.501 1.00 0.00 O ATOM 553 CB ALA A 72 -19.013 11.203 14.362 1.00 0.00 C ATOM 0 H ALA A 72 -21.345 10.377 14.070 1.00 0.00 H new ATOM 0 HA ALA A 72 -20.182 12.995 14.418 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -18.064 11.727 14.251 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -19.186 10.985 15.416 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -18.980 10.270 13.799 1.00 0.00 H new ATOM 559 N SER A 73 -18.732 13.079 12.133 1.00 0.00 N ATOM 560 CA SER A 73 -18.362 13.494 10.785 1.00 0.00 C ATOM 561 C SER A 73 -17.418 12.482 10.143 1.00 0.00 C ATOM 562 O SER A 73 -16.577 12.840 9.319 1.00 0.00 O ATOM 563 CB SER A 73 -17.703 14.874 10.817 1.00 0.00 C ATOM 564 OG SER A 73 -18.483 15.795 11.560 1.00 0.00 O ATOM 0 H SER A 73 -18.042 13.307 12.849 1.00 0.00 H new ATOM 0 HA SER A 73 -19.271 13.546 10.186 1.00 0.00 H new ATOM 0 HB2 SER A 73 -16.709 14.796 11.258 1.00 0.00 H new ATOM 0 HB3 SER A 73 -17.572 15.242 9.799 1.00 0.00 H new ATOM 0 HG SER A 73 -18.039 16.669 11.567 1.00 0.00 H new ATOM 570 N ALA A 74 -17.564 11.218 10.526 1.00 0.00 N ATOM 571 CA ALA A 74 -16.724 10.155 9.987 1.00 0.00 C ATOM 572 C ALA A 74 -15.251 10.423 10.270 1.00 0.00 C ATOM 573 O ALA A 74 -14.863 11.550 10.580 1.00 0.00 O ATOM 574 CB ALA A 74 -16.958 10.005 8.492 1.00 0.00 C ATOM 0 H ALA A 74 -18.256 10.905 11.207 1.00 0.00 H new ATOM 0 HA ALA A 74 -16.998 9.223 10.481 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -16.324 9.208 8.103 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -18.004 9.758 8.310 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -16.713 10.941 7.990 1.00 0.00 H new ATOM 580 N ALA A 75 -14.434 9.382 10.160 1.00 0.00 N ATOM 581 CA ALA A 75 -13.002 9.505 10.404 1.00 0.00 C ATOM 582 C ALA A 75 -12.198 8.908 9.249 1.00 0.00 C ATOM 583 O ALA A 75 -12.288 7.712 8.978 1.00 0.00 O ATOM 584 CB ALA A 75 -12.632 8.824 11.713 1.00 0.00 C ATOM 0 H ALA A 75 -14.739 8.443 9.903 1.00 0.00 H new ATOM 0 HA ALA A 75 -12.757 10.565 10.476 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -11.560 8.923 11.884 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -13.175 9.293 12.533 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -12.895 7.768 11.661 1.00 0.00 H new ATOM 590 N PRO A 76 -11.397 9.734 8.550 1.00 0.00 N ATOM 591 CA PRO A 76 -10.580 9.267 7.424 1.00 0.00 C ATOM 592 C PRO A 76 -9.505 8.281 7.867 1.00 0.00 C ATOM 593 O PRO A 76 -9.311 8.054 9.061 1.00 0.00 O ATOM 594 CB PRO A 76 -9.941 10.549 6.883 1.00 0.00 C ATOM 595 CG PRO A 76 -9.977 11.507 8.021 1.00 0.00 C ATOM 596 CD PRO A 76 -11.219 11.177 8.799 1.00 0.00 C ATOM 0 HA PRO A 76 -11.175 8.732 6.683 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -8.919 10.370 6.550 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -10.493 10.934 6.026 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -9.088 11.407 8.644 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -10.002 12.537 7.664 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -11.098 11.391 9.861 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -12.076 11.754 8.453 1.00 0.00 H new ATOM 604 N ILE A 77 -8.809 7.696 6.899 1.00 0.00 N ATOM 605 CA ILE A 77 -7.755 6.734 7.194 1.00 0.00 C ATOM 606 C ILE A 77 -6.552 6.941 6.278 1.00 0.00 C ATOM 607 O ILE A 77 -6.435 6.302 5.233 1.00 0.00 O ATOM 608 CB ILE A 77 -8.265 5.285 7.054 1.00 0.00 C ATOM 609 CG1 ILE A 77 -7.157 4.287 7.401 1.00 0.00 C ATOM 610 CG2 ILE A 77 -8.790 5.038 5.646 1.00 0.00 C ATOM 611 CD1 ILE A 77 -6.751 4.314 8.859 1.00 0.00 C ATOM 0 H ILE A 77 -8.956 7.871 5.905 1.00 0.00 H new ATOM 0 HA ILE A 77 -7.448 6.900 8.227 1.00 0.00 H new ATOM 0 HB ILE A 77 -9.086 5.140 7.756 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -7.492 3.282 7.144 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -6.283 4.499 6.785 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -9.146 4.011 5.565 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -9.611 5.724 5.438 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -7.989 5.202 4.925 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -5.962 3.581 9.031 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -6.385 5.308 9.116 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -7.613 4.072 9.481 1.00 0.00 H new ATOM 623 N SER A 78 -5.659 7.834 6.684 1.00 0.00 N ATOM 624 CA SER A 78 -4.461 8.125 5.909 1.00 0.00 C ATOM 625 C SER A 78 -3.211 7.835 6.731 1.00 0.00 C ATOM 626 O SER A 78 -3.183 8.070 7.939 1.00 0.00 O ATOM 627 CB SER A 78 -4.462 9.585 5.452 1.00 0.00 C ATOM 628 OG SER A 78 -4.766 10.457 6.527 1.00 0.00 O ATOM 0 H SER A 78 -5.742 8.370 7.548 1.00 0.00 H new ATOM 0 HA SER A 78 -4.457 7.482 5.029 1.00 0.00 H new ATOM 0 HB2 SER A 78 -3.487 9.840 5.038 1.00 0.00 H new ATOM 0 HB3 SER A 78 -5.192 9.719 4.654 1.00 0.00 H new ATOM 0 HG SER A 78 -4.098 11.173 6.567 1.00 0.00 H new ATOM 634 N LEU A 79 -2.179 7.321 6.072 1.00 0.00 N ATOM 635 CA LEU A 79 -0.928 6.996 6.756 1.00 0.00 C ATOM 636 C LEU A 79 0.134 8.064 6.501 1.00 0.00 C ATOM 637 O LEU A 79 0.334 8.500 5.368 1.00 0.00 O ATOM 638 CB LEU A 79 -0.409 5.620 6.322 1.00 0.00 C ATOM 639 CG LEU A 79 -0.878 5.135 4.950 1.00 0.00 C ATOM 640 CD1 LEU A 79 -0.142 5.872 3.839 1.00 0.00 C ATOM 641 CD2 LEU A 79 -0.679 3.631 4.833 1.00 0.00 C ATOM 0 H LEU A 79 -2.181 7.121 5.072 1.00 0.00 H new ATOM 0 HA LEU A 79 -1.136 6.968 7.826 1.00 0.00 H new ATOM 0 HB2 LEU A 79 0.681 5.646 6.324 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -0.712 4.886 7.069 1.00 0.00 H new ATOM 0 HG LEU A 79 -1.941 5.351 4.845 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -0.490 5.512 2.871 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -0.337 6.941 3.920 1.00 0.00 H new ATOM 0 HD13 LEU A 79 0.929 5.691 3.930 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -1.016 3.295 3.852 1.00 0.00 H new ATOM 0 HD22 LEU A 79 0.378 3.393 4.955 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -1.256 3.126 5.608 1.00 0.00 H new ATOM 653 N ALA A 80 0.812 8.478 7.570 1.00 0.00 N ATOM 654 CA ALA A 80 1.858 9.492 7.473 1.00 0.00 C ATOM 655 C ALA A 80 3.203 8.853 7.149 1.00 0.00 C ATOM 656 O ALA A 80 3.586 7.853 7.753 1.00 0.00 O ATOM 657 CB ALA A 80 1.945 10.285 8.768 1.00 0.00 C ATOM 0 H ALA A 80 0.655 8.126 8.514 1.00 0.00 H new ATOM 0 HA ALA A 80 1.601 10.173 6.662 1.00 0.00 H new ATOM 0 HB1 ALA A 80 2.729 11.038 8.682 1.00 0.00 H new ATOM 0 HB2 ALA A 80 0.991 10.775 8.959 1.00 0.00 H new ATOM 0 HB3 ALA A 80 2.178 9.611 9.592 1.00 0.00 H new ATOM 663 N LEU A 81 3.914 9.432 6.188 1.00 0.00 N ATOM 664 CA LEU A 81 5.211 8.906 5.777 1.00 0.00 C ATOM 665 C LEU A 81 6.242 9.017 6.896 1.00 0.00 C ATOM 666 O LEU A 81 6.335 10.040 7.574 1.00 0.00 O ATOM 667 CB LEU A 81 5.711 9.642 4.533 1.00 0.00 C ATOM 668 CG LEU A 81 4.707 9.729 3.384 1.00 0.00 C ATOM 669 CD1 LEU A 81 5.203 10.686 2.312 1.00 0.00 C ATOM 670 CD2 LEU A 81 4.455 8.349 2.793 1.00 0.00 C ATOM 0 H LEU A 81 3.615 10.264 5.680 1.00 0.00 H new ATOM 0 HA LEU A 81 5.080 7.849 5.544 1.00 0.00 H new ATOM 0 HB2 LEU A 81 6.000 10.653 4.820 1.00 0.00 H new ATOM 0 HB3 LEU A 81 6.611 9.144 4.172 1.00 0.00 H new ATOM 0 HG LEU A 81 3.766 10.113 3.777 1.00 0.00 H new ATOM 0 HD11 LEU A 81 4.475 10.735 1.502 1.00 0.00 H new ATOM 0 HD12 LEU A 81 5.334 11.679 2.743 1.00 0.00 H new ATOM 0 HD13 LEU A 81 6.157 10.332 1.921 1.00 0.00 H new ATOM 0 HD21 LEU A 81 3.738 8.428 1.976 1.00 0.00 H new ATOM 0 HD22 LEU A 81 5.391 7.938 2.415 1.00 0.00 H new ATOM 0 HD23 LEU A 81 4.055 7.690 3.564 1.00 0.00 H new ATOM 682 N ASN A 82 7.014 7.950 7.073 1.00 0.00 N ATOM 683 CA ASN A 82 8.050 7.904 8.100 1.00 0.00 C ATOM 684 C ASN A 82 9.397 7.552 7.485 1.00 0.00 C ATOM 685 O ASN A 82 9.511 7.377 6.272 1.00 0.00 O ATOM 686 CB ASN A 82 7.695 6.877 9.173 1.00 0.00 C ATOM 687 CG ASN A 82 6.869 7.470 10.296 1.00 0.00 C ATOM 688 OD1 ASN A 82 6.409 8.609 10.213 1.00 0.00 O ATOM 689 ND2 ASN A 82 6.680 6.696 11.357 1.00 0.00 N ATOM 0 H ASN A 82 6.941 7.100 6.514 1.00 0.00 H new ATOM 0 HA ASN A 82 8.115 8.891 8.558 1.00 0.00 H new ATOM 0 HB2 ASN A 82 7.144 6.055 8.716 1.00 0.00 H new ATOM 0 HB3 ASN A 82 8.612 6.455 9.585 1.00 0.00 H new ATOM 0 HD21 ASN A 82 6.134 7.039 12.148 1.00 0.00 H new ATOM 0 HD22 ASN A 82 7.080 5.758 11.382 1.00 0.00 H new ATOM 696 N ALA A 83 10.418 7.446 8.329 1.00 0.00 N ATOM 697 CA ALA A 83 11.757 7.111 7.863 1.00 0.00 C ATOM 698 C ALA A 83 11.752 5.807 7.072 1.00 0.00 C ATOM 699 O ALA A 83 12.556 5.625 6.158 1.00 0.00 O ATOM 700 CB ALA A 83 12.724 7.019 9.032 1.00 0.00 C ATOM 0 H ALA A 83 10.343 7.587 9.336 1.00 0.00 H new ATOM 0 HA ALA A 83 12.090 7.909 7.199 1.00 0.00 H new ATOM 0 HB1 ALA A 83 13.718 6.768 8.663 1.00 0.00 H new ATOM 0 HB2 ALA A 83 12.761 7.977 9.550 1.00 0.00 H new ATOM 0 HB3 ALA A 83 12.387 6.246 9.723 1.00 0.00 H new ATOM 706 N GLU A 84 10.833 4.906 7.416 1.00 0.00 N ATOM 707 CA GLU A 84 10.726 3.636 6.717 1.00 0.00 C ATOM 708 C GLU A 84 10.236 3.866 5.292 1.00 0.00 C ATOM 709 O GLU A 84 10.453 3.038 4.410 1.00 0.00 O ATOM 710 CB GLU A 84 9.780 2.693 7.459 1.00 0.00 C ATOM 711 CG GLU A 84 10.374 1.321 7.724 1.00 0.00 C ATOM 712 CD GLU A 84 10.192 0.371 6.556 1.00 0.00 C ATOM 713 OE1 GLU A 84 9.453 0.723 5.613 1.00 0.00 O ATOM 714 OE2 GLU A 84 10.791 -0.726 6.584 1.00 0.00 O ATOM 0 H GLU A 84 10.158 5.035 8.170 1.00 0.00 H new ATOM 0 HA GLU A 84 11.712 3.173 6.681 1.00 0.00 H new ATOM 0 HB2 GLU A 84 9.499 3.148 8.409 1.00 0.00 H new ATOM 0 HB3 GLU A 84 8.865 2.578 6.877 1.00 0.00 H new ATOM 0 HG2 GLU A 84 11.437 1.425 7.941 1.00 0.00 H new ATOM 0 HG3 GLU A 84 9.908 0.893 8.612 1.00 0.00 H new ATOM 721 N SER A 85 9.584 5.009 5.075 1.00 0.00 N ATOM 722 CA SER A 85 9.068 5.369 3.758 1.00 0.00 C ATOM 723 C SER A 85 10.168 5.319 2.698 1.00 0.00 C ATOM 724 O SER A 85 9.883 5.290 1.501 1.00 0.00 O ATOM 725 CB SER A 85 8.447 6.767 3.799 1.00 0.00 C ATOM 726 OG SER A 85 7.414 6.840 4.765 1.00 0.00 O ATOM 0 H SER A 85 9.401 5.703 5.800 1.00 0.00 H new ATOM 0 HA SER A 85 8.303 4.642 3.488 1.00 0.00 H new ATOM 0 HB2 SER A 85 9.217 7.503 4.030 1.00 0.00 H new ATOM 0 HB3 SER A 85 8.048 7.020 2.817 1.00 0.00 H new ATOM 0 HG SER A 85 7.184 5.936 5.067 1.00 0.00 H new ATOM 732 N ASN A 86 11.422 5.302 3.139 1.00 0.00 N ATOM 733 CA ASN A 86 12.550 5.246 2.220 1.00 0.00 C ATOM 734 C ASN A 86 12.953 3.802 1.941 1.00 0.00 C ATOM 735 O ASN A 86 13.846 3.543 1.135 1.00 0.00 O ATOM 736 CB ASN A 86 13.742 6.011 2.790 1.00 0.00 C ATOM 737 CG ASN A 86 13.346 7.353 3.371 1.00 0.00 C ATOM 738 OD1 ASN A 86 12.459 7.439 4.220 1.00 0.00 O ATOM 739 ND2 ASN A 86 14.006 8.407 2.913 1.00 0.00 N ATOM 0 H ASN A 86 11.681 5.326 4.125 1.00 0.00 H new ATOM 0 HA ASN A 86 12.242 5.711 1.283 1.00 0.00 H new ATOM 0 HB2 ASN A 86 14.219 5.410 3.564 1.00 0.00 H new ATOM 0 HB3 ASN A 86 14.482 6.163 2.004 1.00 0.00 H new ATOM 0 HD21 ASN A 86 13.786 9.339 3.265 1.00 0.00 H new ATOM 0 HD22 ASN A 86 14.734 8.286 2.209 1.00 0.00 H new ATOM 746 N ASN A 87 12.291 2.861 2.610 1.00 0.00 N ATOM 747 CA ASN A 87 12.585 1.449 2.426 1.00 0.00 C ATOM 748 C ASN A 87 11.324 0.687 2.041 1.00 0.00 C ATOM 749 O ASN A 87 10.454 0.443 2.876 1.00 0.00 O ATOM 750 CB ASN A 87 13.167 0.856 3.711 1.00 0.00 C ATOM 751 CG ASN A 87 14.074 1.821 4.445 1.00 0.00 C ATOM 752 OD1 ASN A 87 13.476 2.837 5.055 1.00 0.00 O flip ATOM 753 ND2 ASN A 87 15.294 1.656 4.466 1.00 0.00 N flip ATOM 0 H ASN A 87 11.549 3.054 3.283 1.00 0.00 H new ATOM 0 HA ASN A 87 13.316 1.355 1.623 1.00 0.00 H new ATOM 0 HB2 ASN A 87 12.351 0.558 4.370 1.00 0.00 H new ATOM 0 HB3 ASN A 87 13.726 -0.047 3.468 1.00 0.00 H new ATOM 0 HD21 ASN A 87 15.709 0.860 3.982 1.00 0.00 H new ATOM 0 HD22 ASN A 87 15.889 2.315 4.967 1.00 0.00 H new ATOM 760 N VAL A 88 11.239 0.305 0.775 1.00 0.00 N ATOM 761 CA VAL A 88 10.088 -0.435 0.276 1.00 0.00 C ATOM 762 C VAL A 88 10.229 -1.925 0.563 1.00 0.00 C ATOM 763 O VAL A 88 11.239 -2.543 0.223 1.00 0.00 O ATOM 764 CB VAL A 88 9.899 -0.223 -1.239 1.00 0.00 C ATOM 765 CG1 VAL A 88 8.608 -0.872 -1.713 1.00 0.00 C ATOM 766 CG2 VAL A 88 9.912 1.261 -1.577 1.00 0.00 C ATOM 0 H VAL A 88 11.954 0.495 0.073 1.00 0.00 H new ATOM 0 HA VAL A 88 9.211 -0.052 0.797 1.00 0.00 H new ATOM 0 HB VAL A 88 10.730 -0.699 -1.759 1.00 0.00 H new ATOM 0 HG11 VAL A 88 8.492 -0.712 -2.785 1.00 0.00 H new ATOM 0 HG12 VAL A 88 8.642 -1.942 -1.508 1.00 0.00 H new ATOM 0 HG13 VAL A 88 7.763 -0.428 -1.186 1.00 0.00 H new ATOM 0 HG21 VAL A 88 9.777 1.391 -2.651 1.00 0.00 H new ATOM 0 HG22 VAL A 88 9.102 1.762 -1.047 1.00 0.00 H new ATOM 0 HG23 VAL A 88 10.866 1.694 -1.276 1.00 0.00 H new ATOM 776 N MET A 89 9.207 -2.493 1.193 1.00 0.00 N ATOM 777 CA MET A 89 9.204 -3.912 1.532 1.00 0.00 C ATOM 778 C MET A 89 8.504 -4.727 0.452 1.00 0.00 C ATOM 779 O MET A 89 7.373 -4.431 0.074 1.00 0.00 O ATOM 780 CB MET A 89 8.526 -4.132 2.889 1.00 0.00 C ATOM 781 CG MET A 89 9.508 -4.432 4.008 1.00 0.00 C ATOM 782 SD MET A 89 9.142 -5.975 4.863 1.00 0.00 S ATOM 783 CE MET A 89 9.826 -5.634 6.482 1.00 0.00 C ATOM 0 H MET A 89 8.367 -1.991 1.480 1.00 0.00 H new ATOM 0 HA MET A 89 10.238 -4.250 1.596 1.00 0.00 H new ATOM 0 HB2 MET A 89 7.950 -3.243 3.148 1.00 0.00 H new ATOM 0 HB3 MET A 89 7.818 -4.957 2.805 1.00 0.00 H new ATOM 0 HG2 MET A 89 10.516 -4.480 3.597 1.00 0.00 H new ATOM 0 HG3 MET A 89 9.495 -3.612 4.726 1.00 0.00 H new ATOM 0 HE1 MET A 89 9.988 -6.572 7.014 1.00 0.00 H new ATOM 0 HE2 MET A 89 10.776 -5.111 6.373 1.00 0.00 H new ATOM 0 HE3 MET A 89 9.132 -5.012 7.047 1.00 0.00 H new ATOM 793 N MET A 90 9.187 -5.755 -0.040 1.00 0.00 N ATOM 794 CA MET A 90 8.633 -6.617 -1.083 1.00 0.00 C ATOM 795 C MET A 90 8.205 -7.959 -0.501 1.00 0.00 C ATOM 796 O MET A 90 8.982 -8.618 0.190 1.00 0.00 O ATOM 797 CB MET A 90 9.655 -6.855 -2.208 1.00 0.00 C ATOM 798 CG MET A 90 10.742 -5.796 -2.317 1.00 0.00 C ATOM 799 SD MET A 90 10.329 -4.496 -3.494 1.00 0.00 S ATOM 800 CE MET A 90 10.522 -3.046 -2.464 1.00 0.00 C ATOM 0 H MET A 90 10.125 -6.013 0.265 1.00 0.00 H new ATOM 0 HA MET A 90 7.763 -6.108 -1.498 1.00 0.00 H new ATOM 0 HB2 MET A 90 10.127 -7.825 -2.052 1.00 0.00 H new ATOM 0 HB3 MET A 90 9.123 -6.909 -3.158 1.00 0.00 H new ATOM 0 HG2 MET A 90 10.911 -5.352 -1.336 1.00 0.00 H new ATOM 0 HG3 MET A 90 11.676 -6.270 -2.618 1.00 0.00 H new ATOM 0 HE1 MET A 90 10.548 -2.155 -3.091 1.00 0.00 H new ATOM 0 HE2 MET A 90 9.684 -2.978 -1.771 1.00 0.00 H new ATOM 0 HE3 MET A 90 11.453 -3.121 -1.901 1.00 0.00 H new ATOM 810 N LEU A 91 6.971 -8.364 -0.781 1.00 0.00 N ATOM 811 CA LEU A 91 6.466 -9.635 -0.273 1.00 0.00 C ATOM 812 C LEU A 91 5.301 -10.156 -1.095 1.00 0.00 C ATOM 813 O LEU A 91 4.439 -9.392 -1.526 1.00 0.00 O ATOM 814 CB LEU A 91 5.999 -9.483 1.175 1.00 0.00 C ATOM 815 CG LEU A 91 4.846 -8.496 1.374 1.00 0.00 C ATOM 816 CD1 LEU A 91 3.710 -9.148 2.144 1.00 0.00 C ATOM 817 CD2 LEU A 91 5.326 -7.245 2.091 1.00 0.00 C ATOM 0 H LEU A 91 6.308 -7.838 -1.350 1.00 0.00 H new ATOM 0 HA LEU A 91 7.290 -10.346 -0.338 1.00 0.00 H new ATOM 0 HB2 LEU A 91 5.692 -10.460 1.548 1.00 0.00 H new ATOM 0 HB3 LEU A 91 6.844 -9.161 1.783 1.00 0.00 H new ATOM 0 HG LEU A 91 4.474 -8.206 0.391 1.00 0.00 H new ATOM 0 HD11 LEU A 91 2.900 -8.430 2.275 1.00 0.00 H new ATOM 0 HD12 LEU A 91 3.343 -10.012 1.589 1.00 0.00 H new ATOM 0 HD13 LEU A 91 4.071 -9.471 3.121 1.00 0.00 H new ATOM 0 HD21 LEU A 91 4.490 -6.557 2.222 1.00 0.00 H new ATOM 0 HD22 LEU A 91 5.729 -7.517 3.067 1.00 0.00 H new ATOM 0 HD23 LEU A 91 6.104 -6.762 1.499 1.00 0.00 H new ATOM 829 N THR A 92 5.248 -11.471 -1.257 1.00 0.00 N ATOM 830 CA THR A 92 4.144 -12.096 -1.960 1.00 0.00 C ATOM 831 C THR A 92 3.085 -12.426 -0.923 1.00 0.00 C ATOM 832 O THR A 92 3.321 -13.242 -0.031 1.00 0.00 O ATOM 833 CB THR A 92 4.604 -13.363 -2.685 1.00 0.00 C ATOM 834 OG1 THR A 92 3.504 -14.026 -3.282 1.00 0.00 O ATOM 835 CG2 THR A 92 5.297 -14.354 -1.774 1.00 0.00 C ATOM 0 H THR A 92 5.955 -12.120 -0.912 1.00 0.00 H new ATOM 0 HA THR A 92 3.745 -11.424 -2.720 1.00 0.00 H new ATOM 0 HB THR A 92 5.316 -13.024 -3.437 1.00 0.00 H new ATOM 0 HG1 THR A 92 3.818 -14.832 -3.742 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.598 -15.229 -2.350 1.00 0.00 H new ATOM 0 HG22 THR A 92 6.179 -13.889 -1.334 1.00 0.00 H new ATOM 0 HG23 THR A 92 4.614 -14.659 -0.981 1.00 0.00 H new ATOM 843 N HIS A 93 1.945 -11.756 -0.996 1.00 0.00 N ATOM 844 CA HIS A 93 0.905 -11.967 0.000 1.00 0.00 C ATOM 845 C HIS A 93 -0.469 -11.540 -0.505 1.00 0.00 C ATOM 846 O HIS A 93 -0.587 -10.679 -1.377 1.00 0.00 O ATOM 847 CB HIS A 93 1.273 -11.168 1.254 1.00 0.00 C ATOM 848 CG HIS A 93 1.103 -11.918 2.534 1.00 0.00 C ATOM 849 ND1 HIS A 93 -0.122 -12.339 3.006 1.00 0.00 N ATOM 850 CD2 HIS A 93 2.015 -12.308 3.453 1.00 0.00 C ATOM 851 CE1 HIS A 93 0.044 -12.956 4.162 1.00 0.00 C ATOM 852 NE2 HIS A 93 1.332 -12.953 4.455 1.00 0.00 N ATOM 0 H HIS A 93 1.718 -11.074 -1.720 1.00 0.00 H new ATOM 0 HA HIS A 93 0.844 -13.033 0.222 1.00 0.00 H new ATOM 0 HB2 HIS A 93 2.310 -10.843 1.172 1.00 0.00 H new ATOM 0 HB3 HIS A 93 0.659 -10.268 1.290 1.00 0.00 H new ATOM 0 HD2 HIS A 93 3.081 -12.143 3.408 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -0.740 -13.389 4.765 1.00 0.00 H new ATOM 0 HE2 HIS A 93 1.751 -13.363 5.290 1.00 0.00 H new ATOM 861 N ALA A 94 -1.507 -12.145 0.066 1.00 0.00 N ATOM 862 CA ALA A 94 -2.879 -11.830 -0.303 1.00 0.00 C ATOM 863 C ALA A 94 -3.358 -10.587 0.437 1.00 0.00 C ATOM 864 O ALA A 94 -3.323 -10.534 1.666 1.00 0.00 O ATOM 865 CB ALA A 94 -3.793 -13.008 0.001 1.00 0.00 C ATOM 0 H ALA A 94 -1.420 -12.859 0.789 1.00 0.00 H new ATOM 0 HA ALA A 94 -2.911 -11.630 -1.374 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -4.816 -12.757 -0.280 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -3.464 -13.879 -0.565 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -3.755 -13.233 1.067 1.00 0.00 H new ATOM 871 N ILE A 95 -3.801 -9.588 -0.316 1.00 0.00 N ATOM 872 CA ILE A 95 -4.280 -8.346 0.278 1.00 0.00 C ATOM 873 C ILE A 95 -5.766 -8.429 0.598 1.00 0.00 C ATOM 874 O ILE A 95 -6.592 -8.648 -0.288 1.00 0.00 O ATOM 875 CB ILE A 95 -4.032 -7.140 -0.649 1.00 0.00 C ATOM 876 CG1 ILE A 95 -2.661 -7.257 -1.317 1.00 0.00 C ATOM 877 CG2 ILE A 95 -4.139 -5.840 0.134 1.00 0.00 C ATOM 878 CD1 ILE A 95 -1.505 -7.161 -0.347 1.00 0.00 C ATOM 0 H ILE A 95 -3.839 -9.613 -1.335 1.00 0.00 H new ATOM 0 HA ILE A 95 -3.718 -8.203 1.201 1.00 0.00 H new ATOM 0 HB ILE A 95 -4.794 -7.135 -1.428 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -2.603 -8.209 -1.845 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -2.563 -6.471 -2.066 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -3.961 -4.997 -0.534 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -5.136 -5.757 0.566 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -3.396 -5.833 0.932 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -0.565 -7.252 -0.891 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -1.537 -6.198 0.163 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -1.579 -7.963 0.387 1.00 0.00 H new ATOM 890 N THR A 96 -6.101 -8.251 1.871 1.00 0.00 N ATOM 891 CA THR A 96 -7.489 -8.302 2.308 1.00 0.00 C ATOM 892 C THR A 96 -8.133 -6.925 2.203 1.00 0.00 C ATOM 893 O THR A 96 -7.451 -5.904 2.288 1.00 0.00 O ATOM 894 CB THR A 96 -7.580 -8.816 3.748 1.00 0.00 C ATOM 895 OG1 THR A 96 -6.330 -9.319 4.183 1.00 0.00 O ATOM 896 CG2 THR A 96 -8.603 -9.918 3.924 1.00 0.00 C ATOM 0 H THR A 96 -5.430 -8.070 2.617 1.00 0.00 H new ATOM 0 HA THR A 96 -8.027 -8.990 1.656 1.00 0.00 H new ATOM 0 HB THR A 96 -7.887 -7.956 4.343 1.00 0.00 H new ATOM 0 HG1 THR A 96 -5.733 -8.572 4.397 1.00 0.00 H new ATOM 0 HG21 THR A 96 -8.618 -10.238 4.966 1.00 0.00 H new ATOM 0 HG22 THR A 96 -9.589 -9.547 3.644 1.00 0.00 H new ATOM 0 HG23 THR A 96 -8.340 -10.764 3.289 1.00 0.00 H new ATOM 904 N ARG A 97 -9.447 -6.903 2.016 1.00 0.00 N ATOM 905 CA ARG A 97 -10.180 -5.649 1.897 1.00 0.00 C ATOM 906 C ARG A 97 -11.192 -5.504 3.027 1.00 0.00 C ATOM 907 O ARG A 97 -12.142 -6.280 3.128 1.00 0.00 O ATOM 908 CB ARG A 97 -10.888 -5.576 0.543 1.00 0.00 C ATOM 909 CG ARG A 97 -10.390 -4.444 -0.343 1.00 0.00 C ATOM 910 CD ARG A 97 -11.535 -3.772 -1.083 1.00 0.00 C ATOM 911 NE ARG A 97 -11.213 -2.397 -1.456 1.00 0.00 N ATOM 912 CZ ARG A 97 -11.948 -1.663 -2.287 1.00 0.00 C ATOM 913 NH1 ARG A 97 -13.058 -2.161 -2.816 1.00 0.00 N ATOM 914 NH2 ARG A 97 -11.575 -0.426 -2.587 1.00 0.00 N ATOM 0 H ARG A 97 -10.027 -7.739 1.944 1.00 0.00 H new ATOM 0 HA ARG A 97 -9.466 -4.828 1.968 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -10.752 -6.523 0.020 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -11.958 -5.453 0.708 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -9.867 -3.707 0.266 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -9.669 -4.833 -1.062 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -11.773 -4.345 -1.979 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -12.426 -3.778 -0.455 1.00 0.00 H new ATOM 0 HE ARG A 97 -10.375 -1.975 -1.056 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -13.351 -3.111 -2.586 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -13.618 -1.594 -3.453 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -10.724 -0.037 -2.180 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -12.139 0.136 -3.224 1.00 0.00 H new ATOM 928 N TYR A 98 -10.983 -4.503 3.874 1.00 0.00 N ATOM 929 CA TYR A 98 -11.875 -4.253 4.998 1.00 0.00 C ATOM 930 C TYR A 98 -12.589 -2.914 4.843 1.00 0.00 C ATOM 931 O TYR A 98 -12.033 -1.861 5.162 1.00 0.00 O ATOM 932 CB TYR A 98 -11.092 -4.274 6.312 1.00 0.00 C ATOM 933 CG TYR A 98 -10.826 -5.667 6.839 1.00 0.00 C ATOM 934 CD1 TYR A 98 -9.739 -6.406 6.389 1.00 0.00 C ATOM 935 CD2 TYR A 98 -11.663 -6.242 7.787 1.00 0.00 C ATOM 936 CE1 TYR A 98 -9.494 -7.679 6.869 1.00 0.00 C ATOM 937 CE2 TYR A 98 -11.424 -7.514 8.272 1.00 0.00 C ATOM 938 CZ TYR A 98 -10.339 -8.228 7.810 1.00 0.00 C ATOM 939 OH TYR A 98 -10.098 -9.494 8.290 1.00 0.00 O ATOM 0 H TYR A 98 -10.202 -3.851 3.803 1.00 0.00 H new ATOM 0 HA TYR A 98 -12.625 -5.044 5.014 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -10.141 -3.762 6.166 1.00 0.00 H new ATOM 0 HB3 TYR A 98 -11.645 -3.710 7.063 1.00 0.00 H new ATOM 0 HD1 TYR A 98 -9.075 -5.979 5.652 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -12.514 -5.686 8.151 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -8.645 -8.241 6.509 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -12.084 -7.946 9.009 1.00 0.00 H new ATOM 0 HH TYR A 98 -10.785 -9.731 8.947 1.00 0.00 H new ATOM 949 N GLY A 99 -13.825 -2.961 4.356 1.00 0.00 N ATOM 950 CA GLY A 99 -14.594 -1.745 4.176 1.00 0.00 C ATOM 951 C GLY A 99 -15.086 -1.175 5.491 1.00 0.00 C ATOM 952 O GLY A 99 -15.779 -1.854 6.250 1.00 0.00 O ATOM 0 H GLY A 99 -14.306 -3.818 4.084 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -13.980 -1.002 3.667 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -15.447 -1.950 3.530 1.00 0.00 H new ATOM 956 N ILE A 100 -14.717 0.071 5.764 1.00 0.00 N ATOM 957 CA ILE A 100 -15.116 0.731 7.003 1.00 0.00 C ATOM 958 C ILE A 100 -15.742 2.098 6.734 1.00 0.00 C ATOM 959 O ILE A 100 -16.679 2.507 7.419 1.00 0.00 O ATOM 960 CB ILE A 100 -13.915 0.909 7.957 1.00 0.00 C ATOM 961 CG1 ILE A 100 -12.897 -0.215 7.759 1.00 0.00 C ATOM 962 CG2 ILE A 100 -14.386 0.946 9.403 1.00 0.00 C ATOM 963 CD1 ILE A 100 -13.474 -1.596 7.977 1.00 0.00 C ATOM 0 H ILE A 100 -14.143 0.644 5.146 1.00 0.00 H new ATOM 0 HA ILE A 100 -15.858 0.086 7.474 1.00 0.00 H new ATOM 0 HB ILE A 100 -13.431 1.857 7.724 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -12.492 -0.154 6.749 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -12.064 -0.065 8.446 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -13.527 1.072 10.062 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -15.074 1.780 9.540 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -14.895 0.013 9.644 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -12.697 -2.344 7.820 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -13.853 -1.675 8.996 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -14.288 -1.765 7.272 1.00 0.00 H new ATOM 975 N SER A 101 -15.214 2.801 5.739 1.00 0.00 N ATOM 976 CA SER A 101 -15.715 4.124 5.384 1.00 0.00 C ATOM 977 C SER A 101 -17.123 4.052 4.804 1.00 0.00 C ATOM 978 O SER A 101 -17.933 4.958 5.004 1.00 0.00 O ATOM 979 CB SER A 101 -14.777 4.792 4.376 1.00 0.00 C ATOM 980 OG SER A 101 -14.882 6.204 4.439 1.00 0.00 O ATOM 0 H SER A 101 -14.438 2.476 5.163 1.00 0.00 H new ATOM 0 HA SER A 101 -15.753 4.718 6.297 1.00 0.00 H new ATOM 0 HB2 SER A 101 -13.749 4.491 4.577 1.00 0.00 H new ATOM 0 HB3 SER A 101 -15.018 4.451 3.369 1.00 0.00 H new ATOM 0 HG SER A 101 -15.810 6.455 4.628 1.00 0.00 H new ATOM 986 N THR A 102 -17.408 2.977 4.078 1.00 0.00 N ATOM 987 CA THR A 102 -18.720 2.802 3.463 1.00 0.00 C ATOM 988 C THR A 102 -18.944 1.352 3.041 1.00 0.00 C ATOM 989 O THR A 102 -18.007 0.555 3.001 1.00 0.00 O ATOM 990 CB THR A 102 -18.854 3.722 2.249 1.00 0.00 C ATOM 991 OG1 THR A 102 -18.399 5.028 2.558 1.00 0.00 O ATOM 992 CG2 THR A 102 -20.272 3.840 1.736 1.00 0.00 C ATOM 0 H THR A 102 -16.752 2.216 3.901 1.00 0.00 H new ATOM 0 HA THR A 102 -19.477 3.062 4.203 1.00 0.00 H new ATOM 0 HB THR A 102 -18.243 3.262 1.472 1.00 0.00 H new ATOM 0 HG1 THR A 102 -18.696 5.273 3.459 1.00 0.00 H new ATOM 0 HG21 THR A 102 -20.293 4.508 0.875 1.00 0.00 H new ATOM 0 HG22 THR A 102 -20.635 2.856 1.441 1.00 0.00 H new ATOM 0 HG23 THR A 102 -20.911 4.242 2.522 1.00 0.00 H new ATOM 1000 N ASP A 103 -20.193 1.021 2.721 1.00 0.00 N ATOM 1001 CA ASP A 103 -20.541 -0.332 2.297 1.00 0.00 C ATOM 1002 C ASP A 103 -20.598 -0.437 0.772 1.00 0.00 C ATOM 1003 O ASP A 103 -21.120 -1.409 0.230 1.00 0.00 O ATOM 1004 CB ASP A 103 -21.887 -0.743 2.896 1.00 0.00 C ATOM 1005 CG ASP A 103 -21.733 -1.481 4.213 1.00 0.00 C ATOM 1006 OD1 ASP A 103 -21.824 -0.827 5.273 1.00 0.00 O ATOM 1007 OD2 ASP A 103 -21.523 -2.710 4.182 1.00 0.00 O ATOM 0 H ASP A 103 -20.979 1.670 2.747 1.00 0.00 H new ATOM 0 HA ASP A 103 -19.764 -1.006 2.657 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -22.500 0.145 3.050 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -22.419 -1.378 2.187 1.00 0.00 H new ATOM 1012 N ASP A 104 -20.053 0.566 0.087 1.00 0.00 N ATOM 1013 CA ASP A 104 -20.039 0.578 -1.372 1.00 0.00 C ATOM 1014 C ASP A 104 -18.604 0.629 -1.889 1.00 0.00 C ATOM 1015 O ASP A 104 -17.800 1.424 -1.404 1.00 0.00 O ATOM 1016 CB ASP A 104 -20.829 1.777 -1.900 1.00 0.00 C ATOM 1017 CG ASP A 104 -21.810 1.389 -2.990 1.00 0.00 C ATOM 1018 OD1 ASP A 104 -21.809 2.047 -4.052 1.00 0.00 O ATOM 1019 OD2 ASP A 104 -22.579 0.426 -2.781 1.00 0.00 O ATOM 0 H ASP A 104 -19.616 1.380 0.519 1.00 0.00 H new ATOM 0 HA ASP A 104 -20.508 -0.338 -1.730 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -21.371 2.243 -1.077 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -20.136 2.523 -2.288 1.00 0.00 H new ATOM 1024 N PRO A 105 -18.262 -0.218 -2.882 1.00 0.00 N ATOM 1025 CA PRO A 105 -16.917 -0.274 -3.465 1.00 0.00 C ATOM 1026 C PRO A 105 -16.226 1.083 -3.528 1.00 0.00 C ATOM 1027 O PRO A 105 -16.316 1.792 -4.530 1.00 0.00 O ATOM 1028 CB PRO A 105 -17.204 -0.805 -4.861 1.00 0.00 C ATOM 1029 CG PRO A 105 -18.321 -1.767 -4.648 1.00 0.00 C ATOM 1030 CD PRO A 105 -19.160 -1.198 -3.526 1.00 0.00 C ATOM 0 HA PRO A 105 -16.232 -0.883 -2.875 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -17.489 -0.004 -5.543 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -16.330 -1.294 -5.291 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -18.913 -1.884 -5.556 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -17.940 -2.754 -4.387 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -20.066 -0.724 -3.904 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -19.474 -1.974 -2.827 1.00 0.00 H new ATOM 1038 N ASN A 106 -15.533 1.435 -2.449 1.00 0.00 N ATOM 1039 CA ASN A 106 -14.824 2.704 -2.387 1.00 0.00 C ATOM 1040 C ASN A 106 -13.675 2.661 -1.379 1.00 0.00 C ATOM 1041 O ASN A 106 -13.276 1.591 -0.918 1.00 0.00 O ATOM 1042 CB ASN A 106 -15.797 3.848 -2.060 1.00 0.00 C ATOM 1043 CG ASN A 106 -15.999 4.058 -0.570 1.00 0.00 C ATOM 1044 OD1 ASN A 106 -16.160 2.967 0.166 1.00 0.00 O flip ATOM 1045 ND2 ASN A 106 -16.011 5.191 -0.089 1.00 0.00 N flip ATOM 0 H ASN A 106 -15.449 0.861 -1.610 1.00 0.00 H new ATOM 0 HA ASN A 106 -14.387 2.889 -3.369 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -15.423 4.771 -2.502 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -16.761 3.640 -2.524 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -15.883 6.003 -0.693 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -16.149 5.318 0.914 1.00 0.00 H new ATOM 1052 N LYS A 107 -13.144 3.839 -1.056 1.00 0.00 N ATOM 1053 CA LYS A 107 -12.030 3.965 -0.117 1.00 0.00 C ATOM 1054 C LYS A 107 -12.228 3.087 1.115 1.00 0.00 C ATOM 1055 O LYS A 107 -13.129 3.318 1.919 1.00 0.00 O ATOM 1056 CB LYS A 107 -11.859 5.437 0.290 1.00 0.00 C ATOM 1057 CG LYS A 107 -11.121 5.653 1.606 1.00 0.00 C ATOM 1058 CD LYS A 107 -11.852 6.643 2.500 1.00 0.00 C ATOM 1059 CE LYS A 107 -11.669 6.309 3.972 1.00 0.00 C ATOM 1060 NZ LYS A 107 -10.893 7.359 4.687 1.00 0.00 N ATOM 0 H LYS A 107 -13.471 4.728 -1.435 1.00 0.00 H new ATOM 0 HA LYS A 107 -11.124 3.621 -0.616 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -11.322 5.959 -0.502 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -12.845 5.897 0.362 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -11.016 4.701 2.126 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -10.114 6.019 1.404 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -11.483 7.650 2.306 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -12.914 6.640 2.255 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -12.646 6.196 4.443 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -11.157 5.352 4.066 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -10.877 7.146 5.705 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -9.919 7.380 4.322 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -11.340 8.286 4.534 1.00 0.00 H new ATOM 1074 N TRP A 108 -11.370 2.080 1.247 1.00 0.00 N ATOM 1075 CA TRP A 108 -11.431 1.154 2.366 1.00 0.00 C ATOM 1076 C TRP A 108 -10.036 0.803 2.872 1.00 0.00 C ATOM 1077 O TRP A 108 -9.031 1.247 2.317 1.00 0.00 O ATOM 1078 CB TRP A 108 -12.169 -0.108 1.954 1.00 0.00 C ATOM 1079 CG TRP A 108 -13.627 0.124 1.732 1.00 0.00 C ATOM 1080 CD1 TRP A 108 -14.419 1.033 2.367 1.00 0.00 C ATOM 1081 CD2 TRP A 108 -14.466 -0.572 0.818 1.00 0.00 C ATOM 1082 NE1 TRP A 108 -15.701 0.946 1.897 1.00 0.00 N ATOM 1083 CE2 TRP A 108 -15.758 -0.039 0.948 1.00 0.00 C ATOM 1084 CE3 TRP A 108 -14.246 -1.594 -0.096 1.00 0.00 C ATOM 1085 CZ2 TRP A 108 -16.831 -0.501 0.197 1.00 0.00 C ATOM 1086 CZ3 TRP A 108 -15.309 -2.054 -0.848 1.00 0.00 C ATOM 1087 CH2 TRP A 108 -16.590 -1.508 -0.695 1.00 0.00 C ATOM 0 H TRP A 108 -10.619 1.886 0.585 1.00 0.00 H new ATOM 0 HA TRP A 108 -11.971 1.640 3.179 1.00 0.00 H new ATOM 0 HB2 TRP A 108 -11.725 -0.502 1.040 1.00 0.00 H new ATOM 0 HB3 TRP A 108 -12.039 -0.868 2.725 1.00 0.00 H new ATOM 0 HD1 TRP A 108 -14.084 1.721 3.129 1.00 0.00 H new ATOM 0 HE1 TRP A 108 -16.486 1.521 2.204 1.00 0.00 H new ATOM 0 HE3 TRP A 108 -13.261 -2.021 -0.217 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 -17.819 -0.080 0.314 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 -15.150 -2.846 -1.565 1.00 0.00 H new ATOM 0 HH2 TRP A 108 -17.403 -1.890 -1.294 1.00 0.00 H new ATOM 1098 N ARG A 109 -9.985 0.005 3.935 1.00 0.00 N ATOM 1099 CA ARG A 109 -8.717 -0.405 4.525 1.00 0.00 C ATOM 1100 C ARG A 109 -8.328 -1.792 4.040 1.00 0.00 C ATOM 1101 O ARG A 109 -9.166 -2.688 3.968 1.00 0.00 O ATOM 1102 CB ARG A 109 -8.828 -0.424 6.050 1.00 0.00 C ATOM 1103 CG ARG A 109 -8.428 0.878 6.716 1.00 0.00 C ATOM 1104 CD ARG A 109 -9.508 1.937 6.560 1.00 0.00 C ATOM 1105 NE ARG A 109 -9.710 2.701 7.790 1.00 0.00 N ATOM 1106 CZ ARG A 109 -10.808 3.407 8.051 1.00 0.00 C ATOM 1107 NH1 ARG A 109 -11.801 3.454 7.172 1.00 0.00 N ATOM 1108 NH2 ARG A 109 -10.911 4.070 9.195 1.00 0.00 N ATOM 0 H ARG A 109 -10.809 -0.370 4.405 1.00 0.00 H new ATOM 0 HA ARG A 109 -7.953 0.311 4.221 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -9.856 -0.660 6.326 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -8.201 -1.226 6.439 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -8.238 0.703 7.775 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -7.496 1.240 6.281 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -9.235 2.616 5.752 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -10.445 1.459 6.272 1.00 0.00 H new ATOM 0 HE ARG A 109 -8.967 2.693 8.488 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -11.726 2.947 6.290 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -12.640 3.997 7.378 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -10.150 4.038 9.873 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -11.752 4.612 9.397 1.00 0.00 H new ATOM 1122 N TYR A 110 -7.052 -1.973 3.718 1.00 0.00 N ATOM 1123 CA TYR A 110 -6.573 -3.265 3.256 1.00 0.00 C ATOM 1124 C TYR A 110 -5.795 -3.946 4.367 1.00 0.00 C ATOM 1125 O TYR A 110 -5.431 -3.305 5.351 1.00 0.00 O ATOM 1126 CB TYR A 110 -5.710 -3.103 2.008 1.00 0.00 C ATOM 1127 CG TYR A 110 -6.515 -2.830 0.757 1.00 0.00 C ATOM 1128 CD1 TYR A 110 -6.762 -3.837 -0.169 1.00 0.00 C ATOM 1129 CD2 TYR A 110 -7.029 -1.563 0.501 1.00 0.00 C ATOM 1130 CE1 TYR A 110 -7.494 -3.588 -1.314 1.00 0.00 C ATOM 1131 CE2 TYR A 110 -7.764 -1.309 -0.642 1.00 0.00 C ATOM 1132 CZ TYR A 110 -7.992 -2.325 -1.547 1.00 0.00 C ATOM 1133 OH TYR A 110 -8.719 -2.076 -2.689 1.00 0.00 O ATOM 0 H TYR A 110 -6.338 -1.246 3.769 1.00 0.00 H new ATOM 0 HA TYR A 110 -7.427 -3.888 2.991 1.00 0.00 H new ATOM 0 HB2 TYR A 110 -5.006 -2.286 2.165 1.00 0.00 H new ATOM 0 HB3 TYR A 110 -5.120 -4.008 1.862 1.00 0.00 H new ATOM 0 HD1 TYR A 110 -6.376 -4.830 0.009 1.00 0.00 H new ATOM 0 HD2 TYR A 110 -6.851 -0.765 1.207 1.00 0.00 H new ATOM 0 HE1 TYR A 110 -7.675 -4.381 -2.024 1.00 0.00 H new ATOM 0 HE2 TYR A 110 -8.158 -0.320 -0.826 1.00 0.00 H new ATOM 0 HH TYR A 110 -8.998 -1.137 -2.701 1.00 0.00 H new ATOM 1143 N TYR A 111 -5.564 -5.245 4.235 1.00 0.00 N ATOM 1144 CA TYR A 111 -4.849 -5.974 5.272 1.00 0.00 C ATOM 1145 C TYR A 111 -3.889 -7.011 4.703 1.00 0.00 C ATOM 1146 O TYR A 111 -4.280 -7.886 3.931 1.00 0.00 O ATOM 1147 CB TYR A 111 -5.844 -6.648 6.214 1.00 0.00 C ATOM 1148 CG TYR A 111 -6.374 -5.721 7.288 1.00 0.00 C ATOM 1149 CD1 TYR A 111 -7.245 -4.683 6.971 1.00 0.00 C ATOM 1150 CD2 TYR A 111 -5.995 -5.880 8.614 1.00 0.00 C ATOM 1151 CE1 TYR A 111 -7.723 -3.827 7.949 1.00 0.00 C ATOM 1152 CE2 TYR A 111 -6.471 -5.031 9.598 1.00 0.00 C ATOM 1153 CZ TYR A 111 -7.333 -4.008 9.260 1.00 0.00 C ATOM 1154 OH TYR A 111 -7.806 -3.161 10.236 1.00 0.00 O ATOM 0 H TYR A 111 -5.855 -5.807 3.435 1.00 0.00 H new ATOM 0 HA TYR A 111 -4.249 -5.248 5.821 1.00 0.00 H new ATOM 0 HB2 TYR A 111 -6.681 -7.034 5.632 1.00 0.00 H new ATOM 0 HB3 TYR A 111 -5.363 -7.504 6.687 1.00 0.00 H new ATOM 0 HD1 TYR A 111 -7.553 -4.543 5.945 1.00 0.00 H new ATOM 0 HD2 TYR A 111 -5.319 -6.678 8.882 1.00 0.00 H new ATOM 0 HE1 TYR A 111 -8.396 -3.024 7.687 1.00 0.00 H new ATOM 0 HE2 TYR A 111 -6.169 -5.169 10.626 1.00 0.00 H new ATOM 0 HH TYR A 111 -7.437 -3.425 11.105 1.00 0.00 H new ATOM 1164 N LEU A 112 -2.633 -6.916 5.125 1.00 0.00 N ATOM 1165 CA LEU A 112 -1.602 -7.851 4.703 1.00 0.00 C ATOM 1166 C LEU A 112 -1.359 -8.861 5.816 1.00 0.00 C ATOM 1167 O LEU A 112 -0.725 -8.544 6.822 1.00 0.00 O ATOM 1168 CB LEU A 112 -0.306 -7.103 4.377 1.00 0.00 C ATOM 1169 CG LEU A 112 0.668 -7.846 3.461 1.00 0.00 C ATOM 1170 CD1 LEU A 112 0.852 -9.285 3.921 1.00 0.00 C ATOM 1171 CD2 LEU A 112 0.180 -7.801 2.023 1.00 0.00 C ATOM 0 H LEU A 112 -2.304 -6.193 5.765 1.00 0.00 H new ATOM 0 HA LEU A 112 -1.932 -8.371 3.804 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -0.563 -6.152 3.911 1.00 0.00 H new ATOM 0 HB3 LEU A 112 0.205 -6.872 5.312 1.00 0.00 H new ATOM 0 HG LEU A 112 1.636 -7.348 3.514 1.00 0.00 H new ATOM 0 HD11 LEU A 112 1.549 -9.794 3.255 1.00 0.00 H new ATOM 0 HD12 LEU A 112 1.248 -9.295 4.936 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -0.109 -9.799 3.902 1.00 0.00 H new ATOM 0 HD21 LEU A 112 0.883 -8.334 1.383 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -0.800 -8.273 1.956 1.00 0.00 H new ATOM 0 HD23 LEU A 112 0.106 -6.764 1.696 1.00 0.00 H new ATOM 1183 N ASP A 113 -1.883 -10.071 5.650 1.00 0.00 N ATOM 1184 CA ASP A 113 -1.733 -11.101 6.666 1.00 0.00 C ATOM 1185 C ASP A 113 -2.484 -10.678 7.937 1.00 0.00 C ATOM 1186 O ASP A 113 -3.681 -10.398 7.881 1.00 0.00 O ATOM 1187 CB ASP A 113 -0.245 -11.354 6.946 1.00 0.00 C ATOM 1188 CG ASP A 113 -0.003 -12.669 7.663 1.00 0.00 C ATOM 1189 OD1 ASP A 113 0.855 -13.448 7.199 1.00 0.00 O ATOM 1190 OD2 ASP A 113 -0.672 -12.918 8.688 1.00 0.00 O ATOM 0 H ASP A 113 -2.412 -10.359 4.827 1.00 0.00 H new ATOM 0 HA ASP A 113 -2.164 -12.037 6.310 1.00 0.00 H new ATOM 0 HB2 ASP A 113 0.304 -11.351 6.004 1.00 0.00 H new ATOM 0 HB3 ASP A 113 0.152 -10.537 7.549 1.00 0.00 H new ATOM 1195 N SER A 114 -1.792 -10.614 9.075 1.00 0.00 N ATOM 1196 CA SER A 114 -2.421 -10.204 10.324 1.00 0.00 C ATOM 1197 C SER A 114 -2.166 -8.723 10.600 1.00 0.00 C ATOM 1198 O SER A 114 -2.300 -8.265 11.735 1.00 0.00 O ATOM 1199 CB SER A 114 -1.895 -11.051 11.485 1.00 0.00 C ATOM 1200 OG SER A 114 -0.588 -11.529 11.217 1.00 0.00 O ATOM 0 H SER A 114 -0.801 -10.840 9.155 1.00 0.00 H new ATOM 0 HA SER A 114 -3.496 -10.357 10.230 1.00 0.00 H new ATOM 0 HB2 SER A 114 -1.888 -10.457 12.399 1.00 0.00 H new ATOM 0 HB3 SER A 114 -2.565 -11.893 11.658 1.00 0.00 H new ATOM 0 HG SER A 114 -0.274 -12.066 11.974 1.00 0.00 H new ATOM 1206 N VAL A 115 -1.791 -7.978 9.561 1.00 0.00 N ATOM 1207 CA VAL A 115 -1.510 -6.553 9.705 1.00 0.00 C ATOM 1208 C VAL A 115 -2.374 -5.718 8.767 1.00 0.00 C ATOM 1209 O VAL A 115 -2.807 -6.192 7.717 1.00 0.00 O ATOM 1210 CB VAL A 115 -0.027 -6.243 9.426 1.00 0.00 C ATOM 1211 CG1 VAL A 115 0.287 -4.789 9.748 1.00 0.00 C ATOM 1212 CG2 VAL A 115 0.877 -7.179 10.217 1.00 0.00 C ATOM 0 H VAL A 115 -1.675 -8.338 8.614 1.00 0.00 H new ATOM 0 HA VAL A 115 -1.744 -6.291 10.737 1.00 0.00 H new ATOM 0 HB VAL A 115 0.162 -6.405 8.365 1.00 0.00 H new ATOM 0 HG11 VAL A 115 1.339 -4.590 9.544 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -0.332 -4.138 9.130 1.00 0.00 H new ATOM 0 HG13 VAL A 115 0.079 -4.596 10.800 1.00 0.00 H new ATOM 0 HG21 VAL A 115 1.920 -6.943 10.005 1.00 0.00 H new ATOM 0 HG22 VAL A 115 0.686 -7.055 11.283 1.00 0.00 H new ATOM 0 HG23 VAL A 115 0.673 -8.211 9.930 1.00 0.00 H new ATOM 1222 N GLU A 116 -2.612 -4.467 9.151 1.00 0.00 N ATOM 1223 CA GLU A 116 -3.415 -3.557 8.342 1.00 0.00 C ATOM 1224 C GLU A 116 -2.525 -2.768 7.388 1.00 0.00 C ATOM 1225 O GLU A 116 -1.495 -2.228 7.792 1.00 0.00 O ATOM 1226 CB GLU A 116 -4.199 -2.600 9.240 1.00 0.00 C ATOM 1227 CG GLU A 116 -3.315 -1.707 10.096 1.00 0.00 C ATOM 1228 CD GLU A 116 -3.538 -1.916 11.582 1.00 0.00 C ATOM 1229 OE1 GLU A 116 -3.281 -0.972 12.358 1.00 0.00 O ATOM 1230 OE2 GLU A 116 -3.968 -3.023 11.968 1.00 0.00 O ATOM 0 H GLU A 116 -2.260 -4.061 10.018 1.00 0.00 H new ATOM 0 HA GLU A 116 -4.120 -4.147 7.756 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -4.840 -1.974 8.618 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -4.854 -3.180 9.890 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -2.269 -1.902 9.858 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -3.509 -0.664 9.847 1.00 0.00 H new ATOM 1237 N VAL A 117 -2.920 -2.711 6.121 1.00 0.00 N ATOM 1238 CA VAL A 117 -2.144 -1.994 5.118 1.00 0.00 C ATOM 1239 C VAL A 117 -3.029 -1.139 4.213 1.00 0.00 C ATOM 1240 O VAL A 117 -4.262 -1.254 4.219 1.00 0.00 O ATOM 1241 CB VAL A 117 -1.323 -2.968 4.250 1.00 0.00 C ATOM 1242 CG1 VAL A 117 -0.426 -3.833 5.122 1.00 0.00 C ATOM 1243 CG2 VAL A 117 -2.239 -3.837 3.397 1.00 0.00 C ATOM 0 H VAL A 117 -3.769 -3.151 5.766 1.00 0.00 H new ATOM 0 HA VAL A 117 -1.468 -1.335 5.663 1.00 0.00 H new ATOM 0 HB VAL A 117 -0.693 -2.381 3.582 1.00 0.00 H new ATOM 0 HG11 VAL A 117 0.146 -4.514 4.492 1.00 0.00 H new ATOM 0 HG12 VAL A 117 0.258 -3.197 5.684 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -1.039 -4.408 5.816 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -1.637 -4.516 2.793 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -2.899 -4.415 4.044 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -2.837 -3.203 2.743 1.00 0.00 H new ATOM 1253 N HIS A 118 -2.379 -0.275 3.440 1.00 0.00 N ATOM 1254 CA HIS A 118 -3.073 0.622 2.525 1.00 0.00 C ATOM 1255 C HIS A 118 -2.889 0.190 1.076 1.00 0.00 C ATOM 1256 O HIS A 118 -1.766 0.124 0.576 1.00 0.00 O ATOM 1257 CB HIS A 118 -2.543 2.043 2.698 1.00 0.00 C ATOM 1258 CG HIS A 118 -3.267 3.071 1.882 1.00 0.00 C ATOM 1259 ND1 HIS A 118 -4.088 4.025 2.438 1.00 0.00 N ATOM 1260 CD2 HIS A 118 -3.281 3.303 0.544 1.00 0.00 C ATOM 1261 CE1 HIS A 118 -4.573 4.795 1.483 1.00 0.00 C ATOM 1262 NE2 HIS A 118 -4.102 4.376 0.324 1.00 0.00 N ATOM 0 H HIS A 118 -1.364 -0.178 3.430 1.00 0.00 H new ATOM 0 HA HIS A 118 -4.136 0.586 2.762 1.00 0.00 H new ATOM 0 HB2 HIS A 118 -2.609 2.318 3.751 1.00 0.00 H new ATOM 0 HB3 HIS A 118 -1.487 2.060 2.430 1.00 0.00 H new ATOM 0 HD1 HIS A 118 -4.290 4.122 3.433 1.00 0.00 H new ATOM 0 HD2 HIS A 118 -2.744 2.744 -0.208 1.00 0.00 H new ATOM 0 HE1 HIS A 118 -5.244 5.629 1.626 1.00 0.00 H new ATOM 1271 N LEU A 119 -3.998 -0.081 0.399 1.00 0.00 N ATOM 1272 CA LEU A 119 -3.956 -0.479 -1.000 1.00 0.00 C ATOM 1273 C LEU A 119 -4.842 0.433 -1.836 1.00 0.00 C ATOM 1274 O LEU A 119 -6.039 0.552 -1.577 1.00 0.00 O ATOM 1275 CB LEU A 119 -4.399 -1.927 -1.179 1.00 0.00 C ATOM 1276 CG LEU A 119 -3.782 -2.604 -2.397 1.00 0.00 C ATOM 1277 CD1 LEU A 119 -2.795 -3.682 -1.978 1.00 0.00 C ATOM 1278 CD2 LEU A 119 -4.855 -3.180 -3.304 1.00 0.00 C ATOM 0 H LEU A 119 -4.936 -0.032 0.797 1.00 0.00 H new ATOM 0 HA LEU A 119 -2.923 -0.391 -1.337 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -4.135 -2.493 -0.286 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -5.485 -1.958 -1.267 1.00 0.00 H new ATOM 0 HG LEU A 119 -3.237 -1.845 -2.959 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -2.369 -4.150 -2.865 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -1.997 -3.234 -1.385 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -3.310 -4.436 -1.383 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -4.386 -3.657 -4.165 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -5.439 -3.918 -2.754 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -5.511 -2.379 -3.645 1.00 0.00 H new ATOM 1290 N PRO A 120 -4.272 1.095 -2.854 1.00 0.00 N ATOM 1291 CA PRO A 120 -5.036 1.994 -3.712 1.00 0.00 C ATOM 1292 C PRO A 120 -6.230 1.291 -4.354 1.00 0.00 C ATOM 1293 O PRO A 120 -6.125 0.152 -4.807 1.00 0.00 O ATOM 1294 CB PRO A 120 -4.028 2.450 -4.774 1.00 0.00 C ATOM 1295 CG PRO A 120 -2.882 1.504 -4.670 1.00 0.00 C ATOM 1296 CD PRO A 120 -2.858 1.028 -3.248 1.00 0.00 C ATOM 0 HA PRO A 120 -5.462 2.826 -3.152 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -4.469 2.423 -5.770 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -3.707 3.476 -4.595 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -3.004 0.668 -5.358 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -1.946 1.997 -4.931 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -2.464 0.015 -3.168 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -2.233 1.663 -2.620 1.00 0.00 H new ATOM 1304 N PRO A 121 -7.391 1.966 -4.379 1.00 0.00 N ATOM 1305 CA PRO A 121 -8.635 1.418 -4.944 1.00 0.00 C ATOM 1306 C PRO A 121 -8.502 0.895 -6.376 1.00 0.00 C ATOM 1307 O PRO A 121 -9.412 0.236 -6.879 1.00 0.00 O ATOM 1308 CB PRO A 121 -9.603 2.610 -4.907 1.00 0.00 C ATOM 1309 CG PRO A 121 -8.749 3.808 -4.666 1.00 0.00 C ATOM 1310 CD PRO A 121 -7.605 3.317 -3.839 1.00 0.00 C ATOM 0 HA PRO A 121 -8.961 0.548 -4.374 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -10.150 2.700 -5.845 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -10.343 2.490 -4.116 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -8.400 4.237 -5.605 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -9.304 4.588 -4.146 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -6.722 3.945 -3.952 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -7.849 3.297 -2.777 1.00 0.00 H new ATOM 1318 N PHE A 122 -7.390 1.193 -7.041 1.00 0.00 N ATOM 1319 CA PHE A 122 -7.203 0.740 -8.420 1.00 0.00 C ATOM 1320 C PHE A 122 -6.621 -0.668 -8.495 1.00 0.00 C ATOM 1321 O PHE A 122 -6.549 -1.251 -9.576 1.00 0.00 O ATOM 1322 CB PHE A 122 -6.325 1.706 -9.237 1.00 0.00 C ATOM 1323 CG PHE A 122 -5.549 2.717 -8.435 1.00 0.00 C ATOM 1324 CD1 PHE A 122 -6.198 3.673 -7.665 1.00 0.00 C ATOM 1325 CD2 PHE A 122 -4.164 2.720 -8.467 1.00 0.00 C ATOM 1326 CE1 PHE A 122 -5.478 4.606 -6.943 1.00 0.00 C ATOM 1327 CE2 PHE A 122 -3.441 3.649 -7.747 1.00 0.00 C ATOM 1328 CZ PHE A 122 -4.098 4.593 -6.984 1.00 0.00 C ATOM 0 H PHE A 122 -6.616 1.736 -6.658 1.00 0.00 H new ATOM 0 HA PHE A 122 -8.201 0.723 -8.859 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -5.621 1.118 -9.826 1.00 0.00 H new ATOM 0 HB3 PHE A 122 -6.962 2.240 -9.942 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -7.277 3.688 -7.630 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -3.643 1.985 -9.063 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -5.994 5.344 -6.347 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -2.362 3.637 -7.781 1.00 0.00 H new ATOM 0 HZ PHE A 122 -3.533 5.321 -6.420 1.00 0.00 H new ATOM 1338 N TRP A 123 -6.204 -1.218 -7.361 1.00 0.00 N ATOM 1339 CA TRP A 123 -5.634 -2.556 -7.349 1.00 0.00 C ATOM 1340 C TRP A 123 -6.638 -3.594 -6.851 1.00 0.00 C ATOM 1341 O TRP A 123 -6.343 -4.787 -6.833 1.00 0.00 O ATOM 1342 CB TRP A 123 -4.383 -2.564 -6.485 1.00 0.00 C ATOM 1343 CG TRP A 123 -3.297 -1.690 -7.020 1.00 0.00 C ATOM 1344 CD1 TRP A 123 -3.207 -1.134 -8.265 1.00 0.00 C ATOM 1345 CD2 TRP A 123 -2.150 -1.262 -6.306 1.00 0.00 C ATOM 1346 NE1 TRP A 123 -2.058 -0.377 -8.358 1.00 0.00 N ATOM 1347 CE2 TRP A 123 -1.396 -0.440 -7.159 1.00 0.00 C ATOM 1348 CE3 TRP A 123 -1.694 -1.495 -5.018 1.00 0.00 C ATOM 1349 CZ2 TRP A 123 -0.206 0.150 -6.751 1.00 0.00 C ATOM 1350 CZ3 TRP A 123 -0.519 -0.913 -4.613 1.00 0.00 C ATOM 1351 CH2 TRP A 123 0.211 -0.098 -5.473 1.00 0.00 C ATOM 0 H TRP A 123 -6.249 -0.763 -6.449 1.00 0.00 H new ATOM 0 HA TRP A 123 -5.373 -2.827 -8.372 1.00 0.00 H new ATOM 0 HB2 TRP A 123 -4.642 -2.237 -5.478 1.00 0.00 H new ATOM 0 HB3 TRP A 123 -4.012 -3.586 -6.403 1.00 0.00 H new ATOM 0 HD1 TRP A 123 -3.928 -1.267 -9.058 1.00 0.00 H new ATOM 0 HE1 TRP A 123 -1.752 0.143 -9.181 1.00 0.00 H new ATOM 0 HE3 TRP A 123 -2.255 -2.125 -4.343 1.00 0.00 H new ATOM 0 HZ2 TRP A 123 0.366 0.779 -7.417 1.00 0.00 H new ATOM 0 HZ3 TRP A 123 -0.155 -1.090 -3.612 1.00 0.00 H new ATOM 0 HH2 TRP A 123 1.129 0.349 -5.122 1.00 0.00 H new ATOM 1362 N GLU A 124 -7.830 -3.143 -6.459 1.00 0.00 N ATOM 1363 CA GLU A 124 -8.867 -4.049 -5.979 1.00 0.00 C ATOM 1364 C GLU A 124 -9.050 -5.218 -6.940 1.00 0.00 C ATOM 1365 O GLU A 124 -9.301 -6.350 -6.525 1.00 0.00 O ATOM 1366 CB GLU A 124 -10.188 -3.295 -5.823 1.00 0.00 C ATOM 1367 CG GLU A 124 -10.900 -3.584 -4.516 1.00 0.00 C ATOM 1368 CD GLU A 124 -11.117 -5.067 -4.285 1.00 0.00 C ATOM 1369 OE1 GLU A 124 -11.935 -5.668 -5.012 1.00 0.00 O ATOM 1370 OE2 GLU A 124 -10.469 -5.626 -3.375 1.00 0.00 O ATOM 0 H GLU A 124 -8.098 -2.159 -6.465 1.00 0.00 H new ATOM 0 HA GLU A 124 -8.559 -4.442 -5.010 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -9.996 -2.224 -5.894 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -10.846 -3.557 -6.651 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -10.318 -3.173 -3.691 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -11.864 -3.075 -4.511 1.00 0.00 H new ATOM 1377 N GLN A 125 -8.919 -4.929 -8.229 1.00 0.00 N ATOM 1378 CA GLN A 125 -9.064 -5.942 -9.265 1.00 0.00 C ATOM 1379 C GLN A 125 -7.730 -6.625 -9.549 1.00 0.00 C ATOM 1380 O GLN A 125 -7.691 -7.760 -10.024 1.00 0.00 O ATOM 1381 CB GLN A 125 -9.601 -5.307 -10.548 1.00 0.00 C ATOM 1382 CG GLN A 125 -8.760 -4.140 -11.045 1.00 0.00 C ATOM 1383 CD GLN A 125 -9.570 -2.870 -11.219 1.00 0.00 C ATOM 1384 OE1 GLN A 125 -10.788 -2.915 -11.398 1.00 0.00 O ATOM 1385 NE2 GLN A 125 -8.896 -1.727 -11.171 1.00 0.00 N ATOM 0 H GLN A 125 -8.711 -3.995 -8.582 1.00 0.00 H new ATOM 0 HA GLN A 125 -9.769 -6.693 -8.910 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -9.650 -6.067 -11.327 1.00 0.00 H new ATOM 0 HB3 GLN A 125 -10.620 -4.962 -10.374 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -7.949 -3.956 -10.341 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -8.301 -4.407 -11.997 1.00 0.00 H new ATOM 0 HE21 GLN A 125 -7.887 -1.736 -11.021 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -9.387 -0.840 -11.284 1.00 0.00 H new ATOM 1394 N TYR A 126 -6.639 -5.923 -9.263 1.00 0.00 N ATOM 1395 CA TYR A 126 -5.303 -6.455 -9.493 1.00 0.00 C ATOM 1396 C TYR A 126 -4.870 -7.398 -8.372 1.00 0.00 C ATOM 1397 O TYR A 126 -3.939 -8.184 -8.539 1.00 0.00 O ATOM 1398 CB TYR A 126 -4.295 -5.313 -9.621 1.00 0.00 C ATOM 1399 CG TYR A 126 -4.690 -4.242 -10.617 1.00 0.00 C ATOM 1400 CD1 TYR A 126 -4.015 -3.030 -10.651 1.00 0.00 C ATOM 1401 CD2 TYR A 126 -5.729 -4.436 -11.520 1.00 0.00 C ATOM 1402 CE1 TYR A 126 -4.363 -2.042 -11.552 1.00 0.00 C ATOM 1403 CE2 TYR A 126 -6.083 -3.453 -12.425 1.00 0.00 C ATOM 1404 CZ TYR A 126 -5.397 -2.258 -12.437 1.00 0.00 C ATOM 1405 OH TYR A 126 -5.746 -1.277 -13.336 1.00 0.00 O ATOM 0 H TYR A 126 -6.655 -4.982 -8.870 1.00 0.00 H new ATOM 0 HA TYR A 126 -5.332 -7.024 -10.422 1.00 0.00 H new ATOM 0 HB2 TYR A 126 -4.161 -4.851 -8.643 1.00 0.00 H new ATOM 0 HB3 TYR A 126 -3.330 -5.727 -9.914 1.00 0.00 H new ATOM 0 HD1 TYR A 126 -3.203 -2.856 -9.961 1.00 0.00 H new ATOM 0 HD2 TYR A 126 -6.269 -5.371 -11.514 1.00 0.00 H new ATOM 0 HE1 TYR A 126 -3.827 -1.104 -11.563 1.00 0.00 H new ATOM 0 HE2 TYR A 126 -6.893 -3.621 -13.119 1.00 0.00 H new ATOM 0 HH TYR A 126 -6.493 -1.590 -13.888 1.00 0.00 H new ATOM 1415 N ILE A 127 -5.539 -7.308 -7.226 1.00 0.00 N ATOM 1416 CA ILE A 127 -5.202 -8.146 -6.084 1.00 0.00 C ATOM 1417 C ILE A 127 -5.796 -9.547 -6.216 1.00 0.00 C ATOM 1418 O ILE A 127 -7.010 -9.733 -6.144 1.00 0.00 O ATOM 1419 CB ILE A 127 -5.678 -7.514 -4.759 1.00 0.00 C ATOM 1420 CG1 ILE A 127 -7.178 -7.211 -4.809 1.00 0.00 C ATOM 1421 CG2 ILE A 127 -4.892 -6.245 -4.466 1.00 0.00 C ATOM 1422 CD1 ILE A 127 -7.905 -7.585 -3.537 1.00 0.00 C ATOM 0 H ILE A 127 -6.315 -6.665 -7.066 1.00 0.00 H new ATOM 0 HA ILE A 127 -4.115 -8.225 -6.070 1.00 0.00 H new ATOM 0 HB ILE A 127 -5.500 -8.230 -3.956 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -7.321 -6.148 -5.002 1.00 0.00 H new ATOM 0 HG13 ILE A 127 -7.623 -7.750 -5.646 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -5.239 -5.810 -3.528 1.00 0.00 H new ATOM 0 HG22 ILE A 127 -3.832 -6.484 -4.385 1.00 0.00 H new ATOM 0 HG23 ILE A 127 -5.041 -5.530 -5.275 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -8.963 -7.345 -3.639 1.00 0.00 H new ATOM 0 HD12 ILE A 127 -7.792 -8.654 -3.354 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -7.485 -7.027 -2.700 1.00 0.00 H new ATOM 1434 N ASN A 128 -4.924 -10.531 -6.407 1.00 0.00 N ATOM 1435 CA ASN A 128 -5.347 -11.923 -6.546 1.00 0.00 C ATOM 1436 C ASN A 128 -5.072 -12.699 -5.259 1.00 0.00 C ATOM 1437 O ASN A 128 -4.646 -12.122 -4.259 1.00 0.00 O ATOM 1438 CB ASN A 128 -4.617 -12.583 -7.719 1.00 0.00 C ATOM 1439 CG ASN A 128 -4.529 -11.677 -8.934 1.00 0.00 C ATOM 1440 OD1 ASN A 128 -3.576 -10.750 -8.917 1.00 0.00 O flip ATOM 1441 ND2 ASN A 128 -5.307 -11.810 -9.878 1.00 0.00 N flip ATOM 0 H ASN A 128 -3.916 -10.391 -6.470 1.00 0.00 H new ATOM 0 HA ASN A 128 -6.419 -11.938 -6.740 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -3.611 -12.863 -7.405 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -5.134 -13.503 -7.993 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -6.024 -12.535 -9.850 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -5.235 -11.195 -10.689 1.00 0.00 H new ATOM 1448 N ASP A 129 -5.309 -14.013 -5.287 1.00 0.00 N ATOM 1449 CA ASP A 129 -5.073 -14.857 -4.114 1.00 0.00 C ATOM 1450 C ASP A 129 -3.683 -14.586 -3.544 1.00 0.00 C ATOM 1451 O ASP A 129 -3.536 -14.215 -2.382 1.00 0.00 O ATOM 1452 CB ASP A 129 -5.210 -16.336 -4.483 1.00 0.00 C ATOM 1453 CG ASP A 129 -5.892 -17.143 -3.396 1.00 0.00 C ATOM 1454 OD1 ASP A 129 -5.224 -17.470 -2.393 1.00 0.00 O ATOM 1455 OD2 ASP A 129 -7.094 -17.447 -3.547 1.00 0.00 O ATOM 0 H ASP A 129 -5.662 -14.512 -6.103 1.00 0.00 H new ATOM 0 HA ASP A 129 -5.820 -14.617 -3.357 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -5.779 -16.425 -5.409 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -4.221 -16.753 -4.675 1.00 0.00 H new ATOM 1460 N GLU A 130 -2.675 -14.742 -4.391 1.00 0.00 N ATOM 1461 CA GLU A 130 -1.296 -14.480 -4.007 1.00 0.00 C ATOM 1462 C GLU A 130 -0.729 -13.429 -4.949 1.00 0.00 C ATOM 1463 O GLU A 130 -0.815 -13.580 -6.168 1.00 0.00 O ATOM 1464 CB GLU A 130 -0.463 -15.764 -4.071 1.00 0.00 C ATOM 1465 CG GLU A 130 0.141 -16.163 -2.734 1.00 0.00 C ATOM 1466 CD GLU A 130 0.005 -17.648 -2.453 1.00 0.00 C ATOM 1467 OE1 GLU A 130 0.918 -18.217 -1.817 1.00 0.00 O ATOM 1468 OE2 GLU A 130 -1.014 -18.239 -2.867 1.00 0.00 O ATOM 0 H GLU A 130 -2.789 -15.051 -5.356 1.00 0.00 H new ATOM 0 HA GLU A 130 -1.262 -14.117 -2.980 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -1.091 -16.577 -4.434 1.00 0.00 H new ATOM 0 HB3 GLU A 130 0.339 -15.632 -4.798 1.00 0.00 H new ATOM 0 HG2 GLU A 130 1.196 -15.889 -2.720 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -0.345 -15.600 -1.937 1.00 0.00 H new ATOM 1475 N ASN A 131 -0.188 -12.346 -4.403 1.00 0.00 N ATOM 1476 CA ASN A 131 0.329 -11.281 -5.250 1.00 0.00 C ATOM 1477 C ASN A 131 1.609 -10.669 -4.719 1.00 0.00 C ATOM 1478 O ASN A 131 1.851 -10.623 -3.513 1.00 0.00 O ATOM 1479 CB ASN A 131 -0.716 -10.173 -5.405 1.00 0.00 C ATOM 1480 CG ASN A 131 -2.128 -10.663 -5.159 1.00 0.00 C ATOM 1481 OD1 ASN A 131 -2.572 -11.639 -5.763 1.00 0.00 O ATOM 1482 ND2 ASN A 131 -2.843 -9.986 -4.267 1.00 0.00 N ATOM 0 H ASN A 131 -0.097 -12.184 -3.400 1.00 0.00 H new ATOM 0 HA ASN A 131 0.552 -11.740 -6.213 1.00 0.00 H new ATOM 0 HB2 ASN A 131 -0.489 -9.366 -4.709 1.00 0.00 H new ATOM 0 HB3 ASN A 131 -0.651 -9.755 -6.410 1.00 0.00 H new ATOM 0 HD21 ASN A 131 -3.801 -10.270 -4.060 1.00 0.00 H new ATOM 0 HD22 ASN A 131 -2.434 -9.183 -3.790 1.00 0.00 H new ATOM 1489 N THR A 132 2.398 -10.155 -5.649 1.00 0.00 N ATOM 1490 CA THR A 132 3.639 -9.481 -5.318 1.00 0.00 C ATOM 1491 C THR A 132 3.307 -8.063 -4.888 1.00 0.00 C ATOM 1492 O THR A 132 2.862 -7.246 -5.701 1.00 0.00 O ATOM 1493 CB THR A 132 4.585 -9.465 -6.521 1.00 0.00 C ATOM 1494 OG1 THR A 132 4.684 -10.756 -7.097 1.00 0.00 O ATOM 1495 CG2 THR A 132 5.986 -9.008 -6.175 1.00 0.00 C ATOM 0 H THR A 132 2.196 -10.194 -6.648 1.00 0.00 H new ATOM 0 HA THR A 132 4.143 -10.011 -4.510 1.00 0.00 H new ATOM 0 HB THR A 132 4.151 -8.752 -7.221 1.00 0.00 H new ATOM 0 HG1 THR A 132 5.291 -10.726 -7.865 1.00 0.00 H new ATOM 0 HG21 THR A 132 6.605 -9.020 -7.072 1.00 0.00 H new ATOM 0 HG22 THR A 132 5.950 -7.996 -5.773 1.00 0.00 H new ATOM 0 HG23 THR A 132 6.414 -9.679 -5.430 1.00 0.00 H new ATOM 1503 N VAL A 133 3.475 -7.789 -3.601 1.00 0.00 N ATOM 1504 CA VAL A 133 3.145 -6.479 -3.056 1.00 0.00 C ATOM 1505 C VAL A 133 4.356 -5.779 -2.457 1.00 0.00 C ATOM 1506 O VAL A 133 5.047 -6.325 -1.597 1.00 0.00 O ATOM 1507 CB VAL A 133 2.044 -6.577 -1.972 1.00 0.00 C ATOM 1508 CG1 VAL A 133 0.722 -6.039 -2.498 1.00 0.00 C ATOM 1509 CG2 VAL A 133 1.884 -8.011 -1.479 1.00 0.00 C ATOM 0 H VAL A 133 3.837 -8.454 -2.917 1.00 0.00 H new ATOM 0 HA VAL A 133 2.781 -5.891 -3.898 1.00 0.00 H new ATOM 0 HB VAL A 133 2.352 -5.964 -1.125 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -0.038 -6.117 -1.720 1.00 0.00 H new ATOM 0 HG12 VAL A 133 0.842 -4.994 -2.784 1.00 0.00 H new ATOM 0 HG13 VAL A 133 0.413 -6.620 -3.367 1.00 0.00 H new ATOM 0 HG21 VAL A 133 1.104 -8.049 -0.718 1.00 0.00 H new ATOM 0 HG22 VAL A 133 1.608 -8.654 -2.315 1.00 0.00 H new ATOM 0 HG23 VAL A 133 2.825 -8.356 -1.051 1.00 0.00 H new ATOM 1519 N GLU A 134 4.578 -4.547 -2.897 1.00 0.00 N ATOM 1520 CA GLU A 134 5.671 -3.737 -2.388 1.00 0.00 C ATOM 1521 C GLU A 134 5.099 -2.569 -1.602 1.00 0.00 C ATOM 1522 O GLU A 134 4.398 -1.721 -2.157 1.00 0.00 O ATOM 1523 CB GLU A 134 6.552 -3.225 -3.524 1.00 0.00 C ATOM 1524 CG GLU A 134 7.260 -4.328 -4.294 1.00 0.00 C ATOM 1525 CD GLU A 134 6.325 -5.098 -5.204 1.00 0.00 C ATOM 1526 OE1 GLU A 134 6.124 -4.659 -6.356 1.00 0.00 O ATOM 1527 OE2 GLU A 134 5.794 -6.141 -4.766 1.00 0.00 O ATOM 0 H GLU A 134 4.011 -4.087 -3.609 1.00 0.00 H new ATOM 0 HA GLU A 134 6.292 -4.353 -1.737 1.00 0.00 H new ATOM 0 HB2 GLU A 134 5.938 -2.648 -4.216 1.00 0.00 H new ATOM 0 HB3 GLU A 134 7.298 -2.544 -3.115 1.00 0.00 H new ATOM 0 HG2 GLU A 134 8.063 -3.893 -4.889 1.00 0.00 H new ATOM 0 HG3 GLU A 134 7.724 -5.018 -3.589 1.00 0.00 H new ATOM 1534 N LEU A 135 5.365 -2.547 -0.304 1.00 0.00 N ATOM 1535 CA LEU A 135 4.832 -1.493 0.553 1.00 0.00 C ATOM 1536 C LEU A 135 5.874 -0.934 1.512 1.00 0.00 C ATOM 1537 O LEU A 135 6.768 -1.646 1.966 1.00 0.00 O ATOM 1538 CB LEU A 135 3.646 -2.030 1.356 1.00 0.00 C ATOM 1539 CG LEU A 135 3.887 -3.374 2.048 1.00 0.00 C ATOM 1540 CD1 LEU A 135 4.837 -3.210 3.224 1.00 0.00 C ATOM 1541 CD2 LEU A 135 2.567 -3.979 2.505 1.00 0.00 C ATOM 0 H LEU A 135 5.940 -3.238 0.177 1.00 0.00 H new ATOM 0 HA LEU A 135 4.516 -0.680 -0.101 1.00 0.00 H new ATOM 0 HB2 LEU A 135 3.375 -1.293 2.112 1.00 0.00 H new ATOM 0 HB3 LEU A 135 2.790 -2.131 0.688 1.00 0.00 H new ATOM 0 HG LEU A 135 4.348 -4.053 1.331 1.00 0.00 H new ATOM 0 HD11 LEU A 135 4.995 -4.177 3.702 1.00 0.00 H new ATOM 0 HD12 LEU A 135 5.791 -2.820 2.869 1.00 0.00 H new ATOM 0 HD13 LEU A 135 4.407 -2.515 3.945 1.00 0.00 H new ATOM 0 HD21 LEU A 135 2.755 -4.934 2.995 1.00 0.00 H new ATOM 0 HD22 LEU A 135 2.079 -3.301 3.206 1.00 0.00 H new ATOM 0 HD23 LEU A 135 1.920 -4.135 1.642 1.00 0.00 H new ATOM 1553 N ILE A 136 5.719 0.345 1.844 1.00 0.00 N ATOM 1554 CA ILE A 136 6.611 1.018 2.780 1.00 0.00 C ATOM 1555 C ILE A 136 5.862 1.274 4.080 1.00 0.00 C ATOM 1556 O ILE A 136 4.720 1.721 4.058 1.00 0.00 O ATOM 1557 CB ILE A 136 7.161 2.358 2.231 1.00 0.00 C ATOM 1558 CG1 ILE A 136 6.698 2.620 0.792 1.00 0.00 C ATOM 1559 CG2 ILE A 136 8.676 2.361 2.299 1.00 0.00 C ATOM 1560 CD1 ILE A 136 5.544 3.593 0.702 1.00 0.00 C ATOM 0 H ILE A 136 4.977 0.939 1.474 1.00 0.00 H new ATOM 0 HA ILE A 136 7.468 0.364 2.943 1.00 0.00 H new ATOM 0 HB ILE A 136 6.765 3.159 2.855 1.00 0.00 H new ATOM 0 HG12 ILE A 136 7.536 3.007 0.213 1.00 0.00 H new ATOM 0 HG13 ILE A 136 6.404 1.675 0.335 1.00 0.00 H new ATOM 0 HG21 ILE A 136 9.056 3.306 1.911 1.00 0.00 H new ATOM 0 HG22 ILE A 136 8.994 2.240 3.334 1.00 0.00 H new ATOM 0 HG23 ILE A 136 9.069 1.539 1.700 1.00 0.00 H new ATOM 0 HD11 ILE A 136 5.267 3.733 -0.343 1.00 0.00 H new ATOM 0 HD12 ILE A 136 4.691 3.198 1.254 1.00 0.00 H new ATOM 0 HD13 ILE A 136 5.841 4.550 1.130 1.00 0.00 H new ATOM 1572 N HIS A 137 6.488 0.968 5.210 1.00 0.00 N ATOM 1573 CA HIS A 137 5.836 1.138 6.502 1.00 0.00 C ATOM 1574 C HIS A 137 5.786 2.598 6.934 1.00 0.00 C ATOM 1575 O HIS A 137 6.815 3.233 7.161 1.00 0.00 O ATOM 1576 CB HIS A 137 6.532 0.275 7.552 1.00 0.00 C ATOM 1577 CG HIS A 137 6.709 -1.143 7.100 1.00 0.00 C ATOM 1578 ND1 HIS A 137 5.968 -2.197 7.596 1.00 0.00 N ATOM 1579 CD2 HIS A 137 7.528 -1.674 6.164 1.00 0.00 C ATOM 1580 CE1 HIS A 137 6.328 -3.313 6.979 1.00 0.00 C ATOM 1581 NE2 HIS A 137 7.271 -3.021 6.108 1.00 0.00 N ATOM 0 H HIS A 137 7.439 0.603 5.258 1.00 0.00 H new ATOM 0 HA HIS A 137 4.802 0.809 6.402 1.00 0.00 H new ATOM 0 HB2 HIS A 137 7.507 0.704 7.783 1.00 0.00 H new ATOM 0 HB3 HIS A 137 5.951 0.290 8.474 1.00 0.00 H new ATOM 0 HD1 HIS A 137 5.256 -2.128 8.323 1.00 0.00 H new ATOM 0 HD2 HIS A 137 8.252 -1.136 5.569 1.00 0.00 H new ATOM 0 HE1 HIS A 137 5.917 -4.295 7.160 1.00 0.00 H new ATOM 1590 N THR A 138 4.567 3.118 7.046 1.00 0.00 N ATOM 1591 CA THR A 138 4.348 4.502 7.451 1.00 0.00 C ATOM 1592 C THR A 138 4.323 4.615 8.971 1.00 0.00 C ATOM 1593 O THR A 138 4.722 3.689 9.678 1.00 0.00 O ATOM 1594 CB THR A 138 3.022 5.014 6.881 1.00 0.00 C ATOM 1595 OG1 THR A 138 1.937 4.581 7.683 1.00 0.00 O ATOM 1596 CG2 THR A 138 2.746 4.560 5.464 1.00 0.00 C ATOM 0 H THR A 138 3.710 2.597 6.860 1.00 0.00 H new ATOM 0 HA THR A 138 5.167 5.107 7.062 1.00 0.00 H new ATOM 0 HB THR A 138 3.117 6.100 6.879 1.00 0.00 H new ATOM 0 HG1 THR A 138 1.455 3.863 7.222 1.00 0.00 H new ATOM 0 HG21 THR A 138 1.789 4.964 5.132 1.00 0.00 H new ATOM 0 HG22 THR A 138 3.538 4.918 4.806 1.00 0.00 H new ATOM 0 HG23 THR A 138 2.711 3.471 5.431 1.00 0.00 H new ATOM 1604 N ASP A 139 3.822 5.741 9.471 1.00 0.00 N ATOM 1605 CA ASP A 139 3.716 5.950 10.909 1.00 0.00 C ATOM 1606 C ASP A 139 2.530 5.165 11.462 1.00 0.00 C ATOM 1607 O ASP A 139 2.358 5.043 12.675 1.00 0.00 O ATOM 1608 CB ASP A 139 3.555 7.439 11.225 1.00 0.00 C ATOM 1609 CG ASP A 139 3.703 7.734 12.704 1.00 0.00 C ATOM 1610 OD1 ASP A 139 4.850 7.727 13.200 1.00 0.00 O ATOM 1611 OD2 ASP A 139 2.673 7.973 13.368 1.00 0.00 O ATOM 0 H ASP A 139 3.485 6.519 8.904 1.00 0.00 H new ATOM 0 HA ASP A 139 4.631 5.594 11.382 1.00 0.00 H new ATOM 0 HB2 ASP A 139 4.298 8.009 10.667 1.00 0.00 H new ATOM 0 HB3 ASP A 139 2.575 7.776 10.886 1.00 0.00 H new ATOM 1616 N SER A 140 1.717 4.630 10.553 1.00 0.00 N ATOM 1617 CA SER A 140 0.546 3.849 10.920 1.00 0.00 C ATOM 1618 C SER A 140 0.649 2.443 10.340 1.00 0.00 C ATOM 1619 O SER A 140 0.907 1.476 11.057 1.00 0.00 O ATOM 1620 CB SER A 140 -0.724 4.535 10.408 1.00 0.00 C ATOM 1621 OG SER A 140 -0.430 5.438 9.353 1.00 0.00 O ATOM 0 H SER A 140 1.854 4.727 9.547 1.00 0.00 H new ATOM 0 HA SER A 140 0.497 3.779 12.007 1.00 0.00 H new ATOM 0 HB2 SER A 140 -1.432 3.783 10.060 1.00 0.00 H new ATOM 0 HB3 SER A 140 -1.206 5.071 11.226 1.00 0.00 H new ATOM 0 HG SER A 140 0.292 5.072 8.801 1.00 0.00 H new ATOM 1627 N LEU A 141 0.456 2.347 9.032 1.00 0.00 N ATOM 1628 CA LEU A 141 0.534 1.074 8.329 1.00 0.00 C ATOM 1629 C LEU A 141 1.353 1.223 7.051 1.00 0.00 C ATOM 1630 O LEU A 141 1.655 2.337 6.623 1.00 0.00 O ATOM 1631 CB LEU A 141 -0.869 0.564 7.993 1.00 0.00 C ATOM 1632 CG LEU A 141 -1.845 1.633 7.501 1.00 0.00 C ATOM 1633 CD1 LEU A 141 -2.730 1.079 6.393 1.00 0.00 C ATOM 1634 CD2 LEU A 141 -2.694 2.150 8.653 1.00 0.00 C ATOM 0 H LEU A 141 0.242 3.143 8.432 1.00 0.00 H new ATOM 0 HA LEU A 141 1.025 0.351 8.980 1.00 0.00 H new ATOM 0 HB2 LEU A 141 -0.785 -0.209 7.229 1.00 0.00 H new ATOM 0 HB3 LEU A 141 -1.289 0.091 8.880 1.00 0.00 H new ATOM 0 HG LEU A 141 -1.269 2.465 7.097 1.00 0.00 H new ATOM 0 HD11 LEU A 141 -3.418 1.854 6.055 1.00 0.00 H new ATOM 0 HD12 LEU A 141 -2.108 0.757 5.558 1.00 0.00 H new ATOM 0 HD13 LEU A 141 -3.298 0.229 6.772 1.00 0.00 H new ATOM 0 HD21 LEU A 141 -3.383 2.910 8.285 1.00 0.00 H new ATOM 0 HD22 LEU A 141 -3.261 1.326 9.086 1.00 0.00 H new ATOM 0 HD23 LEU A 141 -2.047 2.585 9.415 1.00 0.00 H new ATOM 1646 N PRO A 142 1.750 0.102 6.434 1.00 0.00 N ATOM 1647 CA PRO A 142 2.550 0.114 5.212 1.00 0.00 C ATOM 1648 C PRO A 142 1.729 0.444 3.971 1.00 0.00 C ATOM 1649 O PRO A 142 0.702 -0.181 3.699 1.00 0.00 O ATOM 1650 CB PRO A 142 3.105 -1.315 5.118 1.00 0.00 C ATOM 1651 CG PRO A 142 2.721 -1.979 6.398 1.00 0.00 C ATOM 1652 CD PRO A 142 1.489 -1.267 6.877 1.00 0.00 C ATOM 0 HA PRO A 142 3.322 0.883 5.253 1.00 0.00 H new ATOM 0 HB2 PRO A 142 2.686 -1.843 4.261 1.00 0.00 H new ATOM 0 HB3 PRO A 142 4.187 -1.308 4.989 1.00 0.00 H new ATOM 0 HG2 PRO A 142 2.524 -3.040 6.244 1.00 0.00 H new ATOM 0 HG3 PRO A 142 3.524 -1.907 7.132 1.00 0.00 H new ATOM 0 HD2 PRO A 142 0.581 -1.675 6.433 1.00 0.00 H new ATOM 0 HD3 PRO A 142 1.372 -1.332 7.959 1.00 0.00 H new ATOM 1660 N LEU A 143 2.207 1.423 3.214 1.00 0.00 N ATOM 1661 CA LEU A 143 1.548 1.844 1.982 1.00 0.00 C ATOM 1662 C LEU A 143 2.057 1.015 0.813 1.00 0.00 C ATOM 1663 O LEU A 143 3.249 1.025 0.509 1.00 0.00 O ATOM 1664 CB LEU A 143 1.810 3.327 1.714 1.00 0.00 C ATOM 1665 CG LEU A 143 0.911 3.982 0.657 1.00 0.00 C ATOM 1666 CD1 LEU A 143 1.160 3.404 -0.727 1.00 0.00 C ATOM 1667 CD2 LEU A 143 -0.546 3.823 1.022 1.00 0.00 C ATOM 0 H LEU A 143 3.056 1.945 3.433 1.00 0.00 H new ATOM 0 HA LEU A 143 0.474 1.692 2.094 1.00 0.00 H new ATOM 0 HB2 LEU A 143 1.695 3.872 2.651 1.00 0.00 H new ATOM 0 HB3 LEU A 143 2.848 3.443 1.403 1.00 0.00 H new ATOM 0 HG LEU A 143 1.161 5.043 0.634 1.00 0.00 H new ATOM 0 HD11 LEU A 143 0.505 3.893 -1.449 1.00 0.00 H new ATOM 0 HD12 LEU A 143 2.200 3.571 -1.009 1.00 0.00 H new ATOM 0 HD13 LEU A 143 0.954 2.334 -0.717 1.00 0.00 H new ATOM 0 HD21 LEU A 143 -1.166 4.295 0.259 1.00 0.00 H new ATOM 0 HD22 LEU A 143 -0.792 2.763 1.085 1.00 0.00 H new ATOM 0 HD23 LEU A 143 -0.733 4.297 1.986 1.00 0.00 H new ATOM 1679 N VAL A 144 1.154 0.302 0.160 1.00 0.00 N ATOM 1680 CA VAL A 144 1.526 -0.528 -0.978 1.00 0.00 C ATOM 1681 C VAL A 144 1.795 0.338 -2.204 1.00 0.00 C ATOM 1682 O VAL A 144 0.870 0.773 -2.890 1.00 0.00 O ATOM 1683 CB VAL A 144 0.439 -1.574 -1.294 1.00 0.00 C ATOM 1684 CG1 VAL A 144 0.978 -2.633 -2.243 1.00 0.00 C ATOM 1685 CG2 VAL A 144 -0.079 -2.216 -0.010 1.00 0.00 C ATOM 0 H VAL A 144 0.162 0.280 0.396 1.00 0.00 H new ATOM 0 HA VAL A 144 2.438 -1.062 -0.713 1.00 0.00 H new ATOM 0 HB VAL A 144 -0.394 -1.067 -1.782 1.00 0.00 H new ATOM 0 HG11 VAL A 144 0.197 -3.363 -2.455 1.00 0.00 H new ATOM 0 HG12 VAL A 144 1.295 -2.161 -3.173 1.00 0.00 H new ATOM 0 HG13 VAL A 144 1.829 -3.135 -1.782 1.00 0.00 H new ATOM 0 HG21 VAL A 144 -0.846 -2.951 -0.254 1.00 0.00 H new ATOM 0 HG22 VAL A 144 0.744 -2.708 0.508 1.00 0.00 H new ATOM 0 HG23 VAL A 144 -0.506 -1.448 0.634 1.00 0.00 H new ATOM 1695 N ILE A 145 3.076 0.604 -2.455 1.00 0.00 N ATOM 1696 CA ILE A 145 3.489 1.444 -3.576 1.00 0.00 C ATOM 1697 C ILE A 145 3.426 0.709 -4.912 1.00 0.00 C ATOM 1698 O ILE A 145 3.300 1.340 -5.963 1.00 0.00 O ATOM 1699 CB ILE A 145 4.919 1.979 -3.374 1.00 0.00 C ATOM 1700 CG1 ILE A 145 5.908 0.821 -3.236 1.00 0.00 C ATOM 1701 CG2 ILE A 145 4.977 2.882 -2.151 1.00 0.00 C ATOM 1702 CD1 ILE A 145 7.202 1.040 -3.987 1.00 0.00 C ATOM 0 H ILE A 145 3.849 0.247 -1.893 1.00 0.00 H new ATOM 0 HA ILE A 145 2.782 2.273 -3.603 1.00 0.00 H new ATOM 0 HB ILE A 145 5.198 2.565 -4.249 1.00 0.00 H new ATOM 0 HG12 ILE A 145 6.131 0.668 -2.180 1.00 0.00 H new ATOM 0 HG13 ILE A 145 5.437 -0.093 -3.598 1.00 0.00 H new ATOM 0 HG21 ILE A 145 5.994 3.253 -2.020 1.00 0.00 H new ATOM 0 HG22 ILE A 145 4.298 3.724 -2.288 1.00 0.00 H new ATOM 0 HG23 ILE A 145 4.681 2.317 -1.267 1.00 0.00 H new ATOM 0 HD11 ILE A 145 7.856 0.179 -3.845 1.00 0.00 H new ATOM 0 HD12 ILE A 145 6.990 1.163 -5.049 1.00 0.00 H new ATOM 0 HD13 ILE A 145 7.695 1.936 -3.609 1.00 0.00 H new ATOM 1714 N SER A 146 3.515 -0.616 -4.880 1.00 0.00 N ATOM 1715 CA SER A 146 3.470 -1.396 -6.113 1.00 0.00 C ATOM 1716 C SER A 146 2.732 -2.718 -5.923 1.00 0.00 C ATOM 1717 O SER A 146 2.556 -3.193 -4.799 1.00 0.00 O ATOM 1718 CB SER A 146 4.885 -1.655 -6.633 1.00 0.00 C ATOM 1719 OG SER A 146 5.860 -1.072 -5.785 1.00 0.00 O ATOM 0 H SER A 146 3.617 -1.167 -4.028 1.00 0.00 H new ATOM 0 HA SER A 146 2.918 -0.810 -6.848 1.00 0.00 H new ATOM 0 HB2 SER A 146 5.058 -2.729 -6.705 1.00 0.00 H new ATOM 0 HB3 SER A 146 4.985 -1.248 -7.639 1.00 0.00 H new ATOM 0 HG SER A 146 6.755 -1.255 -6.141 1.00 0.00 H new ATOM 1725 N LEU A 147 2.312 -3.307 -7.039 1.00 0.00 N ATOM 1726 CA LEU A 147 1.597 -4.576 -7.025 1.00 0.00 C ATOM 1727 C LEU A 147 1.941 -5.379 -8.274 1.00 0.00 C ATOM 1728 O LEU A 147 2.367 -4.815 -9.280 1.00 0.00 O ATOM 1729 CB LEU A 147 0.087 -4.336 -6.952 1.00 0.00 C ATOM 1730 CG LEU A 147 -0.672 -5.272 -6.009 1.00 0.00 C ATOM 1731 CD1 LEU A 147 -0.990 -4.569 -4.699 1.00 0.00 C ATOM 1732 CD2 LEU A 147 -1.948 -5.774 -6.662 1.00 0.00 C ATOM 0 H LEU A 147 2.457 -2.920 -7.972 1.00 0.00 H new ATOM 0 HA LEU A 147 1.901 -5.141 -6.144 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -0.087 -3.307 -6.636 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -0.331 -4.437 -7.954 1.00 0.00 H new ATOM 0 HG LEU A 147 -0.034 -6.130 -5.796 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -1.530 -5.251 -4.042 1.00 0.00 H new ATOM 0 HD12 LEU A 147 -0.062 -4.259 -4.218 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -1.606 -3.692 -4.897 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -2.472 -6.438 -5.974 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -2.589 -4.927 -6.908 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -1.701 -6.318 -7.574 1.00 0.00 H new ATOM 1744 N ASN A 148 1.779 -6.696 -8.203 1.00 0.00 N ATOM 1745 CA ASN A 148 2.100 -7.563 -9.337 1.00 0.00 C ATOM 1746 C ASN A 148 1.543 -7.022 -10.663 1.00 0.00 C ATOM 1747 O ASN A 148 0.366 -7.195 -10.978 1.00 0.00 O ATOM 1748 CB ASN A 148 1.587 -8.988 -9.077 1.00 0.00 C ATOM 1749 CG ASN A 148 0.113 -9.175 -9.403 1.00 0.00 C ATOM 1750 OD1 ASN A 148 -0.758 -8.746 -8.497 1.00 0.00 O flip ATOM 1751 ND2 ASN A 148 -0.236 -9.700 -10.461 1.00 0.00 N flip ATOM 0 H ASN A 148 1.430 -7.186 -7.379 1.00 0.00 H new ATOM 0 HA ASN A 148 3.186 -7.584 -9.433 1.00 0.00 H new ATOM 0 HB2 ASN A 148 2.173 -9.690 -9.670 1.00 0.00 H new ATOM 0 HB3 ASN A 148 1.753 -9.239 -8.029 1.00 0.00 H new ATOM 0 HD21 ASN A 148 0.467 -10.016 -11.130 1.00 0.00 H new ATOM 0 HD22 ASN A 148 -1.228 -9.819 -10.668 1.00 0.00 H new ATOM 1758 N GLY A 149 2.412 -6.390 -11.447 1.00 0.00 N ATOM 1759 CA GLY A 149 2.006 -5.865 -12.743 1.00 0.00 C ATOM 1760 C GLY A 149 1.289 -4.528 -12.674 1.00 0.00 C ATOM 1761 O GLY A 149 0.543 -4.177 -13.588 1.00 0.00 O ATOM 0 H GLY A 149 3.391 -6.231 -11.209 1.00 0.00 H new ATOM 0 HA2 GLY A 149 2.889 -5.759 -13.373 1.00 0.00 H new ATOM 0 HA3 GLY A 149 1.353 -6.590 -13.228 1.00 0.00 H new ATOM 1765 N HIS A 150 1.515 -3.774 -11.606 1.00 0.00 N ATOM 1766 CA HIS A 150 0.881 -2.465 -11.451 1.00 0.00 C ATOM 1767 C HIS A 150 1.683 -1.588 -10.505 1.00 0.00 C ATOM 1768 O HIS A 150 2.477 -2.083 -9.705 1.00 0.00 O ATOM 1769 CB HIS A 150 -0.551 -2.603 -10.932 1.00 0.00 C ATOM 1770 CG HIS A 150 -1.282 -3.774 -11.500 1.00 0.00 C ATOM 1771 ND1 HIS A 150 -2.086 -3.699 -12.618 1.00 0.00 N ATOM 1772 CD2 HIS A 150 -1.317 -5.060 -11.098 1.00 0.00 C ATOM 1773 CE1 HIS A 150 -2.586 -4.895 -12.877 1.00 0.00 C ATOM 1774 NE2 HIS A 150 -2.133 -5.739 -11.968 1.00 0.00 N ATOM 0 H HIS A 150 2.129 -4.042 -10.836 1.00 0.00 H new ATOM 0 HA HIS A 150 0.852 -1.996 -12.435 1.00 0.00 H new ATOM 0 HB2 HIS A 150 -0.528 -2.692 -9.846 1.00 0.00 H new ATOM 0 HB3 HIS A 150 -1.103 -1.693 -11.166 1.00 0.00 H new ATOM 0 HD2 HIS A 150 -0.799 -5.479 -10.248 1.00 0.00 H new ATOM 0 HE1 HIS A 150 -3.251 -5.140 -13.692 1.00 0.00 H new ATOM 0 HE2 HIS A 150 -2.354 -6.734 -11.920 1.00 0.00 H new ATOM 1783 N THR A 151 1.475 -0.282 -10.602 1.00 0.00 N ATOM 1784 CA THR A 151 2.187 0.657 -9.752 1.00 0.00 C ATOM 1785 C THR A 151 1.313 1.849 -9.383 1.00 0.00 C ATOM 1786 O THR A 151 0.394 2.213 -10.116 1.00 0.00 O ATOM 1787 CB THR A 151 3.457 1.127 -10.448 1.00 0.00 C ATOM 1788 OG1 THR A 151 3.152 2.020 -11.506 1.00 0.00 O ATOM 1789 CG2 THR A 151 4.271 -0.013 -11.025 1.00 0.00 C ATOM 0 H THR A 151 0.822 0.148 -11.258 1.00 0.00 H new ATOM 0 HA THR A 151 2.452 0.143 -8.828 1.00 0.00 H new ATOM 0 HB THR A 151 4.046 1.623 -9.677 1.00 0.00 H new ATOM 0 HG1 THR A 151 3.982 2.311 -11.938 1.00 0.00 H new ATOM 0 HG21 THR A 151 5.163 0.385 -11.508 1.00 0.00 H new ATOM 0 HG22 THR A 151 4.564 -0.692 -10.225 1.00 0.00 H new ATOM 0 HG23 THR A 151 3.672 -0.553 -11.758 1.00 0.00 H new ATOM 1797 N LEU A 152 1.608 2.442 -8.234 1.00 0.00 N ATOM 1798 CA LEU A 152 0.858 3.589 -7.743 1.00 0.00 C ATOM 1799 C LEU A 152 0.988 4.778 -8.685 1.00 0.00 C ATOM 1800 O LEU A 152 0.028 5.515 -8.908 1.00 0.00 O ATOM 1801 CB LEU A 152 1.351 3.967 -6.347 1.00 0.00 C ATOM 1802 CG LEU A 152 0.420 3.573 -5.204 1.00 0.00 C ATOM 1803 CD1 LEU A 152 1.042 3.932 -3.866 1.00 0.00 C ATOM 1804 CD2 LEU A 152 -0.929 4.250 -5.367 1.00 0.00 C ATOM 0 H LEU A 152 2.367 2.145 -7.621 1.00 0.00 H new ATOM 0 HA LEU A 152 -0.196 3.315 -7.695 1.00 0.00 H new ATOM 0 HB2 LEU A 152 2.322 3.499 -6.182 1.00 0.00 H new ATOM 0 HB3 LEU A 152 1.507 5.045 -6.313 1.00 0.00 H new ATOM 0 HG LEU A 152 0.270 2.494 -5.232 1.00 0.00 H new ATOM 0 HD11 LEU A 152 0.365 3.644 -3.061 1.00 0.00 H new ATOM 0 HD12 LEU A 152 1.988 3.403 -3.751 1.00 0.00 H new ATOM 0 HD13 LEU A 152 1.220 5.007 -3.824 1.00 0.00 H new ATOM 0 HD21 LEU A 152 -1.583 3.960 -4.545 1.00 0.00 H new ATOM 0 HD22 LEU A 152 -0.796 5.332 -5.361 1.00 0.00 H new ATOM 0 HD23 LEU A 152 -1.377 3.945 -6.312 1.00 0.00 H new ATOM 1816 N GLN A 153 2.179 4.955 -9.236 1.00 0.00 N ATOM 1817 CA GLN A 153 2.436 6.052 -10.158 1.00 0.00 C ATOM 1818 C GLN A 153 2.966 5.524 -11.484 1.00 0.00 C ATOM 1819 O GLN A 153 4.158 5.627 -11.778 1.00 0.00 O ATOM 1820 CB GLN A 153 3.428 7.056 -9.554 1.00 0.00 C ATOM 1821 CG GLN A 153 4.410 6.449 -8.559 1.00 0.00 C ATOM 1822 CD GLN A 153 5.847 6.861 -8.827 1.00 0.00 C ATOM 1823 OE1 GLN A 153 6.774 6.074 -8.631 1.00 0.00 O ATOM 1824 NE2 GLN A 153 6.045 8.096 -9.277 1.00 0.00 N ATOM 0 H GLN A 153 2.984 4.353 -9.061 1.00 0.00 H new ATOM 0 HA GLN A 153 1.492 6.567 -10.338 1.00 0.00 H new ATOM 0 HB2 GLN A 153 3.991 7.523 -10.362 1.00 0.00 H new ATOM 0 HB3 GLN A 153 2.868 7.847 -9.056 1.00 0.00 H new ATOM 0 HG2 GLN A 153 4.132 6.752 -7.550 1.00 0.00 H new ATOM 0 HG3 GLN A 153 4.335 5.362 -8.598 1.00 0.00 H new ATOM 0 HE21 GLN A 153 5.250 8.718 -9.427 1.00 0.00 H new ATOM 0 HE22 GLN A 153 6.992 8.422 -9.473 1.00 0.00 H new ATOM 1833 N GLU A 154 2.067 4.957 -12.283 1.00 0.00 N ATOM 1834 CA GLU A 154 2.435 4.407 -13.582 1.00 0.00 C ATOM 1835 C GLU A 154 2.309 5.463 -14.674 1.00 0.00 C ATOM 1836 O GLU A 154 2.507 5.116 -15.858 1.00 0.00 O ATOM 1837 CB GLU A 154 1.551 3.203 -13.915 1.00 0.00 C ATOM 1838 CG GLU A 154 0.062 3.493 -13.808 1.00 0.00 C ATOM 1839 CD GLU A 154 -0.764 2.663 -14.770 1.00 0.00 C ATOM 1840 OE1 GLU A 154 -1.818 3.154 -15.225 1.00 0.00 O ATOM 1841 OE2 GLU A 154 -0.356 1.521 -15.070 1.00 0.00 O ATOM 1842 OXT GLU A 154 2.012 6.630 -14.339 1.00 0.00 O ATOM 0 H GLU A 154 1.077 4.867 -12.053 1.00 0.00 H new ATOM 0 HA GLU A 154 3.475 4.084 -13.533 1.00 0.00 H new ATOM 0 HB2 GLU A 154 1.775 2.867 -14.927 1.00 0.00 H new ATOM 0 HB3 GLU A 154 1.802 2.382 -13.244 1.00 0.00 H new ATOM 0 HG2 GLU A 154 -0.270 3.298 -12.788 1.00 0.00 H new ATOM 0 HG3 GLU A 154 -0.113 4.551 -14.004 1.00 0.00 H new TER 1849 GLU A 154