USER MOD reduce.3.24.130724 H: found=0, std=0, add=783, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 780 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 57 GLN : amide:sc= 1.22 K(o=1.6,f=-0.63) USER MOD Set 1.2: A 59 TYR OH : rot -147:sc= 0.342 USER MOD Set 2.1: A 47 MET CE :methyl 164:sc= -0.104 (180deg=-0.369) USER MOD Set 2.2: A 56 HIS : no HD1:sc= 1.35 K(o=1.2,f=-7.7!) USER MOD Single : A 1 GLY N :NH3+ -114:sc= 0.0503 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc=0.000363 USER MOD Single : A 3 SER OG : rot 180:sc= 0.0372 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 10 SER OG : rot 130:sc= 0 USER MOD Single : A 13 ASN : amide:sc= -0.242 K(o=-0.24,f=-5.6!) USER MOD Single : A 14 GLN : amide:sc=-0.00858 X(o=-0.0086,f=-0.43) USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ -148:sc= 1.34 (180deg=1.06) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 38 GLN : amide:sc= 0.963 K(o=0.96,f=0) USER MOD Single : A 44 ASN : amide:sc= 0.85 K(o=0.85,f=-0.36) USER MOD Single : A 45 THR OG1 : rot 178:sc= 0.193 USER MOD Single : A 46 HIS : no HD1:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 49 LYS NZ :NH3+ -165:sc= 2.44 (180deg=1.68) USER MOD Single : A 53 THR OG1 : rot -54:sc= 0.724 USER MOD Single : A 55 GLN : amide:sc= 0.79 K(o=0.79,f=-0.016) USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 72 TYR OH : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 MET CE :methyl -144:sc= -0.132 (180deg=-2.01!) USER MOD Single : A 79 MET CE :methyl -170:sc= 0 (180deg=-0.103) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 TYR OH : rot 30:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ 173:sc= 1.25 (180deg=1.19) USER MOD Single : A 90 ASN : amide:sc= 0.397 K(o=0.4,f=-3.5!) USER MOD Single : A 91 LYS NZ :NH3+ -169:sc= 2.44 (180deg=2.29) USER MOD Single : A 93 SER OG : rot -170:sc= 0 USER MOD Single : A 95 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 96 ASN : amide:sc= 0.634 K(o=0.63,f=-0.14) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 ASN : amide:sc= 0.394 K(o=0.39,f=-2!) USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot 180:sc= 0.00111 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 15.798 2.861 24.656 1.00 0.00 N ATOM 2 CA GLY A 1 15.927 2.856 23.182 1.00 0.00 C ATOM 3 C GLY A 1 17.379 2.737 22.738 1.00 0.00 C ATOM 4 O GLY A 1 18.302 2.995 23.515 1.00 0.00 O ATOM 0 H1 GLY A 1 15.298 2.003 24.964 1.00 0.00 H new ATOM 0 H2 GLY A 1 16.744 2.884 25.087 1.00 0.00 H new ATOM 0 H3 GLY A 1 15.261 3.700 24.955 1.00 0.00 H new ATOM 0 HA2 GLY A 1 15.353 2.026 22.770 1.00 0.00 H new ATOM 0 HA3 GLY A 1 15.498 3.773 22.777 1.00 0.00 H new ATOM 10 N SER A 2 17.596 2.349 21.479 1.00 0.00 N ATOM 11 CA SER A 2 18.925 2.226 20.852 1.00 0.00 C ATOM 12 C SER A 2 19.535 3.582 20.451 1.00 0.00 C ATOM 13 O SER A 2 18.834 4.592 20.323 1.00 0.00 O ATOM 14 CB SER A 2 18.847 1.276 19.647 1.00 0.00 C ATOM 15 OG SER A 2 17.849 1.696 18.725 1.00 0.00 O ATOM 0 H SER A 2 16.835 2.104 20.846 1.00 0.00 H new ATOM 0 HA SER A 2 19.597 1.808 21.601 1.00 0.00 H new ATOM 0 HB2 SER A 2 19.815 1.238 19.147 1.00 0.00 H new ATOM 0 HB3 SER A 2 18.626 0.266 19.991 1.00 0.00 H new ATOM 0 HG SER A 2 17.822 1.075 17.967 1.00 0.00 H new ATOM 21 N SER A 3 20.859 3.613 20.257 1.00 0.00 N ATOM 22 CA SER A 3 21.602 4.812 19.833 1.00 0.00 C ATOM 23 C SER A 3 21.316 5.197 18.373 1.00 0.00 C ATOM 24 O SER A 3 21.166 4.330 17.508 1.00 0.00 O ATOM 25 CB SER A 3 23.107 4.591 20.033 1.00 0.00 C ATOM 26 OG SER A 3 23.835 5.744 19.640 1.00 0.00 O ATOM 0 H SER A 3 21.455 2.796 20.391 1.00 0.00 H new ATOM 0 HA SER A 3 21.262 5.640 20.455 1.00 0.00 H new ATOM 0 HB2 SER A 3 23.311 4.364 21.079 1.00 0.00 H new ATOM 0 HB3 SER A 3 23.435 3.730 19.450 1.00 0.00 H new ATOM 0 HG SER A 3 24.793 5.588 19.775 1.00 0.00 H new ATOM 32 N GLY A 4 21.308 6.503 18.080 1.00 0.00 N ATOM 33 CA GLY A 4 21.193 7.045 16.718 1.00 0.00 C ATOM 34 C GLY A 4 22.406 6.763 15.814 1.00 0.00 C ATOM 35 O GLY A 4 22.322 6.932 14.596 1.00 0.00 O ATOM 0 H GLY A 4 21.383 7.227 18.795 1.00 0.00 H new ATOM 0 HA2 GLY A 4 20.302 6.628 16.249 1.00 0.00 H new ATOM 0 HA3 GLY A 4 21.046 8.123 16.781 1.00 0.00 H new ATOM 39 N SER A 5 23.523 6.293 16.384 1.00 0.00 N ATOM 40 CA SER A 5 24.750 5.914 15.658 1.00 0.00 C ATOM 41 C SER A 5 24.699 4.511 15.021 1.00 0.00 C ATOM 42 O SER A 5 25.703 4.044 14.476 1.00 0.00 O ATOM 43 CB SER A 5 25.969 6.038 16.586 1.00 0.00 C ATOM 44 OG SER A 5 26.084 7.361 17.096 1.00 0.00 O ATOM 0 H SER A 5 23.604 6.161 17.392 1.00 0.00 H new ATOM 0 HA SER A 5 24.837 6.612 14.825 1.00 0.00 H new ATOM 0 HB2 SER A 5 25.876 5.332 17.411 1.00 0.00 H new ATOM 0 HB3 SER A 5 26.875 5.774 16.041 1.00 0.00 H new ATOM 0 HG SER A 5 26.865 7.418 17.685 1.00 0.00 H new ATOM 50 N SER A 6 23.555 3.818 15.078 1.00 0.00 N ATOM 51 CA SER A 6 23.376 2.444 14.572 1.00 0.00 C ATOM 52 C SER A 6 23.433 2.306 13.041 1.00 0.00 C ATOM 53 O SER A 6 23.712 1.215 12.533 1.00 0.00 O ATOM 54 CB SER A 6 22.046 1.882 15.089 1.00 0.00 C ATOM 55 OG SER A 6 20.953 2.648 14.603 1.00 0.00 O ATOM 0 H SER A 6 22.704 4.204 15.487 1.00 0.00 H new ATOM 0 HA SER A 6 24.225 1.875 14.950 1.00 0.00 H new ATOM 0 HB2 SER A 6 21.937 0.844 14.774 1.00 0.00 H new ATOM 0 HB3 SER A 6 22.043 1.886 16.179 1.00 0.00 H new ATOM 0 HG SER A 6 20.114 2.273 14.943 1.00 0.00 H new ATOM 61 N GLY A 7 23.195 3.389 12.293 1.00 0.00 N ATOM 62 CA GLY A 7 23.239 3.419 10.826 1.00 0.00 C ATOM 63 C GLY A 7 22.799 4.763 10.219 1.00 0.00 C ATOM 64 O GLY A 7 22.592 5.730 10.958 1.00 0.00 O ATOM 0 H GLY A 7 22.960 4.293 12.702 1.00 0.00 H new ATOM 0 HA2 GLY A 7 24.255 3.198 10.498 1.00 0.00 H new ATOM 0 HA3 GLY A 7 22.598 2.628 10.436 1.00 0.00 H new ATOM 68 N PRO A 8 22.632 4.842 8.881 1.00 0.00 N ATOM 69 CA PRO A 8 22.287 6.086 8.176 1.00 0.00 C ATOM 70 C PRO A 8 20.898 6.662 8.508 1.00 0.00 C ATOM 71 O PRO A 8 20.676 7.863 8.340 1.00 0.00 O ATOM 72 CB PRO A 8 22.387 5.747 6.683 1.00 0.00 C ATOM 73 CG PRO A 8 23.352 4.565 6.641 1.00 0.00 C ATOM 74 CD PRO A 8 22.993 3.810 7.917 1.00 0.00 C ATOM 0 HA PRO A 8 22.971 6.873 8.492 1.00 0.00 H new ATOM 0 HB2 PRO A 8 21.415 5.484 6.267 1.00 0.00 H new ATOM 0 HB3 PRO A 8 22.763 6.591 6.106 1.00 0.00 H new ATOM 0 HG2 PRO A 8 23.207 3.952 5.751 1.00 0.00 H new ATOM 0 HG3 PRO A 8 24.393 4.889 6.639 1.00 0.00 H new ATOM 0 HD2 PRO A 8 22.165 3.122 7.748 1.00 0.00 H new ATOM 0 HD3 PRO A 8 23.834 3.215 8.273 1.00 0.00 H new ATOM 82 N ILE A 9 19.961 5.822 8.968 1.00 0.00 N ATOM 83 CA ILE A 9 18.587 6.198 9.336 1.00 0.00 C ATOM 84 C ILE A 9 18.072 5.374 10.527 1.00 0.00 C ATOM 85 O ILE A 9 18.099 4.140 10.501 1.00 0.00 O ATOM 86 CB ILE A 9 17.642 6.113 8.105 1.00 0.00 C ATOM 87 CG1 ILE A 9 16.198 6.514 8.483 1.00 0.00 C ATOM 88 CG2 ILE A 9 17.669 4.738 7.402 1.00 0.00 C ATOM 89 CD1 ILE A 9 15.266 6.737 7.287 1.00 0.00 C ATOM 0 H ILE A 9 20.144 4.827 9.099 1.00 0.00 H new ATOM 0 HA ILE A 9 18.598 7.237 9.664 1.00 0.00 H new ATOM 0 HB ILE A 9 18.027 6.831 7.381 1.00 0.00 H new ATOM 0 HG12 ILE A 9 15.773 5.737 9.118 1.00 0.00 H new ATOM 0 HG13 ILE A 9 16.232 7.428 9.076 1.00 0.00 H new ATOM 0 HG21 ILE A 9 16.986 4.750 6.552 1.00 0.00 H new ATOM 0 HG22 ILE A 9 18.680 4.528 7.052 1.00 0.00 H new ATOM 0 HG23 ILE A 9 17.360 3.964 8.105 1.00 0.00 H new ATOM 0 HD11 ILE A 9 14.275 7.015 7.645 1.00 0.00 H new ATOM 0 HD12 ILE A 9 15.663 7.536 6.661 1.00 0.00 H new ATOM 0 HD13 ILE A 9 15.197 5.819 6.703 1.00 0.00 H new ATOM 101 N SER A 10 17.548 6.062 11.544 1.00 0.00 N ATOM 102 CA SER A 10 16.818 5.466 12.680 1.00 0.00 C ATOM 103 C SER A 10 15.292 5.595 12.544 1.00 0.00 C ATOM 104 O SER A 10 14.545 4.883 13.212 1.00 0.00 O ATOM 105 CB SER A 10 17.275 6.103 14.001 1.00 0.00 C ATOM 106 OG SER A 10 18.682 6.011 14.162 1.00 0.00 O ATOM 0 H SER A 10 17.618 7.078 11.608 1.00 0.00 H new ATOM 0 HA SER A 10 17.054 4.402 12.678 1.00 0.00 H new ATOM 0 HB2 SER A 10 16.972 7.150 14.025 1.00 0.00 H new ATOM 0 HB3 SER A 10 16.779 5.608 14.836 1.00 0.00 H new ATOM 0 HG SER A 10 19.043 6.892 14.392 1.00 0.00 H new ATOM 112 N GLU A 11 14.806 6.459 11.644 1.00 0.00 N ATOM 113 CA GLU A 11 13.378 6.734 11.389 1.00 0.00 C ATOM 114 C GLU A 11 12.748 5.727 10.394 1.00 0.00 C ATOM 115 O GLU A 11 11.878 6.058 9.586 1.00 0.00 O ATOM 116 CB GLU A 11 13.229 8.215 10.980 1.00 0.00 C ATOM 117 CG GLU A 11 11.825 8.786 11.229 1.00 0.00 C ATOM 118 CD GLU A 11 11.795 10.302 10.949 1.00 0.00 C ATOM 119 OE1 GLU A 11 11.953 11.102 11.905 1.00 0.00 O ATOM 120 OE2 GLU A 11 11.610 10.708 9.775 1.00 0.00 O ATOM 0 H GLU A 11 15.420 7.012 11.046 1.00 0.00 H new ATOM 0 HA GLU A 11 12.801 6.581 12.301 1.00 0.00 H new ATOM 0 HB2 GLU A 11 13.957 8.810 11.532 1.00 0.00 H new ATOM 0 HB3 GLU A 11 13.471 8.317 9.922 1.00 0.00 H new ATOM 0 HG2 GLU A 11 11.102 8.279 10.590 1.00 0.00 H new ATOM 0 HG3 GLU A 11 11.527 8.596 12.260 1.00 0.00 H new ATOM 127 N ARG A 12 13.214 4.472 10.433 1.00 0.00 N ATOM 128 CA ARG A 12 12.899 3.378 9.491 1.00 0.00 C ATOM 129 C ARG A 12 11.546 2.687 9.761 1.00 0.00 C ATOM 130 O ARG A 12 11.447 1.460 9.764 1.00 0.00 O ATOM 131 CB ARG A 12 14.109 2.427 9.385 1.00 0.00 C ATOM 132 CG ARG A 12 14.497 1.747 10.710 1.00 0.00 C ATOM 133 CD ARG A 12 15.646 0.752 10.517 1.00 0.00 C ATOM 134 NE ARG A 12 16.935 1.427 10.267 1.00 0.00 N ATOM 135 CZ ARG A 12 18.059 0.865 9.865 1.00 0.00 C ATOM 136 NH1 ARG A 12 19.123 1.601 9.739 1.00 0.00 N ATOM 137 NH2 ARG A 12 18.155 -0.405 9.593 1.00 0.00 N ATOM 0 H ARG A 12 13.859 4.170 11.163 1.00 0.00 H new ATOM 0 HA ARG A 12 12.739 3.808 8.503 1.00 0.00 H new ATOM 0 HB2 ARG A 12 13.888 1.657 8.646 1.00 0.00 H new ATOM 0 HB3 ARG A 12 14.966 2.988 9.013 1.00 0.00 H new ATOM 0 HG2 ARG A 12 14.789 2.505 11.437 1.00 0.00 H new ATOM 0 HG3 ARG A 12 13.631 1.228 11.121 1.00 0.00 H new ATOM 0 HD2 ARG A 12 15.733 0.124 11.404 1.00 0.00 H new ATOM 0 HD3 ARG A 12 15.416 0.092 9.681 1.00 0.00 H new ATOM 0 HE ARG A 12 16.959 2.435 10.421 1.00 0.00 H new ATOM 0 HH11 ARG A 12 19.081 2.598 9.950 1.00 0.00 H new ATOM 0 HH12 ARG A 12 20.000 1.181 9.429 1.00 0.00 H new ATOM 0 HH21 ARG A 12 17.339 -1.010 9.688 1.00 0.00 H new ATOM 0 HH22 ARG A 12 19.046 -0.795 9.285 1.00 0.00 H new ATOM 151 N ASN A 13 10.505 3.477 10.030 1.00 0.00 N ATOM 152 CA ASN A 13 9.173 3.005 10.426 1.00 0.00 C ATOM 153 C ASN A 13 8.474 2.219 9.293 1.00 0.00 C ATOM 154 O ASN A 13 8.001 2.801 8.314 1.00 0.00 O ATOM 155 CB ASN A 13 8.354 4.223 10.907 1.00 0.00 C ATOM 156 CG ASN A 13 6.964 3.869 11.421 1.00 0.00 C ATOM 157 OD1 ASN A 13 6.473 2.758 11.285 1.00 0.00 O ATOM 158 ND2 ASN A 13 6.277 4.807 12.028 1.00 0.00 N ATOM 0 H ASN A 13 10.565 4.494 9.977 1.00 0.00 H new ATOM 0 HA ASN A 13 9.262 2.292 11.245 1.00 0.00 H new ATOM 0 HB2 ASN A 13 8.906 4.729 11.699 1.00 0.00 H new ATOM 0 HB3 ASN A 13 8.257 4.931 10.084 1.00 0.00 H new ATOM 0 HD21 ASN A 13 5.342 4.606 12.382 1.00 0.00 H new ATOM 0 HD22 ASN A 13 6.678 5.737 12.146 1.00 0.00 H new ATOM 165 N GLN A 14 8.377 0.895 9.452 1.00 0.00 N ATOM 166 CA GLN A 14 7.744 -0.008 8.481 1.00 0.00 C ATOM 167 C GLN A 14 6.217 -0.117 8.665 1.00 0.00 C ATOM 168 O GLN A 14 5.512 -0.435 7.712 1.00 0.00 O ATOM 169 CB GLN A 14 8.451 -1.375 8.555 1.00 0.00 C ATOM 170 CG GLN A 14 8.126 -2.337 7.395 1.00 0.00 C ATOM 171 CD GLN A 14 8.616 -1.885 6.017 1.00 0.00 C ATOM 172 OE1 GLN A 14 9.360 -0.926 5.847 1.00 0.00 O ATOM 173 NE2 GLN A 14 8.240 -2.583 4.966 1.00 0.00 N ATOM 0 H GLN A 14 8.742 0.411 10.272 1.00 0.00 H new ATOM 0 HA GLN A 14 7.866 0.407 7.480 1.00 0.00 H new ATOM 0 HB2 GLN A 14 9.528 -1.210 8.580 1.00 0.00 H new ATOM 0 HB3 GLN A 14 8.181 -1.857 9.494 1.00 0.00 H new ATOM 0 HG2 GLN A 14 8.564 -3.310 7.618 1.00 0.00 H new ATOM 0 HG3 GLN A 14 7.046 -2.476 7.351 1.00 0.00 H new ATOM 0 HE21 GLN A 14 7.621 -3.386 5.082 1.00 0.00 H new ATOM 0 HE22 GLN A 14 8.568 -2.321 4.036 1.00 0.00 H new ATOM 182 N ASP A 15 5.669 0.214 9.841 1.00 0.00 N ATOM 183 CA ASP A 15 4.213 0.295 10.058 1.00 0.00 C ATOM 184 C ASP A 15 3.574 1.488 9.325 1.00 0.00 C ATOM 185 O ASP A 15 2.400 1.431 8.961 1.00 0.00 O ATOM 186 CB ASP A 15 3.902 0.344 11.559 1.00 0.00 C ATOM 187 CG ASP A 15 4.007 -1.045 12.200 1.00 0.00 C ATOM 188 OD1 ASP A 15 3.099 -1.874 11.958 1.00 0.00 O ATOM 189 OD2 ASP A 15 4.984 -1.304 12.943 1.00 0.00 O ATOM 0 H ASP A 15 6.220 0.434 10.671 1.00 0.00 H new ATOM 0 HA ASP A 15 3.770 -0.606 9.633 1.00 0.00 H new ATOM 0 HB2 ASP A 15 4.593 1.027 12.053 1.00 0.00 H new ATOM 0 HB3 ASP A 15 2.898 0.741 11.711 1.00 0.00 H new ATOM 194 N ALA A 16 4.351 2.539 9.040 1.00 0.00 N ATOM 195 CA ALA A 16 3.953 3.634 8.152 1.00 0.00 C ATOM 196 C ALA A 16 3.994 3.246 6.654 1.00 0.00 C ATOM 197 O ALA A 16 3.659 4.061 5.794 1.00 0.00 O ATOM 198 CB ALA A 16 4.808 4.867 8.470 1.00 0.00 C ATOM 0 H ALA A 16 5.288 2.653 9.426 1.00 0.00 H new ATOM 0 HA ALA A 16 2.906 3.872 8.341 1.00 0.00 H new ATOM 0 HB1 ALA A 16 4.520 5.689 7.814 1.00 0.00 H new ATOM 0 HB2 ALA A 16 4.652 5.160 9.508 1.00 0.00 H new ATOM 0 HB3 ALA A 16 5.860 4.630 8.314 1.00 0.00 H new ATOM 204 N THR A 17 4.372 2.004 6.325 1.00 0.00 N ATOM 205 CA THR A 17 4.249 1.417 4.982 1.00 0.00 C ATOM 206 C THR A 17 3.088 0.421 4.970 1.00 0.00 C ATOM 207 O THR A 17 2.951 -0.403 5.876 1.00 0.00 O ATOM 208 CB THR A 17 5.565 0.762 4.523 1.00 0.00 C ATOM 209 OG1 THR A 17 6.622 1.694 4.621 1.00 0.00 O ATOM 210 CG2 THR A 17 5.551 0.305 3.062 1.00 0.00 C ATOM 0 H THR A 17 4.783 1.362 7.003 1.00 0.00 H new ATOM 0 HA THR A 17 4.038 2.213 4.268 1.00 0.00 H new ATOM 0 HB THR A 17 5.692 -0.106 5.170 1.00 0.00 H new ATOM 0 HG1 THR A 17 7.458 1.273 4.330 1.00 0.00 H new ATOM 0 HG21 THR A 17 6.512 -0.146 2.813 1.00 0.00 H new ATOM 0 HG22 THR A 17 4.757 -0.428 2.918 1.00 0.00 H new ATOM 0 HG23 THR A 17 5.374 1.163 2.414 1.00 0.00 H new ATOM 218 N VAL A 18 2.245 0.478 3.939 1.00 0.00 N ATOM 219 CA VAL A 18 1.184 -0.513 3.689 1.00 0.00 C ATOM 220 C VAL A 18 1.638 -1.522 2.638 1.00 0.00 C ATOM 221 O VAL A 18 2.382 -1.176 1.722 1.00 0.00 O ATOM 222 CB VAL A 18 -0.172 0.127 3.315 1.00 0.00 C ATOM 223 CG1 VAL A 18 -0.580 1.196 4.332 1.00 0.00 C ATOM 224 CG2 VAL A 18 -0.191 0.791 1.938 1.00 0.00 C ATOM 0 H VAL A 18 2.276 1.222 3.241 1.00 0.00 H new ATOM 0 HA VAL A 18 1.011 -1.038 4.628 1.00 0.00 H new ATOM 0 HB VAL A 18 -0.870 -0.710 3.308 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -1.538 1.628 4.042 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -0.671 0.743 5.319 1.00 0.00 H new ATOM 0 HG13 VAL A 18 0.177 1.979 4.360 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -1.178 1.215 1.752 1.00 0.00 H new ATOM 0 HG22 VAL A 18 0.557 1.583 1.906 1.00 0.00 H new ATOM 0 HG23 VAL A 18 0.034 0.048 1.173 1.00 0.00 H new ATOM 234 N TYR A 19 1.166 -2.757 2.760 1.00 0.00 N ATOM 235 CA TYR A 19 1.282 -3.818 1.761 1.00 0.00 C ATOM 236 C TYR A 19 0.006 -3.846 0.909 1.00 0.00 C ATOM 237 O TYR A 19 -1.090 -3.659 1.439 1.00 0.00 O ATOM 238 CB TYR A 19 1.500 -5.159 2.479 1.00 0.00 C ATOM 239 CG TYR A 19 1.240 -6.384 1.619 1.00 0.00 C ATOM 240 CD1 TYR A 19 -0.017 -7.024 1.674 1.00 0.00 C ATOM 241 CD2 TYR A 19 2.233 -6.867 0.746 1.00 0.00 C ATOM 242 CE1 TYR A 19 -0.278 -8.147 0.866 1.00 0.00 C ATOM 243 CE2 TYR A 19 1.978 -7.997 -0.055 1.00 0.00 C ATOM 244 CZ TYR A 19 0.724 -8.640 0.001 1.00 0.00 C ATOM 245 OH TYR A 19 0.491 -9.735 -0.774 1.00 0.00 O ATOM 0 H TYR A 19 0.668 -3.062 3.596 1.00 0.00 H new ATOM 0 HA TYR A 19 2.132 -3.636 1.103 1.00 0.00 H new ATOM 0 HB2 TYR A 19 2.526 -5.198 2.844 1.00 0.00 H new ATOM 0 HB3 TYR A 19 0.849 -5.199 3.352 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -0.782 -6.651 2.339 1.00 0.00 H new ATOM 0 HD2 TYR A 19 3.191 -6.371 0.690 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -1.243 -8.631 0.907 1.00 0.00 H new ATOM 0 HE2 TYR A 19 2.746 -8.373 -0.715 1.00 0.00 H new ATOM 0 HH TYR A 19 1.289 -9.934 -1.308 1.00 0.00 H new ATOM 255 N VAL A 20 0.146 -4.099 -0.395 1.00 0.00 N ATOM 256 CA VAL A 20 -0.950 -4.203 -1.369 1.00 0.00 C ATOM 257 C VAL A 20 -0.748 -5.451 -2.232 1.00 0.00 C ATOM 258 O VAL A 20 0.138 -5.479 -3.084 1.00 0.00 O ATOM 259 CB VAL A 20 -1.025 -2.949 -2.266 1.00 0.00 C ATOM 260 CG1 VAL A 20 -2.269 -3.034 -3.159 1.00 0.00 C ATOM 261 CG2 VAL A 20 -1.095 -1.637 -1.471 1.00 0.00 C ATOM 0 H VAL A 20 1.062 -4.243 -0.821 1.00 0.00 H new ATOM 0 HA VAL A 20 -1.890 -4.280 -0.822 1.00 0.00 H new ATOM 0 HB VAL A 20 -0.107 -2.934 -2.853 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -2.323 -2.149 -3.793 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -2.208 -3.925 -3.784 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -3.161 -3.089 -2.536 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -1.146 -0.795 -2.162 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -1.983 -1.642 -0.839 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -0.206 -1.542 -0.847 1.00 0.00 H new ATOM 271 N GLY A 21 -1.574 -6.478 -2.041 1.00 0.00 N ATOM 272 CA GLY A 21 -1.576 -7.702 -2.847 1.00 0.00 C ATOM 273 C GLY A 21 -2.717 -7.745 -3.866 1.00 0.00 C ATOM 274 O GLY A 21 -3.788 -7.181 -3.637 1.00 0.00 O ATOM 0 H GLY A 21 -2.279 -6.484 -1.304 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -0.624 -7.787 -3.372 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -1.654 -8.565 -2.186 1.00 0.00 H new ATOM 278 N GLY A 22 -2.506 -8.450 -4.977 1.00 0.00 N ATOM 279 CA GLY A 22 -3.537 -8.734 -5.989 1.00 0.00 C ATOM 280 C GLY A 22 -3.601 -7.700 -7.118 1.00 0.00 C ATOM 281 O GLY A 22 -4.685 -7.368 -7.598 1.00 0.00 O ATOM 0 H GLY A 22 -1.597 -8.850 -5.208 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -3.348 -9.717 -6.420 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -4.509 -8.783 -5.499 1.00 0.00 H new ATOM 285 N LEU A 23 -2.445 -7.162 -7.512 1.00 0.00 N ATOM 286 CA LEU A 23 -2.303 -6.077 -8.479 1.00 0.00 C ATOM 287 C LEU A 23 -2.434 -6.585 -9.917 1.00 0.00 C ATOM 288 O LEU A 23 -1.976 -7.679 -10.254 1.00 0.00 O ATOM 289 CB LEU A 23 -0.943 -5.387 -8.275 1.00 0.00 C ATOM 290 CG LEU A 23 -0.751 -4.724 -6.901 1.00 0.00 C ATOM 291 CD1 LEU A 23 0.636 -4.092 -6.845 1.00 0.00 C ATOM 292 CD2 LEU A 23 -1.801 -3.646 -6.636 1.00 0.00 C ATOM 0 H LEU A 23 -1.548 -7.485 -7.150 1.00 0.00 H new ATOM 0 HA LEU A 23 -3.106 -5.359 -8.313 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -0.153 -6.124 -8.420 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -0.817 -4.629 -9.048 1.00 0.00 H new ATOM 0 HG LEU A 23 -0.860 -5.494 -6.137 1.00 0.00 H new ATOM 0 HD11 LEU A 23 0.781 -3.619 -5.874 1.00 0.00 H new ATOM 0 HD12 LEU A 23 1.393 -4.863 -6.990 1.00 0.00 H new ATOM 0 HD13 LEU A 23 0.726 -3.342 -7.631 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -1.629 -3.204 -5.655 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -1.729 -2.872 -7.401 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -2.795 -4.092 -6.663 1.00 0.00 H new ATOM 304 N ASP A 24 -3.018 -5.757 -10.781 1.00 0.00 N ATOM 305 CA ASP A 24 -3.132 -6.035 -12.214 1.00 0.00 C ATOM 306 C ASP A 24 -1.845 -5.671 -12.982 1.00 0.00 C ATOM 307 O ASP A 24 -1.075 -4.808 -12.557 1.00 0.00 O ATOM 308 CB ASP A 24 -4.353 -5.279 -12.758 1.00 0.00 C ATOM 309 CG ASP A 24 -4.617 -5.601 -14.228 1.00 0.00 C ATOM 310 OD1 ASP A 24 -4.144 -4.841 -15.101 1.00 0.00 O ATOM 311 OD2 ASP A 24 -5.273 -6.630 -14.508 1.00 0.00 O ATOM 0 H ASP A 24 -3.430 -4.866 -10.505 1.00 0.00 H new ATOM 0 HA ASP A 24 -3.269 -7.106 -12.362 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -5.232 -5.537 -12.167 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -4.196 -4.206 -12.644 1.00 0.00 H new ATOM 316 N GLU A 25 -1.609 -6.281 -14.146 1.00 0.00 N ATOM 317 CA GLU A 25 -0.440 -5.998 -14.999 1.00 0.00 C ATOM 318 C GLU A 25 -0.319 -4.527 -15.459 1.00 0.00 C ATOM 319 O GLU A 25 0.782 -4.083 -15.794 1.00 0.00 O ATOM 320 CB GLU A 25 -0.428 -6.961 -16.199 1.00 0.00 C ATOM 321 CG GLU A 25 -1.611 -6.786 -17.164 1.00 0.00 C ATOM 322 CD GLU A 25 -1.520 -7.790 -18.331 1.00 0.00 C ATOM 323 OE1 GLU A 25 -2.036 -8.927 -18.202 1.00 0.00 O ATOM 324 OE2 GLU A 25 -0.938 -7.448 -19.388 1.00 0.00 O ATOM 0 H GLU A 25 -2.228 -6.994 -14.532 1.00 0.00 H new ATOM 0 HA GLU A 25 0.440 -6.164 -14.378 1.00 0.00 H new ATOM 0 HB2 GLU A 25 0.501 -6.821 -16.752 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -0.426 -7.986 -15.827 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -2.548 -6.930 -16.627 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -1.620 -5.768 -17.554 1.00 0.00 H new ATOM 331 N LYS A 26 -1.415 -3.751 -15.435 1.00 0.00 N ATOM 332 CA LYS A 26 -1.435 -2.307 -15.742 1.00 0.00 C ATOM 333 C LYS A 26 -1.008 -1.404 -14.569 1.00 0.00 C ATOM 334 O LYS A 26 -0.808 -0.205 -14.771 1.00 0.00 O ATOM 335 CB LYS A 26 -2.826 -1.921 -16.274 1.00 0.00 C ATOM 336 CG LYS A 26 -3.124 -2.600 -17.623 1.00 0.00 C ATOM 337 CD LYS A 26 -4.487 -2.207 -18.212 1.00 0.00 C ATOM 338 CE LYS A 26 -5.700 -2.621 -17.364 1.00 0.00 C ATOM 339 NZ LYS A 26 -5.786 -4.092 -17.176 1.00 0.00 N ATOM 0 H LYS A 26 -2.336 -4.118 -15.196 1.00 0.00 H new ATOM 0 HA LYS A 26 -0.680 -2.133 -16.509 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -3.586 -2.206 -15.547 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -2.885 -0.839 -16.390 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -2.340 -2.340 -18.334 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -3.090 -3.682 -17.493 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -4.509 -1.126 -18.349 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -4.583 -2.656 -19.201 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -5.641 -2.136 -16.390 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -6.612 -2.265 -17.842 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -6.784 -4.376 -17.110 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -5.343 -4.572 -17.985 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -5.291 -4.360 -16.301 1.00 0.00 H new ATOM 353 N VAL A 27 -0.854 -1.945 -13.356 1.00 0.00 N ATOM 354 CA VAL A 27 -0.402 -1.202 -12.162 1.00 0.00 C ATOM 355 C VAL A 27 1.105 -0.915 -12.217 1.00 0.00 C ATOM 356 O VAL A 27 1.895 -1.798 -12.556 1.00 0.00 O ATOM 357 CB VAL A 27 -0.762 -1.958 -10.865 1.00 0.00 C ATOM 358 CG1 VAL A 27 -0.285 -1.227 -9.606 1.00 0.00 C ATOM 359 CG2 VAL A 27 -2.281 -2.148 -10.738 1.00 0.00 C ATOM 0 H VAL A 27 -1.042 -2.930 -13.167 1.00 0.00 H new ATOM 0 HA VAL A 27 -0.927 -0.247 -12.157 1.00 0.00 H new ATOM 0 HB VAL A 27 -0.255 -2.920 -10.938 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -0.564 -1.802 -8.723 1.00 0.00 H new ATOM 0 HG12 VAL A 27 0.799 -1.116 -9.639 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -0.750 -0.242 -9.559 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -2.505 -2.683 -9.815 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -2.769 -1.174 -10.720 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -2.648 -2.722 -11.589 1.00 0.00 H new ATOM 369 N SER A 28 1.499 0.301 -11.817 1.00 0.00 N ATOM 370 CA SER A 28 2.906 0.723 -11.665 1.00 0.00 C ATOM 371 C SER A 28 3.130 1.491 -10.354 1.00 0.00 C ATOM 372 O SER A 28 2.183 2.006 -9.759 1.00 0.00 O ATOM 373 CB SER A 28 3.337 1.595 -12.855 1.00 0.00 C ATOM 374 OG SER A 28 3.220 0.895 -14.085 1.00 0.00 O ATOM 0 H SER A 28 0.836 1.040 -11.583 1.00 0.00 H new ATOM 0 HA SER A 28 3.515 -0.181 -11.638 1.00 0.00 H new ATOM 0 HB2 SER A 28 2.723 2.495 -12.888 1.00 0.00 H new ATOM 0 HB3 SER A 28 4.369 1.917 -12.716 1.00 0.00 H new ATOM 0 HG SER A 28 3.500 1.478 -14.821 1.00 0.00 H new ATOM 380 N GLU A 29 4.378 1.631 -9.902 1.00 0.00 N ATOM 381 CA GLU A 29 4.700 2.349 -8.654 1.00 0.00 C ATOM 382 C GLU A 29 4.210 3.815 -8.610 1.00 0.00 C ATOM 383 O GLU A 29 3.703 4.220 -7.560 1.00 0.00 O ATOM 384 CB GLU A 29 6.220 2.287 -8.399 1.00 0.00 C ATOM 385 CG GLU A 29 6.623 1.043 -7.597 1.00 0.00 C ATOM 386 CD GLU A 29 7.930 0.400 -8.101 1.00 0.00 C ATOM 387 OE1 GLU A 29 8.839 0.135 -7.280 1.00 0.00 O ATOM 388 OE2 GLU A 29 8.032 0.078 -9.310 1.00 0.00 O ATOM 0 H GLU A 29 5.194 1.254 -10.384 1.00 0.00 H new ATOM 0 HA GLU A 29 4.153 1.837 -7.862 1.00 0.00 H new ATOM 0 HB2 GLU A 29 6.747 2.288 -9.353 1.00 0.00 H new ATOM 0 HB3 GLU A 29 6.533 3.181 -7.861 1.00 0.00 H new ATOM 0 HG2 GLU A 29 6.739 1.315 -6.548 1.00 0.00 H new ATOM 0 HG3 GLU A 29 5.820 0.308 -7.648 1.00 0.00 H new ATOM 395 N PRO A 30 4.268 4.613 -9.701 1.00 0.00 N ATOM 396 CA PRO A 30 3.675 5.953 -9.723 1.00 0.00 C ATOM 397 C PRO A 30 2.146 5.951 -9.584 1.00 0.00 C ATOM 398 O PRO A 30 1.586 6.895 -9.025 1.00 0.00 O ATOM 399 CB PRO A 30 4.111 6.582 -11.052 1.00 0.00 C ATOM 400 CG PRO A 30 5.394 5.831 -11.393 1.00 0.00 C ATOM 401 CD PRO A 30 5.077 4.423 -10.897 1.00 0.00 C ATOM 0 HA PRO A 30 4.022 6.525 -8.862 1.00 0.00 H new ATOM 0 HB2 PRO A 30 3.353 6.455 -11.825 1.00 0.00 H new ATOM 0 HB3 PRO A 30 4.287 7.653 -10.951 1.00 0.00 H new ATOM 0 HG2 PRO A 30 5.606 5.849 -12.462 1.00 0.00 H new ATOM 0 HG3 PRO A 30 6.262 6.256 -10.889 1.00 0.00 H new ATOM 0 HD2 PRO A 30 4.536 3.852 -11.652 1.00 0.00 H new ATOM 0 HD3 PRO A 30 5.989 3.870 -10.672 1.00 0.00 H new ATOM 409 N LEU A 31 1.461 4.884 -10.027 1.00 0.00 N ATOM 410 CA LEU A 31 0.022 4.721 -9.805 1.00 0.00 C ATOM 411 C LEU A 31 -0.249 4.493 -8.322 1.00 0.00 C ATOM 412 O LEU A 31 -1.060 5.202 -7.734 1.00 0.00 O ATOM 413 CB LEU A 31 -0.530 3.549 -10.635 1.00 0.00 C ATOM 414 CG LEU A 31 -2.055 3.370 -10.516 1.00 0.00 C ATOM 415 CD1 LEU A 31 -2.785 4.470 -11.269 1.00 0.00 C ATOM 416 CD2 LEU A 31 -2.429 2.026 -11.130 1.00 0.00 C ATOM 0 H LEU A 31 1.889 4.117 -10.545 1.00 0.00 H new ATOM 0 HA LEU A 31 -0.485 5.631 -10.125 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -0.272 3.704 -11.683 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -0.039 2.629 -10.319 1.00 0.00 H new ATOM 0 HG LEU A 31 -2.340 3.415 -9.465 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -3.861 4.325 -11.172 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -2.511 5.439 -10.853 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -2.508 4.436 -12.323 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -3.507 1.879 -11.056 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -2.132 2.010 -12.179 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -1.916 1.226 -10.595 1.00 0.00 H new ATOM 428 N LEU A 32 0.464 3.548 -7.702 1.00 0.00 N ATOM 429 CA LEU A 32 0.311 3.264 -6.273 1.00 0.00 C ATOM 430 C LEU A 32 0.655 4.462 -5.386 1.00 0.00 C ATOM 431 O LEU A 32 0.175 4.551 -4.264 1.00 0.00 O ATOM 432 CB LEU A 32 1.189 2.075 -5.858 1.00 0.00 C ATOM 433 CG LEU A 32 0.881 0.744 -6.544 1.00 0.00 C ATOM 434 CD1 LEU A 32 1.592 -0.367 -5.783 1.00 0.00 C ATOM 435 CD2 LEU A 32 -0.609 0.428 -6.536 1.00 0.00 C ATOM 0 H LEU A 32 1.156 2.964 -8.171 1.00 0.00 H new ATOM 0 HA LEU A 32 -0.743 3.027 -6.126 1.00 0.00 H new ATOM 0 HB2 LEU A 32 2.230 2.331 -6.056 1.00 0.00 H new ATOM 0 HB3 LEU A 32 1.094 1.937 -4.781 1.00 0.00 H new ATOM 0 HG LEU A 32 1.217 0.816 -7.578 1.00 0.00 H new ATOM 0 HD11 LEU A 32 1.383 -1.325 -6.259 1.00 0.00 H new ATOM 0 HD12 LEU A 32 2.666 -0.184 -5.792 1.00 0.00 H new ATOM 0 HD13 LEU A 32 1.236 -0.388 -4.753 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -0.781 -0.526 -7.034 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -0.963 0.370 -5.507 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -1.151 1.214 -7.062 1.00 0.00 H new ATOM 447 N TRP A 33 1.458 5.396 -5.887 1.00 0.00 N ATOM 448 CA TRP A 33 1.712 6.670 -5.227 1.00 0.00 C ATOM 449 C TRP A 33 0.505 7.605 -5.355 1.00 0.00 C ATOM 450 O TRP A 33 -0.161 7.908 -4.367 1.00 0.00 O ATOM 451 CB TRP A 33 2.997 7.274 -5.802 1.00 0.00 C ATOM 452 CG TRP A 33 3.666 8.351 -5.010 1.00 0.00 C ATOM 453 CD1 TRP A 33 3.089 9.407 -4.388 1.00 0.00 C ATOM 454 CD2 TRP A 33 5.096 8.491 -4.787 1.00 0.00 C ATOM 455 NE1 TRP A 33 4.069 10.176 -3.784 1.00 0.00 N ATOM 456 CE2 TRP A 33 5.330 9.669 -4.020 1.00 0.00 C ATOM 457 CE3 TRP A 33 6.216 7.732 -5.180 1.00 0.00 C ATOM 458 CZ2 TRP A 33 6.623 10.084 -3.672 1.00 0.00 C ATOM 459 CZ3 TRP A 33 7.521 8.141 -4.841 1.00 0.00 C ATOM 460 CH2 TRP A 33 7.724 9.316 -4.093 1.00 0.00 C ATOM 0 H TRP A 33 1.955 5.287 -6.771 1.00 0.00 H new ATOM 0 HA TRP A 33 1.857 6.517 -4.157 1.00 0.00 H new ATOM 0 HB2 TRP A 33 3.714 6.466 -5.945 1.00 0.00 H new ATOM 0 HB3 TRP A 33 2.768 7.675 -6.789 1.00 0.00 H new ATOM 0 HD1 TRP A 33 2.030 9.616 -4.367 1.00 0.00 H new ATOM 0 HE1 TRP A 33 3.882 11.014 -3.233 1.00 0.00 H new ATOM 0 HE3 TRP A 33 6.072 6.825 -5.748 1.00 0.00 H new ATOM 0 HZ2 TRP A 33 6.772 10.981 -3.089 1.00 0.00 H new ATOM 0 HZ3 TRP A 33 8.369 7.551 -5.156 1.00 0.00 H new ATOM 0 HH2 TRP A 33 8.727 9.629 -3.842 1.00 0.00 H new ATOM 471 N GLU A 34 0.195 8.039 -6.578 1.00 0.00 N ATOM 472 CA GLU A 34 -0.835 9.059 -6.843 1.00 0.00 C ATOM 473 C GLU A 34 -2.262 8.625 -6.473 1.00 0.00 C ATOM 474 O GLU A 34 -3.072 9.458 -6.063 1.00 0.00 O ATOM 475 CB GLU A 34 -0.786 9.483 -8.318 1.00 0.00 C ATOM 476 CG GLU A 34 0.511 10.231 -8.638 1.00 0.00 C ATOM 477 CD GLU A 34 0.443 10.899 -10.025 1.00 0.00 C ATOM 478 OE1 GLU A 34 0.806 10.257 -11.041 1.00 0.00 O ATOM 479 OE2 GLU A 34 0.030 12.083 -10.112 1.00 0.00 O ATOM 0 H GLU A 34 0.652 7.693 -7.422 1.00 0.00 H new ATOM 0 HA GLU A 34 -0.597 9.900 -6.192 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -0.867 8.602 -8.955 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -1.641 10.120 -8.544 1.00 0.00 H new ATOM 0 HG2 GLU A 34 0.694 10.988 -7.876 1.00 0.00 H new ATOM 0 HG3 GLU A 34 1.351 9.537 -8.607 1.00 0.00 H new ATOM 486 N LEU A 35 -2.568 7.328 -6.558 1.00 0.00 N ATOM 487 CA LEU A 35 -3.859 6.764 -6.146 1.00 0.00 C ATOM 488 C LEU A 35 -4.043 6.813 -4.617 1.00 0.00 C ATOM 489 O LEU A 35 -5.157 7.015 -4.138 1.00 0.00 O ATOM 490 CB LEU A 35 -3.959 5.314 -6.664 1.00 0.00 C ATOM 491 CG LEU A 35 -5.390 4.763 -6.734 1.00 0.00 C ATOM 492 CD1 LEU A 35 -6.129 5.255 -7.977 1.00 0.00 C ATOM 493 CD2 LEU A 35 -5.370 3.236 -6.732 1.00 0.00 C ATOM 0 H LEU A 35 -1.918 6.630 -6.919 1.00 0.00 H new ATOM 0 HA LEU A 35 -4.658 7.366 -6.578 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -3.515 5.265 -7.658 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -3.365 4.668 -6.017 1.00 0.00 H new ATOM 0 HG LEU A 35 -5.919 5.129 -5.854 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -7.138 4.842 -7.988 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -6.183 6.344 -7.961 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -5.595 4.931 -8.870 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -6.391 2.859 -6.782 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -4.808 2.878 -7.595 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -4.896 2.880 -5.818 1.00 0.00 H new ATOM 505 N PHE A 36 -2.964 6.651 -3.847 1.00 0.00 N ATOM 506 CA PHE A 36 -2.977 6.568 -2.380 1.00 0.00 C ATOM 507 C PHE A 36 -2.827 7.935 -1.691 1.00 0.00 C ATOM 508 O PHE A 36 -3.116 8.046 -0.500 1.00 0.00 O ATOM 509 CB PHE A 36 -1.912 5.561 -1.930 1.00 0.00 C ATOM 510 CG PHE A 36 -2.339 4.097 -1.993 1.00 0.00 C ATOM 511 CD1 PHE A 36 -2.545 3.370 -0.805 1.00 0.00 C ATOM 512 CD2 PHE A 36 -2.515 3.447 -3.231 1.00 0.00 C ATOM 513 CE1 PHE A 36 -2.941 2.020 -0.852 1.00 0.00 C ATOM 514 CE2 PHE A 36 -2.898 2.094 -3.283 1.00 0.00 C ATOM 515 CZ PHE A 36 -3.124 1.384 -2.091 1.00 0.00 C ATOM 0 H PHE A 36 -2.025 6.571 -4.238 1.00 0.00 H new ATOM 0 HA PHE A 36 -3.959 6.214 -2.065 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -1.025 5.692 -2.550 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -1.622 5.795 -0.906 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -2.398 3.852 0.150 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -2.354 3.993 -4.149 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -3.104 1.473 0.065 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -3.018 1.602 -4.237 1.00 0.00 H new ATOM 0 HZ PHE A 36 -3.438 0.351 -2.128 1.00 0.00 H new ATOM 525 N LEU A 37 -2.487 8.998 -2.436 1.00 0.00 N ATOM 526 CA LEU A 37 -2.528 10.393 -1.960 1.00 0.00 C ATOM 527 C LEU A 37 -3.904 10.824 -1.407 1.00 0.00 C ATOM 528 O LEU A 37 -3.999 11.782 -0.640 1.00 0.00 O ATOM 529 CB LEU A 37 -2.106 11.331 -3.107 1.00 0.00 C ATOM 530 CG LEU A 37 -0.608 11.331 -3.454 1.00 0.00 C ATOM 531 CD1 LEU A 37 -0.343 12.311 -4.596 1.00 0.00 C ATOM 532 CD2 LEU A 37 0.255 11.751 -2.267 1.00 0.00 C ATOM 0 H LEU A 37 -2.170 8.913 -3.402 1.00 0.00 H new ATOM 0 HA LEU A 37 -1.833 10.462 -1.123 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -2.667 11.057 -4.001 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -2.399 12.348 -2.846 1.00 0.00 H new ATOM 0 HG LEU A 37 -0.346 10.312 -3.739 1.00 0.00 H new ATOM 0 HD11 LEU A 37 0.720 12.308 -4.839 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -0.917 12.011 -5.473 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -0.643 13.314 -4.292 1.00 0.00 H new ATOM 0 HD21 LEU A 37 1.305 11.737 -2.558 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -0.021 12.758 -1.955 1.00 0.00 H new ATOM 0 HD23 LEU A 37 0.098 11.059 -1.440 1.00 0.00 H new ATOM 544 N GLN A 38 -4.965 10.095 -1.764 1.00 0.00 N ATOM 545 CA GLN A 38 -6.327 10.259 -1.231 1.00 0.00 C ATOM 546 C GLN A 38 -6.418 9.931 0.269 1.00 0.00 C ATOM 547 O GLN A 38 -7.213 10.540 0.987 1.00 0.00 O ATOM 548 CB GLN A 38 -7.303 9.345 -1.992 1.00 0.00 C ATOM 549 CG GLN A 38 -7.246 9.565 -3.506 1.00 0.00 C ATOM 550 CD GLN A 38 -8.277 8.717 -4.247 1.00 0.00 C ATOM 551 OE1 GLN A 38 -9.415 9.114 -4.468 1.00 0.00 O ATOM 552 NE2 GLN A 38 -7.924 7.515 -4.648 1.00 0.00 N ATOM 0 H GLN A 38 -4.901 9.348 -2.456 1.00 0.00 H new ATOM 0 HA GLN A 38 -6.592 11.308 -1.366 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -7.070 8.304 -1.770 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -8.318 9.527 -1.639 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -7.418 10.619 -3.726 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -6.248 9.322 -3.870 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -6.979 7.175 -4.469 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -8.595 6.923 -5.138 1.00 0.00 H new ATOM 561 N ALA A 39 -5.606 8.980 0.747 1.00 0.00 N ATOM 562 CA ALA A 39 -5.553 8.605 2.158 1.00 0.00 C ATOM 563 C ALA A 39 -4.743 9.602 3.006 1.00 0.00 C ATOM 564 O ALA A 39 -5.167 9.988 4.097 1.00 0.00 O ATOM 565 CB ALA A 39 -4.946 7.206 2.264 1.00 0.00 C ATOM 0 H ALA A 39 -4.965 8.448 0.159 1.00 0.00 H new ATOM 0 HA ALA A 39 -6.569 8.617 2.554 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -4.898 6.909 3.312 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -5.566 6.498 1.714 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -3.941 7.213 1.843 1.00 0.00 H new ATOM 571 N GLY A 40 -3.583 10.021 2.493 1.00 0.00 N ATOM 572 CA GLY A 40 -2.666 10.959 3.139 1.00 0.00 C ATOM 573 C GLY A 40 -1.385 11.189 2.319 1.00 0.00 C ATOM 574 O GLY A 40 -1.279 10.692 1.196 1.00 0.00 O ATOM 0 H GLY A 40 -3.246 9.704 1.584 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -3.173 11.912 3.290 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -2.399 10.580 4.126 1.00 0.00 H new ATOM 578 N PRO A 41 -0.398 11.927 2.853 1.00 0.00 N ATOM 579 CA PRO A 41 0.858 12.222 2.163 1.00 0.00 C ATOM 580 C PRO A 41 1.710 10.957 1.960 1.00 0.00 C ATOM 581 O PRO A 41 2.257 10.390 2.912 1.00 0.00 O ATOM 582 CB PRO A 41 1.556 13.278 3.029 1.00 0.00 C ATOM 583 CG PRO A 41 0.995 13.018 4.426 1.00 0.00 C ATOM 584 CD PRO A 41 -0.440 12.582 4.148 1.00 0.00 C ATOM 0 HA PRO A 41 0.690 12.596 1.153 1.00 0.00 H new ATOM 0 HB2 PRO A 41 2.640 13.166 3.004 1.00 0.00 H new ATOM 0 HB3 PRO A 41 1.332 14.289 2.688 1.00 0.00 H new ATOM 0 HG2 PRO A 41 1.557 12.244 4.948 1.00 0.00 H new ATOM 0 HG3 PRO A 41 1.031 13.913 5.048 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -0.801 11.903 4.920 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -1.115 13.438 4.134 1.00 0.00 H new ATOM 592 N VAL A 42 1.840 10.535 0.699 1.00 0.00 N ATOM 593 CA VAL A 42 2.709 9.431 0.261 1.00 0.00 C ATOM 594 C VAL A 42 4.121 9.959 -0.010 1.00 0.00 C ATOM 595 O VAL A 42 4.304 11.002 -0.641 1.00 0.00 O ATOM 596 CB VAL A 42 2.144 8.706 -0.977 1.00 0.00 C ATOM 597 CG1 VAL A 42 3.066 7.565 -1.427 1.00 0.00 C ATOM 598 CG2 VAL A 42 0.759 8.104 -0.707 1.00 0.00 C ATOM 0 H VAL A 42 1.328 10.964 -0.072 1.00 0.00 H new ATOM 0 HA VAL A 42 2.750 8.695 1.064 1.00 0.00 H new ATOM 0 HB VAL A 42 2.071 9.464 -1.757 1.00 0.00 H new ATOM 0 HG11 VAL A 42 2.638 7.075 -2.302 1.00 0.00 H new ATOM 0 HG12 VAL A 42 4.047 7.968 -1.680 1.00 0.00 H new ATOM 0 HG13 VAL A 42 3.169 6.840 -0.619 1.00 0.00 H new ATOM 0 HG21 VAL A 42 0.399 7.603 -1.605 1.00 0.00 H new ATOM 0 HG22 VAL A 42 0.828 7.383 0.108 1.00 0.00 H new ATOM 0 HG23 VAL A 42 0.065 8.898 -0.431 1.00 0.00 H new ATOM 608 N VAL A 43 5.116 9.216 0.471 1.00 0.00 N ATOM 609 CA VAL A 43 6.543 9.585 0.498 1.00 0.00 C ATOM 610 C VAL A 43 7.371 8.742 -0.478 1.00 0.00 C ATOM 611 O VAL A 43 8.362 9.225 -1.024 1.00 0.00 O ATOM 612 CB VAL A 43 7.097 9.411 1.931 1.00 0.00 C ATOM 613 CG1 VAL A 43 8.466 10.070 2.122 1.00 0.00 C ATOM 614 CG2 VAL A 43 6.174 10.019 2.993 1.00 0.00 C ATOM 0 H VAL A 43 4.948 8.294 0.874 1.00 0.00 H new ATOM 0 HA VAL A 43 6.622 10.627 0.188 1.00 0.00 H new ATOM 0 HB VAL A 43 7.173 8.331 2.057 1.00 0.00 H new ATOM 0 HG11 VAL A 43 8.805 9.915 3.146 1.00 0.00 H new ATOM 0 HG12 VAL A 43 9.183 9.626 1.432 1.00 0.00 H new ATOM 0 HG13 VAL A 43 8.386 11.139 1.924 1.00 0.00 H new ATOM 0 HG21 VAL A 43 6.609 9.870 3.981 1.00 0.00 H new ATOM 0 HG22 VAL A 43 6.057 11.086 2.805 1.00 0.00 H new ATOM 0 HG23 VAL A 43 5.199 9.534 2.949 1.00 0.00 H new ATOM 624 N ASN A 44 6.988 7.473 -0.666 1.00 0.00 N ATOM 625 CA ASN A 44 7.694 6.476 -1.478 1.00 0.00 C ATOM 626 C ASN A 44 6.755 5.299 -1.858 1.00 0.00 C ATOM 627 O ASN A 44 5.736 5.070 -1.201 1.00 0.00 O ATOM 628 CB ASN A 44 8.931 6.041 -0.659 1.00 0.00 C ATOM 629 CG ASN A 44 9.703 4.869 -1.234 1.00 0.00 C ATOM 630 OD1 ASN A 44 10.062 4.848 -2.402 1.00 0.00 O ATOM 631 ND2 ASN A 44 9.984 3.868 -0.431 1.00 0.00 N ATOM 0 H ASN A 44 6.142 7.098 -0.238 1.00 0.00 H new ATOM 0 HA ASN A 44 8.020 6.886 -2.434 1.00 0.00 H new ATOM 0 HB2 ASN A 44 9.606 6.892 -0.570 1.00 0.00 H new ATOM 0 HB3 ASN A 44 8.608 5.783 0.350 1.00 0.00 H new ATOM 0 HD21 ASN A 44 10.506 3.065 -0.781 1.00 0.00 H new ATOM 0 HD22 ASN A 44 9.680 3.894 0.542 1.00 0.00 H new ATOM 638 N THR A 45 7.111 4.522 -2.884 1.00 0.00 N ATOM 639 CA THR A 45 6.447 3.263 -3.292 1.00 0.00 C ATOM 640 C THR A 45 7.462 2.176 -3.652 1.00 0.00 C ATOM 641 O THR A 45 8.597 2.474 -4.037 1.00 0.00 O ATOM 642 CB THR A 45 5.498 3.449 -4.492 1.00 0.00 C ATOM 643 OG1 THR A 45 6.029 4.295 -5.484 1.00 0.00 O ATOM 644 CG2 THR A 45 4.150 4.013 -4.082 1.00 0.00 C ATOM 0 H THR A 45 7.902 4.755 -3.484 1.00 0.00 H new ATOM 0 HA THR A 45 5.864 2.957 -2.424 1.00 0.00 H new ATOM 0 HB THR A 45 5.375 2.445 -4.898 1.00 0.00 H new ATOM 0 HG1 THR A 45 5.399 4.357 -6.232 1.00 0.00 H new ATOM 0 HG21 THR A 45 3.519 4.125 -4.964 1.00 0.00 H new ATOM 0 HG22 THR A 45 3.671 3.334 -3.377 1.00 0.00 H new ATOM 0 HG23 THR A 45 4.291 4.986 -3.611 1.00 0.00 H new ATOM 652 N HIS A 46 7.065 0.901 -3.541 1.00 0.00 N ATOM 653 CA HIS A 46 7.894 -0.245 -3.927 1.00 0.00 C ATOM 654 C HIS A 46 7.041 -1.342 -4.572 1.00 0.00 C ATOM 655 O HIS A 46 6.005 -1.708 -4.026 1.00 0.00 O ATOM 656 CB HIS A 46 8.630 -0.787 -2.689 1.00 0.00 C ATOM 657 CG HIS A 46 9.816 -1.642 -3.060 1.00 0.00 C ATOM 658 ND1 HIS A 46 9.756 -2.970 -3.486 1.00 0.00 N ATOM 659 CD2 HIS A 46 11.116 -1.228 -3.083 1.00 0.00 C ATOM 660 CE1 HIS A 46 11.024 -3.330 -3.751 1.00 0.00 C ATOM 661 NE2 HIS A 46 11.860 -2.304 -3.516 1.00 0.00 N ATOM 0 H HIS A 46 6.150 0.635 -3.177 1.00 0.00 H new ATOM 0 HA HIS A 46 8.628 0.082 -4.664 1.00 0.00 H new ATOM 0 HB2 HIS A 46 8.965 0.048 -2.073 1.00 0.00 H new ATOM 0 HB3 HIS A 46 7.937 -1.372 -2.084 1.00 0.00 H new ATOM 0 HD2 HIS A 46 11.488 -0.250 -2.815 1.00 0.00 H new ATOM 0 HE1 HIS A 46 11.328 -4.305 -4.103 1.00 0.00 H new ATOM 0 HE2 HIS A 46 12.873 -2.319 -3.637 1.00 0.00 H new ATOM 669 N MET A 47 7.461 -1.893 -5.709 1.00 0.00 N ATOM 670 CA MET A 47 6.861 -3.089 -6.316 1.00 0.00 C ATOM 671 C MET A 47 7.971 -4.057 -6.745 1.00 0.00 C ATOM 672 O MET A 47 8.661 -3.773 -7.730 1.00 0.00 O ATOM 673 CB MET A 47 5.964 -2.714 -7.510 1.00 0.00 C ATOM 674 CG MET A 47 4.641 -2.085 -7.057 1.00 0.00 C ATOM 675 SD MET A 47 3.622 -1.375 -8.375 1.00 0.00 S ATOM 676 CE MET A 47 3.252 -2.872 -9.307 1.00 0.00 C ATOM 0 H MET A 47 8.242 -1.517 -6.247 1.00 0.00 H new ATOM 0 HA MET A 47 6.228 -3.580 -5.577 1.00 0.00 H new ATOM 0 HB2 MET A 47 6.495 -2.016 -8.157 1.00 0.00 H new ATOM 0 HB3 MET A 47 5.758 -3.605 -8.103 1.00 0.00 H new ATOM 0 HG2 MET A 47 4.056 -2.845 -6.539 1.00 0.00 H new ATOM 0 HG3 MET A 47 4.861 -1.303 -6.331 1.00 0.00 H new ATOM 0 HE1 MET A 47 2.416 -2.684 -9.981 1.00 0.00 H new ATOM 0 HE2 MET A 47 4.127 -3.165 -9.887 1.00 0.00 H new ATOM 0 HE3 MET A 47 2.989 -3.674 -8.617 1.00 0.00 H new ATOM 686 N PRO A 48 8.166 -5.191 -6.047 1.00 0.00 N ATOM 687 CA PRO A 48 9.147 -6.208 -6.432 1.00 0.00 C ATOM 688 C PRO A 48 8.918 -6.753 -7.851 1.00 0.00 C ATOM 689 O PRO A 48 7.773 -6.922 -8.283 1.00 0.00 O ATOM 690 CB PRO A 48 9.046 -7.295 -5.356 1.00 0.00 C ATOM 691 CG PRO A 48 8.596 -6.502 -4.129 1.00 0.00 C ATOM 692 CD PRO A 48 7.616 -5.498 -4.735 1.00 0.00 C ATOM 0 HA PRO A 48 10.152 -5.789 -6.479 1.00 0.00 H new ATOM 0 HB2 PRO A 48 8.327 -8.068 -5.626 1.00 0.00 H new ATOM 0 HB3 PRO A 48 10.002 -7.792 -5.190 1.00 0.00 H new ATOM 0 HG2 PRO A 48 8.118 -7.139 -3.385 1.00 0.00 H new ATOM 0 HG3 PRO A 48 9.432 -6.007 -3.635 1.00 0.00 H new ATOM 0 HD2 PRO A 48 6.614 -5.921 -4.814 1.00 0.00 H new ATOM 0 HD3 PRO A 48 7.536 -4.602 -4.120 1.00 0.00 H new ATOM 700 N LYS A 49 10.009 -7.025 -8.582 1.00 0.00 N ATOM 701 CA LYS A 49 10.005 -7.405 -10.009 1.00 0.00 C ATOM 702 C LYS A 49 10.501 -8.835 -10.256 1.00 0.00 C ATOM 703 O LYS A 49 11.207 -9.417 -9.433 1.00 0.00 O ATOM 704 CB LYS A 49 10.847 -6.413 -10.842 1.00 0.00 C ATOM 705 CG LYS A 49 10.499 -4.920 -10.706 1.00 0.00 C ATOM 706 CD LYS A 49 9.030 -4.583 -11.012 1.00 0.00 C ATOM 707 CE LYS A 49 8.779 -3.075 -11.181 1.00 0.00 C ATOM 708 NZ LYS A 49 9.256 -2.284 -10.018 1.00 0.00 N ATOM 0 H LYS A 49 10.949 -6.986 -8.188 1.00 0.00 H new ATOM 0 HA LYS A 49 8.963 -7.365 -10.327 1.00 0.00 H new ATOM 0 HB2 LYS A 49 11.894 -6.544 -10.569 1.00 0.00 H new ATOM 0 HB3 LYS A 49 10.755 -6.689 -11.893 1.00 0.00 H new ATOM 0 HG2 LYS A 49 10.730 -4.596 -9.691 1.00 0.00 H new ATOM 0 HG3 LYS A 49 11.139 -4.347 -11.377 1.00 0.00 H new ATOM 0 HD2 LYS A 49 8.727 -5.100 -11.923 1.00 0.00 H new ATOM 0 HD3 LYS A 49 8.401 -4.962 -10.206 1.00 0.00 H new ATOM 0 HE2 LYS A 49 9.280 -2.726 -12.084 1.00 0.00 H new ATOM 0 HE3 LYS A 49 7.712 -2.901 -11.321 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 8.847 -1.329 -10.057 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 8.962 -2.751 -9.136 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 10.293 -2.217 -10.046 1.00 0.00 H new ATOM 722 N ASP A 50 10.141 -9.391 -11.407 1.00 0.00 N ATOM 723 CA ASP A 50 10.667 -10.643 -11.955 1.00 0.00 C ATOM 724 C ASP A 50 12.067 -10.443 -12.575 1.00 0.00 C ATOM 725 O ASP A 50 12.322 -9.435 -13.238 1.00 0.00 O ATOM 726 CB ASP A 50 9.675 -11.167 -13.002 1.00 0.00 C ATOM 727 CG ASP A 50 10.195 -12.445 -13.663 1.00 0.00 C ATOM 728 OD1 ASP A 50 10.049 -13.542 -13.076 1.00 0.00 O ATOM 729 OD2 ASP A 50 10.803 -12.318 -14.748 1.00 0.00 O ATOM 0 H ASP A 50 9.442 -8.964 -12.015 1.00 0.00 H new ATOM 0 HA ASP A 50 10.779 -11.371 -11.152 1.00 0.00 H new ATOM 0 HB2 ASP A 50 8.713 -11.364 -12.529 1.00 0.00 H new ATOM 0 HB3 ASP A 50 9.506 -10.404 -13.762 1.00 0.00 H new ATOM 734 N ARG A 51 12.974 -11.415 -12.402 1.00 0.00 N ATOM 735 CA ARG A 51 14.390 -11.312 -12.815 1.00 0.00 C ATOM 736 C ARG A 51 14.689 -11.645 -14.289 1.00 0.00 C ATOM 737 O ARG A 51 15.862 -11.709 -14.664 1.00 0.00 O ATOM 738 CB ARG A 51 15.278 -12.092 -11.823 1.00 0.00 C ATOM 739 CG ARG A 51 15.135 -13.620 -11.925 1.00 0.00 C ATOM 740 CD ARG A 51 16.030 -14.321 -10.895 1.00 0.00 C ATOM 741 NE ARG A 51 15.929 -15.791 -11.002 1.00 0.00 N ATOM 742 CZ ARG A 51 16.602 -16.585 -11.820 1.00 0.00 C ATOM 743 NH1 ARG A 51 17.474 -16.130 -12.676 1.00 0.00 N ATOM 744 NH2 ARG A 51 16.407 -17.872 -11.793 1.00 0.00 N ATOM 0 H ARG A 51 12.746 -12.309 -11.966 1.00 0.00 H new ATOM 0 HA ARG A 51 14.642 -10.253 -12.769 1.00 0.00 H new ATOM 0 HB2 ARG A 51 16.320 -11.822 -11.994 1.00 0.00 H new ATOM 0 HB3 ARG A 51 15.031 -11.781 -10.808 1.00 0.00 H new ATOM 0 HG2 ARG A 51 14.095 -13.904 -11.763 1.00 0.00 H new ATOM 0 HG3 ARG A 51 15.402 -13.949 -12.929 1.00 0.00 H new ATOM 0 HD2 ARG A 51 17.066 -14.015 -11.043 1.00 0.00 H new ATOM 0 HD3 ARG A 51 15.745 -14.008 -9.891 1.00 0.00 H new ATOM 0 HE ARG A 51 15.266 -16.246 -10.375 1.00 0.00 H new ATOM 0 HH11 ARG A 51 17.658 -15.128 -12.733 1.00 0.00 H new ATOM 0 HH12 ARG A 51 17.972 -16.776 -13.289 1.00 0.00 H new ATOM 0 HH21 ARG A 51 15.733 -18.272 -11.140 1.00 0.00 H new ATOM 0 HH22 ARG A 51 16.928 -18.480 -12.425 1.00 0.00 H new ATOM 758 N VAL A 52 13.668 -11.873 -15.123 1.00 0.00 N ATOM 759 CA VAL A 52 13.804 -12.323 -16.528 1.00 0.00 C ATOM 760 C VAL A 52 12.955 -11.469 -17.475 1.00 0.00 C ATOM 761 O VAL A 52 13.394 -11.145 -18.580 1.00 0.00 O ATOM 762 CB VAL A 52 13.415 -13.815 -16.668 1.00 0.00 C ATOM 763 CG1 VAL A 52 13.688 -14.344 -18.084 1.00 0.00 C ATOM 764 CG2 VAL A 52 14.183 -14.716 -15.690 1.00 0.00 C ATOM 0 H VAL A 52 12.696 -11.749 -14.840 1.00 0.00 H new ATOM 0 HA VAL A 52 14.851 -12.203 -16.808 1.00 0.00 H new ATOM 0 HB VAL A 52 12.349 -13.852 -16.445 1.00 0.00 H new ATOM 0 HG11 VAL A 52 13.402 -15.394 -18.142 1.00 0.00 H new ATOM 0 HG12 VAL A 52 13.107 -13.770 -18.805 1.00 0.00 H new ATOM 0 HG13 VAL A 52 14.749 -14.244 -18.311 1.00 0.00 H new ATOM 0 HG21 VAL A 52 13.873 -15.752 -15.829 1.00 0.00 H new ATOM 0 HG22 VAL A 52 15.253 -14.629 -15.879 1.00 0.00 H new ATOM 0 HG23 VAL A 52 13.969 -14.408 -14.667 1.00 0.00 H new ATOM 774 N THR A 53 11.761 -11.066 -17.034 1.00 0.00 N ATOM 775 CA THR A 53 10.770 -10.301 -17.810 1.00 0.00 C ATOM 776 C THR A 53 10.557 -8.891 -17.260 1.00 0.00 C ATOM 777 O THR A 53 9.958 -8.043 -17.925 1.00 0.00 O ATOM 778 CB THR A 53 9.418 -11.031 -17.860 1.00 0.00 C ATOM 779 OG1 THR A 53 8.872 -11.149 -16.563 1.00 0.00 O ATOM 780 CG2 THR A 53 9.513 -12.432 -18.465 1.00 0.00 C ATOM 0 H THR A 53 11.441 -11.270 -16.087 1.00 0.00 H new ATOM 0 HA THR A 53 11.178 -10.216 -18.817 1.00 0.00 H new ATOM 0 HB THR A 53 8.777 -10.425 -18.501 1.00 0.00 H new ATOM 0 HG1 THR A 53 9.525 -11.576 -15.971 1.00 0.00 H new ATOM 0 HG21 THR A 53 8.525 -12.893 -18.471 1.00 0.00 H new ATOM 0 HG22 THR A 53 9.888 -12.363 -19.486 1.00 0.00 H new ATOM 0 HG23 THR A 53 10.194 -13.040 -17.869 1.00 0.00 H new ATOM 788 N GLY A 54 11.035 -8.628 -16.037 1.00 0.00 N ATOM 789 CA GLY A 54 11.014 -7.318 -15.391 1.00 0.00 C ATOM 790 C GLY A 54 9.627 -6.816 -14.961 1.00 0.00 C ATOM 791 O GLY A 54 9.505 -5.678 -14.502 1.00 0.00 O ATOM 0 H GLY A 54 11.460 -9.349 -15.454 1.00 0.00 H new ATOM 0 HA2 GLY A 54 11.657 -7.355 -14.511 1.00 0.00 H new ATOM 0 HA3 GLY A 54 11.450 -6.588 -16.073 1.00 0.00 H new ATOM 795 N GLN A 55 8.583 -7.640 -15.097 1.00 0.00 N ATOM 796 CA GLN A 55 7.213 -7.331 -14.669 1.00 0.00 C ATOM 797 C GLN A 55 7.077 -7.463 -13.143 1.00 0.00 C ATOM 798 O GLN A 55 7.891 -8.132 -12.505 1.00 0.00 O ATOM 799 CB GLN A 55 6.212 -8.244 -15.403 1.00 0.00 C ATOM 800 CG GLN A 55 6.374 -8.283 -16.935 1.00 0.00 C ATOM 801 CD GLN A 55 6.388 -6.898 -17.582 1.00 0.00 C ATOM 802 OE1 GLN A 55 5.394 -6.183 -17.609 1.00 0.00 O ATOM 803 NE2 GLN A 55 7.509 -6.454 -18.116 1.00 0.00 N ATOM 0 H GLN A 55 8.669 -8.565 -15.519 1.00 0.00 H new ATOM 0 HA GLN A 55 6.986 -6.297 -14.930 1.00 0.00 H new ATOM 0 HB2 GLN A 55 6.315 -9.257 -15.015 1.00 0.00 H new ATOM 0 HB3 GLN A 55 5.200 -7.914 -15.167 1.00 0.00 H new ATOM 0 HG2 GLN A 55 7.302 -8.800 -17.181 1.00 0.00 H new ATOM 0 HG3 GLN A 55 5.560 -8.867 -17.364 1.00 0.00 H new ATOM 0 HE21 GLN A 55 8.346 -7.036 -18.102 1.00 0.00 H new ATOM 0 HE22 GLN A 55 7.539 -5.528 -18.543 1.00 0.00 H new ATOM 812 N HIS A 56 6.068 -6.840 -12.528 1.00 0.00 N ATOM 813 CA HIS A 56 5.874 -6.925 -11.070 1.00 0.00 C ATOM 814 C HIS A 56 5.368 -8.305 -10.609 1.00 0.00 C ATOM 815 O HIS A 56 4.749 -9.050 -11.372 1.00 0.00 O ATOM 816 CB HIS A 56 5.014 -5.760 -10.560 1.00 0.00 C ATOM 817 CG HIS A 56 3.547 -5.845 -10.905 1.00 0.00 C ATOM 818 ND1 HIS A 56 2.626 -6.688 -10.278 1.00 0.00 N ATOM 819 CD2 HIS A 56 2.886 -5.058 -11.803 1.00 0.00 C ATOM 820 CE1 HIS A 56 1.434 -6.402 -10.826 1.00 0.00 C ATOM 821 NE2 HIS A 56 1.559 -5.420 -11.731 1.00 0.00 N ATOM 0 H HIS A 56 5.372 -6.272 -13.011 1.00 0.00 H new ATOM 0 HA HIS A 56 6.855 -6.822 -10.606 1.00 0.00 H new ATOM 0 HB2 HIS A 56 5.113 -5.704 -9.476 1.00 0.00 H new ATOM 0 HB3 HIS A 56 5.413 -4.830 -10.965 1.00 0.00 H new ATOM 0 HD2 HIS A 56 3.317 -4.302 -12.443 1.00 0.00 H new ATOM 0 HE1 HIS A 56 0.506 -6.893 -10.574 1.00 0.00 H new ATOM 0 HE2 HIS A 56 0.799 -5.010 -12.274 1.00 0.00 H new ATOM 829 N GLN A 57 5.634 -8.651 -9.344 1.00 0.00 N ATOM 830 CA GLN A 57 5.330 -9.967 -8.752 1.00 0.00 C ATOM 831 C GLN A 57 3.855 -10.145 -8.302 1.00 0.00 C ATOM 832 O GLN A 57 3.534 -11.101 -7.593 1.00 0.00 O ATOM 833 CB GLN A 57 6.319 -10.255 -7.605 1.00 0.00 C ATOM 834 CG GLN A 57 7.784 -10.414 -8.057 1.00 0.00 C ATOM 835 CD GLN A 57 8.733 -10.743 -6.898 1.00 0.00 C ATOM 836 OE1 GLN A 57 8.344 -11.177 -5.820 1.00 0.00 O ATOM 837 NE2 GLN A 57 10.026 -10.566 -7.065 1.00 0.00 N ATOM 0 H GLN A 57 6.077 -8.011 -8.685 1.00 0.00 H new ATOM 0 HA GLN A 57 5.458 -10.706 -9.543 1.00 0.00 H new ATOM 0 HB2 GLN A 57 6.261 -9.445 -6.878 1.00 0.00 H new ATOM 0 HB3 GLN A 57 6.008 -11.165 -7.093 1.00 0.00 H new ATOM 0 HG2 GLN A 57 7.844 -11.204 -8.805 1.00 0.00 H new ATOM 0 HG3 GLN A 57 8.112 -9.493 -8.539 1.00 0.00 H new ATOM 0 HE21 GLN A 57 10.381 -10.206 -7.951 1.00 0.00 H new ATOM 0 HE22 GLN A 57 10.673 -10.789 -6.309 1.00 0.00 H new ATOM 846 N GLY A 58 2.944 -9.242 -8.686 1.00 0.00 N ATOM 847 CA GLY A 58 1.522 -9.258 -8.304 1.00 0.00 C ATOM 848 C GLY A 58 1.194 -8.517 -6.997 1.00 0.00 C ATOM 849 O GLY A 58 0.032 -8.490 -6.585 1.00 0.00 O ATOM 0 H GLY A 58 3.181 -8.455 -9.290 1.00 0.00 H new ATOM 0 HA2 GLY A 58 0.939 -8.815 -9.112 1.00 0.00 H new ATOM 0 HA3 GLY A 58 1.198 -10.294 -8.208 1.00 0.00 H new ATOM 853 N TYR A 59 2.192 -7.908 -6.350 1.00 0.00 N ATOM 854 CA TYR A 59 2.045 -7.134 -5.113 1.00 0.00 C ATOM 855 C TYR A 59 3.000 -5.926 -5.061 1.00 0.00 C ATOM 856 O TYR A 59 3.984 -5.849 -5.804 1.00 0.00 O ATOM 857 CB TYR A 59 2.232 -8.050 -3.892 1.00 0.00 C ATOM 858 CG TYR A 59 3.642 -8.572 -3.685 1.00 0.00 C ATOM 859 CD1 TYR A 59 4.510 -7.923 -2.785 1.00 0.00 C ATOM 860 CD2 TYR A 59 4.078 -9.717 -4.379 1.00 0.00 C ATOM 861 CE1 TYR A 59 5.810 -8.424 -2.576 1.00 0.00 C ATOM 862 CE2 TYR A 59 5.387 -10.202 -4.194 1.00 0.00 C ATOM 863 CZ TYR A 59 6.260 -9.551 -3.295 1.00 0.00 C ATOM 864 OH TYR A 59 7.531 -10.002 -3.120 1.00 0.00 O ATOM 0 H TYR A 59 3.155 -7.941 -6.683 1.00 0.00 H new ATOM 0 HA TYR A 59 1.034 -6.726 -5.094 1.00 0.00 H new ATOM 0 HB2 TYR A 59 1.929 -7.504 -2.999 1.00 0.00 H new ATOM 0 HB3 TYR A 59 1.558 -8.901 -3.990 1.00 0.00 H new ATOM 0 HD1 TYR A 59 4.179 -7.042 -2.256 1.00 0.00 H new ATOM 0 HD2 TYR A 59 3.406 -10.225 -5.055 1.00 0.00 H new ATOM 0 HE1 TYR A 59 6.464 -7.944 -1.863 1.00 0.00 H new ATOM 0 HE2 TYR A 59 5.723 -11.071 -4.739 1.00 0.00 H new ATOM 0 HH TYR A 59 7.862 -10.382 -3.961 1.00 0.00 H new ATOM 874 N GLY A 60 2.691 -4.975 -4.180 1.00 0.00 N ATOM 875 CA GLY A 60 3.417 -3.724 -3.979 1.00 0.00 C ATOM 876 C GLY A 60 3.274 -3.165 -2.560 1.00 0.00 C ATOM 877 O GLY A 60 2.650 -3.773 -1.688 1.00 0.00 O ATOM 0 H GLY A 60 1.888 -5.062 -3.557 1.00 0.00 H new ATOM 0 HA2 GLY A 60 4.473 -3.886 -4.194 1.00 0.00 H new ATOM 0 HA3 GLY A 60 3.056 -2.983 -4.693 1.00 0.00 H new ATOM 881 N PHE A 61 3.851 -1.986 -2.345 1.00 0.00 N ATOM 882 CA PHE A 61 3.886 -1.264 -1.075 1.00 0.00 C ATOM 883 C PHE A 61 3.783 0.254 -1.285 1.00 0.00 C ATOM 884 O PHE A 61 4.285 0.784 -2.284 1.00 0.00 O ATOM 885 CB PHE A 61 5.194 -1.563 -0.327 1.00 0.00 C ATOM 886 CG PHE A 61 5.474 -3.019 -0.007 1.00 0.00 C ATOM 887 CD1 PHE A 61 5.048 -3.569 1.218 1.00 0.00 C ATOM 888 CD2 PHE A 61 6.204 -3.813 -0.913 1.00 0.00 C ATOM 889 CE1 PHE A 61 5.354 -4.905 1.535 1.00 0.00 C ATOM 890 CE2 PHE A 61 6.505 -5.149 -0.598 1.00 0.00 C ATOM 891 CZ PHE A 61 6.079 -5.696 0.626 1.00 0.00 C ATOM 0 H PHE A 61 4.332 -1.482 -3.090 1.00 0.00 H new ATOM 0 HA PHE A 61 3.030 -1.601 -0.491 1.00 0.00 H new ATOM 0 HB2 PHE A 61 6.023 -1.179 -0.922 1.00 0.00 H new ATOM 0 HB3 PHE A 61 5.187 -1.003 0.608 1.00 0.00 H new ATOM 0 HD1 PHE A 61 4.486 -2.964 1.914 1.00 0.00 H new ATOM 0 HD2 PHE A 61 6.533 -3.394 -1.852 1.00 0.00 H new ATOM 0 HE1 PHE A 61 5.032 -5.323 2.477 1.00 0.00 H new ATOM 0 HE2 PHE A 61 7.063 -5.756 -1.296 1.00 0.00 H new ATOM 0 HZ PHE A 61 6.309 -6.723 0.868 1.00 0.00 H new ATOM 901 N VAL A 62 3.197 0.958 -0.311 1.00 0.00 N ATOM 902 CA VAL A 62 3.074 2.430 -0.298 1.00 0.00 C ATOM 903 C VAL A 62 3.485 2.980 1.067 1.00 0.00 C ATOM 904 O VAL A 62 2.974 2.543 2.095 1.00 0.00 O ATOM 905 CB VAL A 62 1.649 2.898 -0.664 1.00 0.00 C ATOM 906 CG1 VAL A 62 1.624 4.410 -0.896 1.00 0.00 C ATOM 907 CG2 VAL A 62 1.101 2.201 -1.915 1.00 0.00 C ATOM 0 H VAL A 62 2.784 0.516 0.511 1.00 0.00 H new ATOM 0 HA VAL A 62 3.746 2.823 -1.061 1.00 0.00 H new ATOM 0 HB VAL A 62 1.014 2.631 0.181 1.00 0.00 H new ATOM 0 HG11 VAL A 62 0.612 4.722 -1.153 1.00 0.00 H new ATOM 0 HG12 VAL A 62 1.942 4.923 0.012 1.00 0.00 H new ATOM 0 HG13 VAL A 62 2.300 4.664 -1.712 1.00 0.00 H new ATOM 0 HG21 VAL A 62 0.097 2.568 -2.126 1.00 0.00 H new ATOM 0 HG22 VAL A 62 1.751 2.414 -2.764 1.00 0.00 H new ATOM 0 HG23 VAL A 62 1.066 1.125 -1.746 1.00 0.00 H new ATOM 917 N GLU A 63 4.417 3.930 1.088 1.00 0.00 N ATOM 918 CA GLU A 63 5.003 4.513 2.299 1.00 0.00 C ATOM 919 C GLU A 63 4.405 5.896 2.579 1.00 0.00 C ATOM 920 O GLU A 63 4.500 6.799 1.747 1.00 0.00 O ATOM 921 CB GLU A 63 6.523 4.588 2.109 1.00 0.00 C ATOM 922 CG GLU A 63 7.293 5.015 3.365 1.00 0.00 C ATOM 923 CD GLU A 63 8.821 5.048 3.128 1.00 0.00 C ATOM 924 OE1 GLU A 63 9.504 5.905 3.739 1.00 0.00 O ATOM 925 OE2 GLU A 63 9.354 4.238 2.329 1.00 0.00 O ATOM 0 H GLU A 63 4.801 4.332 0.233 1.00 0.00 H new ATOM 0 HA GLU A 63 4.776 3.889 3.163 1.00 0.00 H new ATOM 0 HB2 GLU A 63 6.886 3.612 1.788 1.00 0.00 H new ATOM 0 HB3 GLU A 63 6.743 5.290 1.305 1.00 0.00 H new ATOM 0 HG2 GLU A 63 6.954 6.002 3.679 1.00 0.00 H new ATOM 0 HG3 GLU A 63 7.068 4.326 4.179 1.00 0.00 H new ATOM 932 N PHE A 64 3.814 6.075 3.758 1.00 0.00 N ATOM 933 CA PHE A 64 3.204 7.328 4.206 1.00 0.00 C ATOM 934 C PHE A 64 4.100 8.106 5.174 1.00 0.00 C ATOM 935 O PHE A 64 4.996 7.548 5.813 1.00 0.00 O ATOM 936 CB PHE A 64 1.840 7.031 4.835 1.00 0.00 C ATOM 937 CG PHE A 64 0.781 6.682 3.813 1.00 0.00 C ATOM 938 CD1 PHE A 64 0.572 5.349 3.414 1.00 0.00 C ATOM 939 CD2 PHE A 64 0.023 7.717 3.235 1.00 0.00 C ATOM 940 CE1 PHE A 64 -0.417 5.049 2.460 1.00 0.00 C ATOM 941 CE2 PHE A 64 -0.964 7.416 2.286 1.00 0.00 C ATOM 942 CZ PHE A 64 -1.191 6.084 1.905 1.00 0.00 C ATOM 0 H PHE A 64 3.743 5.330 4.451 1.00 0.00 H new ATOM 0 HA PHE A 64 3.073 7.969 3.334 1.00 0.00 H new ATOM 0 HB2 PHE A 64 1.943 6.206 5.540 1.00 0.00 H new ATOM 0 HB3 PHE A 64 1.513 7.899 5.407 1.00 0.00 H new ATOM 0 HD1 PHE A 64 1.170 4.557 3.840 1.00 0.00 H new ATOM 0 HD2 PHE A 64 0.201 8.743 3.522 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -0.582 4.026 2.154 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -1.550 8.210 1.847 1.00 0.00 H new ATOM 0 HZ PHE A 64 -1.962 5.854 1.184 1.00 0.00 H new ATOM 952 N LEU A 65 3.836 9.411 5.300 1.00 0.00 N ATOM 953 CA LEU A 65 4.588 10.306 6.186 1.00 0.00 C ATOM 954 C LEU A 65 4.461 9.911 7.668 1.00 0.00 C ATOM 955 O LEU A 65 5.433 10.022 8.421 1.00 0.00 O ATOM 956 CB LEU A 65 4.088 11.740 5.953 1.00 0.00 C ATOM 957 CG LEU A 65 5.013 12.821 6.538 1.00 0.00 C ATOM 958 CD1 LEU A 65 6.276 12.997 5.692 1.00 0.00 C ATOM 959 CD2 LEU A 65 4.281 14.163 6.572 1.00 0.00 C ATOM 0 H LEU A 65 3.089 9.879 4.786 1.00 0.00 H new ATOM 0 HA LEU A 65 5.649 10.229 5.947 1.00 0.00 H new ATOM 0 HB2 LEU A 65 3.980 11.908 4.881 1.00 0.00 H new ATOM 0 HB3 LEU A 65 3.097 11.846 6.394 1.00 0.00 H new ATOM 0 HG LEU A 65 5.294 12.502 7.542 1.00 0.00 H new ATOM 0 HD11 LEU A 65 6.906 13.768 6.135 1.00 0.00 H new ATOM 0 HD12 LEU A 65 6.825 12.056 5.657 1.00 0.00 H new ATOM 0 HD13 LEU A 65 5.998 13.292 4.680 1.00 0.00 H new ATOM 0 HD21 LEU A 65 4.939 14.926 6.987 1.00 0.00 H new ATOM 0 HD22 LEU A 65 3.991 14.445 5.560 1.00 0.00 H new ATOM 0 HD23 LEU A 65 3.390 14.076 7.194 1.00 0.00 H new ATOM 971 N SER A 66 3.285 9.411 8.064 1.00 0.00 N ATOM 972 CA SER A 66 2.978 8.985 9.435 1.00 0.00 C ATOM 973 C SER A 66 2.125 7.713 9.435 1.00 0.00 C ATOM 974 O SER A 66 1.418 7.415 8.470 1.00 0.00 O ATOM 975 CB SER A 66 2.250 10.096 10.208 1.00 0.00 C ATOM 976 OG SER A 66 2.921 11.347 10.118 1.00 0.00 O ATOM 0 H SER A 66 2.500 9.288 7.424 1.00 0.00 H new ATOM 0 HA SER A 66 3.925 8.775 9.932 1.00 0.00 H new ATOM 0 HB2 SER A 66 1.237 10.201 9.820 1.00 0.00 H new ATOM 0 HB3 SER A 66 2.162 9.808 11.256 1.00 0.00 H new ATOM 0 HG SER A 66 2.422 12.023 10.623 1.00 0.00 H new ATOM 982 N GLU A 67 2.159 6.958 10.533 1.00 0.00 N ATOM 983 CA GLU A 67 1.448 5.675 10.638 1.00 0.00 C ATOM 984 C GLU A 67 -0.078 5.831 10.567 1.00 0.00 C ATOM 985 O GLU A 67 -0.745 5.004 9.954 1.00 0.00 O ATOM 986 CB GLU A 67 1.877 4.976 11.931 1.00 0.00 C ATOM 987 CG GLU A 67 1.384 3.522 12.003 1.00 0.00 C ATOM 988 CD GLU A 67 1.700 2.820 13.337 1.00 0.00 C ATOM 989 OE1 GLU A 67 2.690 3.173 14.022 1.00 0.00 O ATOM 990 OE2 GLU A 67 0.944 1.882 13.690 1.00 0.00 O ATOM 0 H GLU A 67 2.677 7.213 11.374 1.00 0.00 H new ATOM 0 HA GLU A 67 1.720 5.063 9.778 1.00 0.00 H new ATOM 0 HB2 GLU A 67 2.964 4.992 12.006 1.00 0.00 H new ATOM 0 HB3 GLU A 67 1.490 5.531 12.786 1.00 0.00 H new ATOM 0 HG2 GLU A 67 0.306 3.506 11.842 1.00 0.00 H new ATOM 0 HG3 GLU A 67 1.836 2.955 11.189 1.00 0.00 H new ATOM 997 N GLU A 68 -0.642 6.909 11.117 1.00 0.00 N ATOM 998 CA GLU A 68 -2.090 7.175 11.058 1.00 0.00 C ATOM 999 C GLU A 68 -2.612 7.417 9.627 1.00 0.00 C ATOM 1000 O GLU A 68 -3.778 7.148 9.339 1.00 0.00 O ATOM 1001 CB GLU A 68 -2.449 8.337 12.001 1.00 0.00 C ATOM 1002 CG GLU A 68 -1.814 9.684 11.619 1.00 0.00 C ATOM 1003 CD GLU A 68 -2.190 10.774 12.641 1.00 0.00 C ATOM 1004 OE1 GLU A 68 -3.261 11.413 12.493 1.00 0.00 O ATOM 1005 OE2 GLU A 68 -1.417 11.002 13.604 1.00 0.00 O ATOM 0 H GLU A 68 -0.113 7.624 11.616 1.00 0.00 H new ATOM 0 HA GLU A 68 -2.597 6.272 11.398 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -3.533 8.452 12.020 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -2.139 8.077 13.013 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -0.730 9.580 11.573 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -2.148 9.980 10.625 1.00 0.00 H new ATOM 1012 N ASP A 69 -1.744 7.858 8.710 1.00 0.00 N ATOM 1013 CA ASP A 69 -2.060 7.997 7.285 1.00 0.00 C ATOM 1014 C ASP A 69 -2.022 6.641 6.558 1.00 0.00 C ATOM 1015 O ASP A 69 -2.857 6.388 5.686 1.00 0.00 O ATOM 1016 CB ASP A 69 -1.101 9.015 6.651 1.00 0.00 C ATOM 1017 CG ASP A 69 -1.337 10.437 7.186 1.00 0.00 C ATOM 1018 OD1 ASP A 69 -0.408 11.011 7.799 1.00 0.00 O ATOM 1019 OD2 ASP A 69 -2.440 10.991 6.968 1.00 0.00 O ATOM 0 H ASP A 69 -0.789 8.132 8.941 1.00 0.00 H new ATOM 0 HA ASP A 69 -3.080 8.366 7.183 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -0.072 8.718 6.852 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -1.229 9.009 5.569 1.00 0.00 H new ATOM 1024 N ALA A 70 -1.131 5.728 6.970 1.00 0.00 N ATOM 1025 CA ALA A 70 -1.116 4.348 6.480 1.00 0.00 C ATOM 1026 C ALA A 70 -2.328 3.553 7.003 1.00 0.00 C ATOM 1027 O ALA A 70 -3.000 2.862 6.238 1.00 0.00 O ATOM 1028 CB ALA A 70 0.215 3.706 6.897 1.00 0.00 C ATOM 0 H ALA A 70 -0.401 5.929 7.653 1.00 0.00 H new ATOM 0 HA ALA A 70 -1.197 4.338 5.393 1.00 0.00 H new ATOM 0 HB1 ALA A 70 0.249 2.676 6.542 1.00 0.00 H new ATOM 0 HB2 ALA A 70 1.042 4.267 6.462 1.00 0.00 H new ATOM 0 HB3 ALA A 70 0.300 3.719 7.984 1.00 0.00 H new ATOM 1034 N ASP A 71 -2.663 3.705 8.287 1.00 0.00 N ATOM 1035 CA ASP A 71 -3.793 3.032 8.941 1.00 0.00 C ATOM 1036 C ASP A 71 -5.147 3.386 8.292 1.00 0.00 C ATOM 1037 O ASP A 71 -6.040 2.541 8.194 1.00 0.00 O ATOM 1038 CB ASP A 71 -3.773 3.367 10.443 1.00 0.00 C ATOM 1039 CG ASP A 71 -4.170 2.157 11.299 1.00 0.00 C ATOM 1040 OD1 ASP A 71 -5.356 2.043 11.691 1.00 0.00 O ATOM 1041 OD2 ASP A 71 -3.273 1.329 11.597 1.00 0.00 O ATOM 0 H ASP A 71 -2.144 4.315 8.918 1.00 0.00 H new ATOM 0 HA ASP A 71 -3.680 1.956 8.810 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -2.776 3.703 10.728 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -4.456 4.193 10.641 1.00 0.00 H new ATOM 1046 N TYR A 72 -5.274 4.611 7.767 1.00 0.00 N ATOM 1047 CA TYR A 72 -6.441 5.064 7.005 1.00 0.00 C ATOM 1048 C TYR A 72 -6.442 4.563 5.552 1.00 0.00 C ATOM 1049 O TYR A 72 -7.498 4.217 5.025 1.00 0.00 O ATOM 1050 CB TYR A 72 -6.503 6.594 7.041 1.00 0.00 C ATOM 1051 CG TYR A 72 -7.790 7.144 6.453 1.00 0.00 C ATOM 1052 CD1 TYR A 72 -8.988 7.085 7.192 1.00 0.00 C ATOM 1053 CD2 TYR A 72 -7.798 7.671 5.148 1.00 0.00 C ATOM 1054 CE1 TYR A 72 -10.192 7.553 6.628 1.00 0.00 C ATOM 1055 CE2 TYR A 72 -8.998 8.138 4.578 1.00 0.00 C ATOM 1056 CZ TYR A 72 -10.199 8.079 5.316 1.00 0.00 C ATOM 1057 OH TYR A 72 -11.356 8.534 4.760 1.00 0.00 O ATOM 0 H TYR A 72 -4.554 5.327 7.863 1.00 0.00 H new ATOM 0 HA TYR A 72 -7.326 4.637 7.476 1.00 0.00 H new ATOM 0 HB2 TYR A 72 -6.406 6.933 8.072 1.00 0.00 H new ATOM 0 HB3 TYR A 72 -5.654 7.001 6.491 1.00 0.00 H new ATOM 0 HD1 TYR A 72 -8.984 6.680 8.193 1.00 0.00 H new ATOM 0 HD2 TYR A 72 -6.880 7.717 4.581 1.00 0.00 H new ATOM 0 HE1 TYR A 72 -11.108 7.510 7.198 1.00 0.00 H new ATOM 0 HE2 TYR A 72 -8.999 8.541 3.576 1.00 0.00 H new ATOM 0 HH TYR A 72 -11.177 8.862 3.854 1.00 0.00 H new ATOM 1067 N ALA A 73 -5.280 4.449 4.903 1.00 0.00 N ATOM 1068 CA ALA A 73 -5.187 3.910 3.543 1.00 0.00 C ATOM 1069 C ALA A 73 -5.637 2.441 3.495 1.00 0.00 C ATOM 1070 O ALA A 73 -6.349 2.041 2.578 1.00 0.00 O ATOM 1071 CB ALA A 73 -3.753 4.105 3.046 1.00 0.00 C ATOM 0 H ALA A 73 -4.383 4.726 5.302 1.00 0.00 H new ATOM 0 HA ALA A 73 -5.863 4.446 2.877 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -3.662 3.710 2.034 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -3.510 5.168 3.044 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -3.064 3.576 3.705 1.00 0.00 H new ATOM 1077 N ILE A 74 -5.324 1.667 4.538 1.00 0.00 N ATOM 1078 CA ILE A 74 -5.800 0.287 4.731 1.00 0.00 C ATOM 1079 C ILE A 74 -7.331 0.238 4.871 1.00 0.00 C ATOM 1080 O ILE A 74 -7.973 -0.670 4.341 1.00 0.00 O ATOM 1081 CB ILE A 74 -5.100 -0.331 5.964 1.00 0.00 C ATOM 1082 CG1 ILE A 74 -3.572 -0.371 5.748 1.00 0.00 C ATOM 1083 CG2 ILE A 74 -5.617 -1.752 6.256 1.00 0.00 C ATOM 1084 CD1 ILE A 74 -2.784 -0.497 7.047 1.00 0.00 C ATOM 0 H ILE A 74 -4.717 1.987 5.293 1.00 0.00 H new ATOM 0 HA ILE A 74 -5.545 -0.302 3.850 1.00 0.00 H new ATOM 0 HB ILE A 74 -5.331 0.300 6.822 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -3.325 -1.211 5.098 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -3.261 0.536 5.229 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -5.103 -2.154 7.129 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -6.689 -1.716 6.451 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -5.426 -2.393 5.395 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -1.717 -0.520 6.825 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -3.003 0.356 7.689 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -3.068 -1.418 7.557 1.00 0.00 H new ATOM 1096 N LYS A 75 -7.932 1.236 5.533 1.00 0.00 N ATOM 1097 CA LYS A 75 -9.386 1.345 5.725 1.00 0.00 C ATOM 1098 C LYS A 75 -10.130 1.584 4.405 1.00 0.00 C ATOM 1099 O LYS A 75 -11.185 0.980 4.199 1.00 0.00 O ATOM 1100 CB LYS A 75 -9.675 2.432 6.777 1.00 0.00 C ATOM 1101 CG LYS A 75 -11.170 2.575 7.084 1.00 0.00 C ATOM 1102 CD LYS A 75 -11.406 3.523 8.269 1.00 0.00 C ATOM 1103 CE LYS A 75 -12.908 3.647 8.549 1.00 0.00 C ATOM 1104 NZ LYS A 75 -13.180 4.536 9.709 1.00 0.00 N ATOM 0 H LYS A 75 -7.413 2.004 5.958 1.00 0.00 H new ATOM 0 HA LYS A 75 -9.768 0.394 6.097 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -9.141 2.193 7.697 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -9.288 3.387 6.422 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -11.690 2.953 6.204 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -11.593 1.596 7.308 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -10.892 3.147 9.154 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -10.986 4.505 8.049 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -13.412 4.038 7.665 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -13.325 2.659 8.742 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -14.206 4.595 9.868 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -12.720 4.150 10.558 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -12.804 5.486 9.514 1.00 0.00 H new ATOM 1118 N ILE A 76 -9.591 2.416 3.506 1.00 0.00 N ATOM 1119 CA ILE A 76 -10.256 2.762 2.241 1.00 0.00 C ATOM 1120 C ILE A 76 -9.889 1.848 1.059 1.00 0.00 C ATOM 1121 O ILE A 76 -10.781 1.477 0.303 1.00 0.00 O ATOM 1122 CB ILE A 76 -10.083 4.257 1.896 1.00 0.00 C ATOM 1123 CG1 ILE A 76 -8.618 4.715 1.755 1.00 0.00 C ATOM 1124 CG2 ILE A 76 -10.798 5.122 2.949 1.00 0.00 C ATOM 1125 CD1 ILE A 76 -8.497 6.023 0.974 1.00 0.00 C ATOM 0 H ILE A 76 -8.685 2.868 3.633 1.00 0.00 H new ATOM 0 HA ILE A 76 -11.316 2.579 2.415 1.00 0.00 H new ATOM 0 HB ILE A 76 -10.534 4.388 0.912 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -8.182 4.843 2.746 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -8.043 3.938 1.251 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -10.672 6.176 2.700 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -11.860 4.876 2.962 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -10.369 4.928 3.932 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -7.447 6.307 0.900 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -8.908 5.889 -0.027 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -9.049 6.808 1.491 1.00 0.00 H new ATOM 1137 N MET A 77 -8.622 1.448 0.896 1.00 0.00 N ATOM 1138 CA MET A 77 -8.120 0.757 -0.313 1.00 0.00 C ATOM 1139 C MET A 77 -8.253 -0.769 -0.293 1.00 0.00 C ATOM 1140 O MET A 77 -7.868 -1.448 -1.243 1.00 0.00 O ATOM 1141 CB MET A 77 -6.687 1.199 -0.626 1.00 0.00 C ATOM 1142 CG MET A 77 -6.618 2.640 -1.132 1.00 0.00 C ATOM 1143 SD MET A 77 -7.011 2.803 -2.892 1.00 0.00 S ATOM 1144 CE MET A 77 -6.452 4.502 -3.139 1.00 0.00 C ATOM 0 H MET A 77 -7.903 1.594 1.604 1.00 0.00 H new ATOM 0 HA MET A 77 -8.780 1.069 -1.123 1.00 0.00 H new ATOM 0 HB2 MET A 77 -6.076 1.102 0.271 1.00 0.00 H new ATOM 0 HB3 MET A 77 -6.260 0.533 -1.376 1.00 0.00 H new ATOM 0 HG2 MET A 77 -7.309 3.254 -0.554 1.00 0.00 H new ATOM 0 HG3 MET A 77 -5.617 3.033 -0.953 1.00 0.00 H new ATOM 0 HE1 MET A 77 -7.112 5.003 -3.847 1.00 0.00 H new ATOM 0 HE2 MET A 77 -6.470 5.033 -2.187 1.00 0.00 H new ATOM 0 HE3 MET A 77 -5.435 4.497 -3.532 1.00 0.00 H new ATOM 1154 N ASP A 78 -8.821 -1.327 0.768 1.00 0.00 N ATOM 1155 CA ASP A 78 -8.986 -2.777 0.911 1.00 0.00 C ATOM 1156 C ASP A 78 -10.243 -3.296 0.190 1.00 0.00 C ATOM 1157 O ASP A 78 -11.323 -2.706 0.276 1.00 0.00 O ATOM 1158 CB ASP A 78 -8.912 -3.200 2.382 1.00 0.00 C ATOM 1159 CG ASP A 78 -8.930 -4.729 2.517 1.00 0.00 C ATOM 1160 OD1 ASP A 78 -8.027 -5.380 1.941 1.00 0.00 O ATOM 1161 OD2 ASP A 78 -9.849 -5.272 3.175 1.00 0.00 O ATOM 0 H ASP A 78 -9.182 -0.791 1.557 1.00 0.00 H new ATOM 0 HA ASP A 78 -8.147 -3.257 0.407 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -8.003 -2.802 2.833 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -9.752 -2.773 2.929 1.00 0.00 H new ATOM 1166 N MET A 79 -10.085 -4.401 -0.545 1.00 0.00 N ATOM 1167 CA MET A 79 -11.050 -4.979 -1.492 1.00 0.00 C ATOM 1168 C MET A 79 -11.466 -4.036 -2.648 1.00 0.00 C ATOM 1169 O MET A 79 -12.430 -4.309 -3.364 1.00 0.00 O ATOM 1170 CB MET A 79 -12.215 -5.640 -0.730 1.00 0.00 C ATOM 1171 CG MET A 79 -12.819 -6.829 -1.492 1.00 0.00 C ATOM 1172 SD MET A 79 -14.084 -7.762 -0.583 1.00 0.00 S ATOM 1173 CE MET A 79 -13.052 -8.590 0.660 1.00 0.00 C ATOM 0 H MET A 79 -9.228 -4.951 -0.493 1.00 0.00 H new ATOM 0 HA MET A 79 -10.539 -5.774 -2.036 1.00 0.00 H new ATOM 0 HB2 MET A 79 -11.862 -5.979 0.244 1.00 0.00 H new ATOM 0 HB3 MET A 79 -12.992 -4.898 -0.547 1.00 0.00 H new ATOM 0 HG2 MET A 79 -13.257 -6.461 -2.420 1.00 0.00 H new ATOM 0 HG3 MET A 79 -12.014 -7.511 -1.768 1.00 0.00 H new ATOM 0 HE1 MET A 79 -13.645 -9.338 1.186 1.00 0.00 H new ATOM 0 HE2 MET A 79 -12.209 -9.076 0.168 1.00 0.00 H new ATOM 0 HE3 MET A 79 -12.681 -7.854 1.373 1.00 0.00 H new ATOM 1183 N ILE A 80 -10.723 -2.943 -2.875 1.00 0.00 N ATOM 1184 CA ILE A 80 -10.919 -2.028 -4.009 1.00 0.00 C ATOM 1185 C ILE A 80 -10.455 -2.668 -5.325 1.00 0.00 C ATOM 1186 O ILE A 80 -9.407 -3.308 -5.399 1.00 0.00 O ATOM 1187 CB ILE A 80 -10.280 -0.648 -3.711 1.00 0.00 C ATOM 1188 CG1 ILE A 80 -11.270 0.201 -2.878 1.00 0.00 C ATOM 1189 CG2 ILE A 80 -9.794 0.090 -4.965 1.00 0.00 C ATOM 1190 CD1 ILE A 80 -10.946 1.700 -2.779 1.00 0.00 C ATOM 0 H ILE A 80 -9.955 -2.665 -2.264 1.00 0.00 H new ATOM 0 HA ILE A 80 -11.985 -1.841 -4.143 1.00 0.00 H new ATOM 0 HB ILE A 80 -9.374 -0.820 -3.130 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -12.265 0.091 -3.309 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -11.312 -0.210 -1.869 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -9.359 1.047 -4.678 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -9.041 -0.513 -5.473 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -10.636 0.261 -5.636 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -11.704 2.197 -2.173 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -9.968 1.831 -2.316 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -10.936 2.137 -3.778 1.00 0.00 H new ATOM 1202 N LYS A 81 -11.237 -2.483 -6.393 1.00 0.00 N ATOM 1203 CA LYS A 81 -11.076 -3.182 -7.675 1.00 0.00 C ATOM 1204 C LYS A 81 -10.253 -2.375 -8.679 1.00 0.00 C ATOM 1205 O LYS A 81 -10.747 -1.977 -9.736 1.00 0.00 O ATOM 1206 CB LYS A 81 -12.453 -3.604 -8.202 1.00 0.00 C ATOM 1207 CG LYS A 81 -13.099 -4.659 -7.289 1.00 0.00 C ATOM 1208 CD LYS A 81 -14.382 -5.265 -7.875 1.00 0.00 C ATOM 1209 CE LYS A 81 -14.059 -6.362 -8.899 1.00 0.00 C ATOM 1210 NZ LYS A 81 -15.281 -6.838 -9.601 1.00 0.00 N ATOM 0 H LYS A 81 -12.019 -1.828 -6.392 1.00 0.00 H new ATOM 0 HA LYS A 81 -10.492 -4.089 -7.516 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -13.102 -2.731 -8.270 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -12.352 -4.005 -9.211 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -12.381 -5.457 -7.103 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -13.327 -4.204 -6.325 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -14.991 -5.681 -7.072 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -14.973 -4.482 -8.351 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -13.346 -5.979 -9.629 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -13.579 -7.201 -8.394 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -15.023 -7.578 -10.284 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -15.951 -7.226 -8.907 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -15.725 -6.043 -10.103 1.00 0.00 H new ATOM 1224 N LEU A 82 -8.981 -2.151 -8.351 1.00 0.00 N ATOM 1225 CA LEU A 82 -8.017 -1.491 -9.240 1.00 0.00 C ATOM 1226 C LEU A 82 -7.899 -2.298 -10.546 1.00 0.00 C ATOM 1227 O LEU A 82 -7.599 -3.493 -10.498 1.00 0.00 O ATOM 1228 CB LEU A 82 -6.674 -1.345 -8.495 1.00 0.00 C ATOM 1229 CG LEU A 82 -5.610 -0.503 -9.222 1.00 0.00 C ATOM 1230 CD1 LEU A 82 -6.126 0.895 -9.570 1.00 0.00 C ATOM 1231 CD2 LEU A 82 -4.385 -0.358 -8.317 1.00 0.00 C ATOM 0 H LEU A 82 -8.584 -2.424 -7.452 1.00 0.00 H new ATOM 0 HA LEU A 82 -8.348 -0.489 -9.514 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -6.865 -0.897 -7.520 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -6.267 -2.340 -8.315 1.00 0.00 H new ATOM 0 HG LEU A 82 -5.357 -1.015 -10.150 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -5.343 1.455 -10.082 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -6.996 0.810 -10.221 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -6.407 1.417 -8.655 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -3.626 0.237 -8.825 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -4.674 0.137 -7.390 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -3.981 -1.345 -8.091 1.00 0.00 H new ATOM 1243 N TYR A 83 -8.205 -1.685 -11.699 1.00 0.00 N ATOM 1244 CA TYR A 83 -8.376 -2.403 -12.981 1.00 0.00 C ATOM 1245 C TYR A 83 -9.221 -3.715 -12.922 1.00 0.00 C ATOM 1246 O TYR A 83 -8.980 -4.646 -13.696 1.00 0.00 O ATOM 1247 CB TYR A 83 -7.010 -2.608 -13.659 1.00 0.00 C ATOM 1248 CG TYR A 83 -6.204 -1.345 -13.889 1.00 0.00 C ATOM 1249 CD1 TYR A 83 -6.658 -0.371 -14.803 1.00 0.00 C ATOM 1250 CD2 TYR A 83 -4.979 -1.161 -13.221 1.00 0.00 C ATOM 1251 CE1 TYR A 83 -5.885 0.781 -15.050 1.00 0.00 C ATOM 1252 CE2 TYR A 83 -4.201 -0.017 -13.474 1.00 0.00 C ATOM 1253 CZ TYR A 83 -4.652 0.961 -14.385 1.00 0.00 C ATOM 1254 OH TYR A 83 -3.894 2.067 -14.622 1.00 0.00 O ATOM 0 H TYR A 83 -8.342 -0.677 -11.774 1.00 0.00 H new ATOM 0 HA TYR A 83 -8.993 -1.752 -13.600 1.00 0.00 H new ATOM 0 HB2 TYR A 83 -6.419 -3.290 -13.048 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -7.170 -3.097 -14.620 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -7.599 -0.508 -15.314 1.00 0.00 H new ATOM 0 HD2 TYR A 83 -4.636 -1.900 -12.512 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -6.236 1.527 -15.748 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -3.255 0.113 -12.969 1.00 0.00 H new ATOM 0 HH TYR A 83 -4.477 2.819 -14.857 1.00 0.00 H new ATOM 1264 N GLY A 84 -10.216 -3.818 -12.024 1.00 0.00 N ATOM 1265 CA GLY A 84 -11.165 -4.946 -11.954 1.00 0.00 C ATOM 1266 C GLY A 84 -10.758 -6.166 -11.103 1.00 0.00 C ATOM 1267 O GLY A 84 -11.464 -7.175 -11.129 1.00 0.00 O ATOM 0 H GLY A 84 -10.387 -3.107 -11.313 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -12.111 -4.567 -11.567 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -11.352 -5.292 -12.971 1.00 0.00 H new ATOM 1271 N LYS A 85 -9.666 -6.092 -10.327 1.00 0.00 N ATOM 1272 CA LYS A 85 -9.145 -7.120 -9.416 1.00 0.00 C ATOM 1273 C LYS A 85 -9.132 -6.553 -7.984 1.00 0.00 C ATOM 1274 O LYS A 85 -8.491 -5.524 -7.762 1.00 0.00 O ATOM 1275 CB LYS A 85 -7.731 -7.547 -9.850 1.00 0.00 C ATOM 1276 CG LYS A 85 -7.770 -8.402 -11.124 1.00 0.00 C ATOM 1277 CD LYS A 85 -6.352 -8.756 -11.597 1.00 0.00 C ATOM 1278 CE LYS A 85 -6.353 -9.627 -12.862 1.00 0.00 C ATOM 1279 NZ LYS A 85 -6.817 -8.883 -14.062 1.00 0.00 N ATOM 0 H LYS A 85 -9.084 -5.254 -10.320 1.00 0.00 H new ATOM 0 HA LYS A 85 -9.784 -8.003 -9.447 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -7.119 -6.662 -10.023 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -7.257 -8.110 -9.046 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -8.332 -9.316 -10.935 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -8.295 -7.862 -11.912 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -5.798 -7.838 -11.793 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -5.827 -9.281 -10.799 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -5.347 -10.006 -13.040 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -6.996 -10.493 -12.703 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -6.688 -9.474 -14.908 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -7.824 -8.646 -13.955 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -6.264 -8.008 -14.163 1.00 0.00 H new ATOM 1293 N PRO A 86 -9.860 -7.156 -7.028 1.00 0.00 N ATOM 1294 CA PRO A 86 -10.034 -6.630 -5.673 1.00 0.00 C ATOM 1295 C PRO A 86 -8.751 -6.778 -4.837 1.00 0.00 C ATOM 1296 O PRO A 86 -8.464 -7.845 -4.285 1.00 0.00 O ATOM 1297 CB PRO A 86 -11.248 -7.375 -5.099 1.00 0.00 C ATOM 1298 CG PRO A 86 -11.304 -8.675 -5.896 1.00 0.00 C ATOM 1299 CD PRO A 86 -10.753 -8.274 -7.262 1.00 0.00 C ATOM 0 HA PRO A 86 -10.219 -5.556 -5.663 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -11.129 -7.567 -4.033 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -12.163 -6.795 -5.218 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -10.702 -9.457 -5.433 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -12.322 -9.058 -5.970 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -10.222 -9.105 -7.726 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -11.559 -7.992 -7.939 1.00 0.00 H new ATOM 1307 N ILE A 87 -7.974 -5.697 -4.743 1.00 0.00 N ATOM 1308 CA ILE A 87 -6.684 -5.659 -4.039 1.00 0.00 C ATOM 1309 C ILE A 87 -6.873 -5.846 -2.528 1.00 0.00 C ATOM 1310 O ILE A 87 -7.888 -5.435 -1.963 1.00 0.00 O ATOM 1311 CB ILE A 87 -5.871 -4.384 -4.373 1.00 0.00 C ATOM 1312 CG1 ILE A 87 -6.434 -3.125 -3.676 1.00 0.00 C ATOM 1313 CG2 ILE A 87 -5.749 -4.215 -5.899 1.00 0.00 C ATOM 1314 CD1 ILE A 87 -5.782 -1.810 -4.108 1.00 0.00 C ATOM 0 H ILE A 87 -8.227 -4.802 -5.162 1.00 0.00 H new ATOM 0 HA ILE A 87 -6.092 -6.500 -4.400 1.00 0.00 H new ATOM 0 HB ILE A 87 -4.866 -4.510 -3.971 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -7.505 -3.066 -3.872 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -6.313 -3.238 -2.599 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -5.175 -3.315 -6.121 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -5.242 -5.082 -6.322 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -6.744 -4.128 -6.336 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -6.240 -0.982 -3.567 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -4.715 -1.843 -3.886 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -5.925 -1.668 -5.179 1.00 0.00 H new ATOM 1326 N ARG A 88 -5.896 -6.457 -1.858 1.00 0.00 N ATOM 1327 CA ARG A 88 -5.902 -6.696 -0.406 1.00 0.00 C ATOM 1328 C ARG A 88 -4.832 -5.843 0.266 1.00 0.00 C ATOM 1329 O ARG A 88 -3.679 -5.873 -0.164 1.00 0.00 O ATOM 1330 CB ARG A 88 -5.730 -8.193 -0.101 1.00 0.00 C ATOM 1331 CG ARG A 88 -6.807 -9.110 -0.711 1.00 0.00 C ATOM 1332 CD ARG A 88 -8.247 -8.667 -0.396 1.00 0.00 C ATOM 1333 NE ARG A 88 -9.195 -9.797 -0.444 1.00 0.00 N ATOM 1334 CZ ARG A 88 -9.717 -10.386 -1.506 1.00 0.00 C ATOM 1335 NH1 ARG A 88 -9.489 -9.997 -2.728 1.00 0.00 N ATOM 1336 NH2 ARG A 88 -10.503 -11.413 -1.353 1.00 0.00 N ATOM 0 H ARG A 88 -5.056 -6.810 -2.317 1.00 0.00 H new ATOM 0 HA ARG A 88 -6.867 -6.399 0.004 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -4.754 -8.513 -0.465 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -5.728 -8.330 0.980 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -6.674 -9.142 -1.792 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -6.659 -10.125 -0.342 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -8.278 -8.210 0.593 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -8.556 -7.904 -1.110 1.00 0.00 H new ATOM 0 HE ARG A 88 -9.485 -10.172 0.459 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -8.879 -9.198 -2.904 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -9.920 -10.491 -3.509 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -10.713 -11.759 -0.417 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -10.908 -11.871 -2.169 1.00 0.00 H new ATOM 1350 N VAL A 89 -5.207 -5.078 1.292 1.00 0.00 N ATOM 1351 CA VAL A 89 -4.356 -4.039 1.902 1.00 0.00 C ATOM 1352 C VAL A 89 -4.259 -4.213 3.420 1.00 0.00 C ATOM 1353 O VAL A 89 -5.262 -4.496 4.077 1.00 0.00 O ATOM 1354 CB VAL A 89 -4.837 -2.623 1.514 1.00 0.00 C ATOM 1355 CG1 VAL A 89 -3.841 -1.535 1.931 1.00 0.00 C ATOM 1356 CG2 VAL A 89 -5.012 -2.483 -0.003 1.00 0.00 C ATOM 0 H VAL A 89 -6.123 -5.159 1.734 1.00 0.00 H new ATOM 0 HA VAL A 89 -3.349 -4.159 1.503 1.00 0.00 H new ATOM 0 HB VAL A 89 -5.785 -2.494 2.036 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -4.225 -0.558 1.636 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -3.706 -1.561 3.012 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -2.883 -1.711 1.441 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -5.351 -1.474 -0.239 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -4.059 -2.670 -0.498 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -5.750 -3.205 -0.352 1.00 0.00 H new ATOM 1366 N ASN A 90 -3.053 -4.057 3.982 1.00 0.00 N ATOM 1367 CA ASN A 90 -2.765 -4.133 5.426 1.00 0.00 C ATOM 1368 C ASN A 90 -1.428 -3.426 5.765 1.00 0.00 C ATOM 1369 O ASN A 90 -0.709 -2.999 4.861 1.00 0.00 O ATOM 1370 CB ASN A 90 -2.754 -5.624 5.833 1.00 0.00 C ATOM 1371 CG ASN A 90 -2.934 -5.882 7.323 1.00 0.00 C ATOM 1372 OD1 ASN A 90 -3.060 -4.981 8.140 1.00 0.00 O ATOM 1373 ND2 ASN A 90 -2.954 -7.131 7.725 1.00 0.00 N ATOM 0 H ASN A 90 -2.219 -3.867 3.426 1.00 0.00 H new ATOM 0 HA ASN A 90 -3.535 -3.611 5.994 1.00 0.00 H new ATOM 0 HB2 ASN A 90 -3.547 -6.140 5.291 1.00 0.00 H new ATOM 0 HB3 ASN A 90 -1.810 -6.066 5.514 1.00 0.00 H new ATOM 0 HD21 ASN A 90 -3.074 -7.346 8.715 1.00 0.00 H new ATOM 0 HD22 ASN A 90 -2.849 -7.886 7.048 1.00 0.00 H new ATOM 1380 N LYS A 91 -1.060 -3.310 7.049 1.00 0.00 N ATOM 1381 CA LYS A 91 0.258 -2.810 7.500 1.00 0.00 C ATOM 1382 C LYS A 91 1.368 -3.740 6.987 1.00 0.00 C ATOM 1383 O LYS A 91 1.213 -4.962 7.026 1.00 0.00 O ATOM 1384 CB LYS A 91 0.316 -2.728 9.046 1.00 0.00 C ATOM 1385 CG LYS A 91 -0.806 -1.928 9.737 1.00 0.00 C ATOM 1386 CD LYS A 91 -0.689 -0.399 9.595 1.00 0.00 C ATOM 1387 CE LYS A 91 0.112 0.267 10.719 1.00 0.00 C ATOM 1388 NZ LYS A 91 -0.658 0.341 11.988 1.00 0.00 N ATOM 0 H LYS A 91 -1.677 -3.564 7.821 1.00 0.00 H new ATOM 0 HA LYS A 91 0.405 -1.808 7.096 1.00 0.00 H new ATOM 0 HB2 LYS A 91 0.304 -3.744 9.442 1.00 0.00 H new ATOM 0 HB3 LYS A 91 1.272 -2.287 9.328 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -1.765 -2.245 9.327 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -0.814 -2.181 10.797 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -0.218 -0.167 8.640 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -1.690 0.032 9.570 1.00 0.00 H new ATOM 0 HE2 LYS A 91 1.033 -0.291 10.887 1.00 0.00 H new ATOM 0 HE3 LYS A 91 0.400 1.272 10.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -0.159 0.957 12.661 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -1.604 0.729 11.798 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -0.750 -0.612 12.394 1.00 0.00 H new ATOM 1402 N ALA A 92 2.513 -3.199 6.564 1.00 0.00 N ATOM 1403 CA ALA A 92 3.641 -4.013 6.089 1.00 0.00 C ATOM 1404 C ALA A 92 4.359 -4.802 7.216 1.00 0.00 C ATOM 1405 O ALA A 92 5.108 -5.738 6.927 1.00 0.00 O ATOM 1406 CB ALA A 92 4.595 -3.116 5.291 1.00 0.00 C ATOM 0 H ALA A 92 2.687 -2.194 6.540 1.00 0.00 H new ATOM 0 HA ALA A 92 3.249 -4.792 5.435 1.00 0.00 H new ATOM 0 HB1 ALA A 92 5.437 -3.708 4.933 1.00 0.00 H new ATOM 0 HB2 ALA A 92 4.065 -2.687 4.441 1.00 0.00 H new ATOM 0 HB3 ALA A 92 4.962 -2.314 5.932 1.00 0.00 H new ATOM 1412 N SER A 93 4.085 -4.471 8.487 1.00 0.00 N ATOM 1413 CA SER A 93 4.546 -5.185 9.697 1.00 0.00 C ATOM 1414 C SER A 93 3.377 -5.636 10.598 1.00 0.00 C ATOM 1415 O SER A 93 3.448 -5.549 11.825 1.00 0.00 O ATOM 1416 CB SER A 93 5.575 -4.345 10.468 1.00 0.00 C ATOM 1417 OG SER A 93 6.757 -4.193 9.703 1.00 0.00 O ATOM 0 H SER A 93 3.509 -3.661 8.715 1.00 0.00 H new ATOM 0 HA SER A 93 5.040 -6.098 9.366 1.00 0.00 H new ATOM 0 HB2 SER A 93 5.155 -3.366 10.700 1.00 0.00 H new ATOM 0 HB3 SER A 93 5.808 -4.825 11.418 1.00 0.00 H new ATOM 0 HG SER A 93 7.458 -3.795 10.260 1.00 0.00 H new ATOM 1423 N ALA A 94 2.273 -6.108 9.999 1.00 0.00 N ATOM 1424 CA ALA A 94 1.034 -6.459 10.709 1.00 0.00 C ATOM 1425 C ALA A 94 1.171 -7.589 11.758 1.00 0.00 C ATOM 1426 O ALA A 94 0.378 -7.646 12.702 1.00 0.00 O ATOM 1427 CB ALA A 94 -0.022 -6.839 9.661 1.00 0.00 C ATOM 0 H ALA A 94 2.215 -6.259 8.992 1.00 0.00 H new ATOM 0 HA ALA A 94 0.745 -5.582 11.288 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -0.953 -7.104 10.162 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -0.196 -5.993 8.996 1.00 0.00 H new ATOM 0 HB3 ALA A 94 0.332 -7.690 9.079 1.00 0.00 H new ATOM 1433 N HIS A 95 2.155 -8.486 11.615 1.00 0.00 N ATOM 1434 CA HIS A 95 2.398 -9.598 12.548 1.00 0.00 C ATOM 1435 C HIS A 95 3.231 -9.160 13.763 1.00 0.00 C ATOM 1436 O HIS A 95 4.272 -8.516 13.613 1.00 0.00 O ATOM 1437 CB HIS A 95 3.054 -10.775 11.812 1.00 0.00 C ATOM 1438 CG HIS A 95 2.161 -11.380 10.756 1.00 0.00 C ATOM 1439 ND1 HIS A 95 1.135 -12.302 10.992 1.00 0.00 N ATOM 1440 CD2 HIS A 95 2.198 -11.095 9.422 1.00 0.00 C ATOM 1441 CE1 HIS A 95 0.582 -12.553 9.793 1.00 0.00 C ATOM 1442 NE2 HIS A 95 1.201 -11.843 8.834 1.00 0.00 N ATOM 0 H HIS A 95 2.815 -8.461 10.838 1.00 0.00 H new ATOM 0 HA HIS A 95 1.433 -9.927 12.935 1.00 0.00 H new ATOM 0 HB2 HIS A 95 3.979 -10.435 11.347 1.00 0.00 H new ATOM 0 HB3 HIS A 95 3.325 -11.544 12.536 1.00 0.00 H new ATOM 0 HD2 HIS A 95 2.875 -10.417 8.925 1.00 0.00 H new ATOM 0 HE1 HIS A 95 -0.243 -13.229 9.624 1.00 0.00 H new ATOM 0 HE2 HIS A 95 0.972 -11.856 7.840 1.00 0.00 H new ATOM 1450 N ASN A 96 2.792 -9.533 14.970 1.00 0.00 N ATOM 1451 CA ASN A 96 3.469 -9.196 16.229 1.00 0.00 C ATOM 1452 C ASN A 96 4.659 -10.135 16.533 1.00 0.00 C ATOM 1453 O ASN A 96 4.713 -11.271 16.053 1.00 0.00 O ATOM 1454 CB ASN A 96 2.424 -9.182 17.363 1.00 0.00 C ATOM 1455 CG ASN A 96 2.970 -8.571 18.645 1.00 0.00 C ATOM 1456 OD1 ASN A 96 3.502 -7.471 18.655 1.00 0.00 O ATOM 1457 ND2 ASN A 96 2.914 -9.271 19.754 1.00 0.00 N ATOM 0 H ASN A 96 1.945 -10.085 15.103 1.00 0.00 H new ATOM 0 HA ASN A 96 3.911 -8.204 16.139 1.00 0.00 H new ATOM 0 HB2 ASN A 96 1.548 -8.620 17.040 1.00 0.00 H new ATOM 0 HB3 ASN A 96 2.093 -10.201 17.561 1.00 0.00 H new ATOM 0 HD21 ASN A 96 3.313 -8.896 20.615 1.00 0.00 H new ATOM 0 HD22 ASN A 96 2.472 -10.190 19.755 1.00 0.00 H new ATOM 1464 N LYS A 97 5.600 -9.678 17.375 1.00 0.00 N ATOM 1465 CA LYS A 97 6.804 -10.431 17.785 1.00 0.00 C ATOM 1466 C LYS A 97 6.494 -11.692 18.617 1.00 0.00 C ATOM 1467 O LYS A 97 7.268 -12.649 18.587 1.00 0.00 O ATOM 1468 CB LYS A 97 7.743 -9.459 18.527 1.00 0.00 C ATOM 1469 CG LYS A 97 9.149 -10.034 18.764 1.00 0.00 C ATOM 1470 CD LYS A 97 10.079 -8.981 19.387 1.00 0.00 C ATOM 1471 CE LYS A 97 11.521 -9.486 19.545 1.00 0.00 C ATOM 1472 NZ LYS A 97 11.646 -10.556 20.570 1.00 0.00 N ATOM 0 H LYS A 97 5.547 -8.753 17.802 1.00 0.00 H new ATOM 0 HA LYS A 97 7.293 -10.818 16.891 1.00 0.00 H new ATOM 0 HB2 LYS A 97 7.827 -8.537 17.953 1.00 0.00 H new ATOM 0 HB3 LYS A 97 7.298 -9.197 19.487 1.00 0.00 H new ATOM 0 HG2 LYS A 97 9.085 -10.901 19.421 1.00 0.00 H new ATOM 0 HG3 LYS A 97 9.568 -10.380 17.819 1.00 0.00 H new ATOM 0 HD2 LYS A 97 10.077 -8.086 18.764 1.00 0.00 H new ATOM 0 HD3 LYS A 97 9.691 -8.691 20.363 1.00 0.00 H new ATOM 0 HE2 LYS A 97 11.876 -9.864 18.586 1.00 0.00 H new ATOM 0 HE3 LYS A 97 12.166 -8.651 19.817 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 12.639 -10.860 20.636 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 11.334 -10.191 21.493 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 11.053 -11.367 20.300 1.00 0.00 H new ATOM 1486 N ASN A 98 5.364 -11.710 19.329 1.00 0.00 N ATOM 1487 CA ASN A 98 4.874 -12.850 20.117 1.00 0.00 C ATOM 1488 C ASN A 98 3.350 -13.054 19.945 1.00 0.00 C ATOM 1489 O ASN A 98 2.611 -12.092 19.718 1.00 0.00 O ATOM 1490 CB ASN A 98 5.276 -12.630 21.588 1.00 0.00 C ATOM 1491 CG ASN A 98 4.988 -13.849 22.445 1.00 0.00 C ATOM 1492 OD1 ASN A 98 3.931 -13.980 23.042 1.00 0.00 O ATOM 1493 ND2 ASN A 98 5.887 -14.807 22.488 1.00 0.00 N ATOM 0 H ASN A 98 4.741 -10.904 19.376 1.00 0.00 H new ATOM 0 HA ASN A 98 5.332 -13.771 19.757 1.00 0.00 H new ATOM 0 HB2 ASN A 98 6.338 -12.392 21.642 1.00 0.00 H new ATOM 0 HB3 ASN A 98 4.736 -11.771 21.987 1.00 0.00 H new ATOM 0 HD21 ASN A 98 5.701 -15.658 23.019 1.00 0.00 H new ATOM 0 HD22 ASN A 98 6.771 -14.700 21.990 1.00 0.00 H new ATOM 1500 N LEU A 99 2.879 -14.303 20.054 1.00 0.00 N ATOM 1501 CA LEU A 99 1.487 -14.697 19.783 1.00 0.00 C ATOM 1502 C LEU A 99 0.589 -14.760 21.041 1.00 0.00 C ATOM 1503 O LEU A 99 -0.638 -14.720 20.919 1.00 0.00 O ATOM 1504 CB LEU A 99 1.541 -16.041 19.026 1.00 0.00 C ATOM 1505 CG LEU A 99 0.200 -16.576 18.482 1.00 0.00 C ATOM 1506 CD1 LEU A 99 -0.470 -15.612 17.500 1.00 0.00 C ATOM 1507 CD2 LEU A 99 0.441 -17.899 17.753 1.00 0.00 C ATOM 0 H LEU A 99 3.467 -15.086 20.339 1.00 0.00 H new ATOM 0 HA LEU A 99 1.009 -13.927 19.177 1.00 0.00 H new ATOM 0 HB2 LEU A 99 2.231 -15.934 18.189 1.00 0.00 H new ATOM 0 HB3 LEU A 99 1.963 -16.792 19.693 1.00 0.00 H new ATOM 0 HG LEU A 99 -0.460 -16.701 19.340 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -1.409 -16.042 17.151 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -0.669 -14.664 17.999 1.00 0.00 H new ATOM 0 HD13 LEU A 99 0.190 -15.443 16.649 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -0.505 -18.280 17.367 1.00 0.00 H new ATOM 0 HD22 LEU A 99 1.132 -17.738 16.925 1.00 0.00 H new ATOM 0 HD23 LEU A 99 0.868 -18.624 18.446 1.00 0.00 H new ATOM 1519 N SER A 100 1.163 -14.859 22.244 1.00 0.00 N ATOM 1520 CA SER A 100 0.416 -15.089 23.493 1.00 0.00 C ATOM 1521 C SER A 100 -0.347 -13.848 23.981 1.00 0.00 C ATOM 1522 O SER A 100 0.156 -12.722 23.918 1.00 0.00 O ATOM 1523 CB SER A 100 1.349 -15.588 24.604 1.00 0.00 C ATOM 1524 OG SER A 100 1.971 -16.808 24.221 1.00 0.00 O ATOM 0 H SER A 100 2.170 -14.781 22.384 1.00 0.00 H new ATOM 0 HA SER A 100 -0.325 -15.854 23.261 1.00 0.00 H new ATOM 0 HB2 SER A 100 2.109 -14.836 24.814 1.00 0.00 H new ATOM 0 HB3 SER A 100 0.783 -15.735 25.524 1.00 0.00 H new ATOM 0 HG SER A 100 2.564 -17.112 24.939 1.00 0.00 H new ATOM 1530 N GLY A 101 -1.560 -14.060 24.507 1.00 0.00 N ATOM 1531 CA GLY A 101 -2.387 -13.017 25.130 1.00 0.00 C ATOM 1532 C GLY A 101 -1.967 -12.661 26.571 1.00 0.00 C ATOM 1533 O GLY A 101 -1.144 -13.365 27.170 1.00 0.00 O ATOM 0 H GLY A 101 -2.003 -14.979 24.512 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -2.342 -12.117 24.517 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -3.426 -13.347 25.136 1.00 0.00 H new ATOM 1537 N PRO A 102 -2.534 -11.586 27.154 1.00 0.00 N ATOM 1538 CA PRO A 102 -2.222 -11.134 28.516 1.00 0.00 C ATOM 1539 C PRO A 102 -2.861 -12.000 29.622 1.00 0.00 C ATOM 1540 O PRO A 102 -2.429 -11.942 30.776 1.00 0.00 O ATOM 1541 CB PRO A 102 -2.742 -9.693 28.567 1.00 0.00 C ATOM 1542 CG PRO A 102 -3.943 -9.718 27.622 1.00 0.00 C ATOM 1543 CD PRO A 102 -3.486 -10.678 26.524 1.00 0.00 C ATOM 0 HA PRO A 102 -1.153 -11.213 28.712 1.00 0.00 H new ATOM 0 HB2 PRO A 102 -3.032 -9.406 29.578 1.00 0.00 H new ATOM 0 HB3 PRO A 102 -1.986 -8.981 28.237 1.00 0.00 H new ATOM 0 HG2 PRO A 102 -4.844 -10.074 28.122 1.00 0.00 H new ATOM 0 HG3 PRO A 102 -4.168 -8.728 27.226 1.00 0.00 H new ATOM 0 HD2 PRO A 102 -4.331 -11.226 26.108 1.00 0.00 H new ATOM 0 HD3 PRO A 102 -3.022 -10.136 25.700 1.00 0.00 H new ATOM 1551 N SER A 103 -3.885 -12.792 29.288 1.00 0.00 N ATOM 1552 CA SER A 103 -4.637 -13.666 30.203 1.00 0.00 C ATOM 1553 C SER A 103 -5.181 -14.916 29.490 1.00 0.00 C ATOM 1554 O SER A 103 -5.050 -15.062 28.269 1.00 0.00 O ATOM 1555 CB SER A 103 -5.790 -12.870 30.840 1.00 0.00 C ATOM 1556 OG SER A 103 -6.776 -12.538 29.872 1.00 0.00 O ATOM 0 H SER A 103 -4.230 -12.846 28.330 1.00 0.00 H new ATOM 0 HA SER A 103 -3.953 -14.011 30.979 1.00 0.00 H new ATOM 0 HB2 SER A 103 -6.243 -13.456 31.639 1.00 0.00 H new ATOM 0 HB3 SER A 103 -5.400 -11.959 31.294 1.00 0.00 H new ATOM 0 HG SER A 103 -7.499 -12.034 30.301 1.00 0.00 H new ATOM 1562 N SER A 104 -5.812 -15.822 30.244 1.00 0.00 N ATOM 1563 CA SER A 104 -6.480 -17.029 29.727 1.00 0.00 C ATOM 1564 C SER A 104 -7.833 -16.767 29.031 1.00 0.00 C ATOM 1565 O SER A 104 -8.406 -17.691 28.444 1.00 0.00 O ATOM 1566 CB SER A 104 -6.652 -18.041 30.869 1.00 0.00 C ATOM 1567 OG SER A 104 -7.357 -17.459 31.958 1.00 0.00 O ATOM 0 H SER A 104 -5.876 -15.737 31.258 1.00 0.00 H new ATOM 0 HA SER A 104 -5.832 -17.429 28.947 1.00 0.00 H new ATOM 0 HB2 SER A 104 -7.191 -18.916 30.507 1.00 0.00 H new ATOM 0 HB3 SER A 104 -5.674 -18.386 31.206 1.00 0.00 H new ATOM 0 HG SER A 104 -7.457 -18.121 32.674 1.00 0.00 H new ATOM 1573 N GLY A 105 -8.338 -15.522 29.059 1.00 0.00 N ATOM 1574 CA GLY A 105 -9.611 -15.096 28.452 1.00 0.00 C ATOM 1575 C GLY A 105 -10.849 -15.602 29.198 1.00 0.00 C ATOM 1576 O GLY A 105 -11.003 -15.266 30.395 1.00 0.00 O ATOM 1577 OXT GLY A 105 -11.677 -16.303 28.575 1.00 0.00 O ATOM 0 H GLY A 105 -7.852 -14.755 29.523 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -9.639 -14.007 28.416 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -9.649 -15.450 27.422 1.00 0.00 H new TER 1581 GLY A 105