USER MOD reduce.3.24.130724 H: found=0, std=0, add=903, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 897 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 45 THR OG1 : rot 180:sc= 0.224 USER MOD Set 1.2: A 84 GLN :FLIP amide:sc= -1.75 F(o=-2.6,f=-1.5) USER MOD Set 2.1: A 83 TYR OH : rot 49:sc= 0.0657 USER MOD Set 2.2: A 101 TYR OH : rot 30:sc= 0 USER MOD Set 3.1: A 62 HIS : no HD1:sc= -0.0397 X(o=-0.04,f=0) USER MOD Set 3.2: A 70 SER OG : rot 160:sc= 0 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 15:sc= 1.14 USER MOD Single : A 8 HIS : no HD1:sc= -0.633 X(o=-0.63,f=-0.58) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 THR OG1 : rot 53:sc= -0.906 USER MOD Single : A 22 SER OG : rot -26:sc= 0.313 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 LYS NZ :NH3+ 143:sc= -0.337 (180deg=-1.95!) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 96:sc= -3.3 USER MOD Single : A 48 SER OG : rot 160:sc= -0.402 USER MOD Single : A 52 THR OG1 : rot -158:sc= 1.13 USER MOD Single : A 53 GLN : amide:sc= -11.6! C(o=-12!,f=-14!) USER MOD Single : A 58 HIS : no HD1:sc= -0.0463 X(o=-0.046,f=0) USER MOD Single : A 60 LYS NZ :NH3+ -170:sc= 0.314 (180deg=0.281) USER MOD Single : A 65 ASN : amide:sc= -1.92! C(o=-1.9!,f=-1.5!) USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 71 THR OG1 : rot -59:sc= 0.0997 USER MOD Single : A 73 CYS SG : rot -147:sc= 0.952 USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 ASN :FLIP amide:sc= 0 F(o=-0.84,f=0) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 TYR OH : rot 7:sc= -0.0771 USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0184) USER MOD Single : A 95 HIS : no HD1:sc= -2.28! C(o=-2.3!,f=-7.2!) USER MOD Single : A 100 THR OG1 : rot 44:sc= 0.169 USER MOD Single : A 108 ASN :FLIP amide:sc= -0.366 F(o=-1.9,f=-0.37) USER MOD Single : A 109 SER OG : rot 33:sc= 0.934 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 CYS SG : rot 180:sc= 0 USER MOD Single : A 120 GLN : amide:sc=-0.00225 K(o=-0.0023,f=-1) USER MOD Single : A 122 SER OG : rot -52:sc= 0.646 USER MOD Single : A 123 SER OG : rot -81:sc= 0.0843 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -26.175 3.768 20.222 1.00 0.00 N ATOM 2 CA GLY A 1 -26.369 2.825 21.308 1.00 0.00 C ATOM 3 C GLY A 1 -25.260 1.795 21.388 1.00 0.00 C ATOM 4 O GLY A 1 -25.521 0.593 21.433 1.00 0.00 O ATOM 0 H1 GLY A 1 -26.960 4.451 20.211 1.00 0.00 H new ATOM 0 H2 GLY A 1 -25.277 4.275 20.359 1.00 0.00 H new ATOM 0 H3 GLY A 1 -26.149 3.255 19.318 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -26.424 3.369 22.251 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -27.324 2.316 21.177 1.00 0.00 H new ATOM 8 N SER A 2 -24.017 2.267 21.402 1.00 0.00 N ATOM 9 CA SER A 2 -22.863 1.379 21.471 1.00 0.00 C ATOM 10 C SER A 2 -22.227 1.420 22.857 1.00 0.00 C ATOM 11 O SER A 2 -22.471 2.341 23.636 1.00 0.00 O ATOM 12 CB SER A 2 -21.830 1.767 20.411 1.00 0.00 C ATOM 13 OG SER A 2 -20.955 0.687 20.131 1.00 0.00 O ATOM 0 H SER A 2 -23.784 3.259 21.366 1.00 0.00 H new ATOM 0 HA SER A 2 -23.206 0.363 21.279 1.00 0.00 H new ATOM 0 HB2 SER A 2 -22.339 2.073 19.497 1.00 0.00 H new ATOM 0 HB3 SER A 2 -21.254 2.625 20.757 1.00 0.00 H new ATOM 0 HG SER A 2 -20.306 0.960 19.450 1.00 0.00 H new ATOM 19 N SER A 3 -21.409 0.416 23.156 1.00 0.00 N ATOM 20 CA SER A 3 -20.739 0.335 24.449 1.00 0.00 C ATOM 21 C SER A 3 -19.241 0.108 24.272 1.00 0.00 C ATOM 22 O SER A 3 -18.818 -0.876 23.667 1.00 0.00 O ATOM 23 CB SER A 3 -21.342 -0.793 25.289 1.00 0.00 C ATOM 24 OG SER A 3 -21.150 -0.557 26.673 1.00 0.00 O ATOM 0 H SER A 3 -21.194 -0.353 22.521 1.00 0.00 H new ATOM 0 HA SER A 3 -20.886 1.283 24.967 1.00 0.00 H new ATOM 0 HB2 SER A 3 -22.407 -0.879 25.076 1.00 0.00 H new ATOM 0 HB3 SER A 3 -20.883 -1.742 25.012 1.00 0.00 H new ATOM 0 HG SER A 3 -21.546 -1.291 27.188 1.00 0.00 H new ATOM 30 N GLY A 4 -18.442 1.028 24.805 1.00 0.00 N ATOM 31 CA GLY A 4 -17.000 0.911 24.696 1.00 0.00 C ATOM 32 C GLY A 4 -16.298 2.248 24.833 1.00 0.00 C ATOM 33 O GLY A 4 -16.898 3.229 25.272 1.00 0.00 O ATOM 0 H GLY A 4 -18.768 1.852 25.310 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -16.634 0.232 25.466 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -16.746 0.468 23.733 1.00 0.00 H new ATOM 37 N SER A 5 -15.024 2.286 24.457 1.00 0.00 N ATOM 38 CA SER A 5 -14.238 3.511 24.545 1.00 0.00 C ATOM 39 C SER A 5 -13.880 4.028 23.155 1.00 0.00 C ATOM 40 O SER A 5 -13.027 3.463 22.471 1.00 0.00 O ATOM 41 CB SER A 5 -12.963 3.267 25.355 1.00 0.00 C ATOM 42 OG SER A 5 -13.258 3.082 26.728 1.00 0.00 O ATOM 0 H SER A 5 -14.514 1.483 24.089 1.00 0.00 H new ATOM 0 HA SER A 5 -14.842 4.265 25.050 1.00 0.00 H new ATOM 0 HB2 SER A 5 -12.446 2.388 24.969 1.00 0.00 H new ATOM 0 HB3 SER A 5 -12.286 4.113 25.236 1.00 0.00 H new ATOM 0 HG SER A 5 -12.427 2.926 27.223 1.00 0.00 H new ATOM 48 N SER A 6 -14.539 5.107 22.744 1.00 0.00 N ATOM 49 CA SER A 6 -14.294 5.699 21.434 1.00 0.00 C ATOM 50 C SER A 6 -14.844 7.121 21.370 1.00 0.00 C ATOM 51 O SER A 6 -15.697 7.506 22.169 1.00 0.00 O ATOM 52 CB SER A 6 -14.932 4.844 20.337 1.00 0.00 C ATOM 53 OG SER A 6 -14.115 3.730 20.020 1.00 0.00 O ATOM 0 H SER A 6 -15.246 5.589 23.299 1.00 0.00 H new ATOM 0 HA SER A 6 -13.216 5.736 21.275 1.00 0.00 H new ATOM 0 HB2 SER A 6 -15.913 4.499 20.665 1.00 0.00 H new ATOM 0 HB3 SER A 6 -15.089 5.450 19.444 1.00 0.00 H new ATOM 0 HG SER A 6 -13.441 3.608 20.721 1.00 0.00 H new ATOM 59 N GLY A 7 -14.347 7.898 20.412 1.00 0.00 N ATOM 60 CA GLY A 7 -14.798 9.269 20.260 1.00 0.00 C ATOM 61 C GLY A 7 -13.786 10.136 19.539 1.00 0.00 C ATOM 62 O GLY A 7 -12.697 9.676 19.194 1.00 0.00 O ATOM 0 H GLY A 7 -13.640 7.602 19.739 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -15.739 9.280 19.709 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -15.000 9.693 21.244 1.00 0.00 H new ATOM 66 N HIS A 8 -14.145 11.395 19.308 1.00 0.00 N ATOM 67 CA HIS A 8 -13.260 12.329 18.621 1.00 0.00 C ATOM 68 C HIS A 8 -13.548 13.765 19.048 1.00 0.00 C ATOM 69 O HIS A 8 -14.705 14.173 19.149 1.00 0.00 O ATOM 70 CB HIS A 8 -13.418 12.194 17.106 1.00 0.00 C ATOM 71 CG HIS A 8 -12.834 10.930 16.553 1.00 0.00 C ATOM 72 ND1 HIS A 8 -13.595 9.948 15.954 1.00 0.00 N ATOM 73 CD2 HIS A 8 -11.554 10.491 16.509 1.00 0.00 C ATOM 74 CE1 HIS A 8 -12.809 8.960 15.568 1.00 0.00 C ATOM 75 NE2 HIS A 8 -11.565 9.265 15.892 1.00 0.00 N ATOM 0 H HIS A 8 -15.042 11.792 19.586 1.00 0.00 H new ATOM 0 HA HIS A 8 -12.233 12.086 18.895 1.00 0.00 H new ATOM 0 HB2 HIS A 8 -14.478 12.235 16.854 1.00 0.00 H new ATOM 0 HB3 HIS A 8 -12.942 13.047 16.622 1.00 0.00 H new ATOM 0 HD2 HIS A 8 -10.686 11.009 16.889 1.00 0.00 H new ATOM 0 HE1 HIS A 8 -13.129 8.056 15.072 1.00 0.00 H new ATOM 0 HE2 HIS A 8 -10.746 8.684 15.713 1.00 0.00 H new ATOM 83 N PHE A 9 -12.488 14.526 19.299 1.00 0.00 N ATOM 84 CA PHE A 9 -12.627 15.916 19.718 1.00 0.00 C ATOM 85 C PHE A 9 -13.157 16.778 18.575 1.00 0.00 C ATOM 86 O PHE A 9 -12.682 16.710 17.441 1.00 0.00 O ATOM 87 CB PHE A 9 -11.282 16.462 20.202 1.00 0.00 C ATOM 88 CG PHE A 9 -10.362 16.867 19.086 1.00 0.00 C ATOM 89 CD1 PHE A 9 -9.547 15.932 18.469 1.00 0.00 C ATOM 90 CD2 PHE A 9 -10.313 18.182 18.653 1.00 0.00 C ATOM 91 CE1 PHE A 9 -8.699 16.300 17.441 1.00 0.00 C ATOM 92 CE2 PHE A 9 -9.468 18.557 17.626 1.00 0.00 C ATOM 93 CZ PHE A 9 -8.659 17.615 17.020 1.00 0.00 C ATOM 0 H PHE A 9 -11.523 14.204 19.220 1.00 0.00 H new ATOM 0 HA PHE A 9 -13.343 15.952 20.539 1.00 0.00 H new ATOM 0 HB2 PHE A 9 -11.459 17.323 20.846 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -10.789 15.704 20.811 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -9.574 14.903 18.795 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -10.943 18.923 19.124 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -8.069 15.561 16.968 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -9.440 19.585 17.297 1.00 0.00 H new ATOM 0 HZ PHE A 9 -7.996 17.906 16.218 1.00 0.00 H new ATOM 103 N PRO A 10 -14.165 17.608 18.879 1.00 0.00 N ATOM 104 CA PRO A 10 -14.782 18.499 17.892 1.00 0.00 C ATOM 105 C PRO A 10 -13.850 19.629 17.469 1.00 0.00 C ATOM 106 O PRO A 10 -13.283 20.326 18.309 1.00 0.00 O ATOM 107 CB PRO A 10 -16.000 19.059 18.632 1.00 0.00 C ATOM 108 CG PRO A 10 -15.642 18.966 20.075 1.00 0.00 C ATOM 109 CD PRO A 10 -14.781 17.741 20.210 1.00 0.00 C ATOM 0 HA PRO A 10 -15.031 17.975 16.969 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -16.201 20.090 18.340 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -16.898 18.483 18.409 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -15.107 19.857 20.402 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -16.535 18.885 20.694 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -14.030 17.862 20.990 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -15.371 16.862 20.469 1.00 0.00 H new ATOM 117 N ALA A 11 -13.697 19.805 16.160 1.00 0.00 N ATOM 118 CA ALA A 11 -12.836 20.852 15.626 1.00 0.00 C ATOM 119 C ALA A 11 -13.631 21.835 14.774 1.00 0.00 C ATOM 120 O ALA A 11 -13.942 21.557 13.615 1.00 0.00 O ATOM 121 CB ALA A 11 -11.704 20.241 14.813 1.00 0.00 C ATOM 0 H ALA A 11 -14.158 19.236 15.451 1.00 0.00 H new ATOM 0 HA ALA A 11 -12.410 21.401 16.466 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -11.069 21.035 14.420 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -11.112 19.584 15.450 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -12.120 19.666 13.986 1.00 0.00 H new ATOM 127 N ARG A 12 -13.958 22.985 15.355 1.00 0.00 N ATOM 128 CA ARG A 12 -14.718 24.009 14.649 1.00 0.00 C ATOM 129 C ARG A 12 -13.791 24.930 13.862 1.00 0.00 C ATOM 130 O ARG A 12 -13.959 26.150 13.867 1.00 0.00 O ATOM 131 CB ARG A 12 -15.551 24.828 15.637 1.00 0.00 C ATOM 132 CG ARG A 12 -16.727 24.064 16.222 1.00 0.00 C ATOM 133 CD ARG A 12 -17.187 24.672 17.538 1.00 0.00 C ATOM 134 NE ARG A 12 -18.046 25.835 17.333 1.00 0.00 N ATOM 135 CZ ARG A 12 -18.225 26.786 18.243 1.00 0.00 C ATOM 136 NH1 ARG A 12 -17.608 26.711 19.415 1.00 0.00 N ATOM 137 NH2 ARG A 12 -19.023 27.814 17.983 1.00 0.00 N ATOM 0 H ARG A 12 -13.708 23.231 16.313 1.00 0.00 H new ATOM 0 HA ARG A 12 -15.386 23.510 13.947 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -14.907 25.165 16.450 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -15.923 25.720 15.133 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -17.553 24.065 15.511 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -16.444 23.023 16.380 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -17.726 23.921 18.116 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -16.317 24.963 18.127 1.00 0.00 H new ATOM 0 HE ARG A 12 -18.535 25.922 16.442 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -16.995 25.922 19.619 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -17.747 27.442 20.112 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -19.500 27.875 17.083 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -19.159 28.543 18.683 1.00 0.00 H new ATOM 151 N VAL A 13 -12.810 24.338 13.187 1.00 0.00 N ATOM 152 CA VAL A 13 -11.856 25.105 12.395 1.00 0.00 C ATOM 153 C VAL A 13 -11.249 24.251 11.288 1.00 0.00 C ATOM 154 O VAL A 13 -10.951 23.074 11.489 1.00 0.00 O ATOM 155 CB VAL A 13 -10.723 25.669 13.273 1.00 0.00 C ATOM 156 CG1 VAL A 13 -9.719 26.433 12.424 1.00 0.00 C ATOM 157 CG2 VAL A 13 -11.291 26.556 14.371 1.00 0.00 C ATOM 0 H VAL A 13 -12.656 23.330 13.173 1.00 0.00 H new ATOM 0 HA VAL A 13 -12.407 25.933 11.950 1.00 0.00 H new ATOM 0 HB VAL A 13 -10.203 24.835 13.744 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -8.926 26.824 13.062 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -9.289 25.764 11.679 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -10.222 27.260 11.922 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -10.477 26.946 14.982 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -11.837 27.386 13.922 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -11.967 25.973 14.997 1.00 0.00 H new ATOM 167 N LYS A 14 -11.067 24.853 10.117 1.00 0.00 N ATOM 168 CA LYS A 14 -10.493 24.149 8.976 1.00 0.00 C ATOM 169 C LYS A 14 -9.108 24.693 8.642 1.00 0.00 C ATOM 170 O LYS A 14 -8.767 25.818 9.008 1.00 0.00 O ATOM 171 CB LYS A 14 -11.411 24.278 7.758 1.00 0.00 C ATOM 172 CG LYS A 14 -11.675 25.716 7.344 1.00 0.00 C ATOM 173 CD LYS A 14 -10.645 26.205 6.340 1.00 0.00 C ATOM 174 CE LYS A 14 -10.929 27.634 5.902 1.00 0.00 C ATOM 175 NZ LYS A 14 -12.003 27.694 4.871 1.00 0.00 N ATOM 0 H LYS A 14 -11.309 25.827 9.933 1.00 0.00 H new ATOM 0 HA LYS A 14 -10.396 23.096 9.241 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -10.965 23.743 6.919 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -12.362 23.792 7.977 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -12.672 25.794 6.911 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -11.659 26.358 8.225 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -9.650 26.149 6.781 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -10.644 25.550 5.469 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -11.223 28.228 6.768 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -10.018 28.080 5.504 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -12.168 28.684 4.598 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -11.712 27.148 4.035 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -12.880 27.292 5.259 1.00 0.00 H new ATOM 189 N VAL A 15 -8.314 23.887 7.944 1.00 0.00 N ATOM 190 CA VAL A 15 -6.966 24.289 7.559 1.00 0.00 C ATOM 191 C VAL A 15 -6.476 23.488 6.357 1.00 0.00 C ATOM 192 O VAL A 15 -6.308 22.272 6.437 1.00 0.00 O ATOM 193 CB VAL A 15 -5.972 24.108 8.721 1.00 0.00 C ATOM 194 CG1 VAL A 15 -4.566 24.492 8.287 1.00 0.00 C ATOM 195 CG2 VAL A 15 -6.409 24.928 9.927 1.00 0.00 C ATOM 0 H VAL A 15 -8.581 22.953 7.634 1.00 0.00 H new ATOM 0 HA VAL A 15 -7.015 25.345 7.294 1.00 0.00 H new ATOM 0 HB VAL A 15 -5.963 23.056 9.008 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -3.878 24.357 9.122 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -4.256 23.859 7.456 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -4.555 25.535 7.972 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -5.696 24.789 10.739 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -6.448 25.983 9.655 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -7.397 24.600 10.251 1.00 0.00 H new ATOM 205 N GLU A 16 -6.250 24.179 5.245 1.00 0.00 N ATOM 206 CA GLU A 16 -5.779 23.531 4.026 1.00 0.00 C ATOM 207 C GLU A 16 -4.455 22.814 4.268 1.00 0.00 C ATOM 208 O GLU A 16 -3.665 23.190 5.134 1.00 0.00 O ATOM 209 CB GLU A 16 -5.617 24.560 2.905 1.00 0.00 C ATOM 210 CG GLU A 16 -4.462 25.522 3.124 1.00 0.00 C ATOM 211 CD GLU A 16 -4.665 26.848 2.417 1.00 0.00 C ATOM 212 OE1 GLU A 16 -5.570 27.606 2.827 1.00 0.00 O ATOM 213 OE2 GLU A 16 -3.921 27.128 1.454 1.00 0.00 O ATOM 0 H GLU A 16 -6.385 25.187 5.162 1.00 0.00 H new ATOM 0 HA GLU A 16 -6.523 22.792 3.727 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -5.468 24.036 1.961 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -6.541 25.130 2.811 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -4.339 25.699 4.192 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -3.539 25.063 2.769 1.00 0.00 H new ATOM 220 N PRO A 17 -4.205 21.754 3.485 1.00 0.00 N ATOM 221 CA PRO A 17 -2.977 20.960 3.594 1.00 0.00 C ATOM 222 C PRO A 17 -1.748 21.726 3.117 1.00 0.00 C ATOM 223 O PRO A 17 -1.787 22.404 2.091 1.00 0.00 O ATOM 224 CB PRO A 17 -3.247 19.761 2.683 1.00 0.00 C ATOM 225 CG PRO A 17 -4.248 20.253 1.695 1.00 0.00 C ATOM 226 CD PRO A 17 -5.102 21.248 2.432 1.00 0.00 C ATOM 0 HA PRO A 17 -2.759 20.687 4.626 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -2.335 19.426 2.189 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -3.633 18.913 3.249 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -3.757 20.718 0.840 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -4.851 19.432 1.308 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -5.443 22.049 1.776 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -5.992 20.780 2.853 1.00 0.00 H new ATOM 234 N ALA A 18 -0.657 21.613 3.868 1.00 0.00 N ATOM 235 CA ALA A 18 0.584 22.292 3.520 1.00 0.00 C ATOM 236 C ALA A 18 1.413 21.458 2.550 1.00 0.00 C ATOM 237 O ALA A 18 2.623 21.652 2.424 1.00 0.00 O ATOM 238 CB ALA A 18 1.388 22.599 4.775 1.00 0.00 C ATOM 0 H ALA A 18 -0.608 21.057 4.722 1.00 0.00 H new ATOM 0 HA ALA A 18 0.329 23.230 3.026 1.00 0.00 H new ATOM 0 HB1 ALA A 18 2.313 23.106 4.500 1.00 0.00 H new ATOM 0 HB2 ALA A 18 0.804 23.242 5.433 1.00 0.00 H new ATOM 0 HB3 ALA A 18 1.624 21.669 5.292 1.00 0.00 H new ATOM 244 N VAL A 19 0.756 20.528 1.864 1.00 0.00 N ATOM 245 CA VAL A 19 1.432 19.664 0.904 1.00 0.00 C ATOM 246 C VAL A 19 0.480 19.219 -0.201 1.00 0.00 C ATOM 247 O VAL A 19 -0.729 19.122 0.009 1.00 0.00 O ATOM 248 CB VAL A 19 2.023 18.418 1.590 1.00 0.00 C ATOM 249 CG1 VAL A 19 0.919 17.443 1.970 1.00 0.00 C ATOM 250 CG2 VAL A 19 3.048 17.749 0.687 1.00 0.00 C ATOM 0 H VAL A 19 -0.245 20.354 1.956 1.00 0.00 H new ATOM 0 HA VAL A 19 2.242 20.248 0.468 1.00 0.00 H new ATOM 0 HB VAL A 19 2.527 18.733 2.504 1.00 0.00 H new ATOM 0 HG11 VAL A 19 1.356 16.569 2.453 1.00 0.00 H new ATOM 0 HG12 VAL A 19 0.225 17.928 2.656 1.00 0.00 H new ATOM 0 HG13 VAL A 19 0.384 17.132 1.073 1.00 0.00 H new ATOM 0 HG21 VAL A 19 3.455 16.871 1.187 1.00 0.00 H new ATOM 0 HG22 VAL A 19 2.570 17.447 -0.245 1.00 0.00 H new ATOM 0 HG23 VAL A 19 3.854 18.450 0.470 1.00 0.00 H new ATOM 260 N ASP A 20 1.034 18.950 -1.378 1.00 0.00 N ATOM 261 CA ASP A 20 0.235 18.513 -2.517 1.00 0.00 C ATOM 262 C ASP A 20 -0.138 17.040 -2.386 1.00 0.00 C ATOM 263 O ASP A 20 -1.317 16.685 -2.382 1.00 0.00 O ATOM 264 CB ASP A 20 0.999 18.745 -3.821 1.00 0.00 C ATOM 265 CG ASP A 20 1.139 20.216 -4.157 1.00 0.00 C ATOM 266 OD1 ASP A 20 1.604 20.982 -3.286 1.00 0.00 O ATOM 267 OD2 ASP A 20 0.785 20.603 -5.290 1.00 0.00 O ATOM 0 H ASP A 20 2.033 19.027 -1.568 1.00 0.00 H new ATOM 0 HA ASP A 20 -0.683 19.101 -2.533 1.00 0.00 H new ATOM 0 HB2 ASP A 20 1.990 18.298 -3.742 1.00 0.00 H new ATOM 0 HB3 ASP A 20 0.483 18.237 -4.636 1.00 0.00 H new ATOM 272 N THR A 21 0.874 16.185 -2.280 1.00 0.00 N ATOM 273 CA THR A 21 0.653 14.750 -2.152 1.00 0.00 C ATOM 274 C THR A 21 -0.561 14.307 -2.960 1.00 0.00 C ATOM 275 O THR A 21 -1.428 13.594 -2.455 1.00 0.00 O ATOM 276 CB THR A 21 0.452 14.342 -0.680 1.00 0.00 C ATOM 277 OG1 THR A 21 -0.384 15.297 -0.017 1.00 0.00 O ATOM 278 CG2 THR A 21 1.788 14.243 0.041 1.00 0.00 C ATOM 0 H THR A 21 1.856 16.462 -2.280 1.00 0.00 H new ATOM 0 HA THR A 21 1.544 14.257 -2.540 1.00 0.00 H new ATOM 0 HB THR A 21 -0.028 13.363 -0.659 1.00 0.00 H new ATOM 0 HG1 THR A 21 -1.213 15.415 -0.526 1.00 0.00 H new ATOM 0 HG21 THR A 21 1.621 13.954 1.079 1.00 0.00 H new ATOM 0 HG22 THR A 21 2.411 13.495 -0.449 1.00 0.00 H new ATOM 0 HG23 THR A 21 2.290 15.210 0.010 1.00 0.00 H new ATOM 286 N SER A 22 -0.616 14.732 -4.218 1.00 0.00 N ATOM 287 CA SER A 22 -1.726 14.381 -5.096 1.00 0.00 C ATOM 288 C SER A 22 -1.220 13.702 -6.365 1.00 0.00 C ATOM 289 O SER A 22 -2.008 13.243 -7.193 1.00 0.00 O ATOM 290 CB SER A 22 -2.532 15.629 -5.458 1.00 0.00 C ATOM 291 OG SER A 22 -3.685 15.292 -6.210 1.00 0.00 O ATOM 0 H SER A 22 0.095 15.320 -4.652 1.00 0.00 H new ATOM 0 HA SER A 22 -2.372 13.683 -4.564 1.00 0.00 H new ATOM 0 HB2 SER A 22 -2.827 16.151 -4.548 1.00 0.00 H new ATOM 0 HB3 SER A 22 -1.908 16.315 -6.031 1.00 0.00 H new ATOM 0 HG SER A 22 -3.531 14.449 -6.685 1.00 0.00 H new ATOM 297 N ARG A 23 0.099 13.642 -6.512 1.00 0.00 N ATOM 298 CA ARG A 23 0.711 13.021 -7.680 1.00 0.00 C ATOM 299 C ARG A 23 1.699 11.936 -7.264 1.00 0.00 C ATOM 300 O ARG A 23 2.664 11.655 -7.976 1.00 0.00 O ATOM 301 CB ARG A 23 1.423 14.075 -8.531 1.00 0.00 C ATOM 302 CG ARG A 23 0.483 14.885 -9.409 1.00 0.00 C ATOM 303 CD ARG A 23 1.224 15.989 -10.147 1.00 0.00 C ATOM 304 NE ARG A 23 1.758 15.529 -11.426 1.00 0.00 N ATOM 305 CZ ARG A 23 2.492 16.288 -12.232 1.00 0.00 C ATOM 306 NH1 ARG A 23 2.778 17.538 -11.892 1.00 0.00 N ATOM 307 NH2 ARG A 23 2.942 15.798 -13.380 1.00 0.00 N ATOM 0 H ARG A 23 0.765 14.016 -5.836 1.00 0.00 H new ATOM 0 HA ARG A 23 -0.080 12.560 -8.271 1.00 0.00 H new ATOM 0 HB2 ARG A 23 1.968 14.753 -7.874 1.00 0.00 H new ATOM 0 HB3 ARG A 23 2.162 13.581 -9.163 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -0.002 14.226 -10.129 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -0.305 15.321 -8.795 1.00 0.00 H new ATOM 0 HD2 ARG A 23 0.549 16.828 -10.317 1.00 0.00 H new ATOM 0 HD3 ARG A 23 2.040 16.357 -9.525 1.00 0.00 H new ATOM 0 HE ARG A 23 1.556 14.572 -11.716 1.00 0.00 H new ATOM 0 HH11 ARG A 23 2.434 17.918 -11.010 1.00 0.00 H new ATOM 0 HH12 ARG A 23 3.342 18.119 -12.512 1.00 0.00 H new ATOM 0 HH21 ARG A 23 2.724 14.837 -13.645 1.00 0.00 H new ATOM 0 HH22 ARG A 23 3.505 16.382 -13.998 1.00 0.00 H new ATOM 321 N ILE A 24 1.452 11.330 -6.108 1.00 0.00 N ATOM 322 CA ILE A 24 2.320 10.275 -5.597 1.00 0.00 C ATOM 323 C ILE A 24 2.008 8.938 -6.261 1.00 0.00 C ATOM 324 O ILE A 24 0.869 8.472 -6.240 1.00 0.00 O ATOM 325 CB ILE A 24 2.183 10.123 -4.071 1.00 0.00 C ATOM 326 CG1 ILE A 24 2.647 11.398 -3.365 1.00 0.00 C ATOM 327 CG2 ILE A 24 2.981 8.922 -3.585 1.00 0.00 C ATOM 328 CD1 ILE A 24 2.830 11.231 -1.873 1.00 0.00 C ATOM 0 H ILE A 24 0.658 11.551 -5.507 1.00 0.00 H new ATOM 0 HA ILE A 24 3.344 10.565 -5.834 1.00 0.00 H new ATOM 0 HB ILE A 24 1.133 9.959 -3.830 1.00 0.00 H new ATOM 0 HG12 ILE A 24 3.590 11.724 -3.804 1.00 0.00 H new ATOM 0 HG13 ILE A 24 1.920 12.189 -3.547 1.00 0.00 H new ATOM 0 HG21 ILE A 24 2.874 8.828 -2.504 1.00 0.00 H new ATOM 0 HG22 ILE A 24 2.608 8.018 -4.067 1.00 0.00 H new ATOM 0 HG23 ILE A 24 4.033 9.059 -3.835 1.00 0.00 H new ATOM 0 HD11 ILE A 24 3.160 12.175 -1.439 1.00 0.00 H new ATOM 0 HD12 ILE A 24 1.883 10.935 -1.421 1.00 0.00 H new ATOM 0 HD13 ILE A 24 3.579 10.462 -1.682 1.00 0.00 H new ATOM 340 N LYS A 25 3.029 8.323 -6.848 1.00 0.00 N ATOM 341 CA LYS A 25 2.867 7.037 -7.516 1.00 0.00 C ATOM 342 C LYS A 25 3.626 5.940 -6.776 1.00 0.00 C ATOM 343 O LYS A 25 4.824 6.065 -6.520 1.00 0.00 O ATOM 344 CB LYS A 25 3.358 7.125 -8.963 1.00 0.00 C ATOM 345 CG LYS A 25 2.354 7.761 -9.908 1.00 0.00 C ATOM 346 CD LYS A 25 1.276 6.774 -10.323 1.00 0.00 C ATOM 347 CE LYS A 25 0.547 7.238 -11.575 1.00 0.00 C ATOM 348 NZ LYS A 25 1.320 6.936 -12.811 1.00 0.00 N ATOM 0 H LYS A 25 3.978 8.695 -6.875 1.00 0.00 H new ATOM 0 HA LYS A 25 1.806 6.786 -7.513 1.00 0.00 H new ATOM 0 HB2 LYS A 25 4.284 7.700 -8.989 1.00 0.00 H new ATOM 0 HB3 LYS A 25 3.595 6.122 -9.319 1.00 0.00 H new ATOM 0 HG2 LYS A 25 1.893 8.622 -9.425 1.00 0.00 H new ATOM 0 HG3 LYS A 25 2.870 8.131 -10.794 1.00 0.00 H new ATOM 0 HD2 LYS A 25 1.725 5.797 -10.503 1.00 0.00 H new ATOM 0 HD3 LYS A 25 0.561 6.651 -9.509 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -0.428 6.753 -11.629 1.00 0.00 H new ATOM 0 HE3 LYS A 25 0.366 8.311 -11.513 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 0.790 7.268 -13.642 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 2.240 7.419 -12.772 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 1.471 5.910 -12.884 1.00 0.00 H new ATOM 362 N VAL A 26 2.922 4.866 -6.436 1.00 0.00 N ATOM 363 CA VAL A 26 3.531 3.746 -5.727 1.00 0.00 C ATOM 364 C VAL A 26 3.460 2.468 -6.556 1.00 0.00 C ATOM 365 O VAL A 26 2.377 2.012 -6.923 1.00 0.00 O ATOM 366 CB VAL A 26 2.846 3.502 -4.369 1.00 0.00 C ATOM 367 CG1 VAL A 26 2.963 4.734 -3.484 1.00 0.00 C ATOM 368 CG2 VAL A 26 1.389 3.115 -4.569 1.00 0.00 C ATOM 0 H VAL A 26 1.930 4.747 -6.640 1.00 0.00 H new ATOM 0 HA VAL A 26 4.575 4.009 -5.557 1.00 0.00 H new ATOM 0 HB VAL A 26 3.351 2.676 -3.869 1.00 0.00 H new ATOM 0 HG11 VAL A 26 2.474 4.544 -2.529 1.00 0.00 H new ATOM 0 HG12 VAL A 26 4.015 4.961 -3.314 1.00 0.00 H new ATOM 0 HG13 VAL A 26 2.484 5.581 -3.975 1.00 0.00 H new ATOM 0 HG21 VAL A 26 0.921 2.946 -3.599 1.00 0.00 H new ATOM 0 HG22 VAL A 26 0.867 3.918 -5.089 1.00 0.00 H new ATOM 0 HG23 VAL A 26 1.333 2.202 -5.162 1.00 0.00 H new ATOM 378 N PHE A 27 4.622 1.893 -6.847 1.00 0.00 N ATOM 379 CA PHE A 27 4.693 0.667 -7.633 1.00 0.00 C ATOM 380 C PHE A 27 5.459 -0.417 -6.882 1.00 0.00 C ATOM 381 O PHE A 27 6.262 -0.125 -5.996 1.00 0.00 O ATOM 382 CB PHE A 27 5.363 0.939 -8.982 1.00 0.00 C ATOM 383 CG PHE A 27 6.544 1.862 -8.889 1.00 0.00 C ATOM 384 CD1 PHE A 27 6.368 3.237 -8.897 1.00 0.00 C ATOM 385 CD2 PHE A 27 7.830 1.356 -8.795 1.00 0.00 C ATOM 386 CE1 PHE A 27 7.453 4.089 -8.812 1.00 0.00 C ATOM 387 CE2 PHE A 27 8.919 2.203 -8.709 1.00 0.00 C ATOM 388 CZ PHE A 27 8.730 3.572 -8.718 1.00 0.00 C ATOM 0 H PHE A 27 5.528 2.257 -6.550 1.00 0.00 H new ATOM 0 HA PHE A 27 3.676 0.316 -7.804 1.00 0.00 H new ATOM 0 HB2 PHE A 27 5.685 -0.008 -9.416 1.00 0.00 H new ATOM 0 HB3 PHE A 27 4.629 1.369 -9.663 1.00 0.00 H new ATOM 0 HD1 PHE A 27 5.372 3.647 -8.970 1.00 0.00 H new ATOM 0 HD2 PHE A 27 7.984 0.287 -8.789 1.00 0.00 H new ATOM 0 HE1 PHE A 27 7.302 5.158 -8.819 1.00 0.00 H new ATOM 0 HE2 PHE A 27 9.916 1.795 -8.635 1.00 0.00 H new ATOM 0 HZ PHE A 27 9.579 4.236 -8.652 1.00 0.00 H new ATOM 398 N GLY A 28 5.204 -1.672 -7.242 1.00 0.00 N ATOM 399 CA GLY A 28 5.876 -2.782 -6.592 1.00 0.00 C ATOM 400 C GLY A 28 4.906 -3.828 -6.082 1.00 0.00 C ATOM 401 O GLY A 28 3.706 -3.584 -5.954 1.00 0.00 O ATOM 0 H GLY A 28 4.544 -1.939 -7.972 1.00 0.00 H new ATOM 0 HA2 GLY A 28 6.569 -3.245 -7.295 1.00 0.00 H new ATOM 0 HA3 GLY A 28 6.471 -2.406 -5.760 1.00 0.00 H new ATOM 405 N PRO A 29 5.427 -5.028 -5.782 1.00 0.00 N ATOM 406 CA PRO A 29 4.615 -6.140 -5.280 1.00 0.00 C ATOM 407 C PRO A 29 4.111 -5.896 -3.861 1.00 0.00 C ATOM 408 O PRO A 29 2.986 -6.260 -3.521 1.00 0.00 O ATOM 409 CB PRO A 29 5.583 -7.326 -5.306 1.00 0.00 C ATOM 410 CG PRO A 29 6.937 -6.712 -5.200 1.00 0.00 C ATOM 411 CD PRO A 29 6.849 -5.390 -5.910 1.00 0.00 C ATOM 0 HA PRO A 29 3.717 -6.291 -5.879 1.00 0.00 H new ATOM 0 HB2 PRO A 29 5.393 -8.010 -4.479 1.00 0.00 H new ATOM 0 HB3 PRO A 29 5.480 -7.901 -6.226 1.00 0.00 H new ATOM 0 HG2 PRO A 29 7.223 -6.576 -4.157 1.00 0.00 H new ATOM 0 HG3 PRO A 29 7.692 -7.351 -5.657 1.00 0.00 H new ATOM 0 HD2 PRO A 29 7.497 -4.643 -5.451 1.00 0.00 H new ATOM 0 HD3 PRO A 29 7.150 -5.474 -6.954 1.00 0.00 H new ATOM 419 N GLY A 30 4.951 -5.276 -3.038 1.00 0.00 N ATOM 420 CA GLY A 30 4.572 -4.994 -1.666 1.00 0.00 C ATOM 421 C GLY A 30 3.268 -4.227 -1.571 1.00 0.00 C ATOM 422 O GLY A 30 2.577 -4.287 -0.553 1.00 0.00 O ATOM 0 H GLY A 30 5.887 -4.964 -3.297 1.00 0.00 H new ATOM 0 HA2 GLY A 30 4.479 -5.932 -1.118 1.00 0.00 H new ATOM 0 HA3 GLY A 30 5.364 -4.420 -1.184 1.00 0.00 H new ATOM 426 N ILE A 31 2.930 -3.503 -2.633 1.00 0.00 N ATOM 427 CA ILE A 31 1.700 -2.721 -2.665 1.00 0.00 C ATOM 428 C ILE A 31 0.700 -3.310 -3.653 1.00 0.00 C ATOM 429 O ILE A 31 -0.510 -3.154 -3.493 1.00 0.00 O ATOM 430 CB ILE A 31 1.976 -1.254 -3.043 1.00 0.00 C ATOM 431 CG1 ILE A 31 0.748 -0.390 -2.748 1.00 0.00 C ATOM 432 CG2 ILE A 31 2.364 -1.149 -4.510 1.00 0.00 C ATOM 433 CD1 ILE A 31 0.485 -0.198 -1.270 1.00 0.00 C ATOM 0 H ILE A 31 3.491 -3.442 -3.483 1.00 0.00 H new ATOM 0 HA ILE A 31 1.277 -2.755 -1.661 1.00 0.00 H new ATOM 0 HB ILE A 31 2.808 -0.889 -2.441 1.00 0.00 H new ATOM 0 HG12 ILE A 31 0.880 0.586 -3.215 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -0.128 -0.848 -3.208 1.00 0.00 H new ATOM 0 HG21 ILE A 31 2.556 -0.106 -4.762 1.00 0.00 H new ATOM 0 HG22 ILE A 31 3.263 -1.738 -4.692 1.00 0.00 H new ATOM 0 HG23 ILE A 31 1.551 -1.528 -5.129 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -0.400 0.424 -1.136 1.00 0.00 H new ATOM 0 HD12 ILE A 31 0.321 -1.168 -0.801 1.00 0.00 H new ATOM 0 HD13 ILE A 31 1.344 0.288 -0.808 1.00 0.00 H new ATOM 445 N GLU A 32 1.214 -3.989 -4.674 1.00 0.00 N ATOM 446 CA GLU A 32 0.364 -4.602 -5.688 1.00 0.00 C ATOM 447 C GLU A 32 -0.181 -5.942 -5.204 1.00 0.00 C ATOM 448 O GLU A 32 -1.384 -6.191 -5.257 1.00 0.00 O ATOM 449 CB GLU A 32 1.145 -4.797 -6.990 1.00 0.00 C ATOM 450 CG GLU A 32 1.530 -3.494 -7.670 1.00 0.00 C ATOM 451 CD GLU A 32 0.453 -2.986 -8.609 1.00 0.00 C ATOM 452 OE1 GLU A 32 -0.336 -3.814 -9.108 1.00 0.00 O ATOM 453 OE2 GLU A 32 0.400 -1.760 -8.844 1.00 0.00 O ATOM 0 H GLU A 32 2.214 -4.128 -4.821 1.00 0.00 H new ATOM 0 HA GLU A 32 -0.477 -3.933 -5.873 1.00 0.00 H new ATOM 0 HB2 GLU A 32 2.049 -5.368 -6.779 1.00 0.00 H new ATOM 0 HB3 GLU A 32 0.545 -5.393 -7.678 1.00 0.00 H new ATOM 0 HG2 GLU A 32 1.731 -2.738 -6.911 1.00 0.00 H new ATOM 0 HG3 GLU A 32 2.455 -3.639 -8.228 1.00 0.00 H new ATOM 460 N GLY A 33 0.715 -6.803 -4.730 1.00 0.00 N ATOM 461 CA GLY A 33 0.306 -8.107 -4.244 1.00 0.00 C ATOM 462 C GLY A 33 0.739 -9.231 -5.164 1.00 0.00 C ATOM 463 O GLY A 33 -0.032 -10.150 -5.441 1.00 0.00 O ATOM 0 H GLY A 33 1.717 -6.620 -4.674 1.00 0.00 H new ATOM 0 HA2 GLY A 33 0.728 -8.270 -3.252 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -0.778 -8.127 -4.136 1.00 0.00 H new ATOM 467 N LYS A 34 1.977 -9.160 -5.641 1.00 0.00 N ATOM 468 CA LYS A 34 2.513 -10.178 -6.536 1.00 0.00 C ATOM 469 C LYS A 34 3.311 -11.220 -5.758 1.00 0.00 C ATOM 470 O LYS A 34 2.880 -12.365 -5.614 1.00 0.00 O ATOM 471 CB LYS A 34 3.401 -9.533 -7.603 1.00 0.00 C ATOM 472 CG LYS A 34 2.809 -8.270 -8.204 1.00 0.00 C ATOM 473 CD LYS A 34 1.494 -8.553 -8.913 1.00 0.00 C ATOM 474 CE LYS A 34 1.721 -9.022 -10.342 1.00 0.00 C ATOM 475 NZ LYS A 34 2.055 -10.473 -10.403 1.00 0.00 N ATOM 0 H LYS A 34 2.629 -8.407 -5.422 1.00 0.00 H new ATOM 0 HA LYS A 34 1.674 -10.676 -7.023 1.00 0.00 H new ATOM 0 HB2 LYS A 34 4.370 -9.297 -7.163 1.00 0.00 H new ATOM 0 HB3 LYS A 34 3.580 -10.255 -8.400 1.00 0.00 H new ATOM 0 HG2 LYS A 34 2.648 -7.533 -7.418 1.00 0.00 H new ATOM 0 HG3 LYS A 34 3.517 -7.835 -8.909 1.00 0.00 H new ATOM 0 HD2 LYS A 34 0.939 -9.313 -8.363 1.00 0.00 H new ATOM 0 HD3 LYS A 34 0.881 -7.652 -8.918 1.00 0.00 H new ATOM 0 HE2 LYS A 34 0.826 -8.830 -10.934 1.00 0.00 H new ATOM 0 HE3 LYS A 34 2.529 -8.444 -10.790 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 1.615 -10.895 -11.245 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 3.087 -10.590 -10.456 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 1.696 -10.948 -9.550 1.00 0.00 H new ATOM 489 N ASP A 35 4.474 -10.817 -5.259 1.00 0.00 N ATOM 490 CA ASP A 35 5.330 -11.715 -4.493 1.00 0.00 C ATOM 491 C ASP A 35 5.236 -11.415 -3.000 1.00 0.00 C ATOM 492 O ASP A 35 6.203 -11.593 -2.259 1.00 0.00 O ATOM 493 CB ASP A 35 6.781 -11.592 -4.960 1.00 0.00 C ATOM 494 CG ASP A 35 6.916 -11.708 -6.466 1.00 0.00 C ATOM 495 OD1 ASP A 35 6.225 -10.955 -7.184 1.00 0.00 O ATOM 496 OD2 ASP A 35 7.714 -12.552 -6.927 1.00 0.00 O ATOM 0 H ASP A 35 4.846 -9.874 -5.371 1.00 0.00 H new ATOM 0 HA ASP A 35 4.987 -12.736 -4.662 1.00 0.00 H new ATOM 0 HB2 ASP A 35 7.184 -10.633 -4.635 1.00 0.00 H new ATOM 0 HB3 ASP A 35 7.380 -12.368 -4.483 1.00 0.00 H new ATOM 501 N VAL A 36 4.066 -10.958 -2.566 1.00 0.00 N ATOM 502 CA VAL A 36 3.846 -10.633 -1.162 1.00 0.00 C ATOM 503 C VAL A 36 3.366 -11.853 -0.384 1.00 0.00 C ATOM 504 O VAL A 36 2.874 -11.733 0.738 1.00 0.00 O ATOM 505 CB VAL A 36 2.815 -9.499 -1.004 1.00 0.00 C ATOM 506 CG1 VAL A 36 2.818 -8.970 0.423 1.00 0.00 C ATOM 507 CG2 VAL A 36 3.098 -8.381 -1.996 1.00 0.00 C ATOM 0 H VAL A 36 3.256 -10.804 -3.166 1.00 0.00 H new ATOM 0 HA VAL A 36 4.804 -10.303 -0.759 1.00 0.00 H new ATOM 0 HB VAL A 36 1.824 -9.900 -1.216 1.00 0.00 H new ATOM 0 HG11 VAL A 36 2.084 -8.170 0.516 1.00 0.00 H new ATOM 0 HG12 VAL A 36 2.564 -9.777 1.111 1.00 0.00 H new ATOM 0 HG13 VAL A 36 3.808 -8.584 0.666 1.00 0.00 H new ATOM 0 HG21 VAL A 36 2.361 -7.588 -1.871 1.00 0.00 H new ATOM 0 HG22 VAL A 36 4.096 -7.980 -1.817 1.00 0.00 H new ATOM 0 HG23 VAL A 36 3.041 -8.773 -3.012 1.00 0.00 H new ATOM 517 N PHE A 37 3.512 -13.028 -0.988 1.00 0.00 N ATOM 518 CA PHE A 37 3.093 -14.271 -0.352 1.00 0.00 C ATOM 519 C PHE A 37 3.492 -14.291 1.120 1.00 0.00 C ATOM 520 O PHE A 37 4.388 -13.559 1.542 1.00 0.00 O ATOM 521 CB PHE A 37 3.709 -15.471 -1.075 1.00 0.00 C ATOM 522 CG PHE A 37 3.742 -15.319 -2.569 1.00 0.00 C ATOM 523 CD1 PHE A 37 2.572 -15.125 -3.285 1.00 0.00 C ATOM 524 CD2 PHE A 37 4.944 -15.370 -3.257 1.00 0.00 C ATOM 525 CE1 PHE A 37 2.599 -14.985 -4.659 1.00 0.00 C ATOM 526 CE2 PHE A 37 4.976 -15.230 -4.632 1.00 0.00 C ATOM 527 CZ PHE A 37 3.803 -15.038 -5.334 1.00 0.00 C ATOM 0 H PHE A 37 3.917 -13.145 -1.917 1.00 0.00 H new ATOM 0 HA PHE A 37 2.007 -14.334 -0.416 1.00 0.00 H new ATOM 0 HB2 PHE A 37 4.725 -15.622 -0.711 1.00 0.00 H new ATOM 0 HB3 PHE A 37 3.143 -16.367 -0.821 1.00 0.00 H new ATOM 0 HD1 PHE A 37 1.628 -15.083 -2.763 1.00 0.00 H new ATOM 0 HD2 PHE A 37 5.865 -15.521 -2.713 1.00 0.00 H new ATOM 0 HE1 PHE A 37 1.679 -14.834 -5.205 1.00 0.00 H new ATOM 0 HE2 PHE A 37 5.919 -15.271 -5.157 1.00 0.00 H new ATOM 0 HZ PHE A 37 3.827 -14.929 -6.408 1.00 0.00 H new ATOM 537 N ARG A 38 2.820 -15.133 1.898 1.00 0.00 N ATOM 538 CA ARG A 38 3.102 -15.247 3.324 1.00 0.00 C ATOM 539 C ARG A 38 4.581 -15.537 3.564 1.00 0.00 C ATOM 540 O ARG A 38 5.173 -16.385 2.896 1.00 0.00 O ATOM 541 CB ARG A 38 2.247 -16.351 3.948 1.00 0.00 C ATOM 542 CG ARG A 38 1.976 -16.147 5.430 1.00 0.00 C ATOM 543 CD ARG A 38 0.801 -16.990 5.902 1.00 0.00 C ATOM 544 NE ARG A 38 0.846 -17.232 7.342 1.00 0.00 N ATOM 545 CZ ARG A 38 1.583 -18.183 7.904 1.00 0.00 C ATOM 546 NH1 ARG A 38 2.334 -18.976 7.153 1.00 0.00 N ATOM 547 NH2 ARG A 38 1.570 -18.342 9.222 1.00 0.00 N ATOM 0 H ARG A 38 2.076 -15.746 1.565 1.00 0.00 H new ATOM 0 HA ARG A 38 2.855 -14.296 3.795 1.00 0.00 H new ATOM 0 HB2 ARG A 38 1.296 -16.406 3.418 1.00 0.00 H new ATOM 0 HB3 ARG A 38 2.747 -17.309 3.807 1.00 0.00 H new ATOM 0 HG2 ARG A 38 2.866 -16.408 6.003 1.00 0.00 H new ATOM 0 HG3 ARG A 38 1.770 -15.094 5.622 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -0.132 -16.487 5.648 1.00 0.00 H new ATOM 0 HD3 ARG A 38 0.803 -17.943 5.374 1.00 0.00 H new ATOM 0 HE ARG A 38 0.281 -16.638 7.949 1.00 0.00 H new ATOM 0 HH11 ARG A 38 2.347 -18.857 6.140 1.00 0.00 H new ATOM 0 HH12 ARG A 38 2.899 -19.705 7.588 1.00 0.00 H new ATOM 0 HH21 ARG A 38 0.994 -17.734 9.803 1.00 0.00 H new ATOM 0 HH22 ARG A 38 2.136 -19.073 9.653 1.00 0.00 H new ATOM 561 N GLU A 39 5.170 -14.827 4.521 1.00 0.00 N ATOM 562 CA GLU A 39 6.580 -15.008 4.847 1.00 0.00 C ATOM 563 C GLU A 39 7.464 -14.669 3.650 1.00 0.00 C ATOM 564 O GLU A 39 8.476 -15.324 3.407 1.00 0.00 O ATOM 565 CB GLU A 39 6.842 -16.448 5.296 1.00 0.00 C ATOM 566 CG GLU A 39 6.138 -16.819 6.591 1.00 0.00 C ATOM 567 CD GLU A 39 6.529 -15.919 7.747 1.00 0.00 C ATOM 568 OE1 GLU A 39 7.668 -16.050 8.242 1.00 0.00 O ATOM 569 OE2 GLU A 39 5.696 -15.084 8.156 1.00 0.00 O ATOM 0 H GLU A 39 4.694 -14.122 5.084 1.00 0.00 H new ATOM 0 HA GLU A 39 6.827 -14.329 5.663 1.00 0.00 H new ATOM 0 HB2 GLU A 39 6.520 -17.130 4.509 1.00 0.00 H new ATOM 0 HB3 GLU A 39 7.915 -16.591 5.422 1.00 0.00 H new ATOM 0 HG2 GLU A 39 5.060 -16.765 6.442 1.00 0.00 H new ATOM 0 HG3 GLU A 39 6.373 -17.853 6.845 1.00 0.00 H new ATOM 576 N ALA A 40 7.071 -13.640 2.906 1.00 0.00 N ATOM 577 CA ALA A 40 7.827 -13.212 1.735 1.00 0.00 C ATOM 578 C ALA A 40 8.250 -11.753 1.859 1.00 0.00 C ATOM 579 O ALA A 40 7.440 -10.886 2.189 1.00 0.00 O ATOM 580 CB ALA A 40 7.006 -13.421 0.471 1.00 0.00 C ATOM 0 H ALA A 40 6.234 -13.088 3.093 1.00 0.00 H new ATOM 0 HA ALA A 40 8.729 -13.820 1.673 1.00 0.00 H new ATOM 0 HB1 ALA A 40 7.583 -13.097 -0.395 1.00 0.00 H new ATOM 0 HB2 ALA A 40 6.759 -14.478 0.368 1.00 0.00 H new ATOM 0 HB3 ALA A 40 6.087 -12.838 0.533 1.00 0.00 H new ATOM 586 N THR A 41 9.525 -11.486 1.592 1.00 0.00 N ATOM 587 CA THR A 41 10.056 -10.131 1.675 1.00 0.00 C ATOM 588 C THR A 41 9.627 -9.298 0.473 1.00 0.00 C ATOM 589 O THR A 41 10.195 -9.417 -0.614 1.00 0.00 O ATOM 590 CB THR A 41 11.594 -10.135 1.760 1.00 0.00 C ATOM 591 OG1 THR A 41 12.025 -11.007 2.811 1.00 0.00 O ATOM 592 CG2 THR A 41 12.126 -8.732 2.009 1.00 0.00 C ATOM 0 H THR A 41 10.209 -12.191 1.316 1.00 0.00 H new ATOM 0 HA THR A 41 9.650 -9.687 2.584 1.00 0.00 H new ATOM 0 HB THR A 41 11.987 -10.492 0.808 1.00 0.00 H new ATOM 0 HG1 THR A 41 13.004 -11.005 2.857 1.00 0.00 H new ATOM 0 HG21 THR A 41 13.214 -8.760 2.065 1.00 0.00 H new ATOM 0 HG22 THR A 41 11.822 -8.077 1.192 1.00 0.00 H new ATOM 0 HG23 THR A 41 11.724 -8.352 2.948 1.00 0.00 H new ATOM 600 N THR A 42 8.621 -8.452 0.673 1.00 0.00 N ATOM 601 CA THR A 42 8.116 -7.599 -0.394 1.00 0.00 C ATOM 602 C THR A 42 8.198 -6.127 -0.007 1.00 0.00 C ATOM 603 O THR A 42 8.033 -5.772 1.161 1.00 0.00 O ATOM 604 CB THR A 42 6.657 -7.945 -0.747 1.00 0.00 C ATOM 605 OG1 THR A 42 6.250 -7.221 -1.913 1.00 0.00 O ATOM 606 CG2 THR A 42 5.727 -7.614 0.411 1.00 0.00 C ATOM 0 H THR A 42 8.140 -8.340 1.565 1.00 0.00 H new ATOM 0 HA THR A 42 8.745 -7.778 -1.266 1.00 0.00 H new ATOM 0 HB THR A 42 6.599 -9.015 -0.945 1.00 0.00 H new ATOM 0 HG1 THR A 42 6.363 -7.786 -2.705 1.00 0.00 H new ATOM 0 HG21 THR A 42 4.702 -7.867 0.138 1.00 0.00 H new ATOM 0 HG22 THR A 42 6.021 -8.188 1.289 1.00 0.00 H new ATOM 0 HG23 THR A 42 5.790 -6.549 0.636 1.00 0.00 H new ATOM 614 N ASP A 43 8.451 -5.273 -0.993 1.00 0.00 N ATOM 615 CA ASP A 43 8.553 -3.838 -0.755 1.00 0.00 C ATOM 616 C ASP A 43 8.125 -3.051 -1.990 1.00 0.00 C ATOM 617 O ASP A 43 8.170 -3.560 -3.110 1.00 0.00 O ATOM 618 CB ASP A 43 9.985 -3.464 -0.368 1.00 0.00 C ATOM 619 CG ASP A 43 10.958 -3.632 -1.518 1.00 0.00 C ATOM 620 OD1 ASP A 43 10.818 -4.615 -2.276 1.00 0.00 O ATOM 621 OD2 ASP A 43 11.860 -2.780 -1.660 1.00 0.00 O ATOM 0 H ASP A 43 8.589 -5.550 -1.965 1.00 0.00 H new ATOM 0 HA ASP A 43 7.884 -3.582 0.067 1.00 0.00 H new ATOM 0 HB2 ASP A 43 10.007 -2.430 -0.025 1.00 0.00 H new ATOM 0 HB3 ASP A 43 10.306 -4.084 0.469 1.00 0.00 H new ATOM 626 N PHE A 44 7.708 -1.807 -1.777 1.00 0.00 N ATOM 627 CA PHE A 44 7.269 -0.950 -2.872 1.00 0.00 C ATOM 628 C PHE A 44 8.094 0.333 -2.923 1.00 0.00 C ATOM 629 O PHE A 44 8.933 0.580 -2.056 1.00 0.00 O ATOM 630 CB PHE A 44 5.785 -0.611 -2.719 1.00 0.00 C ATOM 631 CG PHE A 44 5.459 0.080 -1.426 1.00 0.00 C ATOM 632 CD1 PHE A 44 5.580 1.456 -1.310 1.00 0.00 C ATOM 633 CD2 PHE A 44 5.032 -0.646 -0.326 1.00 0.00 C ATOM 634 CE1 PHE A 44 5.280 2.095 -0.122 1.00 0.00 C ATOM 635 CE2 PHE A 44 4.730 -0.012 0.865 1.00 0.00 C ATOM 636 CZ PHE A 44 4.855 1.360 0.967 1.00 0.00 C ATOM 0 H PHE A 44 7.665 -1.370 -0.856 1.00 0.00 H new ATOM 0 HA PHE A 44 7.416 -1.492 -3.806 1.00 0.00 H new ATOM 0 HB2 PHE A 44 5.478 0.025 -3.549 1.00 0.00 H new ATOM 0 HB3 PHE A 44 5.202 -1.529 -2.788 1.00 0.00 H new ATOM 0 HD1 PHE A 44 5.913 2.036 -2.158 1.00 0.00 H new ATOM 0 HD2 PHE A 44 4.934 -1.719 -0.400 1.00 0.00 H new ATOM 0 HE1 PHE A 44 5.378 3.168 -0.045 1.00 0.00 H new ATOM 0 HE2 PHE A 44 4.397 -0.589 1.715 1.00 0.00 H new ATOM 0 HZ PHE A 44 4.621 1.857 1.897 1.00 0.00 H new ATOM 646 N THR A 45 7.849 1.147 -3.945 1.00 0.00 N ATOM 647 CA THR A 45 8.569 2.403 -4.111 1.00 0.00 C ATOM 648 C THR A 45 7.604 3.578 -4.231 1.00 0.00 C ATOM 649 O THR A 45 6.642 3.528 -4.997 1.00 0.00 O ATOM 650 CB THR A 45 9.477 2.371 -5.354 1.00 0.00 C ATOM 651 OG1 THR A 45 10.322 1.215 -5.314 1.00 0.00 O ATOM 652 CG2 THR A 45 10.331 3.627 -5.434 1.00 0.00 C ATOM 0 H THR A 45 7.157 0.959 -4.670 1.00 0.00 H new ATOM 0 HA THR A 45 9.187 2.532 -3.222 1.00 0.00 H new ATOM 0 HB THR A 45 8.842 2.326 -6.239 1.00 0.00 H new ATOM 0 HG1 THR A 45 10.895 1.201 -6.109 1.00 0.00 H new ATOM 0 HG21 THR A 45 10.964 3.581 -6.320 1.00 0.00 H new ATOM 0 HG22 THR A 45 9.685 4.503 -5.494 1.00 0.00 H new ATOM 0 HG23 THR A 45 10.957 3.699 -4.545 1.00 0.00 H new ATOM 660 N VAL A 46 7.868 4.634 -3.468 1.00 0.00 N ATOM 661 CA VAL A 46 7.023 5.823 -3.490 1.00 0.00 C ATOM 662 C VAL A 46 7.715 6.975 -4.210 1.00 0.00 C ATOM 663 O VAL A 46 8.564 7.658 -3.636 1.00 0.00 O ATOM 664 CB VAL A 46 6.649 6.272 -2.065 1.00 0.00 C ATOM 665 CG1 VAL A 46 5.780 7.520 -2.110 1.00 0.00 C ATOM 666 CG2 VAL A 46 5.946 5.148 -1.320 1.00 0.00 C ATOM 0 H VAL A 46 8.660 4.691 -2.827 1.00 0.00 H new ATOM 0 HA VAL A 46 6.114 5.556 -4.029 1.00 0.00 H new ATOM 0 HB VAL A 46 7.565 6.516 -1.526 1.00 0.00 H new ATOM 0 HG11 VAL A 46 5.525 7.823 -1.094 1.00 0.00 H new ATOM 0 HG12 VAL A 46 6.325 8.325 -2.603 1.00 0.00 H new ATOM 0 HG13 VAL A 46 4.866 7.307 -2.665 1.00 0.00 H new ATOM 0 HG21 VAL A 46 5.689 5.483 -0.315 1.00 0.00 H new ATOM 0 HG22 VAL A 46 5.037 4.871 -1.854 1.00 0.00 H new ATOM 0 HG23 VAL A 46 6.608 4.284 -1.257 1.00 0.00 H new ATOM 676 N ASP A 47 7.347 7.186 -5.468 1.00 0.00 N ATOM 677 CA ASP A 47 7.931 8.257 -6.267 1.00 0.00 C ATOM 678 C ASP A 47 7.124 9.544 -6.124 1.00 0.00 C ATOM 679 O ASP A 47 5.924 9.570 -6.399 1.00 0.00 O ATOM 680 CB ASP A 47 8.001 7.846 -7.738 1.00 0.00 C ATOM 681 CG ASP A 47 9.172 8.480 -8.462 1.00 0.00 C ATOM 682 OD1 ASP A 47 9.535 9.623 -8.115 1.00 0.00 O ATOM 683 OD2 ASP A 47 9.726 7.834 -9.376 1.00 0.00 O ATOM 0 H ASP A 47 6.646 6.629 -5.957 1.00 0.00 H new ATOM 0 HA ASP A 47 8.941 8.440 -5.901 1.00 0.00 H new ATOM 0 HB2 ASP A 47 8.080 6.761 -7.805 1.00 0.00 H new ATOM 0 HB3 ASP A 47 7.074 8.129 -8.236 1.00 0.00 H new ATOM 688 N SER A 48 7.790 10.609 -5.690 1.00 0.00 N ATOM 689 CA SER A 48 7.134 11.898 -5.505 1.00 0.00 C ATOM 690 C SER A 48 7.868 12.996 -6.269 1.00 0.00 C ATOM 691 O SER A 48 9.079 13.165 -6.123 1.00 0.00 O ATOM 692 CB SER A 48 7.067 12.252 -4.018 1.00 0.00 C ATOM 693 OG SER A 48 6.680 11.130 -3.244 1.00 0.00 O ATOM 0 H SER A 48 8.784 10.605 -5.460 1.00 0.00 H new ATOM 0 HA SER A 48 6.120 11.821 -5.898 1.00 0.00 H new ATOM 0 HB2 SER A 48 8.040 12.611 -3.682 1.00 0.00 H new ATOM 0 HB3 SER A 48 6.357 13.065 -3.866 1.00 0.00 H new ATOM 0 HG SER A 48 6.946 11.269 -2.311 1.00 0.00 H new ATOM 699 N ARG A 49 7.126 13.739 -7.083 1.00 0.00 N ATOM 700 CA ARG A 49 7.706 14.821 -7.871 1.00 0.00 C ATOM 701 C ARG A 49 7.554 16.158 -7.153 1.00 0.00 C ATOM 702 O ARG A 49 8.531 16.785 -6.742 1.00 0.00 O ATOM 703 CB ARG A 49 7.041 14.890 -9.247 1.00 0.00 C ATOM 704 CG ARG A 49 7.020 16.288 -9.843 1.00 0.00 C ATOM 705 CD ARG A 49 6.193 16.337 -11.119 1.00 0.00 C ATOM 706 NE ARG A 49 6.680 17.353 -12.048 1.00 0.00 N ATOM 707 CZ ARG A 49 7.666 17.144 -12.914 1.00 0.00 C ATOM 708 NH1 ARG A 49 8.265 15.963 -12.969 1.00 0.00 N ATOM 709 NH2 ARG A 49 8.053 18.118 -13.727 1.00 0.00 N ATOM 0 H ARG A 49 6.122 13.612 -7.215 1.00 0.00 H new ATOM 0 HA ARG A 49 8.769 14.616 -7.998 1.00 0.00 H new ATOM 0 HB2 ARG A 49 7.566 14.221 -9.929 1.00 0.00 H new ATOM 0 HB3 ARG A 49 6.018 14.523 -9.166 1.00 0.00 H new ATOM 0 HG2 ARG A 49 6.611 16.989 -9.115 1.00 0.00 H new ATOM 0 HG3 ARG A 49 8.040 16.609 -10.056 1.00 0.00 H new ATOM 0 HD2 ARG A 49 6.217 15.361 -11.604 1.00 0.00 H new ATOM 0 HD3 ARG A 49 5.152 16.543 -10.869 1.00 0.00 H new ATOM 0 HE ARG A 49 6.240 18.273 -12.031 1.00 0.00 H new ATOM 0 HH11 ARG A 49 7.969 15.212 -12.346 1.00 0.00 H new ATOM 0 HH12 ARG A 49 9.022 15.805 -13.635 1.00 0.00 H new ATOM 0 HH21 ARG A 49 7.594 19.028 -13.688 1.00 0.00 H new ATOM 0 HH22 ARG A 49 8.810 17.957 -14.392 1.00 0.00 H new ATOM 723 N PRO A 50 6.300 16.608 -6.998 1.00 0.00 N ATOM 724 CA PRO A 50 5.990 17.876 -6.330 1.00 0.00 C ATOM 725 C PRO A 50 6.260 17.821 -4.830 1.00 0.00 C ATOM 726 O PRO A 50 5.876 18.725 -4.086 1.00 0.00 O ATOM 727 CB PRO A 50 4.494 18.062 -6.597 1.00 0.00 C ATOM 728 CG PRO A 50 3.973 16.682 -6.808 1.00 0.00 C ATOM 729 CD PRO A 50 5.087 15.914 -7.463 1.00 0.00 C ATOM 0 HA PRO A 50 6.608 18.694 -6.701 1.00 0.00 H new ATOM 0 HB2 PRO A 50 3.999 18.548 -5.756 1.00 0.00 H new ATOM 0 HB3 PRO A 50 4.323 18.688 -7.473 1.00 0.00 H new ATOM 0 HG2 PRO A 50 3.687 16.224 -5.861 1.00 0.00 H new ATOM 0 HG3 PRO A 50 3.084 16.693 -7.438 1.00 0.00 H new ATOM 0 HD2 PRO A 50 5.083 14.866 -7.162 1.00 0.00 H new ATOM 0 HD3 PRO A 50 5.004 15.934 -8.550 1.00 0.00 H new ATOM 737 N LEU A 51 6.924 16.757 -4.391 1.00 0.00 N ATOM 738 CA LEU A 51 7.247 16.585 -2.979 1.00 0.00 C ATOM 739 C LEU A 51 8.751 16.686 -2.748 1.00 0.00 C ATOM 740 O LEU A 51 9.212 17.477 -1.925 1.00 0.00 O ATOM 741 CB LEU A 51 6.731 15.235 -2.479 1.00 0.00 C ATOM 742 CG LEU A 51 5.277 14.904 -2.817 1.00 0.00 C ATOM 743 CD1 LEU A 51 4.811 13.687 -2.033 1.00 0.00 C ATOM 744 CD2 LEU A 51 4.379 16.099 -2.535 1.00 0.00 C ATOM 0 H LEU A 51 7.249 16.000 -4.993 1.00 0.00 H new ATOM 0 HA LEU A 51 6.759 17.383 -2.420 1.00 0.00 H new ATOM 0 HB2 LEU A 51 7.366 14.451 -2.891 1.00 0.00 H new ATOM 0 HB3 LEU A 51 6.847 15.203 -1.396 1.00 0.00 H new ATOM 0 HG LEU A 51 5.215 14.671 -3.880 1.00 0.00 H new ATOM 0 HD11 LEU A 51 3.774 13.466 -2.286 1.00 0.00 H new ATOM 0 HD12 LEU A 51 5.436 12.831 -2.285 1.00 0.00 H new ATOM 0 HD13 LEU A 51 4.888 13.891 -0.965 1.00 0.00 H new ATOM 0 HD21 LEU A 51 3.348 15.845 -2.781 1.00 0.00 H new ATOM 0 HD22 LEU A 51 4.446 16.363 -1.480 1.00 0.00 H new ATOM 0 HD23 LEU A 51 4.699 16.946 -3.142 1.00 0.00 H new ATOM 756 N THR A 52 9.513 15.880 -3.482 1.00 0.00 N ATOM 757 CA THR A 52 10.965 15.879 -3.358 1.00 0.00 C ATOM 758 C THR A 52 11.604 14.956 -4.388 1.00 0.00 C ATOM 759 O THR A 52 11.072 13.888 -4.691 1.00 0.00 O ATOM 760 CB THR A 52 11.408 15.443 -1.949 1.00 0.00 C ATOM 761 OG1 THR A 52 12.829 15.564 -1.823 1.00 0.00 O ATOM 762 CG2 THR A 52 10.990 14.007 -1.671 1.00 0.00 C ATOM 0 H THR A 52 9.148 15.220 -4.168 1.00 0.00 H new ATOM 0 HA THR A 52 11.298 16.902 -3.535 1.00 0.00 H new ATOM 0 HB THR A 52 10.922 16.094 -1.222 1.00 0.00 H new ATOM 0 HG1 THR A 52 13.144 14.983 -1.099 1.00 0.00 H new ATOM 0 HG21 THR A 52 11.314 13.721 -0.670 1.00 0.00 H new ATOM 0 HG22 THR A 52 9.905 13.924 -1.739 1.00 0.00 H new ATOM 0 HG23 THR A 52 11.451 13.345 -2.404 1.00 0.00 H new ATOM 770 N GLN A 53 12.746 15.373 -4.923 1.00 0.00 N ATOM 771 CA GLN A 53 13.457 14.582 -5.920 1.00 0.00 C ATOM 772 C GLN A 53 14.880 14.278 -5.461 1.00 0.00 C ATOM 773 O GLN A 53 15.723 13.859 -6.254 1.00 0.00 O ATOM 774 CB GLN A 53 13.487 15.319 -7.260 1.00 0.00 C ATOM 775 CG GLN A 53 12.159 15.294 -7.998 1.00 0.00 C ATOM 776 CD GLN A 53 11.030 15.900 -7.188 1.00 0.00 C ATOM 777 OE1 GLN A 53 10.271 15.187 -6.530 1.00 0.00 O ATOM 778 NE2 GLN A 53 10.912 17.222 -7.231 1.00 0.00 N ATOM 0 H GLN A 53 13.199 16.255 -4.683 1.00 0.00 H new ATOM 0 HA GLN A 53 12.926 13.638 -6.044 1.00 0.00 H new ATOM 0 HB2 GLN A 53 13.778 16.355 -7.089 1.00 0.00 H new ATOM 0 HB3 GLN A 53 14.254 14.873 -7.893 1.00 0.00 H new ATOM 0 HG2 GLN A 53 12.259 15.837 -8.937 1.00 0.00 H new ATOM 0 HG3 GLN A 53 11.908 14.264 -8.251 1.00 0.00 H new ATOM 0 HE21 GLN A 53 11.563 17.774 -7.789 1.00 0.00 H new ATOM 0 HE22 GLN A 53 10.170 17.685 -6.706 1.00 0.00 H new ATOM 787 N VAL A 54 15.140 14.494 -4.175 1.00 0.00 N ATOM 788 CA VAL A 54 16.461 14.242 -3.610 1.00 0.00 C ATOM 789 C VAL A 54 16.381 13.268 -2.441 1.00 0.00 C ATOM 790 O VAL A 54 17.380 12.661 -2.056 1.00 0.00 O ATOM 791 CB VAL A 54 17.124 15.548 -3.133 1.00 0.00 C ATOM 792 CG1 VAL A 54 17.428 16.456 -4.314 1.00 0.00 C ATOM 793 CG2 VAL A 54 16.237 16.256 -2.119 1.00 0.00 C ATOM 0 H VAL A 54 14.454 14.843 -3.505 1.00 0.00 H new ATOM 0 HA VAL A 54 17.068 13.804 -4.403 1.00 0.00 H new ATOM 0 HB VAL A 54 18.067 15.299 -2.646 1.00 0.00 H new ATOM 0 HG11 VAL A 54 17.896 17.373 -3.957 1.00 0.00 H new ATOM 0 HG12 VAL A 54 18.105 15.947 -5.000 1.00 0.00 H new ATOM 0 HG13 VAL A 54 16.501 16.700 -4.833 1.00 0.00 H new ATOM 0 HG21 VAL A 54 16.721 17.177 -1.793 1.00 0.00 H new ATOM 0 HG22 VAL A 54 15.277 16.493 -2.578 1.00 0.00 H new ATOM 0 HG23 VAL A 54 16.077 15.606 -1.259 1.00 0.00 H new ATOM 803 N GLY A 55 15.185 13.122 -1.879 1.00 0.00 N ATOM 804 CA GLY A 55 14.997 12.219 -0.758 1.00 0.00 C ATOM 805 C GLY A 55 14.251 12.868 0.390 1.00 0.00 C ATOM 806 O GLY A 55 13.788 14.002 0.277 1.00 0.00 O ATOM 0 H GLY A 55 14.343 13.613 -2.180 1.00 0.00 H new ATOM 0 HA2 GLY A 55 14.448 11.339 -1.093 1.00 0.00 H new ATOM 0 HA3 GLY A 55 15.969 11.874 -0.406 1.00 0.00 H new ATOM 810 N GLY A 56 14.132 12.145 1.500 1.00 0.00 N ATOM 811 CA GLY A 56 13.433 12.673 2.658 1.00 0.00 C ATOM 812 C GLY A 56 13.114 11.601 3.681 1.00 0.00 C ATOM 813 O GLY A 56 13.277 10.410 3.414 1.00 0.00 O ATOM 0 H GLY A 56 14.507 11.204 1.618 1.00 0.00 H new ATOM 0 HA2 GLY A 56 14.043 13.447 3.125 1.00 0.00 H new ATOM 0 HA3 GLY A 56 12.507 13.149 2.334 1.00 0.00 H new ATOM 817 N ASP A 57 12.659 12.023 4.855 1.00 0.00 N ATOM 818 CA ASP A 57 12.316 11.091 5.922 1.00 0.00 C ATOM 819 C ASP A 57 10.982 11.464 6.562 1.00 0.00 C ATOM 820 O ASP A 57 10.828 11.402 7.783 1.00 0.00 O ATOM 821 CB ASP A 57 13.417 11.070 6.984 1.00 0.00 C ATOM 822 CG ASP A 57 13.223 9.960 7.997 1.00 0.00 C ATOM 823 OD1 ASP A 57 12.878 8.833 7.584 1.00 0.00 O ATOM 824 OD2 ASP A 57 13.417 10.217 9.204 1.00 0.00 O ATOM 0 H ASP A 57 12.519 13.005 5.092 1.00 0.00 H new ATOM 0 HA ASP A 57 12.224 10.096 5.486 1.00 0.00 H new ATOM 0 HB2 ASP A 57 14.385 10.949 6.497 1.00 0.00 H new ATOM 0 HB3 ASP A 57 13.438 12.030 7.500 1.00 0.00 H new ATOM 829 N HIS A 58 10.020 11.852 5.731 1.00 0.00 N ATOM 830 CA HIS A 58 8.699 12.235 6.215 1.00 0.00 C ATOM 831 C HIS A 58 7.638 11.248 5.739 1.00 0.00 C ATOM 832 O HIS A 58 6.484 11.619 5.522 1.00 0.00 O ATOM 833 CB HIS A 58 8.349 13.646 5.742 1.00 0.00 C ATOM 834 CG HIS A 58 8.833 14.724 6.663 1.00 0.00 C ATOM 835 ND1 HIS A 58 8.283 15.988 6.696 1.00 0.00 N ATOM 836 CD2 HIS A 58 9.820 14.720 7.589 1.00 0.00 C ATOM 837 CE1 HIS A 58 8.912 16.716 7.601 1.00 0.00 C ATOM 838 NE2 HIS A 58 9.849 15.970 8.158 1.00 0.00 N ATOM 0 H HIS A 58 10.131 11.909 4.719 1.00 0.00 H new ATOM 0 HA HIS A 58 8.720 12.220 7.305 1.00 0.00 H new ATOM 0 HB2 HIS A 58 8.778 13.805 4.753 1.00 0.00 H new ATOM 0 HB3 HIS A 58 7.267 13.727 5.638 1.00 0.00 H new ATOM 0 HD2 HIS A 58 10.465 13.889 7.835 1.00 0.00 H new ATOM 0 HE1 HIS A 58 8.697 17.746 7.844 1.00 0.00 H new ATOM 0 HE2 HIS A 58 10.490 16.273 8.891 1.00 0.00 H new ATOM 846 N ILE A 59 8.036 9.991 5.578 1.00 0.00 N ATOM 847 CA ILE A 59 7.119 8.951 5.128 1.00 0.00 C ATOM 848 C ILE A 59 6.861 7.930 6.231 1.00 0.00 C ATOM 849 O ILE A 59 7.771 7.555 6.970 1.00 0.00 O ATOM 850 CB ILE A 59 7.662 8.221 3.885 1.00 0.00 C ATOM 851 CG1 ILE A 59 7.793 9.194 2.712 1.00 0.00 C ATOM 852 CG2 ILE A 59 6.755 7.056 3.517 1.00 0.00 C ATOM 853 CD1 ILE A 59 6.513 9.934 2.395 1.00 0.00 C ATOM 0 H ILE A 59 8.988 9.668 5.752 1.00 0.00 H new ATOM 0 HA ILE A 59 6.183 9.446 4.869 1.00 0.00 H new ATOM 0 HB ILE A 59 8.651 7.826 4.116 1.00 0.00 H new ATOM 0 HG12 ILE A 59 8.576 9.918 2.937 1.00 0.00 H new ATOM 0 HG13 ILE A 59 8.113 8.643 1.828 1.00 0.00 H new ATOM 0 HG21 ILE A 59 7.152 6.550 2.637 1.00 0.00 H new ATOM 0 HG22 ILE A 59 6.709 6.354 4.349 1.00 0.00 H new ATOM 0 HG23 ILE A 59 5.754 7.429 3.301 1.00 0.00 H new ATOM 0 HD11 ILE A 59 6.680 10.606 1.553 1.00 0.00 H new ATOM 0 HD12 ILE A 59 5.733 9.218 2.138 1.00 0.00 H new ATOM 0 HD13 ILE A 59 6.202 10.513 3.265 1.00 0.00 H new ATOM 865 N LYS A 60 5.614 7.484 6.336 1.00 0.00 N ATOM 866 CA LYS A 60 5.234 6.503 7.346 1.00 0.00 C ATOM 867 C LYS A 60 4.129 5.588 6.828 1.00 0.00 C ATOM 868 O LYS A 60 3.239 6.025 6.099 1.00 0.00 O ATOM 869 CB LYS A 60 4.770 7.209 8.622 1.00 0.00 C ATOM 870 CG LYS A 60 4.933 6.369 9.876 1.00 0.00 C ATOM 871 CD LYS A 60 3.693 5.535 10.154 1.00 0.00 C ATOM 872 CE LYS A 60 3.800 4.804 11.483 1.00 0.00 C ATOM 873 NZ LYS A 60 4.735 3.647 11.407 1.00 0.00 N ATOM 0 H LYS A 60 4.849 7.786 5.734 1.00 0.00 H new ATOM 0 HA LYS A 60 6.109 5.894 7.572 1.00 0.00 H new ATOM 0 HB2 LYS A 60 5.333 8.135 8.740 1.00 0.00 H new ATOM 0 HB3 LYS A 60 3.721 7.485 8.514 1.00 0.00 H new ATOM 0 HG2 LYS A 60 5.797 5.713 9.766 1.00 0.00 H new ATOM 0 HG3 LYS A 60 5.133 7.020 10.727 1.00 0.00 H new ATOM 0 HD2 LYS A 60 2.814 6.179 10.162 1.00 0.00 H new ATOM 0 HD3 LYS A 60 3.551 4.812 9.350 1.00 0.00 H new ATOM 0 HE2 LYS A 60 4.142 5.497 12.252 1.00 0.00 H new ATOM 0 HE3 LYS A 60 2.813 4.454 11.785 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 4.653 3.077 12.273 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 4.495 3.060 10.583 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 5.711 3.995 11.312 1.00 0.00 H new ATOM 887 N ALA A 61 4.192 4.317 7.211 1.00 0.00 N ATOM 888 CA ALA A 61 3.195 3.341 6.788 1.00 0.00 C ATOM 889 C ALA A 61 2.819 2.408 7.933 1.00 0.00 C ATOM 890 O ALA A 61 3.578 2.247 8.890 1.00 0.00 O ATOM 891 CB ALA A 61 3.710 2.541 5.600 1.00 0.00 C ATOM 0 H ALA A 61 4.923 3.939 7.814 1.00 0.00 H new ATOM 0 HA ALA A 61 2.298 3.882 6.486 1.00 0.00 H new ATOM 0 HB1 ALA A 61 2.955 1.816 5.295 1.00 0.00 H new ATOM 0 HB2 ALA A 61 3.921 3.216 4.771 1.00 0.00 H new ATOM 0 HB3 ALA A 61 4.623 2.017 5.883 1.00 0.00 H new ATOM 897 N HIS A 62 1.644 1.796 7.831 1.00 0.00 N ATOM 898 CA HIS A 62 1.167 0.879 8.860 1.00 0.00 C ATOM 899 C HIS A 62 0.219 -0.159 8.266 1.00 0.00 C ATOM 900 O HIS A 62 -0.905 0.162 7.880 1.00 0.00 O ATOM 901 CB HIS A 62 0.461 1.652 9.975 1.00 0.00 C ATOM 902 CG HIS A 62 0.289 0.861 11.235 1.00 0.00 C ATOM 903 ND1 HIS A 62 0.985 1.130 12.394 1.00 0.00 N ATOM 904 CD2 HIS A 62 -0.509 -0.197 11.514 1.00 0.00 C ATOM 905 CE1 HIS A 62 0.625 0.272 13.331 1.00 0.00 C ATOM 906 NE2 HIS A 62 -0.281 -0.544 12.823 1.00 0.00 N ATOM 0 H HIS A 62 1.004 1.918 7.046 1.00 0.00 H new ATOM 0 HA HIS A 62 2.030 0.361 9.278 1.00 0.00 H new ATOM 0 HB2 HIS A 62 1.030 2.555 10.197 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -0.519 1.972 9.620 1.00 0.00 H new ATOM 0 HD2 HIS A 62 -1.196 -0.678 10.834 1.00 0.00 H new ATOM 0 HE1 HIS A 62 1.006 0.242 14.341 1.00 0.00 H new ATOM 0 HE2 HIS A 62 -0.737 -1.308 13.322 1.00 0.00 H new ATOM 914 N ILE A 63 0.682 -1.403 8.194 1.00 0.00 N ATOM 915 CA ILE A 63 -0.125 -2.486 7.647 1.00 0.00 C ATOM 916 C ILE A 63 -1.106 -3.020 8.686 1.00 0.00 C ATOM 917 O ILE A 63 -0.796 -3.077 9.875 1.00 0.00 O ATOM 918 CB ILE A 63 0.756 -3.646 7.146 1.00 0.00 C ATOM 919 CG1 ILE A 63 1.688 -3.163 6.033 1.00 0.00 C ATOM 920 CG2 ILE A 63 -0.111 -4.797 6.657 1.00 0.00 C ATOM 921 CD1 ILE A 63 2.978 -3.948 5.942 1.00 0.00 C ATOM 0 H ILE A 63 1.611 -1.685 8.507 1.00 0.00 H new ATOM 0 HA ILE A 63 -0.680 -2.072 6.806 1.00 0.00 H new ATOM 0 HB ILE A 63 1.366 -4.004 7.975 1.00 0.00 H new ATOM 0 HG12 ILE A 63 1.165 -3.227 5.079 1.00 0.00 H new ATOM 0 HG13 ILE A 63 1.923 -2.111 6.198 1.00 0.00 H new ATOM 0 HG21 ILE A 63 0.526 -5.609 6.306 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -0.737 -5.154 7.475 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -0.744 -4.453 5.839 1.00 0.00 H new ATOM 0 HD11 ILE A 63 3.589 -3.551 5.132 1.00 0.00 H new ATOM 0 HD12 ILE A 63 3.523 -3.863 6.882 1.00 0.00 H new ATOM 0 HD13 ILE A 63 2.753 -4.996 5.746 1.00 0.00 H new ATOM 933 N ALA A 64 -2.290 -3.411 8.227 1.00 0.00 N ATOM 934 CA ALA A 64 -3.315 -3.944 9.116 1.00 0.00 C ATOM 935 C ALA A 64 -3.859 -5.270 8.594 1.00 0.00 C ATOM 936 O ALA A 64 -4.527 -5.315 7.563 1.00 0.00 O ATOM 937 CB ALA A 64 -4.444 -2.938 9.282 1.00 0.00 C ATOM 0 H ALA A 64 -2.563 -3.369 7.245 1.00 0.00 H new ATOM 0 HA ALA A 64 -2.858 -4.126 10.089 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -5.202 -3.349 9.948 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -4.049 -2.015 9.707 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -4.890 -2.728 8.310 1.00 0.00 H new ATOM 943 N ASN A 65 -3.566 -6.348 9.314 1.00 0.00 N ATOM 944 CA ASN A 65 -4.024 -7.676 8.923 1.00 0.00 C ATOM 945 C ASN A 65 -5.546 -7.768 8.991 1.00 0.00 C ATOM 946 O ASN A 65 -6.202 -7.058 9.753 1.00 0.00 O ATOM 947 CB ASN A 65 -3.397 -8.742 9.824 1.00 0.00 C ATOM 948 CG ASN A 65 -1.916 -8.928 9.555 1.00 0.00 C ATOM 949 OD1 ASN A 65 -1.396 -8.467 8.538 1.00 0.00 O ATOM 950 ND2 ASN A 65 -1.230 -9.606 10.468 1.00 0.00 N ATOM 0 H ASN A 65 -3.014 -6.328 10.171 1.00 0.00 H new ATOM 0 HA ASN A 65 -3.712 -7.852 7.894 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -3.542 -8.463 10.868 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -3.913 -9.690 9.673 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -0.230 -9.763 10.342 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -1.703 -9.970 11.295 1.00 0.00 H new ATOM 957 N PRO A 66 -6.121 -8.665 8.176 1.00 0.00 N ATOM 958 CA PRO A 66 -7.572 -8.873 8.126 1.00 0.00 C ATOM 959 C PRO A 66 -8.107 -9.534 9.392 1.00 0.00 C ATOM 960 O PRO A 66 -9.312 -9.742 9.532 1.00 0.00 O ATOM 961 CB PRO A 66 -7.756 -9.798 6.921 1.00 0.00 C ATOM 962 CG PRO A 66 -6.457 -10.517 6.793 1.00 0.00 C ATOM 963 CD PRO A 66 -5.400 -9.546 7.242 1.00 0.00 C ATOM 0 HA PRO A 66 -8.116 -7.932 8.045 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -8.580 -10.494 7.079 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -7.985 -9.231 6.018 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -6.447 -11.417 7.408 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -6.285 -10.832 5.764 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -4.568 -10.054 7.730 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -4.984 -8.988 6.403 1.00 0.00 H new ATOM 971 N SER A 67 -7.204 -9.860 10.310 1.00 0.00 N ATOM 972 CA SER A 67 -7.585 -10.500 11.564 1.00 0.00 C ATOM 973 C SER A 67 -7.531 -9.507 12.720 1.00 0.00 C ATOM 974 O SER A 67 -8.234 -9.660 13.718 1.00 0.00 O ATOM 975 CB SER A 67 -6.667 -11.689 11.854 1.00 0.00 C ATOM 976 OG SER A 67 -7.116 -12.855 11.186 1.00 0.00 O ATOM 0 H SER A 67 -6.203 -9.692 10.210 1.00 0.00 H new ATOM 0 HA SER A 67 -8.610 -10.858 11.464 1.00 0.00 H new ATOM 0 HB2 SER A 67 -5.651 -11.453 11.538 1.00 0.00 H new ATOM 0 HB3 SER A 67 -6.632 -11.872 12.928 1.00 0.00 H new ATOM 0 HG SER A 67 -6.512 -13.600 11.386 1.00 0.00 H new ATOM 982 N GLY A 68 -6.690 -8.487 12.577 1.00 0.00 N ATOM 983 CA GLY A 68 -6.558 -7.482 13.616 1.00 0.00 C ATOM 984 C GLY A 68 -5.111 -7.146 13.917 1.00 0.00 C ATOM 985 O GLY A 68 -4.806 -6.050 14.387 1.00 0.00 O ATOM 0 H GLY A 68 -6.098 -8.339 11.760 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -7.082 -6.577 13.310 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -7.042 -7.838 14.525 1.00 0.00 H new ATOM 989 N ALA A 69 -4.217 -8.091 13.646 1.00 0.00 N ATOM 990 CA ALA A 69 -2.794 -7.889 13.891 1.00 0.00 C ATOM 991 C ALA A 69 -2.203 -6.890 12.901 1.00 0.00 C ATOM 992 O ALA A 69 -2.872 -6.467 11.958 1.00 0.00 O ATOM 993 CB ALA A 69 -2.051 -9.215 13.812 1.00 0.00 C ATOM 0 H ALA A 69 -4.453 -9.004 13.257 1.00 0.00 H new ATOM 0 HA ALA A 69 -2.678 -7.479 14.894 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -0.990 -9.049 13.997 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -2.447 -9.899 14.562 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -2.183 -9.648 12.820 1.00 0.00 H new ATOM 999 N SER A 70 -0.947 -6.517 13.123 1.00 0.00 N ATOM 1000 CA SER A 70 -0.268 -5.564 12.253 1.00 0.00 C ATOM 1001 C SER A 70 1.178 -5.984 12.011 1.00 0.00 C ATOM 1002 O SER A 70 1.866 -6.443 12.924 1.00 0.00 O ATOM 1003 CB SER A 70 -0.308 -4.163 12.867 1.00 0.00 C ATOM 1004 OG SER A 70 -1.628 -3.807 13.240 1.00 0.00 O ATOM 0 H SER A 70 -0.379 -6.860 13.898 1.00 0.00 H new ATOM 0 HA SER A 70 -0.789 -5.549 11.296 1.00 0.00 H new ATOM 0 HB2 SER A 70 0.342 -4.127 13.741 1.00 0.00 H new ATOM 0 HB3 SER A 70 0.079 -3.438 12.151 1.00 0.00 H new ATOM 0 HG SER A 70 -1.598 -3.082 13.899 1.00 0.00 H new ATOM 1010 N THR A 71 1.635 -5.824 10.773 1.00 0.00 N ATOM 1011 CA THR A 71 2.998 -6.188 10.408 1.00 0.00 C ATOM 1012 C THR A 71 3.933 -4.987 10.507 1.00 0.00 C ATOM 1013 O THR A 71 3.520 -3.849 10.288 1.00 0.00 O ATOM 1014 CB THR A 71 3.065 -6.759 8.979 1.00 0.00 C ATOM 1015 OG1 THR A 71 2.102 -7.809 8.826 1.00 0.00 O ATOM 1016 CG2 THR A 71 4.456 -7.292 8.673 1.00 0.00 C ATOM 0 H THR A 71 1.080 -5.444 10.006 1.00 0.00 H new ATOM 0 HA THR A 71 3.319 -6.955 11.113 1.00 0.00 H new ATOM 0 HB THR A 71 2.840 -5.954 8.279 1.00 0.00 H new ATOM 0 HG1 THR A 71 2.282 -8.516 9.480 1.00 0.00 H new ATOM 0 HG21 THR A 71 4.478 -7.690 7.658 1.00 0.00 H new ATOM 0 HG22 THR A 71 5.183 -6.485 8.762 1.00 0.00 H new ATOM 0 HG23 THR A 71 4.705 -8.084 9.379 1.00 0.00 H new ATOM 1024 N GLU A 72 5.193 -5.250 10.836 1.00 0.00 N ATOM 1025 CA GLU A 72 6.186 -4.189 10.964 1.00 0.00 C ATOM 1026 C GLU A 72 6.680 -3.739 9.592 1.00 0.00 C ATOM 1027 O GLU A 72 7.072 -4.559 8.761 1.00 0.00 O ATOM 1028 CB GLU A 72 7.367 -4.664 11.812 1.00 0.00 C ATOM 1029 CG GLU A 72 8.128 -3.533 12.483 1.00 0.00 C ATOM 1030 CD GLU A 72 8.971 -4.009 13.651 1.00 0.00 C ATOM 1031 OE1 GLU A 72 8.404 -4.625 14.578 1.00 0.00 O ATOM 1032 OE2 GLU A 72 10.195 -3.766 13.638 1.00 0.00 O ATOM 0 H GLU A 72 5.551 -6.188 11.019 1.00 0.00 H new ATOM 0 HA GLU A 72 5.712 -3.341 11.458 1.00 0.00 H new ATOM 0 HB2 GLU A 72 7.002 -5.349 12.577 1.00 0.00 H new ATOM 0 HB3 GLU A 72 8.053 -5.228 11.180 1.00 0.00 H new ATOM 0 HG2 GLU A 72 8.772 -3.048 11.749 1.00 0.00 H new ATOM 0 HG3 GLU A 72 7.420 -2.781 12.833 1.00 0.00 H new ATOM 1039 N CYS A 73 6.657 -2.431 9.362 1.00 0.00 N ATOM 1040 CA CYS A 73 7.101 -1.870 8.091 1.00 0.00 C ATOM 1041 C CYS A 73 8.484 -1.242 8.227 1.00 0.00 C ATOM 1042 O CYS A 73 8.835 -0.709 9.280 1.00 0.00 O ATOM 1043 CB CYS A 73 6.101 -0.826 7.593 1.00 0.00 C ATOM 1044 SG CYS A 73 5.861 0.565 8.722 1.00 0.00 S ATOM 0 H CYS A 73 6.336 -1.739 10.039 1.00 0.00 H new ATOM 0 HA CYS A 73 7.160 -2.681 7.365 1.00 0.00 H new ATOM 0 HB2 CYS A 73 6.440 -0.444 6.630 1.00 0.00 H new ATOM 0 HB3 CYS A 73 5.140 -1.311 7.423 1.00 0.00 H new ATOM 0 HG CYS A 73 4.631 0.980 8.645 1.00 0.00 H new ATOM 1050 N PHE A 74 9.267 -1.310 7.155 1.00 0.00 N ATOM 1051 CA PHE A 74 10.614 -0.751 7.156 1.00 0.00 C ATOM 1052 C PHE A 74 10.763 0.310 6.069 1.00 0.00 C ATOM 1053 O PHE A 74 10.946 -0.010 4.895 1.00 0.00 O ATOM 1054 CB PHE A 74 11.649 -1.858 6.949 1.00 0.00 C ATOM 1055 CG PHE A 74 11.284 -3.153 7.616 1.00 0.00 C ATOM 1056 CD1 PHE A 74 10.876 -3.175 8.940 1.00 0.00 C ATOM 1057 CD2 PHE A 74 11.347 -4.349 6.918 1.00 0.00 C ATOM 1058 CE1 PHE A 74 10.540 -4.366 9.556 1.00 0.00 C ATOM 1059 CE2 PHE A 74 11.011 -5.543 7.529 1.00 0.00 C ATOM 1060 CZ PHE A 74 10.606 -5.551 8.850 1.00 0.00 C ATOM 0 H PHE A 74 8.992 -1.746 6.275 1.00 0.00 H new ATOM 0 HA PHE A 74 10.784 -0.281 8.124 1.00 0.00 H new ATOM 0 HB2 PHE A 74 11.774 -2.032 5.880 1.00 0.00 H new ATOM 0 HB3 PHE A 74 12.612 -1.520 7.332 1.00 0.00 H new ATOM 0 HD1 PHE A 74 10.820 -2.251 9.497 1.00 0.00 H new ATOM 0 HD2 PHE A 74 11.662 -4.348 5.885 1.00 0.00 H new ATOM 0 HE1 PHE A 74 10.226 -4.370 10.589 1.00 0.00 H new ATOM 0 HE2 PHE A 74 11.065 -6.468 6.974 1.00 0.00 H new ATOM 0 HZ PHE A 74 10.342 -6.482 9.329 1.00 0.00 H new ATOM 1070 N VAL A 75 10.682 1.575 6.470 1.00 0.00 N ATOM 1071 CA VAL A 75 10.808 2.683 5.532 1.00 0.00 C ATOM 1072 C VAL A 75 12.272 3.000 5.248 1.00 0.00 C ATOM 1073 O VAL A 75 13.064 3.206 6.169 1.00 0.00 O ATOM 1074 CB VAL A 75 10.113 3.951 6.064 1.00 0.00 C ATOM 1075 CG1 VAL A 75 10.269 5.100 5.079 1.00 0.00 C ATOM 1076 CG2 VAL A 75 8.644 3.675 6.345 1.00 0.00 C ATOM 0 H VAL A 75 10.530 1.857 7.438 1.00 0.00 H new ATOM 0 HA VAL A 75 10.321 2.372 4.608 1.00 0.00 H new ATOM 0 HB VAL A 75 10.591 4.240 7.000 1.00 0.00 H new ATOM 0 HG11 VAL A 75 9.772 5.987 5.472 1.00 0.00 H new ATOM 0 HG12 VAL A 75 11.328 5.313 4.933 1.00 0.00 H new ATOM 0 HG13 VAL A 75 9.819 4.825 4.125 1.00 0.00 H new ATOM 0 HG21 VAL A 75 8.169 4.581 6.720 1.00 0.00 H new ATOM 0 HG22 VAL A 75 8.151 3.360 5.425 1.00 0.00 H new ATOM 0 HG23 VAL A 75 8.558 2.885 7.091 1.00 0.00 H new ATOM 1086 N THR A 76 12.626 3.039 3.968 1.00 0.00 N ATOM 1087 CA THR A 76 13.995 3.330 3.562 1.00 0.00 C ATOM 1088 C THR A 76 14.032 4.408 2.484 1.00 0.00 C ATOM 1089 O THR A 76 13.370 4.290 1.453 1.00 0.00 O ATOM 1090 CB THR A 76 14.706 2.069 3.036 1.00 0.00 C ATOM 1091 OG1 THR A 76 14.653 1.030 4.020 1.00 0.00 O ATOM 1092 CG2 THR A 76 16.155 2.371 2.686 1.00 0.00 C ATOM 0 H THR A 76 11.983 2.873 3.194 1.00 0.00 H new ATOM 0 HA THR A 76 14.517 3.689 4.449 1.00 0.00 H new ATOM 0 HB THR A 76 14.192 1.739 2.133 1.00 0.00 H new ATOM 0 HG1 THR A 76 15.106 0.231 3.677 1.00 0.00 H new ATOM 0 HG21 THR A 76 16.636 1.465 2.317 1.00 0.00 H new ATOM 0 HG22 THR A 76 16.190 3.141 1.915 1.00 0.00 H new ATOM 0 HG23 THR A 76 16.678 2.723 3.575 1.00 0.00 H new ATOM 1100 N ASP A 77 14.810 5.456 2.729 1.00 0.00 N ATOM 1101 CA ASP A 77 14.935 6.555 1.778 1.00 0.00 C ATOM 1102 C ASP A 77 16.134 6.344 0.859 1.00 0.00 C ATOM 1103 O ASP A 77 17.271 6.247 1.318 1.00 0.00 O ATOM 1104 CB ASP A 77 15.071 7.886 2.518 1.00 0.00 C ATOM 1105 CG ASP A 77 15.601 8.992 1.627 1.00 0.00 C ATOM 1106 OD1 ASP A 77 15.007 9.226 0.554 1.00 0.00 O ATOM 1107 OD2 ASP A 77 16.610 9.625 2.004 1.00 0.00 O ATOM 0 H ASP A 77 15.364 5.568 3.578 1.00 0.00 H new ATOM 0 HA ASP A 77 14.032 6.579 1.168 1.00 0.00 H new ATOM 0 HB2 ASP A 77 14.099 8.178 2.916 1.00 0.00 H new ATOM 0 HB3 ASP A 77 15.739 7.758 3.370 1.00 0.00 H new ATOM 1112 N ASN A 78 15.871 6.273 -0.442 1.00 0.00 N ATOM 1113 CA ASN A 78 16.929 6.072 -1.426 1.00 0.00 C ATOM 1114 C ASN A 78 17.655 7.382 -1.719 1.00 0.00 C ATOM 1115 O ASN A 78 18.442 7.470 -2.661 1.00 0.00 O ATOM 1116 CB ASN A 78 16.348 5.498 -2.720 1.00 0.00 C ATOM 1117 CG ASN A 78 15.849 4.076 -2.548 1.00 0.00 C ATOM 1118 OD1 ASN A 78 14.566 3.933 -2.238 1.00 0.00 O flip ATOM 1119 ND2 ASN A 78 16.609 3.118 -2.693 1.00 0.00 N flip ATOM 0 H ASN A 78 14.935 6.352 -0.839 1.00 0.00 H new ATOM 0 HA ASN A 78 17.647 5.364 -1.012 1.00 0.00 H new ATOM 0 HB2 ASN A 78 15.527 6.130 -3.058 1.00 0.00 H new ATOM 0 HB3 ASN A 78 17.110 5.521 -3.499 1.00 0.00 H new ATOM 0 HD21 ASN A 78 17.588 3.275 -2.931 1.00 0.00 H new ATOM 0 HD22 ASN A 78 16.259 2.167 -2.575 1.00 0.00 H new ATOM 1126 N ALA A 79 17.385 8.397 -0.904 1.00 0.00 N ATOM 1127 CA ALA A 79 18.014 9.701 -1.074 1.00 0.00 C ATOM 1128 C ALA A 79 17.926 10.168 -2.523 1.00 0.00 C ATOM 1129 O ALA A 79 18.766 10.939 -2.989 1.00 0.00 O ATOM 1130 CB ALA A 79 19.466 9.649 -0.622 1.00 0.00 C ATOM 0 H ALA A 79 16.735 8.341 -0.120 1.00 0.00 H new ATOM 0 HA ALA A 79 17.477 10.420 -0.455 1.00 0.00 H new ATOM 0 HB1 ALA A 79 19.924 10.629 -0.754 1.00 0.00 H new ATOM 0 HB2 ALA A 79 19.510 9.367 0.430 1.00 0.00 H new ATOM 0 HB3 ALA A 79 20.006 8.913 -1.217 1.00 0.00 H new ATOM 1136 N ASP A 80 16.905 9.698 -3.230 1.00 0.00 N ATOM 1137 CA ASP A 80 16.706 10.069 -4.627 1.00 0.00 C ATOM 1138 C ASP A 80 15.326 10.683 -4.835 1.00 0.00 C ATOM 1139 O ASP A 80 14.857 10.813 -5.965 1.00 0.00 O ATOM 1140 CB ASP A 80 16.876 8.846 -5.530 1.00 0.00 C ATOM 1141 CG ASP A 80 17.214 9.225 -6.958 1.00 0.00 C ATOM 1142 OD1 ASP A 80 18.091 10.093 -7.151 1.00 0.00 O ATOM 1143 OD2 ASP A 80 16.603 8.651 -7.884 1.00 0.00 O ATOM 0 H ASP A 80 16.202 9.059 -2.859 1.00 0.00 H new ATOM 0 HA ASP A 80 17.458 10.813 -4.891 1.00 0.00 H new ATOM 0 HB2 ASP A 80 17.665 8.209 -5.130 1.00 0.00 H new ATOM 0 HB3 ASP A 80 15.957 8.260 -5.520 1.00 0.00 H new ATOM 1148 N GLY A 81 14.678 11.059 -3.736 1.00 0.00 N ATOM 1149 CA GLY A 81 13.358 11.654 -3.819 1.00 0.00 C ATOM 1150 C GLY A 81 12.250 10.626 -3.697 1.00 0.00 C ATOM 1151 O GLY A 81 11.067 10.967 -3.743 1.00 0.00 O ATOM 0 H GLY A 81 15.045 10.962 -2.789 1.00 0.00 H new ATOM 0 HA2 GLY A 81 13.248 12.398 -3.030 1.00 0.00 H new ATOM 0 HA3 GLY A 81 13.259 12.180 -4.769 1.00 0.00 H new ATOM 1155 N THR A 82 12.632 9.362 -3.542 1.00 0.00 N ATOM 1156 CA THR A 82 11.663 8.281 -3.416 1.00 0.00 C ATOM 1157 C THR A 82 11.840 7.535 -2.098 1.00 0.00 C ATOM 1158 O THR A 82 12.784 7.792 -1.350 1.00 0.00 O ATOM 1159 CB THR A 82 11.784 7.279 -4.580 1.00 0.00 C ATOM 1160 OG1 THR A 82 13.082 6.674 -4.572 1.00 0.00 O ATOM 1161 CG2 THR A 82 11.549 7.970 -5.914 1.00 0.00 C ATOM 0 H THR A 82 13.606 9.062 -3.501 1.00 0.00 H new ATOM 0 HA THR A 82 10.674 8.739 -3.442 1.00 0.00 H new ATOM 0 HB THR A 82 11.024 6.509 -4.449 1.00 0.00 H new ATOM 0 HG1 THR A 82 13.151 6.037 -5.314 1.00 0.00 H new ATOM 0 HG21 THR A 82 11.639 7.243 -6.721 1.00 0.00 H new ATOM 0 HG22 THR A 82 10.550 8.405 -5.927 1.00 0.00 H new ATOM 0 HG23 THR A 82 12.289 8.758 -6.051 1.00 0.00 H new ATOM 1169 N TYR A 83 10.928 6.611 -1.820 1.00 0.00 N ATOM 1170 CA TYR A 83 10.982 5.828 -0.591 1.00 0.00 C ATOM 1171 C TYR A 83 10.706 4.354 -0.870 1.00 0.00 C ATOM 1172 O TYR A 83 10.027 4.012 -1.838 1.00 0.00 O ATOM 1173 CB TYR A 83 9.972 6.364 0.425 1.00 0.00 C ATOM 1174 CG TYR A 83 9.979 7.871 0.549 1.00 0.00 C ATOM 1175 CD1 TYR A 83 9.236 8.662 -0.318 1.00 0.00 C ATOM 1176 CD2 TYR A 83 10.729 8.503 1.533 1.00 0.00 C ATOM 1177 CE1 TYR A 83 9.240 10.040 -0.209 1.00 0.00 C ATOM 1178 CE2 TYR A 83 10.737 9.879 1.651 1.00 0.00 C ATOM 1179 CZ TYR A 83 9.992 10.643 0.777 1.00 0.00 C ATOM 1180 OH TYR A 83 9.999 12.015 0.890 1.00 0.00 O ATOM 0 H TYR A 83 10.142 6.385 -2.429 1.00 0.00 H new ATOM 0 HA TYR A 83 11.986 5.918 -0.178 1.00 0.00 H new ATOM 0 HB2 TYR A 83 8.973 6.036 0.139 1.00 0.00 H new ATOM 0 HB3 TYR A 83 10.184 5.927 1.401 1.00 0.00 H new ATOM 0 HD1 TYR A 83 8.645 8.192 -1.090 1.00 0.00 H new ATOM 0 HD2 TYR A 83 11.316 7.908 2.217 1.00 0.00 H new ATOM 0 HE1 TYR A 83 8.658 10.641 -0.892 1.00 0.00 H new ATOM 0 HE2 TYR A 83 11.323 10.354 2.423 1.00 0.00 H new ATOM 0 HH TYR A 83 9.077 12.348 0.885 1.00 0.00 H new ATOM 1190 N GLN A 84 11.239 3.487 -0.016 1.00 0.00 N ATOM 1191 CA GLN A 84 11.051 2.049 -0.170 1.00 0.00 C ATOM 1192 C GLN A 84 10.633 1.410 1.150 1.00 0.00 C ATOM 1193 O GLN A 84 11.395 1.404 2.117 1.00 0.00 O ATOM 1194 CB GLN A 84 12.336 1.397 -0.683 1.00 0.00 C ATOM 1195 CG GLN A 84 12.133 -0.013 -1.213 1.00 0.00 C ATOM 1196 CD GLN A 84 11.789 -0.037 -2.690 1.00 0.00 C ATOM 1197 OE1 GLN A 84 10.828 -0.875 -3.060 1.00 0.00 O flip ATOM 1198 NE2 GLN A 84 12.380 0.689 -3.489 1.00 0.00 N flip ATOM 0 H GLN A 84 11.804 3.755 0.790 1.00 0.00 H new ATOM 0 HA GLN A 84 10.256 1.888 -0.898 1.00 0.00 H new ATOM 0 HB2 GLN A 84 12.757 2.017 -1.475 1.00 0.00 H new ATOM 0 HB3 GLN A 84 13.068 1.371 0.124 1.00 0.00 H new ATOM 0 HG2 GLN A 84 13.040 -0.594 -1.045 1.00 0.00 H new ATOM 0 HG3 GLN A 84 11.335 -0.497 -0.650 1.00 0.00 H new ATOM 0 HE21 GLN A 84 13.113 1.318 -3.161 1.00 0.00 H new ATOM 0 HE22 GLN A 84 12.137 0.661 -4.479 1.00 0.00 H new ATOM 1207 N VAL A 85 9.418 0.872 1.184 1.00 0.00 N ATOM 1208 CA VAL A 85 8.900 0.229 2.385 1.00 0.00 C ATOM 1209 C VAL A 85 8.855 -1.287 2.222 1.00 0.00 C ATOM 1210 O VAL A 85 8.102 -1.810 1.402 1.00 0.00 O ATOM 1211 CB VAL A 85 7.488 0.738 2.730 1.00 0.00 C ATOM 1212 CG1 VAL A 85 6.959 0.045 3.976 1.00 0.00 C ATOM 1213 CG2 VAL A 85 7.497 2.249 2.913 1.00 0.00 C ATOM 0 H VAL A 85 8.774 0.869 0.393 1.00 0.00 H new ATOM 0 HA VAL A 85 9.580 0.484 3.198 1.00 0.00 H new ATOM 0 HB VAL A 85 6.822 0.499 1.901 1.00 0.00 H new ATOM 0 HG11 VAL A 85 5.960 0.418 4.204 1.00 0.00 H new ATOM 0 HG12 VAL A 85 6.914 -1.030 3.803 1.00 0.00 H new ATOM 0 HG13 VAL A 85 7.623 0.250 4.816 1.00 0.00 H new ATOM 0 HG21 VAL A 85 6.491 2.592 3.156 1.00 0.00 H new ATOM 0 HG22 VAL A 85 8.177 2.513 3.723 1.00 0.00 H new ATOM 0 HG23 VAL A 85 7.830 2.725 1.991 1.00 0.00 H new ATOM 1223 N GLU A 86 9.668 -1.985 3.009 1.00 0.00 N ATOM 1224 CA GLU A 86 9.721 -3.441 2.951 1.00 0.00 C ATOM 1225 C GLU A 86 9.099 -4.058 4.200 1.00 0.00 C ATOM 1226 O GLU A 86 9.355 -3.613 5.319 1.00 0.00 O ATOM 1227 CB GLU A 86 11.168 -3.915 2.801 1.00 0.00 C ATOM 1228 CG GLU A 86 11.312 -5.427 2.764 1.00 0.00 C ATOM 1229 CD GLU A 86 12.761 -5.875 2.756 1.00 0.00 C ATOM 1230 OE1 GLU A 86 13.369 -5.933 3.846 1.00 0.00 O ATOM 1231 OE2 GLU A 86 13.287 -6.167 1.662 1.00 0.00 O ATOM 0 H GLU A 86 10.298 -1.566 3.693 1.00 0.00 H new ATOM 0 HA GLU A 86 9.148 -3.766 2.082 1.00 0.00 H new ATOM 0 HB2 GLU A 86 11.586 -3.496 1.885 1.00 0.00 H new ATOM 0 HB3 GLU A 86 11.758 -3.522 3.629 1.00 0.00 H new ATOM 0 HG2 GLU A 86 10.807 -5.858 3.629 1.00 0.00 H new ATOM 0 HG3 GLU A 86 10.811 -5.814 1.877 1.00 0.00 H new ATOM 1238 N TYR A 87 8.281 -5.086 4.001 1.00 0.00 N ATOM 1239 CA TYR A 87 7.619 -5.763 5.109 1.00 0.00 C ATOM 1240 C TYR A 87 7.378 -7.233 4.784 1.00 0.00 C ATOM 1241 O TYR A 87 7.319 -7.622 3.617 1.00 0.00 O ATOM 1242 CB TYR A 87 6.292 -5.076 5.435 1.00 0.00 C ATOM 1243 CG TYR A 87 5.210 -5.334 4.411 1.00 0.00 C ATOM 1244 CD1 TYR A 87 5.053 -4.497 3.312 1.00 0.00 C ATOM 1245 CD2 TYR A 87 4.344 -6.412 4.542 1.00 0.00 C ATOM 1246 CE1 TYR A 87 4.065 -4.728 2.374 1.00 0.00 C ATOM 1247 CE2 TYR A 87 3.355 -6.652 3.608 1.00 0.00 C ATOM 1248 CZ TYR A 87 3.219 -5.807 2.526 1.00 0.00 C ATOM 1249 OH TYR A 87 2.234 -6.041 1.594 1.00 0.00 O ATOM 0 H TYR A 87 8.061 -5.469 3.081 1.00 0.00 H new ATOM 0 HA TYR A 87 8.273 -5.705 5.979 1.00 0.00 H new ATOM 0 HB2 TYR A 87 5.946 -5.417 6.411 1.00 0.00 H new ATOM 0 HB3 TYR A 87 6.458 -4.002 5.513 1.00 0.00 H new ATOM 0 HD1 TYR A 87 5.714 -3.652 3.189 1.00 0.00 H new ATOM 0 HD2 TYR A 87 4.446 -7.074 5.389 1.00 0.00 H new ATOM 0 HE1 TYR A 87 3.956 -4.067 1.527 1.00 0.00 H new ATOM 0 HE2 TYR A 87 2.692 -7.496 3.724 1.00 0.00 H new ATOM 0 HH TYR A 87 2.338 -5.418 0.845 1.00 0.00 H new ATOM 1259 N THR A 88 7.237 -8.048 5.825 1.00 0.00 N ATOM 1260 CA THR A 88 7.002 -9.476 5.651 1.00 0.00 C ATOM 1261 C THR A 88 5.699 -9.904 6.316 1.00 0.00 C ATOM 1262 O THR A 88 5.623 -10.078 7.533 1.00 0.00 O ATOM 1263 CB THR A 88 8.160 -10.310 6.233 1.00 0.00 C ATOM 1264 OG1 THR A 88 9.415 -9.721 5.878 1.00 0.00 O ATOM 1265 CG2 THR A 88 8.104 -11.742 5.722 1.00 0.00 C ATOM 0 H THR A 88 7.282 -7.743 6.797 1.00 0.00 H new ATOM 0 HA THR A 88 6.936 -9.657 4.578 1.00 0.00 H new ATOM 0 HB THR A 88 8.060 -10.323 7.318 1.00 0.00 H new ATOM 0 HG1 THR A 88 10.145 -10.256 6.253 1.00 0.00 H new ATOM 0 HG21 THR A 88 8.931 -12.312 6.146 1.00 0.00 H new ATOM 0 HG22 THR A 88 7.159 -12.198 6.019 1.00 0.00 H new ATOM 0 HG23 THR A 88 8.182 -11.744 4.635 1.00 0.00 H new ATOM 1273 N PRO A 89 4.648 -10.078 5.502 1.00 0.00 N ATOM 1274 CA PRO A 89 3.328 -10.488 5.989 1.00 0.00 C ATOM 1275 C PRO A 89 3.314 -11.933 6.477 1.00 0.00 C ATOM 1276 O PRO A 89 3.645 -12.854 5.730 1.00 0.00 O ATOM 1277 CB PRO A 89 2.430 -10.330 4.760 1.00 0.00 C ATOM 1278 CG PRO A 89 3.352 -10.467 3.598 1.00 0.00 C ATOM 1279 CD PRO A 89 4.667 -9.887 4.042 1.00 0.00 C ATOM 0 HA PRO A 89 3.008 -9.895 6.846 1.00 0.00 H new ATOM 0 HB2 PRO A 89 1.650 -11.091 4.739 1.00 0.00 H new ATOM 0 HB3 PRO A 89 1.930 -9.361 4.757 1.00 0.00 H new ATOM 0 HG2 PRO A 89 3.464 -11.512 3.310 1.00 0.00 H new ATOM 0 HG3 PRO A 89 2.965 -9.936 2.728 1.00 0.00 H new ATOM 0 HD2 PRO A 89 5.510 -10.402 3.580 1.00 0.00 H new ATOM 0 HD3 PRO A 89 4.752 -8.834 3.776 1.00 0.00 H new ATOM 1287 N PHE A 90 2.928 -12.125 7.734 1.00 0.00 N ATOM 1288 CA PHE A 90 2.871 -13.458 8.321 1.00 0.00 C ATOM 1289 C PHE A 90 1.453 -14.019 8.262 1.00 0.00 C ATOM 1290 O PHE A 90 1.106 -14.936 9.006 1.00 0.00 O ATOM 1291 CB PHE A 90 3.357 -13.421 9.772 1.00 0.00 C ATOM 1292 CG PHE A 90 2.900 -12.206 10.526 1.00 0.00 C ATOM 1293 CD1 PHE A 90 1.642 -12.166 11.106 1.00 0.00 C ATOM 1294 CD2 PHE A 90 3.728 -11.102 10.655 1.00 0.00 C ATOM 1295 CE1 PHE A 90 1.218 -11.049 11.801 1.00 0.00 C ATOM 1296 CE2 PHE A 90 3.309 -9.982 11.349 1.00 0.00 C ATOM 1297 CZ PHE A 90 2.053 -9.956 11.922 1.00 0.00 C ATOM 0 H PHE A 90 2.650 -11.374 8.366 1.00 0.00 H new ATOM 0 HA PHE A 90 3.525 -14.110 7.742 1.00 0.00 H new ATOM 0 HB2 PHE A 90 3.003 -14.313 10.288 1.00 0.00 H new ATOM 0 HB3 PHE A 90 4.446 -13.457 9.783 1.00 0.00 H new ATOM 0 HD1 PHE A 90 0.985 -13.018 11.014 1.00 0.00 H new ATOM 0 HD2 PHE A 90 4.711 -11.117 10.209 1.00 0.00 H new ATOM 0 HE1 PHE A 90 0.235 -11.031 12.249 1.00 0.00 H new ATOM 0 HE2 PHE A 90 3.964 -9.128 11.443 1.00 0.00 H new ATOM 0 HZ PHE A 90 1.724 -9.082 12.464 1.00 0.00 H new ATOM 1307 N GLU A 91 0.638 -13.459 7.374 1.00 0.00 N ATOM 1308 CA GLU A 91 -0.743 -13.901 7.219 1.00 0.00 C ATOM 1309 C GLU A 91 -1.208 -13.737 5.775 1.00 0.00 C ATOM 1310 O GLU A 91 -1.011 -12.687 5.163 1.00 0.00 O ATOM 1311 CB GLU A 91 -1.662 -13.115 8.156 1.00 0.00 C ATOM 1312 CG GLU A 91 -1.768 -13.713 9.548 1.00 0.00 C ATOM 1313 CD GLU A 91 -2.950 -13.170 10.328 1.00 0.00 C ATOM 1314 OE1 GLU A 91 -2.927 -11.974 10.684 1.00 0.00 O ATOM 1315 OE2 GLU A 91 -3.897 -13.943 10.582 1.00 0.00 O ATOM 0 H GLU A 91 0.910 -12.699 6.751 1.00 0.00 H new ATOM 0 HA GLU A 91 -0.791 -14.958 7.479 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -1.295 -12.092 8.236 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -2.658 -13.063 7.715 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -1.857 -14.796 9.468 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -0.850 -13.508 10.098 1.00 0.00 H new ATOM 1322 N LYS A 92 -1.827 -14.782 5.236 1.00 0.00 N ATOM 1323 CA LYS A 92 -2.322 -14.755 3.865 1.00 0.00 C ATOM 1324 C LYS A 92 -3.719 -14.146 3.803 1.00 0.00 C ATOM 1325 O LYS A 92 -4.717 -14.833 4.016 1.00 0.00 O ATOM 1326 CB LYS A 92 -2.344 -16.170 3.281 1.00 0.00 C ATOM 1327 CG LYS A 92 -2.865 -17.219 4.249 1.00 0.00 C ATOM 1328 CD LYS A 92 -3.064 -18.560 3.563 1.00 0.00 C ATOM 1329 CE LYS A 92 -4.190 -19.354 4.208 1.00 0.00 C ATOM 1330 NZ LYS A 92 -3.905 -19.659 5.638 1.00 0.00 N ATOM 0 H LYS A 92 -1.998 -15.659 5.728 1.00 0.00 H new ATOM 0 HA LYS A 92 -1.648 -14.135 3.274 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -2.964 -16.175 2.385 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -1.335 -16.442 2.972 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -2.164 -17.333 5.076 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -3.810 -16.884 4.676 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -3.287 -18.401 2.508 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -2.139 -19.135 3.610 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -5.120 -18.790 4.135 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -4.338 -20.285 3.661 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -4.636 -20.299 6.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -2.973 -20.114 5.717 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -3.907 -18.776 6.188 1.00 0.00 H new ATOM 1344 N GLY A 93 -3.782 -12.851 3.508 1.00 0.00 N ATOM 1345 CA GLY A 93 -5.062 -12.172 3.421 1.00 0.00 C ATOM 1346 C GLY A 93 -4.930 -10.749 2.916 1.00 0.00 C ATOM 1347 O GLY A 93 -3.866 -10.345 2.445 1.00 0.00 O ATOM 0 H GLY A 93 -2.970 -12.260 3.328 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -5.722 -12.730 2.757 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -5.533 -12.163 4.404 1.00 0.00 H new ATOM 1351 N LEU A 94 -6.013 -9.986 3.012 1.00 0.00 N ATOM 1352 CA LEU A 94 -6.015 -8.599 2.560 1.00 0.00 C ATOM 1353 C LEU A 94 -5.799 -7.644 3.729 1.00 0.00 C ATOM 1354 O LEU A 94 -6.624 -7.565 4.640 1.00 0.00 O ATOM 1355 CB LEU A 94 -7.334 -8.273 1.857 1.00 0.00 C ATOM 1356 CG LEU A 94 -7.609 -6.791 1.600 1.00 0.00 C ATOM 1357 CD1 LEU A 94 -6.589 -6.220 0.627 1.00 0.00 C ATOM 1358 CD2 LEU A 94 -9.022 -6.595 1.070 1.00 0.00 C ATOM 0 H LEU A 94 -6.901 -10.304 3.399 1.00 0.00 H new ATOM 0 HA LEU A 94 -5.193 -8.472 1.855 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -7.352 -8.796 0.901 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -8.151 -8.675 2.456 1.00 0.00 H new ATOM 0 HG LEU A 94 -7.519 -6.255 2.545 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -6.800 -5.164 0.456 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -5.588 -6.326 1.045 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -6.646 -6.759 -0.318 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -9.200 -5.534 0.893 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -9.140 -7.144 0.136 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -9.740 -6.966 1.802 1.00 0.00 H new ATOM 1370 N HIS A 95 -4.686 -6.918 3.696 1.00 0.00 N ATOM 1371 CA HIS A 95 -4.363 -5.966 4.753 1.00 0.00 C ATOM 1372 C HIS A 95 -4.630 -4.535 4.294 1.00 0.00 C ATOM 1373 O HIS A 95 -4.679 -4.255 3.096 1.00 0.00 O ATOM 1374 CB HIS A 95 -2.900 -6.115 5.173 1.00 0.00 C ATOM 1375 CG HIS A 95 -2.350 -7.489 4.948 1.00 0.00 C ATOM 1376 ND1 HIS A 95 -3.020 -8.637 5.312 1.00 0.00 N ATOM 1377 CD2 HIS A 95 -1.185 -7.896 4.390 1.00 0.00 C ATOM 1378 CE1 HIS A 95 -2.291 -9.691 4.990 1.00 0.00 C ATOM 1379 NE2 HIS A 95 -1.173 -9.268 4.428 1.00 0.00 N ATOM 0 H HIS A 95 -3.993 -6.971 2.949 1.00 0.00 H new ATOM 0 HA HIS A 95 -5.002 -6.180 5.610 1.00 0.00 H new ATOM 0 HB2 HIS A 95 -2.296 -5.396 4.619 1.00 0.00 H new ATOM 0 HB3 HIS A 95 -2.806 -5.863 6.229 1.00 0.00 H new ATOM 0 HD2 HIS A 95 -0.410 -7.260 3.990 1.00 0.00 H new ATOM 0 HE1 HIS A 95 -2.563 -10.723 5.158 1.00 0.00 H new ATOM 0 HE2 HIS A 95 -0.423 -9.864 4.079 1.00 0.00 H new ATOM 1387 N VAL A 96 -4.802 -3.633 5.255 1.00 0.00 N ATOM 1388 CA VAL A 96 -5.064 -2.232 4.951 1.00 0.00 C ATOM 1389 C VAL A 96 -3.870 -1.357 5.319 1.00 0.00 C ATOM 1390 O VAL A 96 -3.585 -1.141 6.497 1.00 0.00 O ATOM 1391 CB VAL A 96 -6.311 -1.719 5.695 1.00 0.00 C ATOM 1392 CG1 VAL A 96 -6.540 -0.244 5.400 1.00 0.00 C ATOM 1393 CG2 VAL A 96 -7.532 -2.543 5.318 1.00 0.00 C ATOM 0 H VAL A 96 -4.764 -3.848 6.251 1.00 0.00 H new ATOM 0 HA VAL A 96 -5.240 -2.169 3.877 1.00 0.00 H new ATOM 0 HB VAL A 96 -6.144 -1.828 6.767 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -7.425 0.101 5.934 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -5.673 0.331 5.725 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -6.686 -0.106 4.329 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -8.404 -2.167 5.853 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -7.704 -2.468 4.244 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -7.364 -3.586 5.586 1.00 0.00 H new ATOM 1403 N VAL A 97 -3.175 -0.856 4.302 1.00 0.00 N ATOM 1404 CA VAL A 97 -2.013 -0.003 4.518 1.00 0.00 C ATOM 1405 C VAL A 97 -2.400 1.471 4.489 1.00 0.00 C ATOM 1406 O VAL A 97 -2.972 1.953 3.512 1.00 0.00 O ATOM 1407 CB VAL A 97 -0.925 -0.258 3.458 1.00 0.00 C ATOM 1408 CG1 VAL A 97 0.207 0.748 3.601 1.00 0.00 C ATOM 1409 CG2 VAL A 97 -0.400 -1.682 3.566 1.00 0.00 C ATOM 0 H VAL A 97 -3.397 -1.026 3.321 1.00 0.00 H new ATOM 0 HA VAL A 97 -1.616 -0.252 5.502 1.00 0.00 H new ATOM 0 HB VAL A 97 -1.368 -0.132 2.470 1.00 0.00 H new ATOM 0 HG11 VAL A 97 0.966 0.552 2.844 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -0.184 1.757 3.470 1.00 0.00 H new ATOM 0 HG13 VAL A 97 0.651 0.657 4.592 1.00 0.00 H new ATOM 0 HG21 VAL A 97 0.368 -1.845 2.810 1.00 0.00 H new ATOM 0 HG22 VAL A 97 0.027 -1.838 4.557 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -1.219 -2.384 3.409 1.00 0.00 H new ATOM 1419 N GLU A 98 -2.083 2.183 5.566 1.00 0.00 N ATOM 1420 CA GLU A 98 -2.399 3.603 5.663 1.00 0.00 C ATOM 1421 C GLU A 98 -1.133 4.449 5.565 1.00 0.00 C ATOM 1422 O GLU A 98 -0.282 4.421 6.454 1.00 0.00 O ATOM 1423 CB GLU A 98 -3.122 3.899 6.979 1.00 0.00 C ATOM 1424 CG GLU A 98 -4.598 3.542 6.956 1.00 0.00 C ATOM 1425 CD GLU A 98 -5.173 3.345 8.345 1.00 0.00 C ATOM 1426 OE1 GLU A 98 -4.687 2.448 9.066 1.00 0.00 O ATOM 1427 OE2 GLU A 98 -6.108 4.087 8.712 1.00 0.00 O ATOM 0 H GLU A 98 -1.608 1.800 6.383 1.00 0.00 H new ATOM 0 HA GLU A 98 -3.054 3.861 4.831 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -2.636 3.347 7.783 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -3.017 4.959 7.211 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -5.151 4.331 6.447 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -4.738 2.630 6.376 1.00 0.00 H new ATOM 1434 N VAL A 99 -1.015 5.202 4.475 1.00 0.00 N ATOM 1435 CA VAL A 99 0.146 6.057 4.259 1.00 0.00 C ATOM 1436 C VAL A 99 -0.190 7.519 4.530 1.00 0.00 C ATOM 1437 O VAL A 99 -1.307 7.970 4.273 1.00 0.00 O ATOM 1438 CB VAL A 99 0.682 5.924 2.821 1.00 0.00 C ATOM 1439 CG1 VAL A 99 1.912 6.796 2.626 1.00 0.00 C ATOM 1440 CG2 VAL A 99 0.993 4.469 2.502 1.00 0.00 C ATOM 0 H VAL A 99 -1.709 5.237 3.729 1.00 0.00 H new ATOM 0 HA VAL A 99 0.915 5.728 4.958 1.00 0.00 H new ATOM 0 HB VAL A 99 -0.089 6.267 2.131 1.00 0.00 H new ATOM 0 HG11 VAL A 99 2.276 6.688 1.604 1.00 0.00 H new ATOM 0 HG12 VAL A 99 1.652 7.838 2.811 1.00 0.00 H new ATOM 0 HG13 VAL A 99 2.691 6.487 3.323 1.00 0.00 H new ATOM 0 HG21 VAL A 99 1.371 4.393 1.482 1.00 0.00 H new ATOM 0 HG22 VAL A 99 1.746 4.097 3.197 1.00 0.00 H new ATOM 0 HG23 VAL A 99 0.085 3.873 2.598 1.00 0.00 H new ATOM 1450 N THR A 100 0.784 8.258 5.053 1.00 0.00 N ATOM 1451 CA THR A 100 0.592 9.670 5.360 1.00 0.00 C ATOM 1452 C THR A 100 1.877 10.460 5.141 1.00 0.00 C ATOM 1453 O THR A 100 2.909 10.165 5.743 1.00 0.00 O ATOM 1454 CB THR A 100 0.121 9.869 6.813 1.00 0.00 C ATOM 1455 OG1 THR A 100 0.989 9.166 7.710 1.00 0.00 O ATOM 1456 CG2 THR A 100 -1.307 9.378 6.991 1.00 0.00 C ATOM 0 H THR A 100 1.714 7.902 5.273 1.00 0.00 H new ATOM 0 HA THR A 100 -0.178 10.040 4.682 1.00 0.00 H new ATOM 0 HB THR A 100 0.152 10.935 7.039 1.00 0.00 H new ATOM 0 HG1 THR A 100 1.921 9.317 7.448 1.00 0.00 H new ATOM 0 HG21 THR A 100 -1.617 9.529 8.025 1.00 0.00 H new ATOM 0 HG22 THR A 100 -1.969 9.936 6.328 1.00 0.00 H new ATOM 0 HG23 THR A 100 -1.360 8.317 6.747 1.00 0.00 H new ATOM 1464 N TYR A 101 1.807 11.466 4.276 1.00 0.00 N ATOM 1465 CA TYR A 101 2.966 12.298 3.976 1.00 0.00 C ATOM 1466 C TYR A 101 2.846 13.662 4.649 1.00 0.00 C ATOM 1467 O TYR A 101 2.124 14.539 4.175 1.00 0.00 O ATOM 1468 CB TYR A 101 3.116 12.474 2.464 1.00 0.00 C ATOM 1469 CG TYR A 101 4.440 13.078 2.053 1.00 0.00 C ATOM 1470 CD1 TYR A 101 4.817 14.341 2.494 1.00 0.00 C ATOM 1471 CD2 TYR A 101 5.314 12.387 1.224 1.00 0.00 C ATOM 1472 CE1 TYR A 101 6.025 14.897 2.121 1.00 0.00 C ATOM 1473 CE2 TYR A 101 6.525 12.934 0.847 1.00 0.00 C ATOM 1474 CZ TYR A 101 6.876 14.190 1.298 1.00 0.00 C ATOM 1475 OH TYR A 101 8.081 14.739 0.923 1.00 0.00 O ATOM 0 H TYR A 101 0.960 11.725 3.770 1.00 0.00 H new ATOM 0 HA TYR A 101 3.852 11.797 4.366 1.00 0.00 H new ATOM 0 HB2 TYR A 101 3.003 11.503 1.981 1.00 0.00 H new ATOM 0 HB3 TYR A 101 2.308 13.108 2.099 1.00 0.00 H new ATOM 0 HD1 TYR A 101 4.154 14.897 3.140 1.00 0.00 H new ATOM 0 HD2 TYR A 101 5.042 11.404 0.868 1.00 0.00 H new ATOM 0 HE1 TYR A 101 6.302 15.880 2.472 1.00 0.00 H new ATOM 0 HE2 TYR A 101 7.193 12.382 0.203 1.00 0.00 H new ATOM 0 HH TYR A 101 8.401 15.338 1.629 1.00 0.00 H new ATOM 1485 N ASP A 102 3.560 13.832 5.756 1.00 0.00 N ATOM 1486 CA ASP A 102 3.537 15.089 6.495 1.00 0.00 C ATOM 1487 C ASP A 102 2.151 15.353 7.075 1.00 0.00 C ATOM 1488 O ASP A 102 1.590 16.435 6.901 1.00 0.00 O ATOM 1489 CB ASP A 102 3.952 16.247 5.587 1.00 0.00 C ATOM 1490 CG ASP A 102 4.240 17.517 6.363 1.00 0.00 C ATOM 1491 OD1 ASP A 102 3.833 17.598 7.541 1.00 0.00 O ATOM 1492 OD2 ASP A 102 4.873 18.430 5.793 1.00 0.00 O ATOM 0 H ASP A 102 4.162 13.115 6.162 1.00 0.00 H new ATOM 0 HA ASP A 102 4.247 15.011 7.318 1.00 0.00 H new ATOM 0 HB2 ASP A 102 4.839 15.961 5.021 1.00 0.00 H new ATOM 0 HB3 ASP A 102 3.160 16.439 4.863 1.00 0.00 H new ATOM 1497 N ASP A 103 1.603 14.357 7.763 1.00 0.00 N ATOM 1498 CA ASP A 103 0.282 14.481 8.368 1.00 0.00 C ATOM 1499 C ASP A 103 -0.789 14.678 7.300 1.00 0.00 C ATOM 1500 O ASP A 103 -1.826 15.292 7.552 1.00 0.00 O ATOM 1501 CB ASP A 103 0.258 15.649 9.355 1.00 0.00 C ATOM 1502 CG ASP A 103 1.416 15.607 10.332 1.00 0.00 C ATOM 1503 OD1 ASP A 103 1.288 14.929 11.373 1.00 0.00 O ATOM 1504 OD2 ASP A 103 2.450 16.251 10.056 1.00 0.00 O ATOM 0 H ASP A 103 2.053 13.455 7.916 1.00 0.00 H new ATOM 0 HA ASP A 103 0.067 13.557 8.905 1.00 0.00 H new ATOM 0 HB2 ASP A 103 0.287 16.588 8.802 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -0.681 15.634 9.908 1.00 0.00 H new ATOM 1509 N VAL A 104 -0.530 14.154 6.106 1.00 0.00 N ATOM 1510 CA VAL A 104 -1.471 14.272 4.999 1.00 0.00 C ATOM 1511 C VAL A 104 -1.538 12.980 4.194 1.00 0.00 C ATOM 1512 O VAL A 104 -0.567 12.560 3.564 1.00 0.00 O ATOM 1513 CB VAL A 104 -1.089 15.431 4.059 1.00 0.00 C ATOM 1514 CG1 VAL A 104 -2.045 15.497 2.877 1.00 0.00 C ATOM 1515 CG2 VAL A 104 -1.074 16.749 4.817 1.00 0.00 C ATOM 0 H VAL A 104 0.324 13.644 5.881 1.00 0.00 H new ATOM 0 HA VAL A 104 -2.449 14.475 5.435 1.00 0.00 H new ATOM 0 HB VAL A 104 -0.086 15.248 3.675 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -1.760 16.322 2.224 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -2.000 14.561 2.320 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -3.061 15.656 3.239 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -0.802 17.557 4.137 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -2.063 16.941 5.232 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -0.346 16.695 5.626 1.00 0.00 H new ATOM 1525 N PRO A 105 -2.712 12.331 4.212 1.00 0.00 N ATOM 1526 CA PRO A 105 -2.934 11.076 3.487 1.00 0.00 C ATOM 1527 C PRO A 105 -2.957 11.276 1.976 1.00 0.00 C ATOM 1528 O PRO A 105 -3.383 12.321 1.485 1.00 0.00 O ATOM 1529 CB PRO A 105 -4.307 10.617 3.986 1.00 0.00 C ATOM 1530 CG PRO A 105 -4.992 11.869 4.414 1.00 0.00 C ATOM 1531 CD PRO A 105 -3.913 12.773 4.941 1.00 0.00 C ATOM 0 HA PRO A 105 -2.136 10.355 3.666 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -4.865 10.110 3.199 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -4.213 9.914 4.814 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -5.515 12.333 3.578 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -5.738 11.663 5.182 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -4.137 13.822 4.747 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -3.791 12.667 6.019 1.00 0.00 H new ATOM 1539 N ILE A 106 -2.495 10.268 1.244 1.00 0.00 N ATOM 1540 CA ILE A 106 -2.464 10.333 -0.212 1.00 0.00 C ATOM 1541 C ILE A 106 -3.787 9.867 -0.811 1.00 0.00 C ATOM 1542 O ILE A 106 -4.518 9.072 -0.222 1.00 0.00 O ATOM 1543 CB ILE A 106 -1.322 9.476 -0.790 1.00 0.00 C ATOM 1544 CG1 ILE A 106 -1.451 8.027 -0.314 1.00 0.00 C ATOM 1545 CG2 ILE A 106 0.027 10.053 -0.388 1.00 0.00 C ATOM 1546 CD1 ILE A 106 -0.369 7.117 -0.851 1.00 0.00 C ATOM 0 H ILE A 106 -2.137 9.397 1.635 1.00 0.00 H new ATOM 0 HA ILE A 106 -2.294 11.376 -0.478 1.00 0.00 H new ATOM 0 HB ILE A 106 -1.392 9.489 -1.878 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -1.424 8.007 0.775 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -2.424 7.639 -0.616 1.00 0.00 H new ATOM 0 HG21 ILE A 106 0.825 9.437 -0.804 1.00 0.00 H new ATOM 0 HG22 ILE A 106 0.117 11.070 -0.771 1.00 0.00 H new ATOM 0 HG23 ILE A 106 0.108 10.066 0.699 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -0.523 6.106 -0.473 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -0.409 7.107 -1.940 1.00 0.00 H new ATOM 0 HD13 ILE A 106 0.606 7.481 -0.527 1.00 0.00 H new ATOM 1558 N PRO A 107 -4.102 10.373 -2.013 1.00 0.00 N ATOM 1559 CA PRO A 107 -5.337 10.021 -2.721 1.00 0.00 C ATOM 1560 C PRO A 107 -5.329 8.580 -3.220 1.00 0.00 C ATOM 1561 O PRO A 107 -6.257 8.143 -3.899 1.00 0.00 O ATOM 1562 CB PRO A 107 -5.359 10.996 -3.901 1.00 0.00 C ATOM 1563 CG PRO A 107 -3.930 11.348 -4.129 1.00 0.00 C ATOM 1564 CD PRO A 107 -3.277 11.326 -2.774 1.00 0.00 C ATOM 0 HA PRO A 107 -6.212 10.092 -2.075 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -5.799 10.537 -4.786 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -5.953 11.881 -3.672 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -3.455 10.635 -4.803 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -3.839 12.331 -4.590 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -2.239 11.000 -2.834 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -3.275 12.314 -2.313 1.00 0.00 H new ATOM 1572 N ASN A 108 -4.275 7.846 -2.878 1.00 0.00 N ATOM 1573 CA ASN A 108 -4.146 6.454 -3.292 1.00 0.00 C ATOM 1574 C ASN A 108 -4.437 5.511 -2.128 1.00 0.00 C ATOM 1575 O ASN A 108 -4.694 4.324 -2.327 1.00 0.00 O ATOM 1576 CB ASN A 108 -2.742 6.190 -3.838 1.00 0.00 C ATOM 1577 CG ASN A 108 -2.344 7.181 -4.915 1.00 0.00 C ATOM 1578 OD1 ASN A 108 -2.178 8.440 -4.528 1.00 0.00 O flip ATOM 1579 ND2 ASN A 108 -2.188 6.818 -6.081 1.00 0.00 N flip ATOM 0 H ASN A 108 -3.498 8.192 -2.315 1.00 0.00 H new ATOM 0 HA ASN A 108 -4.876 6.266 -4.080 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -2.022 6.238 -3.021 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -2.697 5.179 -4.244 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -2.326 5.839 -6.333 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -1.920 7.496 -6.795 1.00 0.00 H new ATOM 1586 N SER A 109 -4.395 6.049 -0.914 1.00 0.00 N ATOM 1587 CA SER A 109 -4.651 5.256 0.283 1.00 0.00 C ATOM 1588 C SER A 109 -6.073 5.479 0.789 1.00 0.00 C ATOM 1589 O SER A 109 -6.736 6.458 0.444 1.00 0.00 O ATOM 1590 CB SER A 109 -3.646 5.611 1.380 1.00 0.00 C ATOM 1591 OG SER A 109 -2.520 4.750 1.338 1.00 0.00 O ATOM 0 H SER A 109 -4.186 7.031 -0.733 1.00 0.00 H new ATOM 0 HA SER A 109 -4.538 4.204 0.023 1.00 0.00 H new ATOM 0 HB2 SER A 109 -3.322 6.645 1.260 1.00 0.00 H new ATOM 0 HB3 SER A 109 -4.127 5.539 2.356 1.00 0.00 H new ATOM 0 HG SER A 109 -2.342 4.489 0.410 1.00 0.00 H new ATOM 1597 N PRO A 110 -6.554 4.549 1.627 1.00 0.00 N ATOM 1598 CA PRO A 110 -5.775 3.380 2.044 1.00 0.00 C ATOM 1599 C PRO A 110 -5.566 2.386 0.907 1.00 0.00 C ATOM 1600 O PRO A 110 -6.295 2.401 -0.085 1.00 0.00 O ATOM 1601 CB PRO A 110 -6.634 2.757 3.148 1.00 0.00 C ATOM 1602 CG PRO A 110 -8.023 3.199 2.842 1.00 0.00 C ATOM 1603 CD PRO A 110 -7.897 4.568 2.232 1.00 0.00 C ATOM 0 HA PRO A 110 -4.771 3.654 2.369 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -6.555 1.670 3.145 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -6.319 3.097 4.134 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -8.510 2.508 2.153 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -8.631 3.229 3.746 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -8.671 4.749 1.486 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -7.988 5.353 2.983 1.00 0.00 H new ATOM 1611 N PHE A 111 -4.567 1.524 1.057 1.00 0.00 N ATOM 1612 CA PHE A 111 -4.262 0.523 0.041 1.00 0.00 C ATOM 1613 C PHE A 111 -4.808 -0.844 0.443 1.00 0.00 C ATOM 1614 O PHE A 111 -5.205 -1.054 1.589 1.00 0.00 O ATOM 1615 CB PHE A 111 -2.751 0.435 -0.182 1.00 0.00 C ATOM 1616 CG PHE A 111 -2.185 1.614 -0.921 1.00 0.00 C ATOM 1617 CD1 PHE A 111 -2.562 1.876 -2.228 1.00 0.00 C ATOM 1618 CD2 PHE A 111 -1.274 2.461 -0.308 1.00 0.00 C ATOM 1619 CE1 PHE A 111 -2.043 2.960 -2.911 1.00 0.00 C ATOM 1620 CE2 PHE A 111 -0.753 3.546 -0.986 1.00 0.00 C ATOM 1621 CZ PHE A 111 -1.137 3.796 -2.289 1.00 0.00 C ATOM 0 H PHE A 111 -3.954 1.498 1.872 1.00 0.00 H new ATOM 0 HA PHE A 111 -4.742 0.828 -0.889 1.00 0.00 H new ATOM 0 HB2 PHE A 111 -2.254 0.349 0.784 1.00 0.00 H new ATOM 0 HB3 PHE A 111 -2.526 -0.475 -0.739 1.00 0.00 H new ATOM 0 HD1 PHE A 111 -3.270 1.225 -2.719 1.00 0.00 H new ATOM 0 HD2 PHE A 111 -0.969 2.270 0.710 1.00 0.00 H new ATOM 0 HE1 PHE A 111 -2.346 3.153 -3.930 1.00 0.00 H new ATOM 0 HE2 PHE A 111 -0.045 4.199 -0.497 1.00 0.00 H new ATOM 0 HZ PHE A 111 -0.730 4.643 -2.820 1.00 0.00 H new ATOM 1631 N LYS A 112 -4.825 -1.771 -0.509 1.00 0.00 N ATOM 1632 CA LYS A 112 -5.320 -3.119 -0.256 1.00 0.00 C ATOM 1633 C LYS A 112 -4.384 -4.164 -0.854 1.00 0.00 C ATOM 1634 O LYS A 112 -4.310 -4.323 -2.072 1.00 0.00 O ATOM 1635 CB LYS A 112 -6.726 -3.285 -0.839 1.00 0.00 C ATOM 1636 CG LYS A 112 -7.833 -2.868 0.113 1.00 0.00 C ATOM 1637 CD LYS A 112 -9.091 -2.464 -0.637 1.00 0.00 C ATOM 1638 CE LYS A 112 -10.085 -1.766 0.278 1.00 0.00 C ATOM 1639 NZ LYS A 112 -10.965 -2.737 0.985 1.00 0.00 N ATOM 0 H LYS A 112 -4.501 -1.613 -1.463 1.00 0.00 H new ATOM 0 HA LYS A 112 -5.360 -3.268 0.823 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -6.803 -2.696 -1.753 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -6.873 -4.328 -1.119 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -8.061 -3.691 0.790 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -7.491 -2.035 0.727 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -8.827 -1.802 -1.462 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -9.555 -3.348 -1.074 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -9.545 -1.166 1.010 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -10.698 -1.080 -0.307 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -11.628 -2.222 1.599 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -11.500 -3.293 0.287 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -10.383 -3.376 1.564 1.00 0.00 H new ATOM 1653 N VAL A 113 -3.670 -4.877 0.013 1.00 0.00 N ATOM 1654 CA VAL A 113 -2.740 -5.909 -0.430 1.00 0.00 C ATOM 1655 C VAL A 113 -3.315 -7.302 -0.199 1.00 0.00 C ATOM 1656 O VAL A 113 -3.329 -7.800 0.926 1.00 0.00 O ATOM 1657 CB VAL A 113 -1.388 -5.796 0.300 1.00 0.00 C ATOM 1658 CG1 VAL A 113 -0.443 -6.898 -0.154 1.00 0.00 C ATOM 1659 CG2 VAL A 113 -0.771 -4.425 0.069 1.00 0.00 C ATOM 0 H VAL A 113 -3.718 -4.759 1.025 1.00 0.00 H new ATOM 0 HA VAL A 113 -2.582 -5.757 -1.498 1.00 0.00 H new ATOM 0 HB VAL A 113 -1.561 -5.916 1.370 1.00 0.00 H new ATOM 0 HG11 VAL A 113 0.507 -6.802 0.372 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -0.884 -7.870 0.067 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -0.273 -6.813 -1.227 1.00 0.00 H new ATOM 0 HG21 VAL A 113 0.183 -4.363 0.592 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -0.611 -4.273 -0.998 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -1.443 -3.655 0.448 1.00 0.00 H new ATOM 1669 N ALA A 114 -3.788 -7.926 -1.273 1.00 0.00 N ATOM 1670 CA ALA A 114 -4.362 -9.263 -1.188 1.00 0.00 C ATOM 1671 C ALA A 114 -3.292 -10.333 -1.377 1.00 0.00 C ATOM 1672 O ALA A 114 -2.920 -10.661 -2.503 1.00 0.00 O ATOM 1673 CB ALA A 114 -5.466 -9.430 -2.221 1.00 0.00 C ATOM 0 H ALA A 114 -3.785 -7.527 -2.212 1.00 0.00 H new ATOM 0 HA ALA A 114 -4.789 -9.385 -0.193 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -5.886 -10.433 -2.146 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -6.249 -8.694 -2.038 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -5.055 -9.282 -3.220 1.00 0.00 H new ATOM 1679 N VAL A 115 -2.800 -10.873 -0.266 1.00 0.00 N ATOM 1680 CA VAL A 115 -1.772 -11.907 -0.310 1.00 0.00 C ATOM 1681 C VAL A 115 -2.352 -13.239 -0.771 1.00 0.00 C ATOM 1682 O VAL A 115 -3.436 -13.639 -0.345 1.00 0.00 O ATOM 1683 CB VAL A 115 -1.109 -12.097 1.067 1.00 0.00 C ATOM 1684 CG1 VAL A 115 -0.101 -13.236 1.022 1.00 0.00 C ATOM 1685 CG2 VAL A 115 -0.446 -10.805 1.522 1.00 0.00 C ATOM 0 H VAL A 115 -3.096 -10.612 0.674 1.00 0.00 H new ATOM 0 HA VAL A 115 -1.019 -11.575 -1.025 1.00 0.00 H new ATOM 0 HB VAL A 115 -1.882 -12.356 1.790 1.00 0.00 H new ATOM 0 HG11 VAL A 115 0.357 -13.355 2.004 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -0.608 -14.160 0.743 1.00 0.00 H new ATOM 0 HG13 VAL A 115 0.671 -13.010 0.286 1.00 0.00 H new ATOM 0 HG21 VAL A 115 0.017 -10.958 2.497 1.00 0.00 H new ATOM 0 HG22 VAL A 115 0.316 -10.513 0.800 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -1.196 -10.018 1.596 1.00 0.00 H new ATOM 1695 N THR A 116 -1.622 -13.925 -1.645 1.00 0.00 N ATOM 1696 CA THR A 116 -2.063 -15.213 -2.165 1.00 0.00 C ATOM 1697 C THR A 116 -1.107 -16.328 -1.757 1.00 0.00 C ATOM 1698 O THR A 116 0.085 -16.094 -1.562 1.00 0.00 O ATOM 1699 CB THR A 116 -2.179 -15.189 -3.701 1.00 0.00 C ATOM 1700 OG1 THR A 116 -2.602 -16.470 -4.181 1.00 0.00 O ATOM 1701 CG2 THR A 116 -0.849 -14.817 -4.339 1.00 0.00 C ATOM 0 H THR A 116 -0.722 -13.610 -2.008 1.00 0.00 H new ATOM 0 HA THR A 116 -3.046 -15.406 -1.736 1.00 0.00 H new ATOM 0 HB THR A 116 -2.918 -14.437 -3.975 1.00 0.00 H new ATOM 0 HG1 THR A 116 -2.675 -16.446 -5.158 1.00 0.00 H new ATOM 0 HG21 THR A 116 -0.956 -14.807 -5.424 1.00 0.00 H new ATOM 0 HG22 THR A 116 -0.544 -13.829 -3.995 1.00 0.00 H new ATOM 0 HG23 THR A 116 -0.092 -15.549 -4.056 1.00 0.00 H new ATOM 1709 N GLU A 117 -1.638 -17.540 -1.631 1.00 0.00 N ATOM 1710 CA GLU A 117 -0.829 -18.691 -1.245 1.00 0.00 C ATOM 1711 C GLU A 117 0.210 -19.008 -2.316 1.00 0.00 C ATOM 1712 O GLU A 117 -0.129 -19.431 -3.421 1.00 0.00 O ATOM 1713 CB GLU A 117 -1.721 -19.911 -1.006 1.00 0.00 C ATOM 1714 CG GLU A 117 -2.205 -20.040 0.428 1.00 0.00 C ATOM 1715 CD GLU A 117 -1.178 -20.692 1.334 1.00 0.00 C ATOM 1716 OE1 GLU A 117 -0.896 -21.894 1.143 1.00 0.00 O ATOM 1717 OE2 GLU A 117 -0.656 -20.000 2.233 1.00 0.00 O ATOM 0 H GLU A 117 -2.623 -17.751 -1.790 1.00 0.00 H new ATOM 0 HA GLU A 117 -0.308 -18.444 -0.320 1.00 0.00 H new ATOM 0 HB2 GLU A 117 -2.585 -19.854 -1.668 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -1.170 -20.812 -1.277 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -2.450 -19.051 0.815 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -3.124 -20.626 0.446 1.00 0.00 H new ATOM 1724 N GLY A 118 1.480 -18.801 -1.980 1.00 0.00 N ATOM 1725 CA GLY A 118 2.550 -19.070 -2.922 1.00 0.00 C ATOM 1726 C GLY A 118 3.290 -20.355 -2.609 1.00 0.00 C ATOM 1727 O GLY A 118 2.689 -21.429 -2.557 1.00 0.00 O ATOM 0 H GLY A 118 1.786 -18.452 -1.072 1.00 0.00 H new ATOM 0 HA2 GLY A 118 2.137 -19.129 -3.929 1.00 0.00 H new ATOM 0 HA3 GLY A 118 3.254 -18.238 -2.914 1.00 0.00 H new ATOM 1731 N CYS A 119 4.598 -20.247 -2.401 1.00 0.00 N ATOM 1732 CA CYS A 119 5.422 -21.411 -2.093 1.00 0.00 C ATOM 1733 C CYS A 119 5.801 -21.433 -0.616 1.00 0.00 C ATOM 1734 O CYS A 119 6.259 -20.431 -0.069 1.00 0.00 O ATOM 1735 CB CYS A 119 6.684 -21.411 -2.957 1.00 0.00 C ATOM 1736 SG CYS A 119 7.321 -23.061 -3.333 1.00 0.00 S ATOM 0 H CYS A 119 5.110 -19.366 -2.440 1.00 0.00 H new ATOM 0 HA CYS A 119 4.840 -22.306 -2.313 1.00 0.00 H new ATOM 0 HB2 CYS A 119 6.471 -20.894 -3.892 1.00 0.00 H new ATOM 0 HB3 CYS A 119 7.461 -20.841 -2.447 1.00 0.00 H new ATOM 0 HG CYS A 119 8.387 -22.957 -4.070 1.00 0.00 H new ATOM 1742 N GLN A 120 5.606 -22.583 0.022 1.00 0.00 N ATOM 1743 CA GLN A 120 5.926 -22.734 1.437 1.00 0.00 C ATOM 1744 C GLN A 120 7.414 -23.004 1.632 1.00 0.00 C ATOM 1745 O GLN A 120 8.052 -23.704 0.845 1.00 0.00 O ATOM 1746 CB GLN A 120 5.105 -23.871 2.048 1.00 0.00 C ATOM 1747 CG GLN A 120 5.445 -25.240 1.482 1.00 0.00 C ATOM 1748 CD GLN A 120 4.367 -26.270 1.757 1.00 0.00 C ATOM 1749 OE1 GLN A 120 3.430 -26.017 2.515 1.00 0.00 O ATOM 1750 NE2 GLN A 120 4.495 -27.439 1.142 1.00 0.00 N ATOM 0 H GLN A 120 5.229 -23.422 -0.418 1.00 0.00 H new ATOM 0 HA GLN A 120 5.675 -21.801 1.943 1.00 0.00 H new ATOM 0 HB2 GLN A 120 5.264 -23.883 3.126 1.00 0.00 H new ATOM 0 HB3 GLN A 120 4.046 -23.672 1.884 1.00 0.00 H new ATOM 0 HG2 GLN A 120 5.596 -25.157 0.406 1.00 0.00 H new ATOM 0 HG3 GLN A 120 6.387 -25.582 1.911 1.00 0.00 H new ATOM 0 HE21 GLN A 120 5.288 -27.605 0.522 1.00 0.00 H new ATOM 0 HE22 GLN A 120 3.800 -28.171 1.289 1.00 0.00 H new ATOM 1759 N PRO A 121 7.983 -22.436 2.706 1.00 0.00 N ATOM 1760 CA PRO A 121 9.403 -22.601 3.030 1.00 0.00 C ATOM 1761 C PRO A 121 9.733 -24.019 3.484 1.00 0.00 C ATOM 1762 O PRO A 121 10.676 -24.636 2.988 1.00 0.00 O ATOM 1763 CB PRO A 121 9.623 -21.609 4.174 1.00 0.00 C ATOM 1764 CG PRO A 121 8.282 -21.450 4.802 1.00 0.00 C ATOM 1765 CD PRO A 121 7.283 -21.589 3.686 1.00 0.00 C ATOM 0 HA PRO A 121 10.042 -22.424 2.165 1.00 0.00 H new ATOM 0 HB2 PRO A 121 10.353 -21.986 4.890 1.00 0.00 H new ATOM 0 HB3 PRO A 121 10.002 -20.656 3.804 1.00 0.00 H new ATOM 0 HG2 PRO A 121 8.118 -22.207 5.569 1.00 0.00 H new ATOM 0 HG3 PRO A 121 8.191 -20.479 5.288 1.00 0.00 H new ATOM 0 HD2 PRO A 121 6.358 -22.052 4.030 1.00 0.00 H new ATOM 0 HD3 PRO A 121 7.016 -20.621 3.262 1.00 0.00 H new ATOM 1773 N SER A 122 8.950 -24.530 4.428 1.00 0.00 N ATOM 1774 CA SER A 122 9.161 -25.875 4.951 1.00 0.00 C ATOM 1775 C SER A 122 10.649 -26.213 4.996 1.00 0.00 C ATOM 1776 O SER A 122 11.058 -27.312 4.621 1.00 0.00 O ATOM 1777 CB SER A 122 8.419 -26.901 4.093 1.00 0.00 C ATOM 1778 OG SER A 122 8.526 -28.202 4.646 1.00 0.00 O ATOM 0 H SER A 122 8.164 -24.033 4.847 1.00 0.00 H new ATOM 0 HA SER A 122 8.767 -25.909 5.967 1.00 0.00 H new ATOM 0 HB2 SER A 122 7.368 -26.622 4.014 1.00 0.00 H new ATOM 0 HB3 SER A 122 8.827 -26.897 3.082 1.00 0.00 H new ATOM 0 HG SER A 122 9.470 -28.412 4.807 1.00 0.00 H new ATOM 1784 N SER A 123 11.452 -25.260 5.456 1.00 0.00 N ATOM 1785 CA SER A 123 12.894 -25.453 5.547 1.00 0.00 C ATOM 1786 C SER A 123 13.467 -24.718 6.755 1.00 0.00 C ATOM 1787 O SER A 123 13.034 -23.615 7.086 1.00 0.00 O ATOM 1788 CB SER A 123 13.577 -24.965 4.268 1.00 0.00 C ATOM 1789 OG SER A 123 13.346 -23.582 4.063 1.00 0.00 O ATOM 0 H SER A 123 11.128 -24.346 5.772 1.00 0.00 H new ATOM 0 HA SER A 123 13.085 -26.519 5.669 1.00 0.00 H new ATOM 0 HB2 SER A 123 14.649 -25.153 4.330 1.00 0.00 H new ATOM 0 HB3 SER A 123 13.203 -25.530 3.414 1.00 0.00 H new ATOM 0 HG SER A 123 12.465 -23.455 3.653 1.00 0.00 H new ATOM 1795 N GLY A 124 14.443 -25.338 7.410 1.00 0.00 N ATOM 1796 CA GLY A 124 15.060 -24.729 8.574 1.00 0.00 C ATOM 1797 C GLY A 124 16.509 -24.356 8.334 1.00 0.00 C ATOM 1798 O GLY A 124 17.429 -25.093 8.690 1.00 0.00 O ATOM 0 H GLY A 124 14.818 -26.252 7.155 1.00 0.00 H new ATOM 0 HA2 GLY A 124 14.500 -23.837 8.853 1.00 0.00 H new ATOM 0 HA3 GLY A 124 15.000 -25.419 9.416 1.00 0.00 H new ATOM 1802 N PRO A 125 16.729 -23.187 7.715 1.00 0.00 N ATOM 1803 CA PRO A 125 18.075 -22.691 7.413 1.00 0.00 C ATOM 1804 C PRO A 125 18.838 -22.282 8.669 1.00 0.00 C ATOM 1805 O PRO A 125 18.728 -21.146 9.131 1.00 0.00 O ATOM 1806 CB PRO A 125 17.814 -21.472 6.525 1.00 0.00 C ATOM 1807 CG PRO A 125 16.447 -21.015 6.902 1.00 0.00 C ATOM 1808 CD PRO A 125 15.680 -22.257 7.263 1.00 0.00 C ATOM 0 HA PRO A 125 18.694 -23.454 6.941 1.00 0.00 H new ATOM 0 HB2 PRO A 125 18.554 -20.691 6.697 1.00 0.00 H new ATOM 0 HB3 PRO A 125 17.867 -21.733 5.468 1.00 0.00 H new ATOM 0 HG2 PRO A 125 16.485 -20.322 7.742 1.00 0.00 H new ATOM 0 HG3 PRO A 125 15.970 -20.488 6.076 1.00 0.00 H new ATOM 0 HD2 PRO A 125 14.949 -22.064 8.048 1.00 0.00 H new ATOM 0 HD3 PRO A 125 15.132 -22.654 6.408 1.00 0.00 H new ATOM 1816 N SER A 126 19.611 -23.215 9.217 1.00 0.00 N ATOM 1817 CA SER A 126 20.389 -22.951 10.421 1.00 0.00 C ATOM 1818 C SER A 126 21.279 -24.142 10.764 1.00 0.00 C ATOM 1819 O SER A 126 21.035 -25.263 10.317 1.00 0.00 O ATOM 1820 CB SER A 126 19.460 -22.640 11.596 1.00 0.00 C ATOM 1821 OG SER A 126 20.176 -22.059 12.672 1.00 0.00 O ATOM 0 H SER A 126 19.715 -24.160 8.846 1.00 0.00 H new ATOM 0 HA SER A 126 21.025 -22.086 10.231 1.00 0.00 H new ATOM 0 HB2 SER A 126 18.672 -21.961 11.271 1.00 0.00 H new ATOM 0 HB3 SER A 126 18.973 -23.556 11.931 1.00 0.00 H new ATOM 0 HG SER A 126 19.560 -21.868 13.410 1.00 0.00 H new ATOM 1827 N SER A 127 22.313 -23.890 11.561 1.00 0.00 N ATOM 1828 CA SER A 127 23.243 -24.939 11.961 1.00 0.00 C ATOM 1829 C SER A 127 22.503 -26.098 12.622 1.00 0.00 C ATOM 1830 O SER A 127 21.465 -25.907 13.255 1.00 0.00 O ATOM 1831 CB SER A 127 24.295 -24.379 12.919 1.00 0.00 C ATOM 1832 OG SER A 127 25.411 -23.869 12.210 1.00 0.00 O ATOM 0 H SER A 127 22.527 -22.968 11.942 1.00 0.00 H new ATOM 0 HA SER A 127 23.739 -25.311 11.065 1.00 0.00 H new ATOM 0 HB2 SER A 127 23.854 -23.589 13.526 1.00 0.00 H new ATOM 0 HB3 SER A 127 24.622 -25.162 13.603 1.00 0.00 H new ATOM 0 HG SER A 127 26.068 -23.515 12.845 1.00 0.00 H new ATOM 1838 N GLY A 128 23.044 -27.303 12.469 1.00 0.00 N ATOM 1839 CA GLY A 128 22.423 -28.476 13.056 1.00 0.00 C ATOM 1840 C GLY A 128 23.037 -29.768 12.556 1.00 0.00 C ATOM 1841 O GLY A 128 24.105 -30.174 13.014 1.00 0.00 O ATOM 0 H GLY A 128 23.902 -27.488 11.949 1.00 0.00 H new ATOM 0 HA2 GLY A 128 22.517 -28.429 14.141 1.00 0.00 H new ATOM 0 HA3 GLY A 128 21.357 -28.472 12.828 1.00 0.00 H new TER 1845 GLY A 128