USER MOD reduce.3.24.130724 H: found=0, std=0, add=846, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 845 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 25 GLN : amide:sc= 0.238 K(o=0.47,f=-0.11) USER MOD Set 1.2: B 5 SER OG : rot -113:sc= 0.236 USER MOD Single : A 1 ARG N :NH3+ -170:sc= 0 (180deg=-0.0943) USER MOD Single : A 5 SER OG : rot 180:sc= 0.0534 USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 178:sc= 0.912 (180deg=0.74) USER MOD Single : A 17 GLN : amide:sc= -0.215 K(o=-0.21,f=-1.3) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 LYS NZ :NH3+ 151:sc= 1.31 (180deg=1.21) USER MOD Single : A 42 HIS : no HE2:sc= 1.06 K(o=1.1,f=-3.8!) USER MOD Single : A 44 THR OG1 : rot 73:sc= 0.983 USER MOD Single : A 45 ASN : amide:sc= 1.06 K(o=1.1,f=0) USER MOD Single : A 50 CYS SG : rot 180:sc= 0.00169 USER MOD Single : A 52 GLN : amide:sc= -0.281 X(o=-0.28,f=-0.28) USER MOD Single : A 54 GLN : amide:sc= 0 K(o=0,f=-0.5) USER MOD Single : A 55 GLN : amide:sc= -0.113 X(o=-0.11,f=-0.11) USER MOD Single : A 58 GLN : amide:sc= 0.574 K(o=0.57,f=0) USER MOD Single : A 61 GLN : amide:sc= 0 K(o=0,f=-0.61) USER MOD Single : A 62 GLN : amide:sc= 0.687 K(o=0.69,f=0) USER MOD Single : A 63 THR OG1 : rot -130:sc=-0.00789 USER MOD Single : A 70 GLN : amide:sc= -0.185 X(o=-0.18,f=-0.23) USER MOD Single : A 71 MET CE :methyl -177:sc= -0.317 (180deg=-0.323) USER MOD Single : A 74 THR OG1 : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ -160:sc= 0.932 (180deg=-0.536!) USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 81 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 85 SER OG : rot 83:sc= 0.883 USER MOD Single : A 87 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : B 1 GLY N :NH3+ -111:sc= 0.159 (180deg=0) USER MOD Single : B 9 SER OG : rot -27:sc= 0.1 USER MOD Single : B 10 TYR OH : rot 166:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 1 1.312 0.028 -0.330 1.00 0.00 N ATOM 2 CA ARG A 1 2.200 0.305 -1.474 1.00 0.00 C ATOM 3 C ARG A 1 3.168 1.432 -1.109 1.00 0.00 C ATOM 4 O ARG A 1 4.212 1.158 -0.524 1.00 0.00 O ATOM 5 CB ARG A 1 1.408 0.591 -2.764 1.00 0.00 C ATOM 6 CG ARG A 1 0.624 -0.614 -3.311 1.00 0.00 C ATOM 7 CD ARG A 1 1.538 -1.716 -3.869 1.00 0.00 C ATOM 8 NE ARG A 1 0.764 -2.786 -4.521 1.00 0.00 N ATOM 9 CZ ARG A 1 0.282 -2.756 -5.777 1.00 0.00 C ATOM 10 NH1 ARG A 1 0.445 -1.673 -6.548 1.00 0.00 N ATOM 11 NH2 ARG A 1 -0.371 -3.821 -6.261 1.00 0.00 N ATOM 0 H1 ARG A 1 0.772 -0.842 -0.512 1.00 0.00 H new ATOM 0 H2 ARG A 1 1.883 -0.092 0.531 1.00 0.00 H new ATOM 0 H3 ARG A 1 0.654 0.823 -0.201 1.00 0.00 H new ATOM 0 HA ARG A 1 2.788 -0.587 -1.689 1.00 0.00 H new ATOM 0 HB2 ARG A 1 0.710 1.406 -2.574 1.00 0.00 H new ATOM 0 HB3 ARG A 1 2.101 0.937 -3.531 1.00 0.00 H new ATOM 0 HG2 ARG A 1 0.005 -1.030 -2.516 1.00 0.00 H new ATOM 0 HG3 ARG A 1 -0.051 -0.276 -4.097 1.00 0.00 H new ATOM 0 HD2 ARG A 1 2.235 -1.282 -4.586 1.00 0.00 H new ATOM 0 HD3 ARG A 1 2.134 -2.139 -3.060 1.00 0.00 H new ATOM 0 HE ARG A 1 0.577 -3.625 -3.971 1.00 0.00 H new ATOM 0 HH11 ARG A 1 0.939 -0.858 -6.185 1.00 0.00 H new ATOM 0 HH12 ARG A 1 0.075 -1.663 -7.498 1.00 0.00 H new ATOM 0 HH21 ARG A 1 -0.500 -4.648 -5.678 1.00 0.00 H new ATOM 0 HH22 ARG A 1 -0.739 -3.805 -7.212 1.00 0.00 H new ATOM 27 N ALA A 2 2.831 2.685 -1.436 1.00 0.00 N ATOM 28 CA ALA A 2 3.649 3.854 -1.149 1.00 0.00 C ATOM 29 C ALA A 2 2.768 5.103 -1.210 1.00 0.00 C ATOM 30 O ALA A 2 1.591 5.010 -1.561 1.00 0.00 O ATOM 31 CB ALA A 2 4.798 3.942 -2.162 1.00 0.00 C ATOM 0 H ALA A 2 1.961 2.912 -1.918 1.00 0.00 H new ATOM 0 HA ALA A 2 4.082 3.775 -0.152 1.00 0.00 H new ATOM 0 HB1 ALA A 2 5.409 4.818 -1.944 1.00 0.00 H new ATOM 0 HB2 ALA A 2 5.413 3.045 -2.093 1.00 0.00 H new ATOM 0 HB3 ALA A 2 4.390 4.025 -3.169 1.00 0.00 H new ATOM 37 N GLY A 3 3.339 6.263 -0.868 1.00 0.00 N ATOM 38 CA GLY A 3 2.639 7.539 -0.883 1.00 0.00 C ATOM 39 C GLY A 3 2.484 8.081 -2.306 1.00 0.00 C ATOM 40 O GLY A 3 2.836 7.414 -3.279 1.00 0.00 O ATOM 0 H GLY A 3 4.312 6.336 -0.570 1.00 0.00 H new ATOM 0 HA2 GLY A 3 1.655 7.420 -0.429 1.00 0.00 H new ATOM 0 HA3 GLY A 3 3.185 8.261 -0.276 1.00 0.00 H new ATOM 44 N LEU A 4 1.952 9.303 -2.420 1.00 0.00 N ATOM 45 CA LEU A 4 1.723 9.981 -3.686 1.00 0.00 C ATOM 46 C LEU A 4 1.864 11.486 -3.445 1.00 0.00 C ATOM 47 O LEU A 4 1.312 12.003 -2.475 1.00 0.00 O ATOM 48 CB LEU A 4 0.325 9.614 -4.211 1.00 0.00 C ATOM 49 CG LEU A 4 0.204 9.518 -5.742 1.00 0.00 C ATOM 50 CD1 LEU A 4 0.707 10.760 -6.485 1.00 0.00 C ATOM 51 CD2 LEU A 4 0.860 8.250 -6.303 1.00 0.00 C ATOM 0 H LEU A 4 1.665 9.855 -1.612 1.00 0.00 H new ATOM 0 HA LEU A 4 2.448 9.675 -4.440 1.00 0.00 H new ATOM 0 HB2 LEU A 4 0.032 8.657 -3.779 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -0.387 10.357 -3.852 1.00 0.00 H new ATOM 0 HG LEU A 4 -0.868 9.458 -5.927 1.00 0.00 H new ATOM 0 HD11 LEU A 4 0.588 10.615 -7.559 1.00 0.00 H new ATOM 0 HD12 LEU A 4 0.131 11.630 -6.171 1.00 0.00 H new ATOM 0 HD13 LEU A 4 1.760 10.920 -6.255 1.00 0.00 H new ATOM 0 HD21 LEU A 4 0.747 8.231 -7.387 1.00 0.00 H new ATOM 0 HD22 LEU A 4 1.920 8.246 -6.049 1.00 0.00 H new ATOM 0 HD23 LEU A 4 0.380 7.371 -5.872 1.00 0.00 H new ATOM 63 N SER A 5 2.599 12.189 -4.313 1.00 0.00 N ATOM 64 CA SER A 5 2.818 13.619 -4.244 1.00 0.00 C ATOM 65 C SER A 5 3.380 14.111 -5.578 1.00 0.00 C ATOM 66 O SER A 5 3.585 13.320 -6.498 1.00 0.00 O ATOM 67 CB SER A 5 3.736 13.988 -3.069 1.00 0.00 C ATOM 68 OG SER A 5 3.614 15.369 -2.785 1.00 0.00 O ATOM 0 H SER A 5 3.070 11.754 -5.106 1.00 0.00 H new ATOM 0 HA SER A 5 1.865 14.117 -4.062 1.00 0.00 H new ATOM 0 HB2 SER A 5 3.471 13.401 -2.190 1.00 0.00 H new ATOM 0 HB3 SER A 5 4.771 13.747 -3.313 1.00 0.00 H new ATOM 0 HG SER A 5 4.199 15.601 -2.034 1.00 0.00 H new ATOM 74 N LYS A 6 3.626 15.421 -5.669 1.00 0.00 N ATOM 75 CA LYS A 6 4.168 16.078 -6.849 1.00 0.00 C ATOM 76 C LYS A 6 5.700 16.061 -6.757 1.00 0.00 C ATOM 77 O LYS A 6 6.235 16.204 -5.660 1.00 0.00 O ATOM 78 CB LYS A 6 3.671 17.540 -6.912 1.00 0.00 C ATOM 79 CG LYS A 6 2.167 17.746 -7.200 1.00 0.00 C ATOM 80 CD LYS A 6 1.399 18.430 -6.061 1.00 0.00 C ATOM 81 CE LYS A 6 1.289 17.565 -4.801 1.00 0.00 C ATOM 82 NZ LYS A 6 0.305 18.123 -3.855 1.00 0.00 N ATOM 0 H LYS A 6 3.447 16.066 -4.900 1.00 0.00 H new ATOM 0 HA LYS A 6 3.839 15.555 -7.747 1.00 0.00 H new ATOM 0 HB2 LYS A 6 3.905 18.021 -5.962 1.00 0.00 H new ATOM 0 HB3 LYS A 6 4.240 18.061 -7.682 1.00 0.00 H new ATOM 0 HG2 LYS A 6 2.060 18.343 -8.106 1.00 0.00 H new ATOM 0 HG3 LYS A 6 1.710 16.777 -7.401 1.00 0.00 H new ATOM 0 HD2 LYS A 6 1.896 19.367 -5.808 1.00 0.00 H new ATOM 0 HD3 LYS A 6 0.397 18.684 -6.408 1.00 0.00 H new ATOM 0 HE2 LYS A 6 0.998 16.551 -5.077 1.00 0.00 H new ATOM 0 HE3 LYS A 6 2.264 17.496 -4.318 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 0.252 17.517 -3.012 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 0.597 19.081 -3.575 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -0.629 18.165 -4.310 1.00 0.00 H new ATOM 96 N LEU A 7 6.399 15.892 -7.893 1.00 0.00 N ATOM 97 CA LEU A 7 7.857 15.857 -7.988 1.00 0.00 C ATOM 98 C LEU A 7 8.511 15.060 -6.853 1.00 0.00 C ATOM 99 O LEU A 7 9.270 15.621 -6.066 1.00 0.00 O ATOM 100 CB LEU A 7 8.409 17.288 -8.103 1.00 0.00 C ATOM 101 CG LEU A 7 7.745 18.123 -9.214 1.00 0.00 C ATOM 102 CD1 LEU A 7 8.300 19.551 -9.178 1.00 0.00 C ATOM 103 CD2 LEU A 7 7.971 17.538 -10.613 1.00 0.00 C ATOM 0 H LEU A 7 5.943 15.773 -8.797 1.00 0.00 H new ATOM 0 HA LEU A 7 8.121 15.316 -8.897 1.00 0.00 H new ATOM 0 HB2 LEU A 7 8.274 17.797 -7.149 1.00 0.00 H new ATOM 0 HB3 LEU A 7 9.482 17.240 -8.290 1.00 0.00 H new ATOM 0 HG LEU A 7 6.672 18.114 -9.023 1.00 0.00 H new ATOM 0 HD11 LEU A 7 7.831 20.143 -9.964 1.00 0.00 H new ATOM 0 HD12 LEU A 7 8.086 20.000 -8.208 1.00 0.00 H new ATOM 0 HD13 LEU A 7 9.378 19.526 -9.337 1.00 0.00 H new ATOM 0 HD21 LEU A 7 7.480 18.168 -11.355 1.00 0.00 H new ATOM 0 HD22 LEU A 7 9.040 17.497 -10.822 1.00 0.00 H new ATOM 0 HD23 LEU A 7 7.554 16.532 -10.659 1.00 0.00 H new ATOM 115 N PRO A 8 8.224 13.750 -6.763 1.00 0.00 N ATOM 116 CA PRO A 8 8.773 12.892 -5.728 1.00 0.00 C ATOM 117 C PRO A 8 10.296 12.774 -5.844 1.00 0.00 C ATOM 118 O PRO A 8 11.002 13.148 -4.910 1.00 0.00 O ATOM 119 CB PRO A 8 8.047 11.552 -5.865 1.00 0.00 C ATOM 120 CG PRO A 8 7.551 11.534 -7.311 1.00 0.00 C ATOM 121 CD PRO A 8 7.338 13.011 -7.651 1.00 0.00 C ATOM 0 HA PRO A 8 8.612 13.303 -4.731 1.00 0.00 H new ATOM 0 HB2 PRO A 8 8.716 10.715 -5.664 1.00 0.00 H new ATOM 0 HB3 PRO A 8 7.219 11.475 -5.160 1.00 0.00 H new ATOM 0 HG2 PRO A 8 8.280 11.073 -7.977 1.00 0.00 H new ATOM 0 HG3 PRO A 8 6.626 10.965 -7.408 1.00 0.00 H new ATOM 0 HD2 PRO A 8 7.575 13.211 -8.696 1.00 0.00 H new ATOM 0 HD3 PRO A 8 6.299 13.302 -7.499 1.00 0.00 H new ATOM 129 N ASP A 9 10.802 12.257 -6.973 1.00 0.00 N ATOM 130 CA ASP A 9 12.237 12.090 -7.196 1.00 0.00 C ATOM 131 C ASP A 9 12.645 12.219 -8.673 1.00 0.00 C ATOM 132 O ASP A 9 13.809 12.477 -8.969 1.00 0.00 O ATOM 133 CB ASP A 9 12.684 10.750 -6.592 1.00 0.00 C ATOM 134 CG ASP A 9 14.163 10.724 -6.211 1.00 0.00 C ATOM 135 OD1 ASP A 9 14.852 11.752 -6.389 1.00 0.00 O ATOM 136 OD2 ASP A 9 14.629 9.651 -5.768 1.00 0.00 O ATOM 0 H ASP A 9 10.225 11.945 -7.754 1.00 0.00 H new ATOM 0 HA ASP A 9 12.753 12.908 -6.693 1.00 0.00 H new ATOM 0 HB2 ASP A 9 12.084 10.540 -5.707 1.00 0.00 H new ATOM 0 HB3 ASP A 9 12.486 9.952 -7.308 1.00 0.00 H new ATOM 141 N LEU A 10 11.701 12.051 -9.611 1.00 0.00 N ATOM 142 CA LEU A 10 11.890 12.169 -11.060 1.00 0.00 C ATOM 143 C LEU A 10 12.554 10.982 -11.738 1.00 0.00 C ATOM 144 O LEU A 10 12.430 10.835 -12.953 1.00 0.00 O ATOM 145 CB LEU A 10 12.567 13.485 -11.475 1.00 0.00 C ATOM 146 CG LEU A 10 12.005 14.720 -10.761 1.00 0.00 C ATOM 147 CD1 LEU A 10 12.751 15.966 -11.240 1.00 0.00 C ATOM 148 CD2 LEU A 10 10.514 14.880 -11.045 1.00 0.00 C ATOM 0 H LEU A 10 10.739 11.818 -9.365 1.00 0.00 H new ATOM 0 HA LEU A 10 10.866 12.176 -11.433 1.00 0.00 H new ATOM 0 HB2 LEU A 10 13.635 13.413 -11.271 1.00 0.00 H new ATOM 0 HB3 LEU A 10 12.456 13.617 -12.551 1.00 0.00 H new ATOM 0 HG LEU A 10 12.141 14.593 -9.687 1.00 0.00 H new ATOM 0 HD11 LEU A 10 12.353 16.845 -10.734 1.00 0.00 H new ATOM 0 HD12 LEU A 10 13.812 15.865 -11.012 1.00 0.00 H new ATOM 0 HD13 LEU A 10 12.620 16.077 -12.316 1.00 0.00 H new ATOM 0 HD21 LEU A 10 10.138 15.763 -10.528 1.00 0.00 H new ATOM 0 HD22 LEU A 10 10.358 14.994 -12.118 1.00 0.00 H new ATOM 0 HD23 LEU A 10 9.980 13.998 -10.692 1.00 0.00 H new ATOM 160 N LYS A 11 13.226 10.128 -10.968 1.00 0.00 N ATOM 161 CA LYS A 11 13.830 8.921 -11.526 1.00 0.00 C ATOM 162 C LYS A 11 12.723 8.098 -12.193 1.00 0.00 C ATOM 163 O LYS A 11 12.934 7.529 -13.263 1.00 0.00 O ATOM 164 CB LYS A 11 14.548 8.066 -10.473 1.00 0.00 C ATOM 165 CG LYS A 11 15.910 8.623 -10.036 1.00 0.00 C ATOM 166 CD LYS A 11 15.795 9.393 -8.721 1.00 0.00 C ATOM 167 CE LYS A 11 17.174 9.764 -8.164 1.00 0.00 C ATOM 168 NZ LYS A 11 17.058 10.363 -6.823 1.00 0.00 N ATOM 0 H LYS A 11 13.365 10.248 -9.965 1.00 0.00 H new ATOM 0 HA LYS A 11 14.590 9.226 -12.246 1.00 0.00 H new ATOM 0 HB2 LYS A 11 13.907 7.974 -9.596 1.00 0.00 H new ATOM 0 HB3 LYS A 11 14.689 7.061 -10.871 1.00 0.00 H new ATOM 0 HG2 LYS A 11 16.621 7.805 -9.920 1.00 0.00 H new ATOM 0 HG3 LYS A 11 16.303 9.280 -10.812 1.00 0.00 H new ATOM 0 HD2 LYS A 11 15.210 10.299 -8.879 1.00 0.00 H new ATOM 0 HD3 LYS A 11 15.257 8.789 -7.990 1.00 0.00 H new ATOM 0 HE2 LYS A 11 17.802 8.874 -8.116 1.00 0.00 H new ATOM 0 HE3 LYS A 11 17.666 10.465 -8.838 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 18.007 10.574 -6.454 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 16.506 11.242 -6.882 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 16.579 9.696 -6.185 1.00 0.00 H new ATOM 182 N ASP A 12 11.540 8.058 -11.567 1.00 0.00 N ATOM 183 CA ASP A 12 10.392 7.348 -12.092 1.00 0.00 C ATOM 184 C ASP A 12 9.739 8.211 -13.167 1.00 0.00 C ATOM 185 O ASP A 12 9.545 9.414 -12.992 1.00 0.00 O ATOM 186 CB ASP A 12 9.370 7.072 -10.993 1.00 0.00 C ATOM 187 CG ASP A 12 10.002 6.476 -9.741 1.00 0.00 C ATOM 188 OD1 ASP A 12 10.500 7.287 -8.930 1.00 0.00 O ATOM 189 OD2 ASP A 12 9.983 5.233 -9.626 1.00 0.00 O ATOM 0 H ASP A 12 11.363 8.524 -10.677 1.00 0.00 H new ATOM 0 HA ASP A 12 10.724 6.395 -12.504 1.00 0.00 H new ATOM 0 HB2 ASP A 12 8.863 8.001 -10.732 1.00 0.00 H new ATOM 0 HB3 ASP A 12 8.610 6.389 -11.372 1.00 0.00 H new ATOM 194 N ALA A 13 9.397 7.570 -14.281 1.00 0.00 N ATOM 195 CA ALA A 13 8.768 8.209 -15.426 1.00 0.00 C ATOM 196 C ALA A 13 7.280 8.389 -15.176 1.00 0.00 C ATOM 197 O ALA A 13 6.707 9.407 -15.547 1.00 0.00 O ATOM 198 CB ALA A 13 9.026 7.385 -16.690 1.00 0.00 C ATOM 0 H ALA A 13 9.554 6.571 -14.413 1.00 0.00 H new ATOM 0 HA ALA A 13 9.203 9.198 -15.571 1.00 0.00 H new ATOM 0 HB1 ALA A 13 8.552 7.870 -17.543 1.00 0.00 H new ATOM 0 HB2 ALA A 13 10.100 7.312 -16.864 1.00 0.00 H new ATOM 0 HB3 ALA A 13 8.611 6.385 -16.564 1.00 0.00 H new ATOM 204 N GLU A 14 6.667 7.396 -14.534 1.00 0.00 N ATOM 205 CA GLU A 14 5.254 7.395 -14.196 1.00 0.00 C ATOM 206 C GLU A 14 4.906 8.591 -13.311 1.00 0.00 C ATOM 207 O GLU A 14 3.867 9.212 -13.501 1.00 0.00 O ATOM 208 CB GLU A 14 4.883 6.077 -13.508 1.00 0.00 C ATOM 209 CG GLU A 14 5.096 4.877 -14.439 1.00 0.00 C ATOM 210 CD GLU A 14 4.623 3.587 -13.779 1.00 0.00 C ATOM 211 OE1 GLU A 14 3.388 3.415 -13.697 1.00 0.00 O ATOM 212 OE2 GLU A 14 5.505 2.808 -13.358 1.00 0.00 O ATOM 0 H GLU A 14 7.154 6.553 -14.230 1.00 0.00 H new ATOM 0 HA GLU A 14 4.674 7.484 -15.114 1.00 0.00 H new ATOM 0 HB2 GLU A 14 5.486 5.953 -12.609 1.00 0.00 H new ATOM 0 HB3 GLU A 14 3.841 6.112 -13.191 1.00 0.00 H new ATOM 0 HG2 GLU A 14 4.553 5.034 -15.371 1.00 0.00 H new ATOM 0 HG3 GLU A 14 6.152 4.793 -14.695 1.00 0.00 H new ATOM 219 N ALA A 15 5.776 8.922 -12.352 1.00 0.00 N ATOM 220 CA ALA A 15 5.573 10.046 -11.441 1.00 0.00 C ATOM 221 C ALA A 15 5.632 11.365 -12.196 1.00 0.00 C ATOM 222 O ALA A 15 4.870 12.292 -11.927 1.00 0.00 O ATOM 223 CB ALA A 15 6.675 10.088 -10.380 1.00 0.00 C ATOM 0 H ALA A 15 6.645 8.413 -12.187 1.00 0.00 H new ATOM 0 HA ALA A 15 4.596 9.910 -10.977 1.00 0.00 H new ATOM 0 HB1 ALA A 15 6.505 10.932 -9.712 1.00 0.00 H new ATOM 0 HB2 ALA A 15 6.662 9.162 -9.805 1.00 0.00 H new ATOM 0 HB3 ALA A 15 7.644 10.200 -10.866 1.00 0.00 H new ATOM 229 N VAL A 16 6.570 11.427 -13.140 1.00 0.00 N ATOM 230 CA VAL A 16 6.797 12.604 -13.963 1.00 0.00 C ATOM 231 C VAL A 16 5.594 12.749 -14.883 1.00 0.00 C ATOM 232 O VAL A 16 5.136 13.864 -15.100 1.00 0.00 O ATOM 233 CB VAL A 16 8.162 12.534 -14.682 1.00 0.00 C ATOM 234 CG1 VAL A 16 8.161 12.881 -16.168 1.00 0.00 C ATOM 235 CG2 VAL A 16 9.231 13.336 -13.961 1.00 0.00 C ATOM 0 H VAL A 16 7.197 10.652 -13.354 1.00 0.00 H new ATOM 0 HA VAL A 16 6.872 13.510 -13.362 1.00 0.00 H new ATOM 0 HB VAL A 16 8.401 11.472 -14.638 1.00 0.00 H new ATOM 0 HG11 VAL A 16 9.174 12.797 -16.562 1.00 0.00 H new ATOM 0 HG12 VAL A 16 7.505 12.193 -16.702 1.00 0.00 H new ATOM 0 HG13 VAL A 16 7.803 13.902 -16.303 1.00 0.00 H new ATOM 0 HG21 VAL A 16 10.173 13.257 -14.503 1.00 0.00 H new ATOM 0 HG22 VAL A 16 8.929 14.382 -13.910 1.00 0.00 H new ATOM 0 HG23 VAL A 16 9.360 12.946 -12.951 1.00 0.00 H new ATOM 245 N GLN A 17 5.068 11.629 -15.393 1.00 0.00 N ATOM 246 CA GLN A 17 3.898 11.650 -16.256 1.00 0.00 C ATOM 247 C GLN A 17 2.689 12.103 -15.449 1.00 0.00 C ATOM 248 O GLN A 17 1.912 12.922 -15.933 1.00 0.00 O ATOM 249 CB GLN A 17 3.653 10.291 -16.937 1.00 0.00 C ATOM 250 CG GLN A 17 2.520 10.324 -17.978 1.00 0.00 C ATOM 251 CD GLN A 17 2.798 11.234 -19.176 1.00 0.00 C ATOM 252 OE1 GLN A 17 3.923 11.671 -19.399 1.00 0.00 O ATOM 253 NE2 GLN A 17 1.762 11.531 -19.959 1.00 0.00 N ATOM 0 H GLN A 17 5.442 10.696 -15.217 1.00 0.00 H new ATOM 0 HA GLN A 17 4.074 12.361 -17.064 1.00 0.00 H new ATOM 0 HB2 GLN A 17 4.573 9.965 -17.422 1.00 0.00 H new ATOM 0 HB3 GLN A 17 3.415 9.549 -16.175 1.00 0.00 H new ATOM 0 HG2 GLN A 17 2.343 9.311 -18.339 1.00 0.00 H new ATOM 0 HG3 GLN A 17 1.603 10.654 -17.490 1.00 0.00 H new ATOM 0 HE21 GLN A 17 0.838 11.153 -19.748 1.00 0.00 H new ATOM 0 HE22 GLN A 17 1.892 12.137 -20.769 1.00 0.00 H new ATOM 262 N LYS A 18 2.534 11.578 -14.225 1.00 0.00 N ATOM 263 CA LYS A 18 1.402 11.930 -13.375 1.00 0.00 C ATOM 264 C LYS A 18 1.404 13.431 -13.101 1.00 0.00 C ATOM 265 O LYS A 18 0.412 14.107 -13.361 1.00 0.00 O ATOM 266 CB LYS A 18 1.400 11.129 -12.059 1.00 0.00 C ATOM 267 CG LYS A 18 1.157 9.617 -12.232 1.00 0.00 C ATOM 268 CD LYS A 18 -0.048 9.097 -11.434 1.00 0.00 C ATOM 269 CE LYS A 18 -1.395 9.545 -12.019 1.00 0.00 C ATOM 270 NZ LYS A 18 -2.529 9.057 -11.211 1.00 0.00 N ATOM 0 H LYS A 18 3.181 10.909 -13.807 1.00 0.00 H new ATOM 0 HA LYS A 18 0.487 11.668 -13.907 1.00 0.00 H new ATOM 0 HB2 LYS A 18 2.357 11.275 -11.558 1.00 0.00 H new ATOM 0 HB3 LYS A 18 0.631 11.535 -11.402 1.00 0.00 H new ATOM 0 HG2 LYS A 18 1.004 9.400 -13.289 1.00 0.00 H new ATOM 0 HG3 LYS A 18 2.050 9.075 -11.921 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -0.015 8.008 -11.406 1.00 0.00 H new ATOM 0 HD3 LYS A 18 0.028 9.445 -10.404 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -1.426 10.633 -12.070 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -1.490 9.175 -13.040 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -3.422 9.379 -11.636 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -2.514 8.017 -11.183 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -2.452 9.430 -10.243 1.00 0.00 H new ATOM 284 N PHE A 19 2.523 13.944 -12.587 1.00 0.00 N ATOM 285 CA PHE A 19 2.674 15.358 -12.283 1.00 0.00 C ATOM 286 C PHE A 19 2.532 16.223 -13.543 1.00 0.00 C ATOM 287 O PHE A 19 1.856 17.248 -13.512 1.00 0.00 O ATOM 288 CB PHE A 19 4.025 15.599 -11.583 1.00 0.00 C ATOM 289 CG PHE A 19 4.508 17.024 -11.750 1.00 0.00 C ATOM 290 CD1 PHE A 19 5.217 17.364 -12.913 1.00 0.00 C ATOM 291 CD2 PHE A 19 4.237 18.011 -10.786 1.00 0.00 C ATOM 292 CE1 PHE A 19 5.636 18.681 -13.117 1.00 0.00 C ATOM 293 CE2 PHE A 19 4.675 19.333 -10.990 1.00 0.00 C ATOM 294 CZ PHE A 19 5.374 19.666 -12.167 1.00 0.00 C ATOM 0 H PHE A 19 3.349 13.385 -12.371 1.00 0.00 H new ATOM 0 HA PHE A 19 1.873 15.655 -11.606 1.00 0.00 H new ATOM 0 HB2 PHE A 19 3.928 15.372 -10.521 1.00 0.00 H new ATOM 0 HB3 PHE A 19 4.770 14.915 -11.989 1.00 0.00 H new ATOM 0 HD1 PHE A 19 5.439 16.607 -13.651 1.00 0.00 H new ATOM 0 HD2 PHE A 19 3.693 17.755 -9.889 1.00 0.00 H new ATOM 0 HE1 PHE A 19 6.169 18.938 -14.021 1.00 0.00 H new ATOM 0 HE2 PHE A 19 4.476 20.090 -10.246 1.00 0.00 H new ATOM 0 HZ PHE A 19 5.705 20.681 -12.332 1.00 0.00 H new ATOM 304 N PHE A 20 3.188 15.824 -14.641 1.00 0.00 N ATOM 305 CA PHE A 20 3.178 16.570 -15.899 1.00 0.00 C ATOM 306 C PHE A 20 1.722 16.792 -16.310 1.00 0.00 C ATOM 307 O PHE A 20 1.313 17.913 -16.609 1.00 0.00 O ATOM 308 CB PHE A 20 3.994 15.799 -16.944 1.00 0.00 C ATOM 309 CG PHE A 20 3.991 16.262 -18.380 1.00 0.00 C ATOM 310 CD1 PHE A 20 4.473 17.539 -18.703 1.00 0.00 C ATOM 311 CD2 PHE A 20 3.537 15.401 -19.397 1.00 0.00 C ATOM 312 CE1 PHE A 20 4.505 17.958 -20.042 1.00 0.00 C ATOM 313 CE2 PHE A 20 3.572 15.820 -20.737 1.00 0.00 C ATOM 314 CZ PHE A 20 4.061 17.095 -21.057 1.00 0.00 C ATOM 0 H PHE A 20 3.743 14.969 -14.678 1.00 0.00 H new ATOM 0 HA PHE A 20 3.645 17.550 -15.797 1.00 0.00 H new ATOM 0 HB2 PHE A 20 5.030 15.789 -16.606 1.00 0.00 H new ATOM 0 HB3 PHE A 20 3.645 14.766 -16.933 1.00 0.00 H new ATOM 0 HD1 PHE A 20 4.819 18.199 -17.922 1.00 0.00 H new ATOM 0 HD2 PHE A 20 3.162 14.419 -19.147 1.00 0.00 H new ATOM 0 HE1 PHE A 20 4.871 18.943 -20.292 1.00 0.00 H new ATOM 0 HE2 PHE A 20 3.223 15.162 -21.519 1.00 0.00 H new ATOM 0 HZ PHE A 20 4.096 17.414 -22.088 1.00 0.00 H new ATOM 324 N LEU A 21 0.933 15.711 -16.279 1.00 0.00 N ATOM 325 CA LEU A 21 -0.486 15.744 -16.583 1.00 0.00 C ATOM 326 C LEU A 21 -1.259 16.551 -15.548 1.00 0.00 C ATOM 327 O LEU A 21 -2.153 17.307 -15.922 1.00 0.00 O ATOM 328 CB LEU A 21 -1.039 14.311 -16.681 1.00 0.00 C ATOM 329 CG LEU A 21 -1.315 13.803 -18.107 1.00 0.00 C ATOM 330 CD1 LEU A 21 -1.524 12.285 -18.030 1.00 0.00 C ATOM 331 CD2 LEU A 21 -2.563 14.520 -18.624 1.00 0.00 C ATOM 0 H LEU A 21 1.276 14.781 -16.038 1.00 0.00 H new ATOM 0 HA LEU A 21 -0.615 16.239 -17.546 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -0.331 13.634 -16.204 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -1.966 14.258 -16.110 1.00 0.00 H new ATOM 0 HG LEU A 21 -0.490 14.006 -18.789 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -1.722 11.894 -19.028 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -0.627 11.814 -17.627 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -2.371 12.067 -17.380 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -2.785 14.180 -19.636 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -3.408 14.296 -17.972 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -2.387 15.596 -18.633 1.00 0.00 H new ATOM 343 N GLU A 22 -0.927 16.413 -14.261 1.00 0.00 N ATOM 344 CA GLU A 22 -1.597 17.173 -13.216 1.00 0.00 C ATOM 345 C GLU A 22 -1.449 18.668 -13.501 1.00 0.00 C ATOM 346 O GLU A 22 -2.370 19.428 -13.229 1.00 0.00 O ATOM 347 CB GLU A 22 -1.027 16.829 -11.826 1.00 0.00 C ATOM 348 CG GLU A 22 -1.809 17.502 -10.688 1.00 0.00 C ATOM 349 CD GLU A 22 -1.175 17.204 -9.334 1.00 0.00 C ATOM 350 OE1 GLU A 22 -1.354 16.065 -8.851 1.00 0.00 O ATOM 351 OE2 GLU A 22 -0.508 18.119 -8.804 1.00 0.00 O ATOM 0 H GLU A 22 -0.200 15.782 -13.924 1.00 0.00 H new ATOM 0 HA GLU A 22 -2.654 16.908 -13.213 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -1.046 15.748 -11.686 1.00 0.00 H new ATOM 0 HB3 GLU A 22 0.017 17.138 -11.778 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -1.838 18.579 -10.850 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -2.841 17.151 -10.695 1.00 0.00 H new ATOM 358 N GLU A 23 -0.300 19.087 -14.045 1.00 0.00 N ATOM 359 CA GLU A 23 0.002 20.478 -14.334 1.00 0.00 C ATOM 360 C GLU A 23 -0.705 20.914 -15.614 1.00 0.00 C ATOM 361 O GLU A 23 -1.329 21.970 -15.639 1.00 0.00 O ATOM 362 CB GLU A 23 1.517 20.695 -14.345 1.00 0.00 C ATOM 363 CG GLU A 23 1.814 22.187 -14.202 1.00 0.00 C ATOM 364 CD GLU A 23 3.247 22.415 -13.750 1.00 0.00 C ATOM 365 OE1 GLU A 23 4.136 21.738 -14.310 1.00 0.00 O ATOM 366 OE2 GLU A 23 3.419 23.253 -12.836 1.00 0.00 O ATOM 0 H GLU A 23 0.455 18.450 -14.298 1.00 0.00 H new ATOM 0 HA GLU A 23 -0.386 21.124 -13.546 1.00 0.00 H new ATOM 0 HB2 GLU A 23 1.981 20.140 -13.530 1.00 0.00 H new ATOM 0 HB3 GLU A 23 1.944 20.315 -15.273 1.00 0.00 H new ATOM 0 HG2 GLU A 23 1.645 22.688 -15.155 1.00 0.00 H new ATOM 0 HG3 GLU A 23 1.127 22.631 -13.482 1.00 0.00 H new ATOM 373 N ILE A 24 -0.639 20.080 -16.658 1.00 0.00 N ATOM 374 CA ILE A 24 -1.331 20.301 -17.936 1.00 0.00 C ATOM 375 C ILE A 24 -2.817 20.591 -17.623 1.00 0.00 C ATOM 376 O ILE A 24 -3.394 21.582 -18.090 1.00 0.00 O ATOM 377 CB ILE A 24 -1.130 19.060 -18.883 1.00 0.00 C ATOM 378 CG1 ILE A 24 0.081 19.132 -19.858 1.00 0.00 C ATOM 379 CG2 ILE A 24 -2.374 18.560 -19.626 1.00 0.00 C ATOM 380 CD1 ILE A 24 -0.169 18.542 -21.259 1.00 0.00 C ATOM 0 H ILE A 24 -0.094 19.218 -16.640 1.00 0.00 H new ATOM 0 HA ILE A 24 -0.918 21.156 -18.471 1.00 0.00 H new ATOM 0 HB ILE A 24 -0.892 18.309 -18.130 1.00 0.00 H new ATOM 0 HG12 ILE A 24 0.377 20.175 -19.968 1.00 0.00 H new ATOM 0 HG13 ILE A 24 0.923 18.608 -19.406 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -2.108 17.703 -20.245 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -3.135 18.264 -18.904 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -2.765 19.357 -20.258 1.00 0.00 H new ATOM 0 HD11 ILE A 24 0.734 18.640 -21.862 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -0.432 17.488 -21.168 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -0.986 19.080 -21.740 1.00 0.00 H new ATOM 392 N GLN A 25 -3.432 19.715 -16.813 1.00 0.00 N ATOM 393 CA GLN A 25 -4.842 19.830 -16.448 1.00 0.00 C ATOM 394 C GLN A 25 -5.106 20.992 -15.498 1.00 0.00 C ATOM 395 O GLN A 25 -6.005 21.790 -15.749 1.00 0.00 O ATOM 396 CB GLN A 25 -5.372 18.511 -15.856 1.00 0.00 C ATOM 397 CG GLN A 25 -5.378 17.294 -16.801 1.00 0.00 C ATOM 398 CD GLN A 25 -6.188 16.162 -16.179 1.00 0.00 C ATOM 399 OE1 GLN A 25 -7.380 16.033 -16.441 1.00 0.00 O ATOM 400 NE2 GLN A 25 -5.548 15.348 -15.341 1.00 0.00 N ATOM 0 H GLN A 25 -2.962 18.911 -16.397 1.00 0.00 H new ATOM 0 HA GLN A 25 -5.386 20.040 -17.369 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -4.771 18.262 -14.981 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -6.391 18.678 -15.506 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -5.805 17.572 -17.765 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -4.357 16.962 -16.989 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -4.556 15.490 -15.150 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -6.050 14.583 -14.890 1.00 0.00 H new ATOM 409 N LEU A 26 -4.327 21.086 -14.419 1.00 0.00 N ATOM 410 CA LEU A 26 -4.444 22.149 -13.417 1.00 0.00 C ATOM 411 C LEU A 26 -4.420 23.498 -14.132 1.00 0.00 C ATOM 412 O LEU A 26 -5.276 24.338 -13.875 1.00 0.00 O ATOM 413 CB LEU A 26 -3.345 21.997 -12.349 1.00 0.00 C ATOM 414 CG LEU A 26 -3.166 23.046 -11.246 1.00 0.00 C ATOM 415 CD1 LEU A 26 -2.833 24.459 -11.725 1.00 0.00 C ATOM 416 CD2 LEU A 26 -4.382 23.054 -10.335 1.00 0.00 C ATOM 0 H LEU A 26 -3.586 20.416 -14.213 1.00 0.00 H new ATOM 0 HA LEU A 26 -5.390 22.080 -12.881 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -3.510 21.039 -11.855 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -2.394 21.924 -12.877 1.00 0.00 H new ATOM 0 HG LEU A 26 -2.278 22.735 -10.696 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -2.728 25.120 -10.864 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -1.898 24.442 -12.286 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -3.635 24.824 -12.367 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -4.247 23.802 -9.554 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -5.271 23.294 -10.917 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -4.502 22.071 -9.879 1.00 0.00 H new ATOM 428 N GLY A 27 -3.463 23.693 -15.047 1.00 0.00 N ATOM 429 CA GLY A 27 -3.346 24.907 -15.840 1.00 0.00 C ATOM 430 C GLY A 27 -4.639 25.124 -16.603 1.00 0.00 C ATOM 431 O GLY A 27 -5.306 26.121 -16.340 1.00 0.00 O ATOM 0 H GLY A 27 -2.744 23.000 -15.254 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -3.142 25.761 -15.194 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -2.509 24.825 -16.533 1.00 0.00 H new ATOM 435 N GLU A 28 -5.012 24.214 -17.522 1.00 0.00 N ATOM 436 CA GLU A 28 -6.272 24.396 -18.253 1.00 0.00 C ATOM 437 C GLU A 28 -7.444 24.783 -17.330 1.00 0.00 C ATOM 438 O GLU A 28 -8.233 25.668 -17.655 1.00 0.00 O ATOM 439 CB GLU A 28 -6.603 23.172 -19.117 1.00 0.00 C ATOM 440 CG GLU A 28 -7.728 23.518 -20.106 1.00 0.00 C ATOM 441 CD GLU A 28 -8.100 22.340 -20.996 1.00 0.00 C ATOM 442 OE1 GLU A 28 -8.752 21.419 -20.463 1.00 0.00 O ATOM 443 OE2 GLU A 28 -7.726 22.379 -22.187 1.00 0.00 O ATOM 0 H GLU A 28 -4.481 23.378 -17.767 1.00 0.00 H new ATOM 0 HA GLU A 28 -6.123 25.241 -18.925 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -5.715 22.849 -19.661 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -6.908 22.340 -18.482 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -8.608 23.843 -19.552 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -7.416 24.356 -20.729 1.00 0.00 H new ATOM 450 N GLU A 29 -7.540 24.136 -16.167 1.00 0.00 N ATOM 451 CA GLU A 29 -8.574 24.390 -15.167 1.00 0.00 C ATOM 452 C GLU A 29 -8.455 25.789 -14.547 1.00 0.00 C ATOM 453 O GLU A 29 -9.462 26.466 -14.360 1.00 0.00 O ATOM 454 CB GLU A 29 -8.599 23.265 -14.123 1.00 0.00 C ATOM 455 CG GLU A 29 -9.727 23.442 -13.103 1.00 0.00 C ATOM 456 CD GLU A 29 -10.055 22.129 -12.395 1.00 0.00 C ATOM 457 OE1 GLU A 29 -10.640 21.250 -13.068 1.00 0.00 O ATOM 458 OE2 GLU A 29 -9.724 22.026 -11.195 1.00 0.00 O ATOM 0 H GLU A 29 -6.885 23.405 -15.890 1.00 0.00 H new ATOM 0 HA GLU A 29 -9.541 24.384 -15.669 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -8.717 22.306 -14.628 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -7.642 23.235 -13.602 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -9.438 24.191 -12.366 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -10.618 23.817 -13.606 1.00 0.00 H new ATOM 465 N LEU A 30 -7.244 26.261 -14.239 1.00 0.00 N ATOM 466 CA LEU A 30 -7.063 27.603 -13.696 1.00 0.00 C ATOM 467 C LEU A 30 -7.463 28.616 -14.765 1.00 0.00 C ATOM 468 O LEU A 30 -8.097 29.625 -14.463 1.00 0.00 O ATOM 469 CB LEU A 30 -5.612 27.835 -13.233 1.00 0.00 C ATOM 470 CG LEU A 30 -5.306 27.565 -11.746 1.00 0.00 C ATOM 471 CD1 LEU A 30 -3.824 27.869 -11.500 1.00 0.00 C ATOM 472 CD2 LEU A 30 -6.121 28.457 -10.794 1.00 0.00 C ATOM 0 H LEU A 30 -6.379 25.733 -14.357 1.00 0.00 H new ATOM 0 HA LEU A 30 -7.696 27.723 -12.817 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -4.958 27.204 -13.835 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -5.346 28.869 -13.452 1.00 0.00 H new ATOM 0 HG LEU A 30 -5.566 26.526 -11.544 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -3.584 27.685 -10.453 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -3.211 27.226 -12.131 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -3.622 28.913 -11.741 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -5.862 28.220 -9.762 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -5.895 29.504 -10.994 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -7.185 28.279 -10.951 1.00 0.00 H new ATOM 484 N LEU A 31 -7.125 28.344 -16.026 1.00 0.00 N ATOM 485 CA LEU A 31 -7.504 29.212 -17.137 1.00 0.00 C ATOM 486 C LEU A 31 -9.012 29.169 -17.317 1.00 0.00 C ATOM 487 O LEU A 31 -9.615 30.173 -17.686 1.00 0.00 O ATOM 488 CB LEU A 31 -6.759 28.781 -18.383 1.00 0.00 C ATOM 489 CG LEU A 31 -5.271 29.144 -18.301 1.00 0.00 C ATOM 490 CD1 LEU A 31 -4.625 29.292 -16.915 1.00 0.00 C ATOM 491 CD2 LEU A 31 -4.543 28.067 -19.084 1.00 0.00 C ATOM 0 H LEU A 31 -6.586 27.523 -16.303 1.00 0.00 H new ATOM 0 HA LEU A 31 -7.229 30.247 -16.931 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -6.865 27.705 -18.518 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -7.203 29.257 -19.257 1.00 0.00 H new ATOM 0 HG LEU A 31 -5.188 30.156 -18.697 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -3.572 29.550 -17.030 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -5.133 30.080 -16.359 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -4.711 28.351 -16.371 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -3.471 28.266 -19.066 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -4.739 27.094 -18.633 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -4.895 28.067 -20.116 1.00 0.00 H new ATOM 503 N ALA A 32 -9.620 28.024 -16.995 1.00 0.00 N ATOM 504 CA ALA A 32 -11.067 27.887 -17.002 1.00 0.00 C ATOM 505 C ALA A 32 -11.690 28.880 -16.009 1.00 0.00 C ATOM 506 O ALA A 32 -12.865 29.216 -16.136 1.00 0.00 O ATOM 507 CB ALA A 32 -11.494 26.440 -16.731 1.00 0.00 C ATOM 0 H ALA A 32 -9.122 27.176 -16.725 1.00 0.00 H new ATOM 0 HA ALA A 32 -11.441 28.131 -17.996 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -12.582 26.373 -16.743 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -11.082 25.789 -17.502 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -11.122 26.128 -15.755 1.00 0.00 H new ATOM 513 N GLN A 33 -10.893 29.375 -15.046 1.00 0.00 N ATOM 514 CA GLN A 33 -11.280 30.382 -14.070 1.00 0.00 C ATOM 515 C GLN A 33 -10.894 31.745 -14.655 1.00 0.00 C ATOM 516 O GLN A 33 -11.642 32.713 -14.536 1.00 0.00 O ATOM 517 CB GLN A 33 -10.591 30.102 -12.724 1.00 0.00 C ATOM 518 CG GLN A 33 -11.620 29.964 -11.598 1.00 0.00 C ATOM 519 CD GLN A 33 -10.944 29.697 -10.256 1.00 0.00 C ATOM 520 OE1 GLN A 33 -11.006 30.521 -9.349 1.00 0.00 O ATOM 521 NE2 GLN A 33 -10.291 28.542 -10.123 1.00 0.00 N ATOM 0 H GLN A 33 -9.928 29.066 -14.931 1.00 0.00 H new ATOM 0 HA GLN A 33 -12.352 30.365 -13.873 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -10.001 29.188 -12.797 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -9.898 30.911 -12.491 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -12.215 30.875 -11.533 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -12.308 29.150 -11.829 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -10.261 27.881 -10.899 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -9.822 28.320 -9.245 1.00 0.00 H new ATOM 530 N GLY A 34 -9.727 31.786 -15.308 1.00 0.00 N ATOM 531 CA GLY A 34 -9.161 32.936 -15.995 1.00 0.00 C ATOM 532 C GLY A 34 -7.714 33.239 -15.608 1.00 0.00 C ATOM 533 O GLY A 34 -7.222 34.304 -15.978 1.00 0.00 O ATOM 0 H GLY A 34 -9.123 30.966 -15.370 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -9.211 32.765 -17.070 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -9.774 33.812 -15.783 1.00 0.00 H new ATOM 537 N ASP A 35 -7.020 32.354 -14.873 1.00 0.00 N ATOM 538 CA ASP A 35 -5.648 32.657 -14.442 1.00 0.00 C ATOM 539 C ASP A 35 -4.564 32.312 -15.479 1.00 0.00 C ATOM 540 O ASP A 35 -3.627 31.567 -15.198 1.00 0.00 O ATOM 541 CB ASP A 35 -5.374 32.075 -13.047 1.00 0.00 C ATOM 542 CG ASP A 35 -4.188 32.737 -12.342 1.00 0.00 C ATOM 543 OD1 ASP A 35 -3.396 33.427 -13.024 1.00 0.00 O ATOM 544 OD2 ASP A 35 -4.077 32.515 -11.117 1.00 0.00 O ATOM 0 H ASP A 35 -7.376 31.447 -14.572 1.00 0.00 H new ATOM 0 HA ASP A 35 -5.580 33.742 -14.363 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -6.266 32.190 -12.431 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -5.184 31.005 -13.137 1.00 0.00 H new ATOM 549 N TYR A 36 -4.692 32.882 -16.682 1.00 0.00 N ATOM 550 CA TYR A 36 -3.792 32.762 -17.829 1.00 0.00 C ATOM 551 C TYR A 36 -2.325 32.870 -17.435 1.00 0.00 C ATOM 552 O TYR A 36 -1.489 32.098 -17.901 1.00 0.00 O ATOM 553 CB TYR A 36 -4.146 33.825 -18.876 1.00 0.00 C ATOM 554 CG TYR A 36 -5.633 34.037 -19.101 1.00 0.00 C ATOM 555 CD1 TYR A 36 -6.452 32.965 -19.502 1.00 0.00 C ATOM 556 CD2 TYR A 36 -6.201 35.309 -18.899 1.00 0.00 C ATOM 557 CE1 TYR A 36 -7.829 33.162 -19.700 1.00 0.00 C ATOM 558 CE2 TYR A 36 -7.577 35.507 -19.098 1.00 0.00 C ATOM 559 CZ TYR A 36 -8.391 34.434 -19.497 1.00 0.00 C ATOM 560 OH TYR A 36 -9.727 34.632 -19.686 1.00 0.00 O ATOM 0 H TYR A 36 -5.488 33.484 -16.893 1.00 0.00 H new ATOM 0 HA TYR A 36 -3.930 31.767 -18.252 1.00 0.00 H new ATOM 0 HB2 TYR A 36 -3.701 34.773 -18.573 1.00 0.00 H new ATOM 0 HB3 TYR A 36 -3.687 33.546 -19.824 1.00 0.00 H new ATOM 0 HD1 TYR A 36 -6.020 31.987 -19.658 1.00 0.00 H new ATOM 0 HD2 TYR A 36 -5.577 36.135 -18.590 1.00 0.00 H new ATOM 0 HE1 TYR A 36 -8.455 32.337 -20.008 1.00 0.00 H new ATOM 0 HE2 TYR A 36 -8.010 36.485 -18.944 1.00 0.00 H new ATOM 0 HH TYR A 36 -9.948 35.569 -19.501 1.00 0.00 H new ATOM 570 N GLU A 37 -2.036 33.834 -16.566 1.00 0.00 N ATOM 571 CA GLU A 37 -0.700 34.104 -16.063 1.00 0.00 C ATOM 572 C GLU A 37 -0.119 32.864 -15.397 1.00 0.00 C ATOM 573 O GLU A 37 1.036 32.505 -15.629 1.00 0.00 O ATOM 574 CB GLU A 37 -0.701 35.330 -15.143 1.00 0.00 C ATOM 575 CG GLU A 37 -1.339 36.559 -15.810 1.00 0.00 C ATOM 576 CD GLU A 37 -0.673 36.894 -17.140 1.00 0.00 C ATOM 577 OE1 GLU A 37 0.421 37.500 -17.104 1.00 0.00 O ATOM 578 OE2 GLU A 37 -1.240 36.520 -18.190 1.00 0.00 O ATOM 0 H GLU A 37 -2.744 34.462 -16.185 1.00 0.00 H new ATOM 0 HA GLU A 37 -0.047 34.347 -16.901 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -1.243 35.094 -14.227 1.00 0.00 H new ATOM 0 HB3 GLU A 37 0.323 35.566 -14.855 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -2.401 36.374 -15.972 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -1.264 37.416 -15.140 1.00 0.00 H new ATOM 585 N LYS A 38 -0.945 32.193 -14.596 1.00 0.00 N ATOM 586 CA LYS A 38 -0.544 30.954 -13.946 1.00 0.00 C ATOM 587 C LYS A 38 -0.449 29.843 -14.977 1.00 0.00 C ATOM 588 O LYS A 38 0.413 28.981 -14.846 1.00 0.00 O ATOM 589 CB LYS A 38 -1.473 30.565 -12.787 1.00 0.00 C ATOM 590 CG LYS A 38 -0.923 31.022 -11.430 1.00 0.00 C ATOM 591 CD LYS A 38 0.140 30.021 -10.940 1.00 0.00 C ATOM 592 CE LYS A 38 1.188 30.663 -10.025 1.00 0.00 C ATOM 593 NZ LYS A 38 2.255 31.324 -10.801 1.00 0.00 N ATOM 0 H LYS A 38 -1.897 32.490 -14.383 1.00 0.00 H new ATOM 0 HA LYS A 38 0.438 31.114 -13.501 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -2.456 31.007 -12.947 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -1.607 29.483 -12.778 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -0.487 32.017 -11.519 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -1.732 31.093 -10.703 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -0.352 29.209 -10.406 1.00 0.00 H new ATOM 0 HD3 LYS A 38 0.640 29.579 -11.802 1.00 0.00 H new ATOM 0 HE2 LYS A 38 0.706 31.392 -9.374 1.00 0.00 H new ATOM 0 HE3 LYS A 38 1.625 29.900 -9.380 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 2.642 32.118 -10.253 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 3.013 30.640 -11.002 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 1.864 31.680 -11.696 1.00 0.00 H new ATOM 607 N GLY A 39 -1.294 29.861 -16.011 1.00 0.00 N ATOM 608 CA GLY A 39 -1.216 28.863 -17.061 1.00 0.00 C ATOM 609 C GLY A 39 0.127 28.937 -17.761 1.00 0.00 C ATOM 610 O GLY A 39 0.694 27.902 -18.084 1.00 0.00 O ATOM 0 H GLY A 39 -2.032 30.554 -16.136 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -1.359 27.869 -16.638 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -2.018 29.021 -17.782 1.00 0.00 H new ATOM 614 N VAL A 40 0.641 30.149 -17.997 1.00 0.00 N ATOM 615 CA VAL A 40 1.927 30.304 -18.663 1.00 0.00 C ATOM 616 C VAL A 40 3.021 29.647 -17.817 1.00 0.00 C ATOM 617 O VAL A 40 3.816 28.866 -18.329 1.00 0.00 O ATOM 618 CB VAL A 40 2.229 31.791 -18.972 1.00 0.00 C ATOM 619 CG1 VAL A 40 3.677 31.958 -19.443 1.00 0.00 C ATOM 620 CG2 VAL A 40 1.312 32.378 -20.061 1.00 0.00 C ATOM 0 H VAL A 40 0.187 31.025 -17.738 1.00 0.00 H new ATOM 0 HA VAL A 40 1.895 29.798 -19.628 1.00 0.00 H new ATOM 0 HB VAL A 40 2.052 32.328 -18.040 1.00 0.00 H new ATOM 0 HG11 VAL A 40 3.872 33.009 -19.656 1.00 0.00 H new ATOM 0 HG12 VAL A 40 4.356 31.614 -18.662 1.00 0.00 H new ATOM 0 HG13 VAL A 40 3.836 31.370 -20.347 1.00 0.00 H new ATOM 0 HG21 VAL A 40 1.573 33.422 -20.232 1.00 0.00 H new ATOM 0 HG22 VAL A 40 1.439 31.816 -20.986 1.00 0.00 H new ATOM 0 HG23 VAL A 40 0.273 32.312 -19.737 1.00 0.00 H new ATOM 630 N ASP A 41 3.046 29.968 -16.523 1.00 0.00 N ATOM 631 CA ASP A 41 4.021 29.462 -15.558 1.00 0.00 C ATOM 632 C ASP A 41 3.944 27.939 -15.437 1.00 0.00 C ATOM 633 O ASP A 41 4.940 27.233 -15.573 1.00 0.00 O ATOM 634 CB ASP A 41 3.806 30.169 -14.206 1.00 0.00 C ATOM 635 CG ASP A 41 4.542 29.526 -13.036 1.00 0.00 C ATOM 636 OD1 ASP A 41 5.703 29.113 -13.232 1.00 0.00 O ATOM 637 OD2 ASP A 41 3.921 29.501 -11.949 1.00 0.00 O ATOM 0 H ASP A 41 2.368 30.606 -16.106 1.00 0.00 H new ATOM 0 HA ASP A 41 5.029 29.686 -15.907 1.00 0.00 H new ATOM 0 HB2 ASP A 41 4.129 31.206 -14.297 1.00 0.00 H new ATOM 0 HB3 ASP A 41 2.739 30.185 -13.984 1.00 0.00 H new ATOM 642 N HIS A 42 2.743 27.435 -15.181 1.00 0.00 N ATOM 643 CA HIS A 42 2.477 26.017 -15.022 1.00 0.00 C ATOM 644 C HIS A 42 2.807 25.277 -16.301 1.00 0.00 C ATOM 645 O HIS A 42 3.362 24.182 -16.252 1.00 0.00 O ATOM 646 CB HIS A 42 1.023 25.764 -14.604 1.00 0.00 C ATOM 647 CG HIS A 42 0.798 25.928 -13.125 1.00 0.00 C ATOM 648 ND1 HIS A 42 1.525 25.218 -12.180 1.00 0.00 N ATOM 649 CD2 HIS A 42 -0.068 26.710 -12.403 1.00 0.00 C ATOM 650 CE1 HIS A 42 1.080 25.595 -10.970 1.00 0.00 C ATOM 651 NE2 HIS A 42 0.105 26.505 -11.037 1.00 0.00 N ATOM 0 H HIS A 42 1.911 28.016 -15.077 1.00 0.00 H new ATOM 0 HA HIS A 42 3.117 25.639 -14.224 1.00 0.00 H new ATOM 0 HB2 HIS A 42 0.371 26.451 -15.143 1.00 0.00 H new ATOM 0 HB3 HIS A 42 0.736 24.755 -14.900 1.00 0.00 H new ATOM 0 HD1 HIS A 42 2.260 24.537 -12.369 1.00 0.00 H new ATOM 0 HD2 HIS A 42 -0.786 27.391 -12.835 1.00 0.00 H new ATOM 0 HE1 HIS A 42 1.469 25.204 -10.042 1.00 0.00 H new ATOM 659 N LEU A 43 2.488 25.864 -17.458 1.00 0.00 N ATOM 660 CA LEU A 43 2.814 25.170 -18.686 1.00 0.00 C ATOM 661 C LEU A 43 4.334 25.155 -18.797 1.00 0.00 C ATOM 662 O LEU A 43 4.900 24.110 -19.093 1.00 0.00 O ATOM 663 CB LEU A 43 2.097 25.746 -19.916 1.00 0.00 C ATOM 664 CG LEU A 43 1.827 24.635 -20.946 1.00 0.00 C ATOM 665 CD1 LEU A 43 0.544 23.854 -20.609 1.00 0.00 C ATOM 666 CD2 LEU A 43 1.637 25.237 -22.341 1.00 0.00 C ATOM 0 H LEU A 43 2.029 26.769 -17.562 1.00 0.00 H new ATOM 0 HA LEU A 43 2.444 24.145 -18.655 1.00 0.00 H new ATOM 0 HB2 LEU A 43 1.157 26.208 -19.614 1.00 0.00 H new ATOM 0 HB3 LEU A 43 2.706 26.529 -20.367 1.00 0.00 H new ATOM 0 HG LEU A 43 2.687 23.966 -20.921 1.00 0.00 H new ATOM 0 HD11 LEU A 43 0.384 23.077 -21.357 1.00 0.00 H new ATOM 0 HD12 LEU A 43 0.645 23.395 -19.625 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -0.307 24.536 -20.606 1.00 0.00 H new ATOM 0 HD21 LEU A 43 1.447 24.439 -23.059 1.00 0.00 H new ATOM 0 HD22 LEU A 43 0.790 25.923 -22.329 1.00 0.00 H new ATOM 0 HD23 LEU A 43 2.538 25.778 -22.630 1.00 0.00 H new ATOM 678 N THR A 44 5.001 26.284 -18.514 1.00 0.00 N ATOM 679 CA THR A 44 6.462 26.349 -18.554 1.00 0.00 C ATOM 680 C THR A 44 7.070 25.230 -17.689 1.00 0.00 C ATOM 681 O THR A 44 8.084 24.625 -18.039 1.00 0.00 O ATOM 682 CB THR A 44 6.987 27.740 -18.162 1.00 0.00 C ATOM 683 OG1 THR A 44 6.522 28.700 -19.088 1.00 0.00 O ATOM 684 CG2 THR A 44 8.519 27.784 -18.183 1.00 0.00 C ATOM 0 H THR A 44 4.549 27.161 -18.256 1.00 0.00 H new ATOM 0 HA THR A 44 6.782 26.186 -19.583 1.00 0.00 H new ATOM 0 HB THR A 44 6.629 27.954 -17.155 1.00 0.00 H new ATOM 0 HG1 THR A 44 5.567 28.862 -18.940 1.00 0.00 H new ATOM 0 HG21 THR A 44 8.858 28.781 -17.901 1.00 0.00 H new ATOM 0 HG22 THR A 44 8.914 27.053 -17.477 1.00 0.00 H new ATOM 0 HG23 THR A 44 8.876 27.549 -19.186 1.00 0.00 H new ATOM 692 N ASN A 45 6.422 24.946 -16.557 1.00 0.00 N ATOM 693 CA ASN A 45 6.855 23.902 -15.634 1.00 0.00 C ATOM 694 C ASN A 45 6.651 22.528 -16.278 1.00 0.00 C ATOM 695 O ASN A 45 7.526 21.660 -16.192 1.00 0.00 O ATOM 696 CB ASN A 45 6.179 24.031 -14.265 1.00 0.00 C ATOM 697 CG ASN A 45 6.899 25.014 -13.346 1.00 0.00 C ATOM 698 OD1 ASN A 45 7.722 24.613 -12.527 1.00 0.00 O ATOM 699 ND2 ASN A 45 6.602 26.305 -13.470 1.00 0.00 N ATOM 0 H ASN A 45 5.580 25.437 -16.256 1.00 0.00 H new ATOM 0 HA ASN A 45 7.921 24.022 -15.439 1.00 0.00 H new ATOM 0 HB2 ASN A 45 5.148 24.356 -14.402 1.00 0.00 H new ATOM 0 HB3 ASN A 45 6.144 23.052 -13.787 1.00 0.00 H new ATOM 0 HD21 ASN A 45 7.063 26.994 -12.875 1.00 0.00 H new ATOM 0 HD22 ASN A 45 5.914 26.606 -14.160 1.00 0.00 H new ATOM 706 N ALA A 46 5.515 22.338 -16.964 1.00 0.00 N ATOM 707 CA ALA A 46 5.234 21.098 -17.666 1.00 0.00 C ATOM 708 C ALA A 46 6.404 20.834 -18.639 1.00 0.00 C ATOM 709 O ALA A 46 6.933 19.723 -18.705 1.00 0.00 O ATOM 710 CB ALA A 46 3.824 21.132 -18.284 1.00 0.00 C ATOM 0 H ALA A 46 4.777 23.038 -17.042 1.00 0.00 H new ATOM 0 HA ALA A 46 5.191 20.238 -16.998 1.00 0.00 H new ATOM 0 HB1 ALA A 46 3.633 20.194 -18.805 1.00 0.00 H new ATOM 0 HB2 ALA A 46 3.084 21.266 -17.495 1.00 0.00 H new ATOM 0 HB3 ALA A 46 3.756 21.960 -18.990 1.00 0.00 H new ATOM 716 N ILE A 47 6.861 21.872 -19.359 1.00 0.00 N ATOM 717 CA ILE A 47 8.015 21.761 -20.255 1.00 0.00 C ATOM 718 C ILE A 47 9.293 21.438 -19.477 1.00 0.00 C ATOM 719 O ILE A 47 10.154 20.722 -19.982 1.00 0.00 O ATOM 720 CB ILE A 47 8.237 23.026 -21.126 1.00 0.00 C ATOM 721 CG1 ILE A 47 7.175 23.208 -22.238 1.00 0.00 C ATOM 722 CG2 ILE A 47 9.653 23.061 -21.738 1.00 0.00 C ATOM 723 CD1 ILE A 47 5.856 23.753 -21.704 1.00 0.00 C ATOM 0 H ILE A 47 6.443 22.802 -19.334 1.00 0.00 H new ATOM 0 HA ILE A 47 7.784 20.938 -20.931 1.00 0.00 H new ATOM 0 HB ILE A 47 8.127 23.864 -20.438 1.00 0.00 H new ATOM 0 HG12 ILE A 47 7.563 23.886 -22.998 1.00 0.00 H new ATOM 0 HG13 ILE A 47 6.997 22.250 -22.726 1.00 0.00 H new ATOM 0 HG21 ILE A 47 9.767 23.962 -22.340 1.00 0.00 H new ATOM 0 HG22 ILE A 47 10.395 23.062 -20.939 1.00 0.00 H new ATOM 0 HG23 ILE A 47 9.799 22.183 -22.368 1.00 0.00 H new ATOM 0 HD11 ILE A 47 5.148 23.861 -22.525 1.00 0.00 H new ATOM 0 HD12 ILE A 47 5.450 23.063 -20.964 1.00 0.00 H new ATOM 0 HD13 ILE A 47 6.025 24.725 -21.240 1.00 0.00 H new ATOM 735 N ALA A 48 9.429 21.977 -18.267 1.00 0.00 N ATOM 736 CA ALA A 48 10.613 21.795 -17.437 1.00 0.00 C ATOM 737 C ALA A 48 10.793 20.343 -17.040 1.00 0.00 C ATOM 738 O ALA A 48 11.923 19.899 -16.852 1.00 0.00 O ATOM 739 CB ALA A 48 10.609 22.697 -16.202 1.00 0.00 C ATOM 0 H ALA A 48 8.712 22.558 -17.833 1.00 0.00 H new ATOM 0 HA ALA A 48 11.465 22.092 -18.049 1.00 0.00 H new ATOM 0 HB1 ALA A 48 11.513 22.520 -15.620 1.00 0.00 H new ATOM 0 HB2 ALA A 48 10.576 23.741 -16.514 1.00 0.00 H new ATOM 0 HB3 ALA A 48 9.734 22.473 -15.591 1.00 0.00 H new ATOM 745 N VAL A 49 9.685 19.606 -16.932 1.00 0.00 N ATOM 746 CA VAL A 49 9.746 18.204 -16.568 1.00 0.00 C ATOM 747 C VAL A 49 9.645 17.311 -17.801 1.00 0.00 C ATOM 748 O VAL A 49 10.016 16.142 -17.725 1.00 0.00 O ATOM 749 CB VAL A 49 8.668 17.888 -15.531 1.00 0.00 C ATOM 750 CG1 VAL A 49 8.790 18.860 -14.355 1.00 0.00 C ATOM 751 CG2 VAL A 49 7.237 17.919 -16.071 1.00 0.00 C ATOM 0 H VAL A 49 8.743 19.962 -17.092 1.00 0.00 H new ATOM 0 HA VAL A 49 10.715 17.995 -16.114 1.00 0.00 H new ATOM 0 HB VAL A 49 8.848 16.860 -15.217 1.00 0.00 H new ATOM 0 HG11 VAL A 49 8.021 18.635 -13.616 1.00 0.00 H new ATOM 0 HG12 VAL A 49 9.774 18.757 -13.898 1.00 0.00 H new ATOM 0 HG13 VAL A 49 8.661 19.882 -14.713 1.00 0.00 H new ATOM 0 HG21 VAL A 49 6.540 17.683 -15.267 1.00 0.00 H new ATOM 0 HG22 VAL A 49 7.017 18.912 -16.462 1.00 0.00 H new ATOM 0 HG23 VAL A 49 7.133 17.184 -16.869 1.00 0.00 H new ATOM 761 N CYS A 50 9.164 17.842 -18.934 1.00 0.00 N ATOM 762 CA CYS A 50 9.059 17.050 -20.155 1.00 0.00 C ATOM 763 C CYS A 50 10.380 17.075 -20.925 1.00 0.00 C ATOM 764 O CYS A 50 10.899 16.025 -21.298 1.00 0.00 O ATOM 765 CB CYS A 50 7.879 17.537 -20.989 1.00 0.00 C ATOM 766 SG CYS A 50 7.846 16.694 -22.589 1.00 0.00 S ATOM 0 H CYS A 50 8.846 18.807 -19.025 1.00 0.00 H new ATOM 0 HA CYS A 50 8.867 16.007 -19.901 1.00 0.00 H new ATOM 0 HB2 CYS A 50 6.947 17.353 -20.454 1.00 0.00 H new ATOM 0 HB3 CYS A 50 7.952 18.614 -21.140 1.00 0.00 H new ATOM 0 HG CYS A 50 6.833 17.121 -23.283 1.00 0.00 H new ATOM 772 N GLY A 51 10.928 18.271 -21.168 1.00 0.00 N ATOM 773 CA GLY A 51 12.185 18.444 -21.886 1.00 0.00 C ATOM 774 C GLY A 51 12.026 18.338 -23.406 1.00 0.00 C ATOM 775 O GLY A 51 13.019 18.377 -24.129 1.00 0.00 O ATOM 0 H GLY A 51 10.505 19.149 -20.868 1.00 0.00 H new ATOM 0 HA2 GLY A 51 12.608 19.417 -21.638 1.00 0.00 H new ATOM 0 HA3 GLY A 51 12.897 17.691 -21.547 1.00 0.00 H new ATOM 779 N GLN A 52 10.786 18.218 -23.890 1.00 0.00 N ATOM 780 CA GLN A 52 10.442 18.125 -25.304 1.00 0.00 C ATOM 781 C GLN A 52 9.305 19.124 -25.534 1.00 0.00 C ATOM 782 O GLN A 52 8.182 18.713 -25.833 1.00 0.00 O ATOM 783 CB GLN A 52 10.071 16.670 -25.636 1.00 0.00 C ATOM 784 CG GLN A 52 9.999 16.424 -27.149 1.00 0.00 C ATOM 785 CD GLN A 52 11.360 16.526 -27.833 1.00 0.00 C ATOM 786 OE1 GLN A 52 11.595 17.446 -28.611 1.00 0.00 O ATOM 787 NE2 GLN A 52 12.261 15.588 -27.545 1.00 0.00 N ATOM 0 H GLN A 52 9.968 18.182 -23.282 1.00 0.00 H new ATOM 0 HA GLN A 52 11.267 18.378 -25.970 1.00 0.00 H new ATOM 0 HB2 GLN A 52 10.808 15.999 -25.195 1.00 0.00 H new ATOM 0 HB3 GLN A 52 9.109 16.429 -25.184 1.00 0.00 H new ATOM 0 HG2 GLN A 52 9.580 15.435 -27.332 1.00 0.00 H new ATOM 0 HG3 GLN A 52 9.318 17.147 -27.598 1.00 0.00 H new ATOM 0 HE21 GLN A 52 12.027 14.839 -26.893 1.00 0.00 H new ATOM 0 HE22 GLN A 52 13.185 15.619 -27.976 1.00 0.00 H new ATOM 796 N PRO A 53 9.565 20.439 -25.383 1.00 0.00 N ATOM 797 CA PRO A 53 8.543 21.454 -25.552 1.00 0.00 C ATOM 798 C PRO A 53 7.803 21.350 -26.874 1.00 0.00 C ATOM 799 O PRO A 53 6.583 21.302 -26.883 1.00 0.00 O ATOM 800 CB PRO A 53 9.246 22.812 -25.432 1.00 0.00 C ATOM 801 CG PRO A 53 10.727 22.493 -25.616 1.00 0.00 C ATOM 802 CD PRO A 53 10.826 21.088 -25.031 1.00 0.00 C ATOM 0 HA PRO A 53 7.778 21.322 -24.787 1.00 0.00 H new ATOM 0 HB2 PRO A 53 8.893 23.510 -26.191 1.00 0.00 H new ATOM 0 HB3 PRO A 53 9.057 23.273 -24.462 1.00 0.00 H new ATOM 0 HG2 PRO A 53 11.022 22.520 -26.665 1.00 0.00 H new ATOM 0 HG3 PRO A 53 11.365 23.201 -25.087 1.00 0.00 H new ATOM 0 HD2 PRO A 53 11.677 20.547 -25.446 1.00 0.00 H new ATOM 0 HD3 PRO A 53 10.965 21.120 -23.950 1.00 0.00 H new ATOM 810 N GLN A 54 8.548 21.340 -27.977 1.00 0.00 N ATOM 811 CA GLN A 54 8.015 21.322 -29.334 1.00 0.00 C ATOM 812 C GLN A 54 7.012 20.197 -29.571 1.00 0.00 C ATOM 813 O GLN A 54 5.997 20.420 -30.232 1.00 0.00 O ATOM 814 CB GLN A 54 9.160 21.303 -30.361 1.00 0.00 C ATOM 815 CG GLN A 54 10.168 22.464 -30.219 1.00 0.00 C ATOM 816 CD GLN A 54 11.123 22.532 -31.412 1.00 0.00 C ATOM 817 OE1 GLN A 54 11.338 21.541 -32.104 1.00 0.00 O ATOM 818 NE2 GLN A 54 11.701 23.707 -31.662 1.00 0.00 N ATOM 0 H GLN A 54 9.568 21.344 -27.949 1.00 0.00 H new ATOM 0 HA GLN A 54 7.449 22.244 -29.469 1.00 0.00 H new ATOM 0 HB2 GLN A 54 9.697 20.359 -30.270 1.00 0.00 H new ATOM 0 HB3 GLN A 54 8.732 21.331 -31.363 1.00 0.00 H new ATOM 0 HG2 GLN A 54 9.628 23.407 -30.131 1.00 0.00 H new ATOM 0 HG3 GLN A 54 10.741 22.338 -29.300 1.00 0.00 H new ATOM 0 HE21 GLN A 54 11.500 24.511 -31.067 1.00 0.00 H new ATOM 0 HE22 GLN A 54 12.344 23.802 -32.448 1.00 0.00 H new ATOM 827 N GLN A 55 7.263 18.999 -29.032 1.00 0.00 N ATOM 828 CA GLN A 55 6.314 17.903 -29.192 1.00 0.00 C ATOM 829 C GLN A 55 5.007 18.303 -28.524 1.00 0.00 C ATOM 830 O GLN A 55 3.934 18.194 -29.116 1.00 0.00 O ATOM 831 CB GLN A 55 6.864 16.582 -28.629 1.00 0.00 C ATOM 832 CG GLN A 55 5.891 15.406 -28.805 1.00 0.00 C ATOM 833 CD GLN A 55 5.614 15.099 -30.274 1.00 0.00 C ATOM 834 OE1 GLN A 55 4.537 15.395 -30.784 1.00 0.00 O ATOM 835 NE2 GLN A 55 6.587 14.504 -30.963 1.00 0.00 N ATOM 0 H GLN A 55 8.098 18.770 -28.493 1.00 0.00 H new ATOM 0 HA GLN A 55 6.141 17.723 -30.253 1.00 0.00 H new ATOM 0 HB2 GLN A 55 7.805 16.345 -29.125 1.00 0.00 H new ATOM 0 HB3 GLN A 55 7.085 16.709 -27.569 1.00 0.00 H new ATOM 0 HG2 GLN A 55 6.304 14.520 -28.323 1.00 0.00 H new ATOM 0 HG3 GLN A 55 4.952 15.635 -28.301 1.00 0.00 H new ATOM 0 HE21 GLN A 55 7.469 14.273 -30.505 1.00 0.00 H new ATOM 0 HE22 GLN A 55 6.450 14.279 -31.948 1.00 0.00 H new ATOM 844 N LEU A 56 5.112 18.786 -27.286 1.00 0.00 N ATOM 845 CA LEU A 56 3.947 19.215 -26.547 1.00 0.00 C ATOM 846 C LEU A 56 3.261 20.391 -27.251 1.00 0.00 C ATOM 847 O LEU A 56 2.040 20.449 -27.284 1.00 0.00 O ATOM 848 CB LEU A 56 4.284 19.511 -25.075 1.00 0.00 C ATOM 849 CG LEU A 56 3.033 19.769 -24.215 1.00 0.00 C ATOM 850 CD1 LEU A 56 2.170 18.505 -24.007 1.00 0.00 C ATOM 851 CD2 LEU A 56 3.489 20.351 -22.875 1.00 0.00 C ATOM 0 H LEU A 56 5.994 18.886 -26.783 1.00 0.00 H new ATOM 0 HA LEU A 56 3.231 18.394 -26.529 1.00 0.00 H new ATOM 0 HB2 LEU A 56 4.838 18.670 -24.658 1.00 0.00 H new ATOM 0 HB3 LEU A 56 4.939 20.381 -25.025 1.00 0.00 H new ATOM 0 HG LEU A 56 2.390 20.475 -24.741 1.00 0.00 H new ATOM 0 HD11 LEU A 56 1.304 18.753 -23.393 1.00 0.00 H new ATOM 0 HD12 LEU A 56 1.834 18.131 -24.974 1.00 0.00 H new ATOM 0 HD13 LEU A 56 2.762 17.739 -23.507 1.00 0.00 H new ATOM 0 HD21 LEU A 56 2.619 20.543 -22.247 1.00 0.00 H new ATOM 0 HD22 LEU A 56 4.148 19.641 -22.375 1.00 0.00 H new ATOM 0 HD23 LEU A 56 4.025 21.284 -23.047 1.00 0.00 H new ATOM 863 N LEU A 57 4.006 21.333 -27.833 1.00 0.00 N ATOM 864 CA LEU A 57 3.381 22.462 -28.515 1.00 0.00 C ATOM 865 C LEU A 57 2.533 21.981 -29.693 1.00 0.00 C ATOM 866 O LEU A 57 1.431 22.488 -29.904 1.00 0.00 O ATOM 867 CB LEU A 57 4.403 23.533 -28.934 1.00 0.00 C ATOM 868 CG LEU A 57 5.220 24.193 -27.800 1.00 0.00 C ATOM 869 CD1 LEU A 57 6.090 25.301 -28.405 1.00 0.00 C ATOM 870 CD2 LEU A 57 4.373 24.696 -26.619 1.00 0.00 C ATOM 0 H LEU A 57 5.026 21.336 -27.845 1.00 0.00 H new ATOM 0 HA LEU A 57 2.715 22.948 -27.802 1.00 0.00 H new ATOM 0 HB2 LEU A 57 5.101 23.080 -29.638 1.00 0.00 H new ATOM 0 HB3 LEU A 57 3.872 24.318 -29.472 1.00 0.00 H new ATOM 0 HG LEU A 57 5.852 23.424 -27.355 1.00 0.00 H new ATOM 0 HD11 LEU A 57 6.673 25.777 -27.617 1.00 0.00 H new ATOM 0 HD12 LEU A 57 6.764 24.871 -29.146 1.00 0.00 H new ATOM 0 HD13 LEU A 57 5.452 26.044 -28.883 1.00 0.00 H new ATOM 0 HD21 LEU A 57 5.024 25.145 -25.869 1.00 0.00 H new ATOM 0 HD22 LEU A 57 3.661 25.441 -26.973 1.00 0.00 H new ATOM 0 HD23 LEU A 57 3.833 23.859 -26.176 1.00 0.00 H new ATOM 882 N GLN A 58 3.014 20.985 -30.442 1.00 0.00 N ATOM 883 CA GLN A 58 2.250 20.429 -31.549 1.00 0.00 C ATOM 884 C GLN A 58 0.993 19.756 -30.994 1.00 0.00 C ATOM 885 O GLN A 58 -0.089 19.874 -31.571 1.00 0.00 O ATOM 886 CB GLN A 58 3.122 19.445 -32.338 1.00 0.00 C ATOM 887 CG GLN A 58 4.209 20.187 -33.126 1.00 0.00 C ATOM 888 CD GLN A 58 5.295 19.232 -33.609 1.00 0.00 C ATOM 889 OE1 GLN A 58 5.253 18.750 -34.737 1.00 0.00 O ATOM 890 NE2 GLN A 58 6.277 18.959 -32.751 1.00 0.00 N ATOM 0 H GLN A 58 3.926 20.552 -30.298 1.00 0.00 H new ATOM 0 HA GLN A 58 1.943 21.218 -32.236 1.00 0.00 H new ATOM 0 HB2 GLN A 58 3.585 18.734 -31.654 1.00 0.00 H new ATOM 0 HB3 GLN A 58 2.499 18.870 -33.023 1.00 0.00 H new ATOM 0 HG2 GLN A 58 3.760 20.692 -33.981 1.00 0.00 H new ATOM 0 HG3 GLN A 58 4.654 20.958 -32.497 1.00 0.00 H new ATOM 0 HE21 GLN A 58 6.275 19.381 -31.822 1.00 0.00 H new ATOM 0 HE22 GLN A 58 7.031 18.328 -33.023 1.00 0.00 H new ATOM 899 N VAL A 59 1.137 19.058 -29.864 1.00 0.00 N ATOM 900 CA VAL A 59 0.041 18.365 -29.200 1.00 0.00 C ATOM 901 C VAL A 59 -1.006 19.341 -28.655 1.00 0.00 C ATOM 902 O VAL A 59 -2.198 19.042 -28.670 1.00 0.00 O ATOM 903 CB VAL A 59 0.580 17.352 -28.173 1.00 0.00 C ATOM 904 CG1 VAL A 59 0.405 17.686 -26.684 1.00 0.00 C ATOM 905 CG2 VAL A 59 -0.046 16.004 -28.405 1.00 0.00 C ATOM 0 H VAL A 59 2.031 18.960 -29.383 1.00 0.00 H new ATOM 0 HA VAL A 59 -0.503 17.774 -29.937 1.00 0.00 H new ATOM 0 HB VAL A 59 1.655 17.377 -28.354 1.00 0.00 H new ATOM 0 HG11 VAL A 59 0.831 16.885 -26.079 1.00 0.00 H new ATOM 0 HG12 VAL A 59 0.916 18.622 -26.459 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -0.656 17.788 -26.456 1.00 0.00 H new ATOM 0 HG21 VAL A 59 0.340 15.293 -27.675 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -1.128 16.082 -28.298 1.00 0.00 H new ATOM 0 HG23 VAL A 59 0.195 15.659 -29.410 1.00 0.00 H new ATOM 915 N LEU A 60 -0.568 20.521 -28.210 1.00 0.00 N ATOM 916 CA LEU A 60 -1.445 21.557 -27.679 1.00 0.00 C ATOM 917 C LEU A 60 -2.117 22.301 -28.830 1.00 0.00 C ATOM 918 O LEU A 60 -3.244 22.755 -28.663 1.00 0.00 O ATOM 919 CB LEU A 60 -0.612 22.594 -26.899 1.00 0.00 C ATOM 920 CG LEU A 60 -0.376 22.381 -25.393 1.00 0.00 C ATOM 921 CD1 LEU A 60 -1.462 23.067 -24.550 1.00 0.00 C ATOM 922 CD2 LEU A 60 -0.336 20.923 -24.934 1.00 0.00 C ATOM 0 H LEU A 60 0.418 20.783 -28.210 1.00 0.00 H new ATOM 0 HA LEU A 60 -2.185 21.084 -27.033 1.00 0.00 H new ATOM 0 HB2 LEU A 60 0.364 22.660 -27.379 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -1.094 23.564 -27.023 1.00 0.00 H new ATOM 0 HG LEU A 60 0.611 22.817 -25.240 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -1.264 22.896 -23.492 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -1.457 24.138 -24.752 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -2.437 22.654 -24.808 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -0.165 20.885 -23.858 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -1.286 20.442 -25.168 1.00 0.00 H new ATOM 0 HD23 LEU A 60 0.471 20.402 -25.449 1.00 0.00 H new ATOM 934 N GLN A 61 -1.455 22.441 -29.983 1.00 0.00 N ATOM 935 CA GLN A 61 -2.030 23.166 -31.111 1.00 0.00 C ATOM 936 C GLN A 61 -3.105 22.344 -31.825 1.00 0.00 C ATOM 937 O GLN A 61 -3.997 22.913 -32.451 1.00 0.00 O ATOM 938 CB GLN A 61 -0.908 23.599 -32.080 1.00 0.00 C ATOM 939 CG GLN A 61 -1.402 24.203 -33.409 1.00 0.00 C ATOM 940 CD GLN A 61 -0.275 24.855 -34.209 1.00 0.00 C ATOM 941 OE1 GLN A 61 0.903 24.659 -33.924 1.00 0.00 O ATOM 942 NE2 GLN A 61 -0.635 25.635 -35.227 1.00 0.00 N ATOM 0 H GLN A 61 -0.524 22.062 -30.155 1.00 0.00 H new ATOM 0 HA GLN A 61 -2.525 24.059 -30.731 1.00 0.00 H new ATOM 0 HB2 GLN A 61 -0.275 24.330 -31.577 1.00 0.00 H new ATOM 0 HB3 GLN A 61 -0.283 22.734 -32.300 1.00 0.00 H new ATOM 0 HG2 GLN A 61 -1.865 23.421 -34.010 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -2.173 24.945 -33.203 1.00 0.00 H new ATOM 0 HE21 GLN A 61 -1.623 25.776 -35.436 1.00 0.00 H new ATOM 0 HE22 GLN A 61 0.078 26.091 -35.797 1.00 0.00 H new ATOM 951 N GLN A 62 -3.006 21.012 -31.752 1.00 0.00 N ATOM 952 CA GLN A 62 -3.908 20.092 -32.429 1.00 0.00 C ATOM 953 C GLN A 62 -5.065 19.616 -31.553 1.00 0.00 C ATOM 954 O GLN A 62 -6.101 19.227 -32.088 1.00 0.00 O ATOM 955 CB GLN A 62 -3.089 18.927 -32.998 1.00 0.00 C ATOM 956 CG GLN A 62 -2.842 17.808 -31.980 1.00 0.00 C ATOM 957 CD GLN A 62 -1.820 16.796 -32.485 1.00 0.00 C ATOM 958 OE1 GLN A 62 -2.140 15.628 -32.683 1.00 0.00 O ATOM 959 NE2 GLN A 62 -0.581 17.241 -32.691 1.00 0.00 N ATOM 0 H GLN A 62 -2.282 20.541 -31.210 1.00 0.00 H new ATOM 0 HA GLN A 62 -4.392 20.629 -33.245 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -3.609 18.514 -33.863 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -2.130 19.305 -33.353 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -2.492 18.241 -31.043 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -3.781 17.299 -31.765 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -0.355 18.220 -32.515 1.00 0.00 H new ATOM 0 HE22 GLN A 62 0.141 16.603 -33.025 1.00 0.00 H new ATOM 968 N THR A 63 -4.907 19.637 -30.223 1.00 0.00 N ATOM 969 CA THR A 63 -5.964 19.174 -29.333 1.00 0.00 C ATOM 970 C THR A 63 -7.040 20.248 -29.170 1.00 0.00 C ATOM 971 O THR A 63 -8.220 19.917 -29.064 1.00 0.00 O ATOM 972 CB THR A 63 -5.388 18.609 -28.030 1.00 0.00 C ATOM 973 OG1 THR A 63 -6.403 17.915 -27.329 1.00 0.00 O ATOM 974 CG2 THR A 63 -4.743 19.651 -27.121 1.00 0.00 C ATOM 0 H THR A 63 -4.066 19.967 -29.750 1.00 0.00 H new ATOM 0 HA THR A 63 -6.481 18.327 -29.783 1.00 0.00 H new ATOM 0 HB THR A 63 -4.582 17.934 -28.319 1.00 0.00 H new ATOM 0 HG1 THR A 63 -6.426 18.221 -26.398 1.00 0.00 H new ATOM 0 HG21 THR A 63 -4.362 19.165 -26.223 1.00 0.00 H new ATOM 0 HG22 THR A 63 -3.921 20.134 -27.648 1.00 0.00 H new ATOM 0 HG23 THR A 63 -5.485 20.399 -26.842 1.00 0.00 H new ATOM 982 N LEU A 64 -6.645 21.526 -29.197 1.00 0.00 N ATOM 983 CA LEU A 64 -7.567 22.662 -29.126 1.00 0.00 C ATOM 984 C LEU A 64 -6.813 23.952 -29.456 1.00 0.00 C ATOM 985 O LEU A 64 -5.635 24.032 -29.128 1.00 0.00 O ATOM 986 CB LEU A 64 -8.307 22.752 -27.769 1.00 0.00 C ATOM 987 CG LEU A 64 -7.590 23.504 -26.631 1.00 0.00 C ATOM 988 CD1 LEU A 64 -8.571 23.702 -25.468 1.00 0.00 C ATOM 989 CD2 LEU A 64 -6.368 22.742 -26.113 1.00 0.00 C ATOM 0 H LEU A 64 -5.666 21.802 -29.270 1.00 0.00 H new ATOM 0 HA LEU A 64 -8.349 22.509 -29.870 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -9.270 23.233 -27.939 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -8.514 21.738 -27.428 1.00 0.00 H new ATOM 0 HG LEU A 64 -7.249 24.459 -27.030 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -8.072 24.234 -24.658 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -9.428 24.283 -25.810 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -8.911 22.730 -25.109 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -5.896 23.312 -25.312 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -6.680 21.770 -25.731 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -5.656 22.601 -26.926 1.00 0.00 H new ATOM 1001 N PRO A 65 -7.439 24.967 -30.080 1.00 0.00 N ATOM 1002 CA PRO A 65 -6.778 26.231 -30.391 1.00 0.00 C ATOM 1003 C PRO A 65 -6.414 26.916 -29.063 1.00 0.00 C ATOM 1004 O PRO A 65 -7.322 27.295 -28.326 1.00 0.00 O ATOM 1005 CB PRO A 65 -7.797 27.036 -31.206 1.00 0.00 C ATOM 1006 CG PRO A 65 -9.148 26.459 -30.785 1.00 0.00 C ATOM 1007 CD PRO A 65 -8.826 24.990 -30.514 1.00 0.00 C ATOM 0 HA PRO A 65 -5.856 26.121 -30.962 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -7.732 28.101 -30.985 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -7.631 26.922 -32.277 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -9.540 26.956 -29.898 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -9.896 26.570 -31.570 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -9.483 24.580 -29.747 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -8.966 24.386 -31.411 1.00 0.00 H new ATOM 1015 N PRO A 66 -5.122 27.056 -28.714 1.00 0.00 N ATOM 1016 CA PRO A 66 -4.692 27.619 -27.445 1.00 0.00 C ATOM 1017 C PRO A 66 -4.357 29.120 -27.519 1.00 0.00 C ATOM 1018 O PRO A 66 -3.303 29.483 -28.039 1.00 0.00 O ATOM 1019 CB PRO A 66 -3.460 26.776 -27.113 1.00 0.00 C ATOM 1020 CG PRO A 66 -2.801 26.533 -28.475 1.00 0.00 C ATOM 1021 CD PRO A 66 -3.956 26.624 -29.476 1.00 0.00 C ATOM 0 HA PRO A 66 -5.475 27.580 -26.687 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -2.789 27.300 -26.432 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -3.736 25.839 -26.630 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -2.034 27.278 -28.684 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -2.317 25.557 -28.514 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -3.727 27.333 -30.272 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -4.137 25.660 -29.951 1.00 0.00 H new ATOM 1029 N PRO A 67 -5.202 30.024 -26.987 1.00 0.00 N ATOM 1030 CA PRO A 67 -4.906 31.451 -26.977 1.00 0.00 C ATOM 1031 C PRO A 67 -3.825 31.741 -25.925 1.00 0.00 C ATOM 1032 O PRO A 67 -2.960 32.589 -26.127 1.00 0.00 O ATOM 1033 CB PRO A 67 -6.231 32.135 -26.637 1.00 0.00 C ATOM 1034 CG PRO A 67 -6.951 31.105 -25.766 1.00 0.00 C ATOM 1035 CD PRO A 67 -6.480 29.765 -26.337 1.00 0.00 C ATOM 0 HA PRO A 67 -4.519 31.814 -27.929 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -6.074 33.072 -26.103 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -6.803 32.371 -27.534 1.00 0.00 H new ATOM 0 HG2 PRO A 67 -6.683 31.210 -24.715 1.00 0.00 H new ATOM 0 HG3 PRO A 67 -8.034 31.211 -25.831 1.00 0.00 H new ATOM 0 HD2 PRO A 67 -6.371 29.022 -25.547 1.00 0.00 H new ATOM 0 HD3 PRO A 67 -7.205 29.369 -27.048 1.00 0.00 H new ATOM 1043 N VAL A 68 -3.879 31.015 -24.801 1.00 0.00 N ATOM 1044 CA VAL A 68 -2.946 31.115 -23.686 1.00 0.00 C ATOM 1045 C VAL A 68 -1.528 30.879 -24.180 1.00 0.00 C ATOM 1046 O VAL A 68 -0.633 31.649 -23.858 1.00 0.00 O ATOM 1047 CB VAL A 68 -3.322 30.129 -22.573 1.00 0.00 C ATOM 1048 CG1 VAL A 68 -2.161 29.993 -21.584 1.00 0.00 C ATOM 1049 CG2 VAL A 68 -4.579 30.653 -21.871 1.00 0.00 C ATOM 0 H VAL A 68 -4.605 30.316 -24.643 1.00 0.00 H new ATOM 0 HA VAL A 68 -3.001 32.119 -23.264 1.00 0.00 H new ATOM 0 HB VAL A 68 -3.523 29.142 -22.990 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -2.435 29.291 -20.796 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -1.278 29.625 -22.107 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -1.942 30.966 -21.144 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -4.864 29.966 -21.075 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -4.376 31.636 -21.446 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -5.393 30.731 -22.592 1.00 0.00 H new ATOM 1059 N PHE A 69 -1.338 29.823 -24.972 1.00 0.00 N ATOM 1060 CA PHE A 69 -0.059 29.485 -25.589 1.00 0.00 C ATOM 1061 C PHE A 69 0.569 30.736 -26.207 1.00 0.00 C ATOM 1062 O PHE A 69 1.749 31.001 -26.004 1.00 0.00 O ATOM 1063 CB PHE A 69 -0.298 28.403 -26.643 1.00 0.00 C ATOM 1064 CG PHE A 69 0.766 28.292 -27.710 1.00 0.00 C ATOM 1065 CD1 PHE A 69 2.031 27.777 -27.389 1.00 0.00 C ATOM 1066 CD2 PHE A 69 0.489 28.711 -29.024 1.00 0.00 C ATOM 1067 CE1 PHE A 69 3.015 27.681 -28.384 1.00 0.00 C ATOM 1068 CE2 PHE A 69 1.475 28.613 -30.019 1.00 0.00 C ATOM 1069 CZ PHE A 69 2.741 28.096 -29.698 1.00 0.00 C ATOM 0 H PHE A 69 -2.084 29.168 -25.206 1.00 0.00 H new ATOM 0 HA PHE A 69 0.636 29.104 -24.840 1.00 0.00 H new ATOM 0 HB2 PHE A 69 -0.384 27.441 -26.138 1.00 0.00 H new ATOM 0 HB3 PHE A 69 -1.255 28.596 -27.127 1.00 0.00 H new ATOM 0 HD1 PHE A 69 2.246 27.456 -26.380 1.00 0.00 H new ATOM 0 HD2 PHE A 69 -0.485 29.109 -29.268 1.00 0.00 H new ATOM 0 HE1 PHE A 69 3.990 27.286 -28.138 1.00 0.00 H new ATOM 0 HE2 PHE A 69 1.261 28.934 -31.028 1.00 0.00 H new ATOM 0 HZ PHE A 69 3.502 28.018 -30.460 1.00 0.00 H new ATOM 1079 N GLN A 70 -0.232 31.511 -26.939 1.00 0.00 N ATOM 1080 CA GLN A 70 0.214 32.742 -27.585 1.00 0.00 C ATOM 1081 C GLN A 70 0.745 33.746 -26.557 1.00 0.00 C ATOM 1082 O GLN A 70 1.704 34.469 -26.817 1.00 0.00 O ATOM 1083 CB GLN A 70 -0.926 33.350 -28.420 1.00 0.00 C ATOM 1084 CG GLN A 70 -0.475 33.598 -29.863 1.00 0.00 C ATOM 1085 CD GLN A 70 -0.196 32.294 -30.609 1.00 0.00 C ATOM 1086 OE1 GLN A 70 0.900 32.087 -31.120 1.00 0.00 O ATOM 1087 NE2 GLN A 70 -1.185 31.402 -30.672 1.00 0.00 N ATOM 0 H GLN A 70 -1.216 31.299 -27.100 1.00 0.00 H new ATOM 0 HA GLN A 70 1.037 32.498 -28.256 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -1.785 32.679 -28.414 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -1.251 34.288 -27.970 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -1.245 34.160 -30.392 1.00 0.00 H new ATOM 0 HG3 GLN A 70 0.424 34.214 -29.861 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -2.084 31.606 -30.236 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -1.042 30.516 -31.156 1.00 0.00 H new ATOM 1096 N MET A 71 0.124 33.773 -25.377 1.00 0.00 N ATOM 1097 CA MET A 71 0.507 34.625 -24.269 1.00 0.00 C ATOM 1098 C MET A 71 1.763 34.043 -23.625 1.00 0.00 C ATOM 1099 O MET A 71 2.619 34.798 -23.184 1.00 0.00 O ATOM 1100 CB MET A 71 -0.646 34.828 -23.275 1.00 0.00 C ATOM 1101 CG MET A 71 -1.941 35.304 -23.959 1.00 0.00 C ATOM 1102 SD MET A 71 -2.884 36.545 -23.034 1.00 0.00 S ATOM 1103 CE MET A 71 -3.307 35.584 -21.566 1.00 0.00 C ATOM 0 H MET A 71 -0.681 33.183 -25.168 1.00 0.00 H new ATOM 0 HA MET A 71 0.737 35.626 -24.633 1.00 0.00 H new ATOM 0 HB2 MET A 71 -0.839 33.891 -22.752 1.00 0.00 H new ATOM 0 HB3 MET A 71 -0.348 35.558 -22.522 1.00 0.00 H new ATOM 0 HG2 MET A 71 -1.688 35.716 -24.936 1.00 0.00 H new ATOM 0 HG3 MET A 71 -2.581 34.439 -24.134 1.00 0.00 H new ATOM 0 HE1 MET A 71 -3.937 36.183 -20.908 1.00 0.00 H new ATOM 0 HE2 MET A 71 -3.844 34.683 -21.863 1.00 0.00 H new ATOM 0 HE3 MET A 71 -2.395 35.305 -21.039 1.00 0.00 H new ATOM 1113 N LEU A 72 1.920 32.713 -23.601 1.00 0.00 N ATOM 1114 CA LEU A 72 3.124 32.083 -23.089 1.00 0.00 C ATOM 1115 C LEU A 72 4.281 32.585 -23.956 1.00 0.00 C ATOM 1116 O LEU A 72 5.338 32.960 -23.450 1.00 0.00 O ATOM 1117 CB LEU A 72 2.953 30.548 -23.022 1.00 0.00 C ATOM 1118 CG LEU A 72 4.201 29.719 -23.343 1.00 0.00 C ATOM 1119 CD1 LEU A 72 5.270 29.826 -22.248 1.00 0.00 C ATOM 1120 CD2 LEU A 72 3.811 28.244 -23.475 1.00 0.00 C ATOM 0 H LEU A 72 1.216 32.055 -23.936 1.00 0.00 H new ATOM 0 HA LEU A 72 3.341 32.356 -22.056 1.00 0.00 H new ATOM 0 HB2 LEU A 72 2.613 30.283 -22.021 1.00 0.00 H new ATOM 0 HB3 LEU A 72 2.162 30.260 -23.714 1.00 0.00 H new ATOM 0 HG LEU A 72 4.614 30.110 -24.273 1.00 0.00 H new ATOM 0 HD11 LEU A 72 6.134 29.221 -22.523 1.00 0.00 H new ATOM 0 HD12 LEU A 72 5.576 30.866 -22.138 1.00 0.00 H new ATOM 0 HD13 LEU A 72 4.861 29.467 -21.304 1.00 0.00 H new ATOM 0 HD21 LEU A 72 4.697 27.652 -23.703 1.00 0.00 H new ATOM 0 HD22 LEU A 72 3.375 27.898 -22.538 1.00 0.00 H new ATOM 0 HD23 LEU A 72 3.082 28.131 -24.278 1.00 0.00 H new ATOM 1132 N LEU A 73 4.052 32.624 -25.270 1.00 0.00 N ATOM 1133 CA LEU A 73 5.056 33.091 -26.218 1.00 0.00 C ATOM 1134 C LEU A 73 5.368 34.572 -26.097 1.00 0.00 C ATOM 1135 O LEU A 73 6.437 34.997 -26.527 1.00 0.00 O ATOM 1136 CB LEU A 73 4.638 32.876 -27.670 1.00 0.00 C ATOM 1137 CG LEU A 73 4.254 31.468 -28.122 1.00 0.00 C ATOM 1138 CD1 LEU A 73 4.030 31.616 -29.620 1.00 0.00 C ATOM 1139 CD2 LEU A 73 5.297 30.404 -27.771 1.00 0.00 C ATOM 0 H LEU A 73 3.173 32.335 -25.700 1.00 0.00 H new ATOM 0 HA LEU A 73 5.932 32.496 -25.962 1.00 0.00 H new ATOM 0 HB2 LEU A 73 3.789 33.530 -27.870 1.00 0.00 H new ATOM 0 HB3 LEU A 73 5.458 33.214 -28.304 1.00 0.00 H new ATOM 0 HG LEU A 73 3.367 31.103 -27.604 1.00 0.00 H new ATOM 0 HD11 LEU A 73 3.748 30.652 -30.043 1.00 0.00 H new ATOM 0 HD12 LEU A 73 3.233 32.338 -29.799 1.00 0.00 H new ATOM 0 HD13 LEU A 73 4.948 31.964 -30.093 1.00 0.00 H new ATOM 0 HD21 LEU A 73 4.956 29.430 -28.123 1.00 0.00 H new ATOM 0 HD22 LEU A 73 6.244 30.651 -28.250 1.00 0.00 H new ATOM 0 HD23 LEU A 73 5.434 30.372 -26.690 1.00 0.00 H new ATOM 1151 N THR A 74 4.442 35.348 -25.540 1.00 0.00 N ATOM 1152 CA THR A 74 4.618 36.780 -25.370 1.00 0.00 C ATOM 1153 C THR A 74 5.229 37.054 -23.999 1.00 0.00 C ATOM 1154 O THR A 74 5.866 38.086 -23.806 1.00 0.00 O ATOM 1155 CB THR A 74 3.354 37.574 -25.733 1.00 0.00 C ATOM 1156 OG1 THR A 74 3.700 38.798 -26.347 1.00 0.00 O ATOM 1157 CG2 THR A 74 2.505 37.912 -24.518 1.00 0.00 C ATOM 0 H THR A 74 3.549 34.997 -25.195 1.00 0.00 H new ATOM 0 HA THR A 74 5.338 37.163 -26.093 1.00 0.00 H new ATOM 0 HB THR A 74 2.784 36.933 -26.406 1.00 0.00 H new ATOM 0 HG1 THR A 74 2.885 39.292 -26.574 1.00 0.00 H new ATOM 0 HG21 THR A 74 1.625 38.473 -24.833 1.00 0.00 H new ATOM 0 HG22 THR A 74 2.191 36.991 -24.026 1.00 0.00 H new ATOM 0 HG23 THR A 74 3.089 38.514 -23.822 1.00 0.00 H new ATOM 1165 N LYS A 75 5.055 36.123 -23.051 1.00 0.00 N ATOM 1166 CA LYS A 75 5.620 36.271 -21.722 1.00 0.00 C ATOM 1167 C LYS A 75 7.131 36.030 -21.754 1.00 0.00 C ATOM 1168 O LYS A 75 7.881 36.726 -21.074 1.00 0.00 O ATOM 1169 CB LYS A 75 4.936 35.273 -20.773 1.00 0.00 C ATOM 1170 CG LYS A 75 4.503 35.868 -19.440 1.00 0.00 C ATOM 1171 CD LYS A 75 3.324 36.852 -19.453 1.00 0.00 C ATOM 1172 CE LYS A 75 1.995 36.212 -19.865 1.00 0.00 C ATOM 1173 NZ LYS A 75 0.888 37.176 -19.737 1.00 0.00 N ATOM 0 H LYS A 75 4.526 35.262 -23.190 1.00 0.00 H new ATOM 0 HA LYS A 75 5.449 37.287 -21.365 1.00 0.00 H new ATOM 0 HB2 LYS A 75 4.061 34.857 -21.272 1.00 0.00 H new ATOM 0 HB3 LYS A 75 5.619 34.445 -20.583 1.00 0.00 H new ATOM 0 HG2 LYS A 75 4.248 35.046 -18.772 1.00 0.00 H new ATOM 0 HG3 LYS A 75 5.362 36.378 -19.004 1.00 0.00 H new ATOM 0 HD2 LYS A 75 3.215 37.288 -18.460 1.00 0.00 H new ATOM 0 HD3 LYS A 75 3.551 37.669 -20.137 1.00 0.00 H new ATOM 0 HE2 LYS A 75 2.059 35.860 -20.895 1.00 0.00 H new ATOM 0 HE3 LYS A 75 1.798 35.340 -19.242 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -0.015 36.663 -19.686 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 1.016 37.739 -18.872 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 0.881 37.808 -20.563 1.00 0.00 H new ATOM 1187 N LEU A 76 7.558 35.034 -22.538 1.00 0.00 N ATOM 1188 CA LEU A 76 8.950 34.635 -22.696 1.00 0.00 C ATOM 1189 C LEU A 76 9.884 35.811 -23.058 1.00 0.00 C ATOM 1190 O LEU A 76 10.731 36.166 -22.239 1.00 0.00 O ATOM 1191 CB LEU A 76 9.022 33.421 -23.649 1.00 0.00 C ATOM 1192 CG LEU A 76 8.536 32.067 -23.089 1.00 0.00 C ATOM 1193 CD1 LEU A 76 8.333 31.100 -24.261 1.00 0.00 C ATOM 1194 CD2 LEU A 76 9.545 31.456 -22.112 1.00 0.00 C ATOM 0 H LEU A 76 6.918 34.468 -23.096 1.00 0.00 H new ATOM 0 HA LEU A 76 9.345 34.312 -21.733 1.00 0.00 H new ATOM 0 HB2 LEU A 76 8.435 33.652 -24.538 1.00 0.00 H new ATOM 0 HB3 LEU A 76 10.056 33.304 -23.972 1.00 0.00 H new ATOM 0 HG LEU A 76 7.605 32.236 -22.547 1.00 0.00 H new ATOM 0 HD11 LEU A 76 7.989 30.137 -23.883 1.00 0.00 H new ATOM 0 HD12 LEU A 76 7.589 31.508 -24.945 1.00 0.00 H new ATOM 0 HD13 LEU A 76 9.277 30.966 -24.790 1.00 0.00 H new ATOM 0 HD21 LEU A 76 9.163 30.504 -21.742 1.00 0.00 H new ATOM 0 HD22 LEU A 76 10.493 31.292 -22.624 1.00 0.00 H new ATOM 0 HD23 LEU A 76 9.698 32.136 -21.274 1.00 0.00 H new ATOM 1206 N PRO A 77 9.780 36.432 -24.245 1.00 0.00 N ATOM 1207 CA PRO A 77 10.626 37.540 -24.656 1.00 0.00 C ATOM 1208 C PRO A 77 10.111 38.870 -24.095 1.00 0.00 C ATOM 1209 O PRO A 77 8.908 39.058 -23.925 1.00 0.00 O ATOM 1210 CB PRO A 77 10.525 37.547 -26.181 1.00 0.00 C ATOM 1211 CG PRO A 77 9.067 37.143 -26.406 1.00 0.00 C ATOM 1212 CD PRO A 77 8.848 36.109 -25.300 1.00 0.00 C ATOM 0 HA PRO A 77 11.648 37.426 -24.294 1.00 0.00 H new ATOM 0 HB2 PRO A 77 10.745 38.529 -26.600 1.00 0.00 H new ATOM 0 HB3 PRO A 77 11.219 36.842 -26.639 1.00 0.00 H new ATOM 0 HG2 PRO A 77 8.389 37.991 -26.311 1.00 0.00 H new ATOM 0 HG3 PRO A 77 8.910 36.719 -27.398 1.00 0.00 H new ATOM 0 HD2 PRO A 77 7.822 36.143 -24.935 1.00 0.00 H new ATOM 0 HD3 PRO A 77 9.020 35.099 -25.673 1.00 0.00 H new ATOM 1220 N THR A 78 11.035 39.799 -23.830 1.00 0.00 N ATOM 1221 CA THR A 78 10.754 41.125 -23.309 1.00 0.00 C ATOM 1222 C THR A 78 11.397 42.182 -24.214 1.00 0.00 C ATOM 1223 O THR A 78 10.745 43.148 -24.608 1.00 0.00 O ATOM 1224 CB THR A 78 11.275 41.180 -21.866 1.00 0.00 C ATOM 1225 OG1 THR A 78 10.550 40.259 -21.077 1.00 0.00 O ATOM 1226 CG2 THR A 78 11.120 42.577 -21.273 1.00 0.00 C ATOM 0 H THR A 78 12.030 39.635 -23.980 1.00 0.00 H new ATOM 0 HA THR A 78 9.685 41.336 -23.299 1.00 0.00 H new ATOM 0 HB THR A 78 12.335 40.927 -21.874 1.00 0.00 H new ATOM 0 HG1 THR A 78 10.879 40.288 -20.154 1.00 0.00 H new ATOM 0 HG21 THR A 78 11.498 42.582 -20.251 1.00 0.00 H new ATOM 0 HG22 THR A 78 11.684 43.291 -21.872 1.00 0.00 H new ATOM 0 HG23 THR A 78 10.067 42.857 -21.272 1.00 0.00 H new ATOM 1234 N ILE A 79 12.681 41.997 -24.545 1.00 0.00 N ATOM 1235 CA ILE A 79 13.448 42.911 -25.382 1.00 0.00 C ATOM 1236 C ILE A 79 12.787 43.043 -26.749 1.00 0.00 C ATOM 1237 O ILE A 79 12.625 44.148 -27.260 1.00 0.00 O ATOM 1238 CB ILE A 79 14.920 42.454 -25.514 1.00 0.00 C ATOM 1239 CG1 ILE A 79 15.699 42.429 -24.184 1.00 0.00 C ATOM 1240 CG2 ILE A 79 15.675 43.388 -26.473 1.00 0.00 C ATOM 1241 CD1 ILE A 79 15.392 41.212 -23.307 1.00 0.00 C ATOM 0 H ILE A 79 13.221 41.191 -24.230 1.00 0.00 H new ATOM 0 HA ILE A 79 13.458 43.891 -24.904 1.00 0.00 H new ATOM 0 HB ILE A 79 14.868 41.431 -25.888 1.00 0.00 H new ATOM 0 HG12 ILE A 79 16.767 42.449 -24.400 1.00 0.00 H new ATOM 0 HG13 ILE A 79 15.470 43.335 -23.623 1.00 0.00 H new ATOM 0 HG21 ILE A 79 16.711 43.060 -26.561 1.00 0.00 H new ATOM 0 HG22 ILE A 79 15.202 43.362 -27.455 1.00 0.00 H new ATOM 0 HG23 ILE A 79 15.649 44.406 -26.085 1.00 0.00 H new ATOM 0 HD11 ILE A 79 15.979 41.267 -22.390 1.00 0.00 H new ATOM 0 HD12 ILE A 79 14.331 41.201 -23.059 1.00 0.00 H new ATOM 0 HD13 ILE A 79 15.648 40.300 -23.847 1.00 0.00 H new ATOM 1253 N SER A 80 12.410 41.899 -27.325 1.00 0.00 N ATOM 1254 CA SER A 80 11.764 41.828 -28.630 1.00 0.00 C ATOM 1255 C SER A 80 10.603 42.820 -28.728 1.00 0.00 C ATOM 1256 O SER A 80 10.522 43.593 -29.683 1.00 0.00 O ATOM 1257 CB SER A 80 11.303 40.394 -28.916 1.00 0.00 C ATOM 1258 OG SER A 80 10.840 40.285 -30.245 1.00 0.00 O ATOM 0 H SER A 80 12.548 40.987 -26.890 1.00 0.00 H new ATOM 0 HA SER A 80 12.492 42.109 -29.391 1.00 0.00 H new ATOM 0 HB2 SER A 80 12.128 39.700 -28.753 1.00 0.00 H new ATOM 0 HB3 SER A 80 10.509 40.115 -28.223 1.00 0.00 H new ATOM 0 HG SER A 80 10.550 39.365 -30.416 1.00 0.00 H new ATOM 1264 N GLN A 81 9.716 42.804 -27.725 1.00 0.00 N ATOM 1265 CA GLN A 81 8.570 43.696 -27.684 1.00 0.00 C ATOM 1266 C GLN A 81 8.997 45.163 -27.690 1.00 0.00 C ATOM 1267 O GLN A 81 8.345 45.996 -28.321 1.00 0.00 O ATOM 1268 CB GLN A 81 7.655 43.362 -26.499 1.00 0.00 C ATOM 1269 CG GLN A 81 7.140 41.917 -26.580 1.00 0.00 C ATOM 1270 CD GLN A 81 5.861 41.734 -25.766 1.00 0.00 C ATOM 1271 OE1 GLN A 81 4.764 41.863 -26.303 1.00 0.00 O ATOM 1272 NE2 GLN A 81 5.986 41.438 -24.474 1.00 0.00 N ATOM 0 H GLN A 81 9.779 42.172 -26.927 1.00 0.00 H new ATOM 0 HA GLN A 81 7.990 43.538 -28.594 1.00 0.00 H new ATOM 0 HB2 GLN A 81 8.199 43.504 -25.565 1.00 0.00 H new ATOM 0 HB3 GLN A 81 6.810 44.051 -26.484 1.00 0.00 H new ATOM 0 HG2 GLN A 81 6.951 41.654 -27.621 1.00 0.00 H new ATOM 0 HG3 GLN A 81 7.907 41.235 -26.213 1.00 0.00 H new ATOM 0 HE21 GLN A 81 6.913 41.338 -24.061 1.00 0.00 H new ATOM 0 HE22 GLN A 81 5.154 41.311 -23.897 1.00 0.00 H new ATOM 1281 N ARG A 82 10.099 45.475 -27.002 1.00 0.00 N ATOM 1282 CA ARG A 82 10.617 46.835 -26.941 1.00 0.00 C ATOM 1283 C ARG A 82 11.076 47.309 -28.324 1.00 0.00 C ATOM 1284 O ARG A 82 10.837 48.466 -28.666 1.00 0.00 O ATOM 1285 CB ARG A 82 11.727 46.973 -25.887 1.00 0.00 C ATOM 1286 CG ARG A 82 12.079 48.445 -25.636 1.00 0.00 C ATOM 1287 CD ARG A 82 13.147 48.563 -24.545 1.00 0.00 C ATOM 1288 NE ARG A 82 13.487 49.970 -24.296 1.00 0.00 N ATOM 1289 CZ ARG A 82 14.394 50.396 -23.402 1.00 0.00 C ATOM 1290 NH1 ARG A 82 15.075 49.517 -22.656 1.00 0.00 N ATOM 1291 NH2 ARG A 82 14.617 51.709 -23.256 1.00 0.00 N ATOM 0 H ARG A 82 10.649 44.795 -26.478 1.00 0.00 H new ATOM 0 HA ARG A 82 9.803 47.488 -26.625 1.00 0.00 H new ATOM 0 HB2 ARG A 82 11.405 46.510 -24.954 1.00 0.00 H new ATOM 0 HB3 ARG A 82 12.616 46.436 -26.219 1.00 0.00 H new ATOM 0 HG2 ARG A 82 12.441 48.901 -26.558 1.00 0.00 H new ATOM 0 HG3 ARG A 82 11.185 48.993 -25.339 1.00 0.00 H new ATOM 0 HD2 ARG A 82 12.785 48.104 -23.625 1.00 0.00 H new ATOM 0 HD3 ARG A 82 14.041 48.016 -24.845 1.00 0.00 H new ATOM 0 HE ARG A 82 12.997 50.677 -24.844 1.00 0.00 H new ATOM 0 HH11 ARG A 82 14.906 48.517 -22.765 1.00 0.00 H new ATOM 0 HH12 ARG A 82 15.763 49.847 -21.979 1.00 0.00 H new ATOM 0 HH21 ARG A 82 14.099 52.380 -23.823 1.00 0.00 H new ATOM 0 HH22 ARG A 82 15.305 52.037 -22.578 1.00 0.00 H new ATOM 1305 N ILE A 83 11.722 46.440 -29.120 1.00 0.00 N ATOM 1306 CA ILE A 83 12.185 46.826 -30.452 1.00 0.00 C ATOM 1307 C ILE A 83 10.982 47.237 -31.282 1.00 0.00 C ATOM 1308 O ILE A 83 10.964 48.321 -31.856 1.00 0.00 O ATOM 1309 CB ILE A 83 12.929 45.694 -31.193 1.00 0.00 C ATOM 1310 CG1 ILE A 83 13.908 44.918 -30.333 1.00 0.00 C ATOM 1311 CG2 ILE A 83 13.607 46.191 -32.483 1.00 0.00 C ATOM 1312 CD1 ILE A 83 14.863 45.722 -29.463 1.00 0.00 C ATOM 0 H ILE A 83 11.931 45.476 -28.862 1.00 0.00 H new ATOM 0 HA ILE A 83 12.892 47.645 -30.322 1.00 0.00 H new ATOM 0 HB ILE A 83 12.145 44.987 -31.465 1.00 0.00 H new ATOM 0 HG12 ILE A 83 13.335 44.257 -29.683 1.00 0.00 H new ATOM 0 HG13 ILE A 83 14.503 44.283 -30.989 1.00 0.00 H new ATOM 0 HG21 ILE A 83 14.117 45.360 -32.969 1.00 0.00 H new ATOM 0 HG22 ILE A 83 12.853 46.598 -33.157 1.00 0.00 H new ATOM 0 HG23 ILE A 83 14.331 46.968 -32.237 1.00 0.00 H new ATOM 0 HD11 ILE A 83 15.505 45.042 -28.903 1.00 0.00 H new ATOM 0 HD12 ILE A 83 15.478 46.364 -30.094 1.00 0.00 H new ATOM 0 HD13 ILE A 83 14.292 46.337 -28.768 1.00 0.00 H new ATOM 1324 N VAL A 84 9.977 46.359 -31.336 1.00 0.00 N ATOM 1325 CA VAL A 84 8.759 46.632 -32.096 1.00 0.00 C ATOM 1326 C VAL A 84 8.123 47.941 -31.638 1.00 0.00 C ATOM 1327 O VAL A 84 7.742 48.776 -32.461 1.00 0.00 O ATOM 1328 CB VAL A 84 7.777 45.447 -32.041 1.00 0.00 C ATOM 1329 CG1 VAL A 84 6.521 45.738 -32.873 1.00 0.00 C ATOM 1330 CG2 VAL A 84 8.421 44.156 -32.567 1.00 0.00 C ATOM 0 H VAL A 84 9.985 45.455 -30.863 1.00 0.00 H new ATOM 0 HA VAL A 84 9.030 46.752 -33.145 1.00 0.00 H new ATOM 0 HB VAL A 84 7.506 45.312 -30.994 1.00 0.00 H new ATOM 0 HG11 VAL A 84 5.843 44.886 -32.818 1.00 0.00 H new ATOM 0 HG12 VAL A 84 6.022 46.625 -32.481 1.00 0.00 H new ATOM 0 HG13 VAL A 84 6.804 45.910 -33.911 1.00 0.00 H new ATOM 0 HG21 VAL A 84 7.699 43.341 -32.513 1.00 0.00 H new ATOM 0 HG22 VAL A 84 8.730 44.299 -33.602 1.00 0.00 H new ATOM 0 HG23 VAL A 84 9.292 43.910 -31.959 1.00 0.00 H new ATOM 1340 N SER A 85 8.041 48.131 -30.322 1.00 0.00 N ATOM 1341 CA SER A 85 7.493 49.325 -29.702 1.00 0.00 C ATOM 1342 C SER A 85 8.470 50.506 -29.761 1.00 0.00 C ATOM 1343 O SER A 85 8.609 51.243 -28.786 1.00 0.00 O ATOM 1344 CB SER A 85 7.093 49.012 -28.259 1.00 0.00 C ATOM 1345 OG SER A 85 6.251 47.878 -28.207 1.00 0.00 O ATOM 0 H SER A 85 8.363 47.439 -29.645 1.00 0.00 H new ATOM 0 HA SER A 85 6.609 49.626 -30.264 1.00 0.00 H new ATOM 0 HB2 SER A 85 7.986 48.835 -27.659 1.00 0.00 H new ATOM 0 HB3 SER A 85 6.582 49.871 -27.824 1.00 0.00 H new ATOM 0 HG SER A 85 6.797 47.064 -28.221 1.00 0.00 H new ATOM 1351 N ALA A 86 9.138 50.689 -30.903 1.00 0.00 N ATOM 1352 CA ALA A 86 10.095 51.757 -31.141 1.00 0.00 C ATOM 1353 C ALA A 86 10.410 51.854 -32.634 1.00 0.00 C ATOM 1354 O ALA A 86 10.150 52.884 -33.253 1.00 0.00 O ATOM 1355 CB ALA A 86 11.371 51.537 -30.317 1.00 0.00 C ATOM 0 H ALA A 86 9.019 50.075 -31.709 1.00 0.00 H new ATOM 0 HA ALA A 86 9.655 52.702 -30.821 1.00 0.00 H new ATOM 0 HB1 ALA A 86 12.073 52.348 -30.510 1.00 0.00 H new ATOM 0 HB2 ALA A 86 11.121 51.519 -29.256 1.00 0.00 H new ATOM 0 HB3 ALA A 86 11.827 50.588 -30.598 1.00 0.00 H new ATOM 1361 N GLN A 87 10.964 50.772 -33.194 1.00 0.00 N ATOM 1362 CA GLN A 87 11.371 50.609 -34.592 1.00 0.00 C ATOM 1363 C GLN A 87 10.423 51.268 -35.581 1.00 0.00 C ATOM 1364 O GLN A 87 10.821 52.050 -36.441 1.00 0.00 O ATOM 1365 CB GLN A 87 11.584 49.120 -34.916 1.00 0.00 C ATOM 1366 CG GLN A 87 12.142 48.904 -36.327 1.00 0.00 C ATOM 1367 CD GLN A 87 12.473 47.434 -36.566 1.00 0.00 C ATOM 1368 OE1 GLN A 87 13.638 47.064 -36.674 1.00 0.00 O ATOM 1369 NE2 GLN A 87 11.448 46.585 -36.646 1.00 0.00 N ATOM 0 H GLN A 87 11.152 49.933 -32.645 1.00 0.00 H new ATOM 0 HA GLN A 87 12.319 51.135 -34.708 1.00 0.00 H new ATOM 0 HB2 GLN A 87 12.269 48.687 -34.187 1.00 0.00 H new ATOM 0 HB3 GLN A 87 10.636 48.590 -34.818 1.00 0.00 H new ATOM 0 HG2 GLN A 87 11.414 49.241 -37.065 1.00 0.00 H new ATOM 0 HG3 GLN A 87 13.038 49.509 -36.464 1.00 0.00 H new ATOM 0 HE21 GLN A 87 10.492 46.929 -36.551 1.00 0.00 H new ATOM 0 HE22 GLN A 87 11.620 45.592 -36.802 1.00 0.00 H new ATOM 1378 N SER A 88 9.161 50.917 -35.412 1.00 0.00 N ATOM 1379 CA SER A 88 8.020 51.384 -36.178 1.00 0.00 C ATOM 1380 C SER A 88 6.940 51.888 -35.224 1.00 0.00 C ATOM 1381 O SER A 88 5.755 51.798 -35.528 1.00 0.00 O ATOM 1382 CB SER A 88 7.513 50.238 -37.053 1.00 0.00 C ATOM 1383 OG SER A 88 7.263 49.088 -36.267 1.00 0.00 O ATOM 0 H SER A 88 8.888 50.253 -34.687 1.00 0.00 H new ATOM 0 HA SER A 88 8.303 52.213 -36.827 1.00 0.00 H new ATOM 0 HB2 SER A 88 6.600 50.541 -37.566 1.00 0.00 H new ATOM 0 HB3 SER A 88 8.249 50.007 -37.823 1.00 0.00 H new ATOM 0 HG SER A 88 6.937 48.364 -36.841 1.00 0.00 H new ATOM 1389 N LEU A 89 7.374 52.401 -34.066 1.00 0.00 N ATOM 1390 CA LEU A 89 6.563 52.914 -32.970 1.00 0.00 C ATOM 1391 C LEU A 89 5.329 52.040 -32.724 1.00 0.00 C ATOM 1392 O LEU A 89 4.222 52.535 -32.527 1.00 0.00 O ATOM 1393 CB LEU A 89 6.329 54.434 -33.087 1.00 0.00 C ATOM 1394 CG LEU A 89 5.873 54.986 -34.450 1.00 0.00 C ATOM 1395 CD1 LEU A 89 4.390 54.722 -34.728 1.00 0.00 C ATOM 1396 CD2 LEU A 89 6.102 56.502 -34.480 1.00 0.00 C ATOM 0 H LEU A 89 8.371 52.470 -33.862 1.00 0.00 H new ATOM 0 HA LEU A 89 7.122 52.826 -32.038 1.00 0.00 H new ATOM 0 HB2 LEU A 89 5.583 54.716 -32.344 1.00 0.00 H new ATOM 0 HB3 LEU A 89 7.256 54.938 -32.815 1.00 0.00 H new ATOM 0 HG LEU A 89 6.457 54.474 -35.215 1.00 0.00 H new ATOM 0 HD11 LEU A 89 4.124 55.133 -35.702 1.00 0.00 H new ATOM 0 HD12 LEU A 89 4.205 53.648 -34.724 1.00 0.00 H new ATOM 0 HD13 LEU A 89 3.785 55.197 -33.956 1.00 0.00 H new ATOM 0 HD21 LEU A 89 5.781 56.899 -35.443 1.00 0.00 H new ATOM 0 HD22 LEU A 89 5.526 56.973 -33.683 1.00 0.00 H new ATOM 0 HD23 LEU A 89 7.162 56.713 -34.335 1.00 0.00 H new ATOM 1408 N GLY A 90 5.545 50.718 -32.739 1.00 0.00 N ATOM 1409 CA GLY A 90 4.503 49.723 -32.540 1.00 0.00 C ATOM 1410 C GLY A 90 3.982 49.225 -33.887 1.00 0.00 C ATOM 1411 O GLY A 90 4.054 48.030 -34.167 1.00 0.00 O ATOM 0 H GLY A 90 6.468 50.311 -32.893 1.00 0.00 H new ATOM 0 HA2 GLY A 90 4.895 48.886 -31.962 1.00 0.00 H new ATOM 0 HA3 GLY A 90 3.685 50.154 -31.963 1.00 0.00 H new ATOM 1415 N GLU A 91 3.462 50.139 -34.715 1.00 0.00 N ATOM 1416 CA GLU A 91 2.925 49.841 -36.037 1.00 0.00 C ATOM 1417 C GLU A 91 3.006 51.110 -36.898 1.00 0.00 C ATOM 1418 O GLU A 91 2.857 52.208 -36.365 1.00 0.00 O ATOM 1419 CB GLU A 91 1.478 49.350 -35.893 1.00 0.00 C ATOM 1420 CG GLU A 91 0.874 48.892 -37.224 1.00 0.00 C ATOM 1421 CD GLU A 91 -0.518 48.310 -37.007 1.00 0.00 C ATOM 1422 OE1 GLU A 91 -1.473 49.116 -36.979 1.00 0.00 O ATOM 1423 OE2 GLU A 91 -0.597 47.072 -36.855 1.00 0.00 O ATOM 0 H GLU A 91 3.404 51.128 -34.473 1.00 0.00 H new ATOM 0 HA GLU A 91 3.502 49.055 -36.524 1.00 0.00 H new ATOM 0 HB2 GLU A 91 1.448 48.524 -35.182 1.00 0.00 H new ATOM 0 HB3 GLU A 91 0.866 50.151 -35.478 1.00 0.00 H new ATOM 0 HG2 GLU A 91 0.819 49.734 -37.914 1.00 0.00 H new ATOM 0 HG3 GLU A 91 1.519 48.144 -37.685 1.00 0.00 H new ATOM 1430 N ASP A 92 3.236 50.972 -38.214 1.00 0.00 N ATOM 1431 CA ASP A 92 3.341 52.079 -39.158 1.00 0.00 C ATOM 1432 C ASP A 92 2.746 51.633 -40.501 1.00 0.00 C ATOM 1433 O ASP A 92 2.556 50.434 -40.712 1.00 0.00 O ATOM 1434 CB ASP A 92 4.821 52.476 -39.283 1.00 0.00 C ATOM 1435 CG ASP A 92 5.056 53.691 -40.175 1.00 0.00 C ATOM 1436 OD1 ASP A 92 4.116 54.506 -40.302 1.00 0.00 O ATOM 1437 OD2 ASP A 92 6.186 53.788 -40.700 1.00 0.00 O ATOM 0 H ASP A 92 3.356 50.060 -38.655 1.00 0.00 H new ATOM 0 HA ASP A 92 2.786 52.953 -38.817 1.00 0.00 H new ATOM 0 HB2 ASP A 92 5.218 52.684 -38.289 1.00 0.00 H new ATOM 0 HB3 ASP A 92 5.383 51.630 -39.680 1.00 0.00 H new ATOM 1442 N ASP A 93 2.444 52.577 -41.403 1.00 0.00 N ATOM 1443 CA ASP A 93 1.867 52.285 -42.712 1.00 0.00 C ATOM 1444 C ASP A 93 2.954 51.997 -43.752 1.00 0.00 C ATOM 1445 O ASP A 93 4.147 52.070 -43.460 1.00 0.00 O ATOM 1446 CB ASP A 93 0.910 53.408 -43.146 1.00 0.00 C ATOM 1447 CG ASP A 93 1.621 54.711 -43.499 1.00 0.00 C ATOM 1448 OD1 ASP A 93 2.201 54.761 -44.605 1.00 0.00 O ATOM 1449 OD2 ASP A 93 1.539 55.643 -42.672 1.00 0.00 O ATOM 0 H ASP A 93 2.597 53.572 -41.238 1.00 0.00 H new ATOM 0 HA ASP A 93 1.274 51.374 -42.633 1.00 0.00 H new ATOM 0 HB2 ASP A 93 0.335 53.072 -44.009 1.00 0.00 H new ATOM 0 HB3 ASP A 93 0.198 53.598 -42.343 1.00 0.00 H new ATOM 1454 N VAL A 94 2.524 51.653 -44.972 1.00 0.00 N ATOM 1455 CA VAL A 94 3.378 51.335 -46.107 1.00 0.00 C ATOM 1456 C VAL A 94 2.708 51.889 -47.366 1.00 0.00 C ATOM 1457 O VAL A 94 1.479 51.936 -47.439 1.00 0.00 O ATOM 1458 CB VAL A 94 3.582 49.807 -46.209 1.00 0.00 C ATOM 1459 CG1 VAL A 94 4.465 49.432 -47.408 1.00 0.00 C ATOM 1460 CG2 VAL A 94 4.233 49.234 -44.942 1.00 0.00 C ATOM 0 H VAL A 94 1.531 51.588 -45.197 1.00 0.00 H new ATOM 0 HA VAL A 94 4.363 51.786 -45.987 1.00 0.00 H new ATOM 0 HB VAL A 94 2.587 49.380 -46.336 1.00 0.00 H new ATOM 0 HG11 VAL A 94 4.586 48.349 -47.447 1.00 0.00 H new ATOM 0 HG12 VAL A 94 3.995 49.778 -48.329 1.00 0.00 H new ATOM 0 HG13 VAL A 94 5.442 49.902 -47.301 1.00 0.00 H new ATOM 0 HG21 VAL A 94 4.359 48.157 -45.053 1.00 0.00 H new ATOM 0 HG22 VAL A 94 5.207 49.700 -44.791 1.00 0.00 H new ATOM 0 HG23 VAL A 94 3.596 49.438 -44.082 1.00 0.00 H new ATOM 1470 N GLU A 95 3.520 52.292 -48.348 1.00 0.00 N ATOM 1471 CA GLU A 95 3.100 52.823 -49.635 1.00 0.00 C ATOM 1472 C GLU A 95 4.010 52.197 -50.694 1.00 0.00 C ATOM 1473 O GLU A 95 3.453 51.456 -51.533 1.00 0.00 O ATOM 1474 CB GLU A 95 3.203 54.356 -49.617 1.00 0.00 C ATOM 1475 CG GLU A 95 2.644 54.984 -50.900 1.00 0.00 C ATOM 1476 CD GLU A 95 2.723 56.507 -50.857 1.00 0.00 C ATOM 1477 OE1 GLU A 95 3.810 57.031 -51.184 1.00 0.00 O ATOM 1478 OE2 GLU A 95 1.695 57.122 -50.499 1.00 0.00 O ATOM 1479 OXT GLU A 95 5.224 52.131 -50.393 1.00 0.00 O ATOM 0 H GLU A 95 4.535 52.252 -48.256 1.00 0.00 H new ATOM 0 HA GLU A 95 2.061 52.579 -49.859 1.00 0.00 H new ATOM 0 HB2 GLU A 95 2.660 54.746 -48.756 1.00 0.00 H new ATOM 0 HB3 GLU A 95 4.246 54.648 -49.495 1.00 0.00 H new ATOM 0 HG2 GLU A 95 3.201 54.614 -51.760 1.00 0.00 H new ATOM 0 HG3 GLU A 95 1.607 54.676 -51.035 1.00 0.00 H new TER 1486 GLU A 95 ATOM 1487 N GLY B 1 -13.962 20.867 -21.813 1.00 0.00 N ATOM 1488 CA GLY B 1 -13.981 20.988 -20.345 1.00 0.00 C ATOM 1489 C GLY B 1 -12.561 21.168 -19.812 1.00 0.00 C ATOM 1490 O GLY B 1 -11.623 20.984 -20.583 1.00 0.00 O ATOM 0 H1 GLY B 1 -14.394 21.713 -22.237 1.00 0.00 H new ATOM 0 H2 GLY B 1 -12.979 20.779 -22.141 1.00 0.00 H new ATOM 0 H3 GLY B 1 -14.500 20.024 -22.099 1.00 0.00 H new ATOM 0 HA2 GLY B 1 -14.598 21.837 -20.051 1.00 0.00 H new ATOM 0 HA3 GLY B 1 -14.432 20.099 -19.905 1.00 0.00 H new ATOM 1496 N PRO B 2 -12.398 21.523 -18.526 1.00 0.00 N ATOM 1497 CA PRO B 2 -11.111 21.758 -17.876 1.00 0.00 C ATOM 1498 C PRO B 2 -10.340 20.459 -17.588 1.00 0.00 C ATOM 1499 O PRO B 2 -10.012 20.164 -16.440 1.00 0.00 O ATOM 1500 CB PRO B 2 -11.478 22.523 -16.598 1.00 0.00 C ATOM 1501 CG PRO B 2 -12.858 21.982 -16.235 1.00 0.00 C ATOM 1502 CD PRO B 2 -13.498 21.758 -17.602 1.00 0.00 C ATOM 0 HA PRO B 2 -10.426 22.319 -18.513 1.00 0.00 H new ATOM 0 HB2 PRO B 2 -10.755 22.343 -15.802 1.00 0.00 H new ATOM 0 HB3 PRO B 2 -11.502 23.599 -16.769 1.00 0.00 H new ATOM 0 HG2 PRO B 2 -12.793 21.057 -15.662 1.00 0.00 H new ATOM 0 HG3 PRO B 2 -13.426 22.691 -15.633 1.00 0.00 H new ATOM 0 HD2 PRO B 2 -14.178 20.906 -17.580 1.00 0.00 H new ATOM 0 HD3 PRO B 2 -14.084 22.626 -17.905 1.00 0.00 H new ATOM 1510 N ARG B 3 -10.049 19.682 -18.636 1.00 0.00 N ATOM 1511 CA ARG B 3 -9.317 18.426 -18.591 1.00 0.00 C ATOM 1512 C ARG B 3 -8.592 18.269 -19.928 1.00 0.00 C ATOM 1513 O ARG B 3 -9.099 17.617 -20.840 1.00 0.00 O ATOM 1514 CB ARG B 3 -10.240 17.220 -18.326 1.00 0.00 C ATOM 1515 CG ARG B 3 -10.699 17.097 -16.865 1.00 0.00 C ATOM 1516 CD ARG B 3 -12.015 17.830 -16.570 1.00 0.00 C ATOM 1517 NE ARG B 3 -11.920 18.568 -15.298 1.00 0.00 N ATOM 1518 CZ ARG B 3 -12.743 18.502 -14.237 1.00 0.00 C ATOM 1519 NH1 ARG B 3 -13.807 17.687 -14.230 1.00 0.00 N ATOM 1520 NH2 ARG B 3 -12.501 19.272 -13.170 1.00 0.00 N ATOM 0 H ARG B 3 -10.335 19.930 -19.583 1.00 0.00 H new ATOM 0 HA ARG B 3 -8.608 18.450 -17.763 1.00 0.00 H new ATOM 0 HB2 ARG B 3 -11.118 17.299 -18.967 1.00 0.00 H new ATOM 0 HB3 ARG B 3 -9.719 16.306 -18.611 1.00 0.00 H new ATOM 0 HG2 ARG B 3 -10.817 16.042 -16.618 1.00 0.00 H new ATOM 0 HG3 ARG B 3 -9.919 17.492 -16.214 1.00 0.00 H new ATOM 0 HD2 ARG B 3 -12.244 18.521 -17.382 1.00 0.00 H new ATOM 0 HD3 ARG B 3 -12.835 17.113 -16.521 1.00 0.00 H new ATOM 0 HE ARG B 3 -11.131 19.209 -15.212 1.00 0.00 H new ATOM 0 HH11 ARG B 3 -14.006 17.101 -15.041 1.00 0.00 H new ATOM 0 HH12 ARG B 3 -14.418 17.653 -13.414 1.00 0.00 H new ATOM 0 HH21 ARG B 3 -11.698 19.901 -13.167 1.00 0.00 H new ATOM 0 HH22 ARG B 3 -13.119 19.230 -12.360 1.00 0.00 H new ATOM 1534 N LEU B 4 -7.396 18.857 -20.034 1.00 0.00 N ATOM 1535 CA LEU B 4 -6.556 18.815 -21.226 1.00 0.00 C ATOM 1536 C LEU B 4 -6.012 17.403 -21.499 1.00 0.00 C ATOM 1537 O LEU B 4 -5.323 17.194 -22.494 1.00 0.00 O ATOM 1538 CB LEU B 4 -5.442 19.867 -21.058 1.00 0.00 C ATOM 1539 CG LEU B 4 -4.404 19.993 -22.190 1.00 0.00 C ATOM 1540 CD1 LEU B 4 -5.027 20.161 -23.576 1.00 0.00 C ATOM 1541 CD2 LEU B 4 -3.496 21.205 -21.929 1.00 0.00 C ATOM 0 H LEU B 4 -6.978 19.388 -19.270 1.00 0.00 H new ATOM 0 HA LEU B 4 -7.147 19.059 -22.109 1.00 0.00 H new ATOM 0 HB2 LEU B 4 -5.916 20.840 -20.926 1.00 0.00 H new ATOM 0 HB3 LEU B 4 -4.907 19.645 -20.135 1.00 0.00 H new ATOM 0 HG LEU B 4 -3.843 19.058 -22.188 1.00 0.00 H new ATOM 0 HD11 LEU B 4 -4.237 20.243 -24.322 1.00 0.00 H new ATOM 0 HD12 LEU B 4 -5.651 19.296 -23.802 1.00 0.00 H new ATOM 0 HD13 LEU B 4 -5.638 21.063 -23.593 1.00 0.00 H new ATOM 0 HD21 LEU B 4 -2.764 21.290 -22.732 1.00 0.00 H new ATOM 0 HD22 LEU B 4 -4.101 22.111 -21.891 1.00 0.00 H new ATOM 0 HD23 LEU B 4 -2.979 21.074 -20.978 1.00 0.00 H new ATOM 1553 N SER B 5 -6.306 16.411 -20.649 1.00 0.00 N ATOM 1554 CA SER B 5 -5.839 15.043 -20.813 1.00 0.00 C ATOM 1555 C SER B 5 -6.609 14.260 -21.882 1.00 0.00 C ATOM 1556 O SER B 5 -7.071 13.150 -21.623 1.00 0.00 O ATOM 1557 CB SER B 5 -5.869 14.350 -19.453 1.00 0.00 C ATOM 1558 OG SER B 5 -7.197 14.256 -18.983 1.00 0.00 O ATOM 0 H SER B 5 -6.883 16.546 -19.819 1.00 0.00 H new ATOM 0 HA SER B 5 -4.815 15.073 -21.185 1.00 0.00 H new ATOM 0 HB2 SER B 5 -5.433 13.354 -19.534 1.00 0.00 H new ATOM 0 HB3 SER B 5 -5.262 14.907 -18.739 1.00 0.00 H new ATOM 0 HG SER B 5 -7.302 14.816 -18.186 1.00 0.00 H new ATOM 1564 N ARG B 6 -6.723 14.826 -23.087 1.00 0.00 N ATOM 1565 CA ARG B 6 -7.372 14.204 -24.228 1.00 0.00 C ATOM 1566 C ARG B 6 -6.246 13.501 -24.983 1.00 0.00 C ATOM 1567 O ARG B 6 -6.156 12.274 -24.980 1.00 0.00 O ATOM 1568 CB ARG B 6 -8.106 15.276 -25.049 1.00 0.00 C ATOM 1569 CG ARG B 6 -8.907 14.663 -26.202 1.00 0.00 C ATOM 1570 CD ARG B 6 -9.641 15.767 -26.975 1.00 0.00 C ATOM 1571 NE ARG B 6 -10.540 15.214 -28.000 1.00 0.00 N ATOM 1572 CZ ARG B 6 -11.773 14.726 -27.774 1.00 0.00 C ATOM 1573 NH1 ARG B 6 -12.266 14.665 -26.530 1.00 0.00 N ATOM 1574 NH2 ARG B 6 -12.516 14.295 -28.802 1.00 0.00 N ATOM 0 H ARG B 6 -6.354 15.754 -23.294 1.00 0.00 H new ATOM 0 HA ARG B 6 -8.142 13.479 -23.963 1.00 0.00 H new ATOM 0 HB2 ARG B 6 -8.777 15.836 -24.398 1.00 0.00 H new ATOM 0 HB3 ARG B 6 -7.382 15.987 -25.447 1.00 0.00 H new ATOM 0 HG2 ARG B 6 -8.240 14.121 -26.872 1.00 0.00 H new ATOM 0 HG3 ARG B 6 -9.625 13.941 -25.814 1.00 0.00 H new ATOM 0 HD2 ARG B 6 -10.216 16.377 -26.278 1.00 0.00 H new ATOM 0 HD3 ARG B 6 -8.912 16.425 -27.448 1.00 0.00 H new ATOM 0 HE ARG B 6 -10.200 15.199 -28.962 1.00 0.00 H new ATOM 0 HH11 ARG B 6 -11.705 14.990 -25.743 1.00 0.00 H new ATOM 0 HH12 ARG B 6 -13.202 14.293 -26.370 1.00 0.00 H new ATOM 0 HH21 ARG B 6 -12.146 14.338 -29.752 1.00 0.00 H new ATOM 0 HH22 ARG B 6 -13.451 13.924 -28.635 1.00 0.00 H new ATOM 1588 N LEU B 7 -5.359 14.298 -25.591 1.00 0.00 N ATOM 1589 CA LEU B 7 -4.186 13.818 -26.301 1.00 0.00 C ATOM 1590 C LEU B 7 -3.326 12.937 -25.412 1.00 0.00 C ATOM 1591 O LEU B 7 -2.776 11.969 -25.909 1.00 0.00 O ATOM 1592 CB LEU B 7 -3.412 14.975 -26.968 1.00 0.00 C ATOM 1593 CG LEU B 7 -2.761 16.115 -26.146 1.00 0.00 C ATOM 1594 CD1 LEU B 7 -3.665 16.897 -25.204 1.00 0.00 C ATOM 1595 CD2 LEU B 7 -1.514 15.697 -25.363 1.00 0.00 C ATOM 0 H LEU B 7 -5.446 15.314 -25.598 1.00 0.00 H new ATOM 0 HA LEU B 7 -4.518 13.180 -27.120 1.00 0.00 H new ATOM 0 HB2 LEU B 7 -2.616 14.520 -27.558 1.00 0.00 H new ATOM 0 HB3 LEU B 7 -4.099 15.448 -27.670 1.00 0.00 H new ATOM 0 HG LEU B 7 -2.490 16.787 -26.960 1.00 0.00 H new ATOM 0 HD11 LEU B 7 -3.082 17.663 -24.692 1.00 0.00 H new ATOM 0 HD12 LEU B 7 -4.464 17.370 -25.775 1.00 0.00 H new ATOM 0 HD13 LEU B 7 -4.098 16.219 -24.468 1.00 0.00 H new ATOM 0 HD21 LEU B 7 -1.123 16.555 -24.816 1.00 0.00 H new ATOM 0 HD22 LEU B 7 -1.774 14.906 -24.659 1.00 0.00 H new ATOM 0 HD23 LEU B 7 -0.755 15.331 -26.055 1.00 0.00 H new ATOM 1607 N LEU B 8 -3.206 13.245 -24.118 1.00 0.00 N ATOM 1608 CA LEU B 8 -2.350 12.500 -23.206 1.00 0.00 C ATOM 1609 C LEU B 8 -2.753 11.031 -23.064 1.00 0.00 C ATOM 1610 O LEU B 8 -1.952 10.231 -22.588 1.00 0.00 O ATOM 1611 CB LEU B 8 -2.149 13.212 -21.865 1.00 0.00 C ATOM 1612 CG LEU B 8 -1.397 14.570 -21.849 1.00 0.00 C ATOM 1613 CD1 LEU B 8 -0.046 14.604 -22.589 1.00 0.00 C ATOM 1614 CD2 LEU B 8 -2.311 15.755 -22.182 1.00 0.00 C ATOM 0 H LEU B 8 -3.702 14.020 -23.678 1.00 0.00 H new ATOM 0 HA LEU B 8 -1.366 12.478 -23.673 1.00 0.00 H new ATOM 0 HB2 LEU B 8 -3.133 13.374 -21.426 1.00 0.00 H new ATOM 0 HB3 LEU B 8 -1.613 12.529 -21.205 1.00 0.00 H new ATOM 0 HG LEU B 8 -1.097 14.687 -20.808 1.00 0.00 H new ATOM 0 HD11 LEU B 8 0.387 15.601 -22.511 1.00 0.00 H new ATOM 0 HD12 LEU B 8 0.633 13.878 -22.141 1.00 0.00 H new ATOM 0 HD13 LEU B 8 -0.200 14.357 -23.639 1.00 0.00 H new ATOM 0 HD21 LEU B 8 -1.733 16.679 -22.156 1.00 0.00 H new ATOM 0 HD22 LEU B 8 -2.735 15.619 -23.177 1.00 0.00 H new ATOM 0 HD23 LEU B 8 -3.116 15.810 -21.449 1.00 0.00 H new ATOM 1626 N SER B 9 -3.954 10.646 -23.517 1.00 0.00 N ATOM 1627 CA SER B 9 -4.363 9.248 -23.506 1.00 0.00 C ATOM 1628 C SER B 9 -3.445 8.423 -24.430 1.00 0.00 C ATOM 1629 O SER B 9 -3.434 7.197 -24.346 1.00 0.00 O ATOM 1630 CB SER B 9 -5.826 9.138 -23.948 1.00 0.00 C ATOM 1631 OG SER B 9 -6.285 7.812 -23.785 1.00 0.00 O ATOM 0 H SER B 9 -4.653 11.287 -23.893 1.00 0.00 H new ATOM 0 HA SER B 9 -4.274 8.850 -22.495 1.00 0.00 H new ATOM 0 HB2 SER B 9 -6.443 9.819 -23.362 1.00 0.00 H new ATOM 0 HB3 SER B 9 -5.922 9.439 -24.991 1.00 0.00 H new ATOM 0 HG SER B 9 -5.527 7.194 -23.847 1.00 0.00 H new ATOM 1637 N TYR B 10 -2.683 9.095 -25.307 1.00 0.00 N ATOM 1638 CA TYR B 10 -1.747 8.518 -26.259 1.00 0.00 C ATOM 1639 C TYR B 10 -0.448 7.990 -25.630 1.00 0.00 C ATOM 1640 O TYR B 10 0.382 7.445 -26.355 1.00 0.00 O ATOM 1641 CB TYR B 10 -1.423 9.594 -27.320 1.00 0.00 C ATOM 1642 CG TYR B 10 -0.532 10.783 -26.936 1.00 0.00 C ATOM 1643 CD1 TYR B 10 -0.175 11.077 -25.601 1.00 0.00 C ATOM 1644 CD2 TYR B 10 -0.066 11.635 -27.953 1.00 0.00 C ATOM 1645 CE1 TYR B 10 0.646 12.168 -25.286 1.00 0.00 C ATOM 1646 CE2 TYR B 10 0.757 12.729 -27.639 1.00 0.00 C ATOM 1647 CZ TYR B 10 1.121 12.996 -26.310 1.00 0.00 C ATOM 1648 OH TYR B 10 1.919 14.062 -26.014 1.00 0.00 O ATOM 0 H TYR B 10 -2.712 10.113 -25.367 1.00 0.00 H new ATOM 0 HA TYR B 10 -2.227 7.644 -26.699 1.00 0.00 H new ATOM 0 HB2 TYR B 10 -0.951 9.090 -28.164 1.00 0.00 H new ATOM 0 HB3 TYR B 10 -2.370 9.997 -27.678 1.00 0.00 H new ATOM 0 HD1 TYR B 10 -0.543 10.447 -24.805 1.00 0.00 H new ATOM 0 HD2 TYR B 10 -0.342 11.447 -28.980 1.00 0.00 H new ATOM 0 HE1 TYR B 10 0.911 12.369 -24.258 1.00 0.00 H new ATOM 0 HE2 TYR B 10 1.114 13.372 -28.430 1.00 0.00 H new ATOM 0 HH TYR B 10 2.343 14.391 -26.834 1.00 0.00 H new ATOM 1658 N ALA B 11 -0.238 8.178 -24.318 1.00 0.00 N ATOM 1659 CA ALA B 11 0.995 7.803 -23.647 1.00 0.00 C ATOM 1660 C ALA B 11 0.747 7.635 -22.148 1.00 0.00 C ATOM 1661 O ALA B 11 1.087 6.544 -21.641 1.00 0.00 O ATOM 1662 CB ALA B 11 2.029 8.910 -23.913 1.00 0.00 C ATOM 1663 OXT ALA B 11 0.444 8.664 -21.505 1.00 0.00 O ATOM 0 H ALA B 11 -0.930 8.598 -23.697 1.00 0.00 H new ATOM 0 HA ALA B 11 1.366 6.851 -24.026 1.00 0.00 H new ATOM 0 HB1 ALA B 11 2.968 8.657 -23.421 1.00 0.00 H new ATOM 0 HB2 ALA B 11 2.195 9.002 -24.986 1.00 0.00 H new ATOM 0 HB3 ALA B 11 1.658 9.857 -23.521 1.00 0.00 H new TER 1669 ALA B 11