USER MOD reduce.3.24.130724 H: found=0, std=0, add=1184, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1180 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 90 LYS NZ :NH3+ 149:sc= 1.22 (180deg=0) USER MOD Set 1.2: A 103 HIS : no HD1:sc= 1.11 K(o=1.6,f=-7.4!) USER MOD Set 1.3: A 107 ASN : amide:sc= -0.688 K(o=1.6,f=-0.046!) USER MOD Set 2.1: A 56 ASN : amide:sc= 0.371 K(o=0.71,f=-1.4!) USER MOD Set 2.2: A 58 THR OG1 : rot 180:sc= 0.343 USER MOD Set 3.1: A 45 GLN : amide:sc= 0.955 K(o=1.8,f=-0.11) USER MOD Set 3.2: A 49 ASN : amide:sc= 0.843 K(o=1.8,f=-1.8) USER MOD Single : A 4 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ -122:sc= 0.021 (180deg=-0.112) USER MOD Single : A 22 THR OG1 : rot -17:sc= 0.449 USER MOD Single : A 24 THR OG1 : rot -75:sc= 0.888 USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 170:sc=-0.00669 (180deg=-0.244) USER MOD Single : A 30 THR OG1 : rot 80:sc= 0.214 USER MOD Single : A 32 MET CE :methyl -177:sc= -0.355 (180deg=-0.388) USER MOD Single : A 34 SER OG : rot 83:sc= 1.23 USER MOD Single : A 37 GLN : amide:sc= -0.127 X(o=-0.13,f=0) USER MOD Single : A 38 ASN : amide:sc=-0.00137 X(o=-0.0014,f=-0.098) USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 MET CE :methyl 180:sc= -0.0143 (180deg=-0.0143) USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 MET CE :methyl 164:sc= 0 (180deg=-0.287) USER MOD Single : A 68 MET CE :methyl -167:sc= -0.103 (180deg=-0.152) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 MET CE :methyl -164:sc= 0 (180deg=-0.291) USER MOD Single : A 73 LYS NZ :NH3+ 177:sc= 1.06 (180deg=0.924) USER MOD Single : A 75 THR OG1 : rot -65:sc= 0.0651 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 93 ASN : amide:sc= -0.681 K(o=-0.68,f=-4.9!) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot -68:sc= 0.588 USER MOD Single : A 105 MET CE :methyl -150:sc= -2.58 (180deg=-4.45!) USER MOD Single : A 106 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.103) USER MOD Single : A 113 THR OG1 : rot 180:sc= -0.0118 USER MOD Single : A 120 MET CE :methyl -145:sc= -0.105 (180deg=-1.44) USER MOD Single : A 131 GLN : amide:sc=-0.00191 K(o=-0.0019,f=-0.64) USER MOD Single : A 133 ASN : amide:sc=-0.00796 K(o=-0.008,f=-8.8!) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 139 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 140 MET CE :methyl 162:sc= -1.44! (180deg=-3.09!) USER MOD Single : A 141 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 142 THR OG1 : rot 170:sc= 0 USER MOD Single : B 1 ARG N :NH3+ -171:sc= 1.28 (180deg=1.16) USER MOD Single : B 3 LYS NZ :NH3+ 149:sc= 2.17 (180deg=1.81) USER MOD Single : B 5 GLN : amide:sc= -0.085 K(o=-0.085,f=-1.5!) USER MOD Single : B 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 7 THR OG1 : rot 83:sc= 0.506 USER MOD Single : B 9 HIS :FLIP no HE2:sc= -0.188 F(o=-1.2,f=-0.19) USER MOD ----------------------------------------------------------------- ATOM 29 N GLU A 3 2.481 3.384 16.755 1.00 0.00 N ATOM 30 CA GLU A 3 1.526 2.935 15.790 1.00 0.00 C ATOM 31 C GLU A 3 1.982 2.719 14.388 1.00 0.00 C ATOM 32 O GLU A 3 1.525 1.839 13.661 1.00 0.00 O ATOM 33 CB GLU A 3 0.237 3.773 15.814 1.00 0.00 C ATOM 34 CG GLU A 3 -0.450 3.689 17.178 1.00 0.00 C ATOM 35 CD GLU A 3 -1.968 3.796 17.134 1.00 0.00 C ATOM 36 OE1 GLU A 3 -2.494 4.819 16.620 1.00 0.00 O ATOM 37 OE2 GLU A 3 -2.687 2.804 17.427 1.00 0.00 O ATOM 0 HA GLU A 3 1.334 1.923 16.145 1.00 0.00 H new ATOM 0 HB2 GLU A 3 0.471 4.813 15.585 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -0.443 3.421 15.039 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -0.180 2.743 17.648 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -0.062 4.484 17.815 1.00 0.00 H new ATOM 44 N GLN A 4 2.888 3.600 13.928 1.00 0.00 N ATOM 45 CA GLN A 4 3.472 3.712 12.627 1.00 0.00 C ATOM 46 C GLN A 4 4.544 2.679 12.548 1.00 0.00 C ATOM 47 O GLN A 4 4.679 1.960 11.560 1.00 0.00 O ATOM 48 CB GLN A 4 3.764 5.149 12.166 1.00 0.00 C ATOM 49 CG GLN A 4 4.102 5.128 10.674 1.00 0.00 C ATOM 50 CD GLN A 4 4.410 6.548 10.222 1.00 0.00 C ATOM 51 OE1 GLN A 4 3.616 7.264 9.616 1.00 0.00 O ATOM 52 NE2 GLN A 4 5.697 6.952 10.402 1.00 0.00 N ATOM 0 H GLN A 4 3.254 4.322 14.549 1.00 0.00 H new ATOM 0 HA GLN A 4 2.760 3.479 11.835 1.00 0.00 H new ATOM 0 HB2 GLN A 4 2.899 5.787 12.348 1.00 0.00 H new ATOM 0 HB3 GLN A 4 4.594 5.567 12.735 1.00 0.00 H new ATOM 0 HG2 GLN A 4 4.958 4.479 10.490 1.00 0.00 H new ATOM 0 HG3 GLN A 4 3.266 4.723 10.103 1.00 0.00 H new ATOM 0 HE21 GLN A 4 6.353 6.355 10.905 1.00 0.00 H new ATOM 0 HE22 GLN A 4 6.005 7.852 10.033 1.00 0.00 H new ATOM 61 N ILE A 5 5.443 2.459 13.523 1.00 0.00 N ATOM 62 CA ILE A 5 6.453 1.446 13.522 1.00 0.00 C ATOM 63 C ILE A 5 5.900 0.064 13.581 1.00 0.00 C ATOM 64 O ILE A 5 6.267 -0.793 12.779 1.00 0.00 O ATOM 65 CB ILE A 5 7.553 1.668 14.518 1.00 0.00 C ATOM 66 CG1 ILE A 5 8.241 3.027 14.309 1.00 0.00 C ATOM 67 CG2 ILE A 5 8.602 0.555 14.356 1.00 0.00 C ATOM 68 CD1 ILE A 5 9.160 3.361 15.484 1.00 0.00 C ATOM 0 H ILE A 5 5.465 3.028 14.369 1.00 0.00 H new ATOM 0 HA ILE A 5 6.930 1.545 12.547 1.00 0.00 H new ATOM 0 HB ILE A 5 7.116 1.654 15.516 1.00 0.00 H new ATOM 0 HG12 ILE A 5 8.818 3.008 13.385 1.00 0.00 H new ATOM 0 HG13 ILE A 5 7.488 3.807 14.198 1.00 0.00 H new ATOM 0 HG21 ILE A 5 9.407 0.706 15.075 1.00 0.00 H new ATOM 0 HG22 ILE A 5 8.135 -0.414 14.533 1.00 0.00 H new ATOM 0 HG23 ILE A 5 9.009 0.583 13.345 1.00 0.00 H new ATOM 0 HD11 ILE A 5 9.635 4.327 15.312 1.00 0.00 H new ATOM 0 HD12 ILE A 5 8.575 3.403 16.403 1.00 0.00 H new ATOM 0 HD13 ILE A 5 9.927 2.592 15.577 1.00 0.00 H new ATOM 80 N ALA A 6 4.794 -0.080 14.334 1.00 0.00 N ATOM 81 CA ALA A 6 3.919 -1.210 14.337 1.00 0.00 C ATOM 82 C ALA A 6 3.353 -1.530 12.996 1.00 0.00 C ATOM 83 O ALA A 6 3.316 -2.721 12.690 1.00 0.00 O ATOM 84 CB ALA A 6 2.818 -0.935 15.375 1.00 0.00 C ATOM 0 H ALA A 6 4.492 0.645 14.985 1.00 0.00 H new ATOM 0 HA ALA A 6 4.489 -2.100 14.605 1.00 0.00 H new ATOM 0 HB1 ALA A 6 2.128 -1.779 15.406 1.00 0.00 H new ATOM 0 HB2 ALA A 6 3.270 -0.799 16.358 1.00 0.00 H new ATOM 0 HB3 ALA A 6 2.274 -0.032 15.098 1.00 0.00 H new ATOM 90 N GLU A 7 2.948 -0.510 12.219 1.00 0.00 N ATOM 91 CA GLU A 7 2.345 -0.477 10.923 1.00 0.00 C ATOM 92 C GLU A 7 3.189 -1.260 9.978 1.00 0.00 C ATOM 93 O GLU A 7 2.792 -2.255 9.373 1.00 0.00 O ATOM 94 CB GLU A 7 2.046 0.872 10.248 1.00 0.00 C ATOM 95 CG GLU A 7 1.166 0.755 9.002 1.00 0.00 C ATOM 96 CD GLU A 7 0.940 2.025 8.194 1.00 0.00 C ATOM 97 OE1 GLU A 7 0.375 3.016 8.728 1.00 0.00 O ATOM 98 OE2 GLU A 7 1.173 1.963 6.957 1.00 0.00 O ATOM 0 H GLU A 7 3.066 0.443 12.563 1.00 0.00 H new ATOM 0 HA GLU A 7 1.356 -0.886 11.131 1.00 0.00 H new ATOM 0 HB2 GLU A 7 1.556 1.528 10.968 1.00 0.00 H new ATOM 0 HB3 GLU A 7 2.988 1.347 9.974 1.00 0.00 H new ATOM 0 HG2 GLU A 7 1.609 0.009 8.343 1.00 0.00 H new ATOM 0 HG3 GLU A 7 0.193 0.371 9.309 1.00 0.00 H new ATOM 105 N PHE A 8 4.430 -0.748 9.887 1.00 0.00 N ATOM 106 CA PHE A 8 5.492 -1.283 9.093 1.00 0.00 C ATOM 107 C PHE A 8 6.036 -2.623 9.454 1.00 0.00 C ATOM 108 O PHE A 8 6.240 -3.471 8.586 1.00 0.00 O ATOM 109 CB PHE A 8 6.667 -0.292 9.119 1.00 0.00 C ATOM 110 CG PHE A 8 6.405 1.028 8.477 1.00 0.00 C ATOM 111 CD1 PHE A 8 5.972 1.102 7.174 1.00 0.00 C ATOM 112 CD2 PHE A 8 6.667 2.183 9.175 1.00 0.00 C ATOM 113 CE1 PHE A 8 5.729 2.310 6.565 1.00 0.00 C ATOM 114 CE2 PHE A 8 6.334 3.390 8.608 1.00 0.00 C ATOM 115 CZ PHE A 8 5.917 3.457 7.300 1.00 0.00 C ATOM 0 H PHE A 8 4.707 0.090 10.399 1.00 0.00 H new ATOM 0 HA PHE A 8 5.029 -1.427 8.117 1.00 0.00 H new ATOM 0 HB2 PHE A 8 6.954 -0.122 10.157 1.00 0.00 H new ATOM 0 HB3 PHE A 8 7.521 -0.754 8.624 1.00 0.00 H new ATOM 0 HD1 PHE A 8 5.819 0.190 6.616 1.00 0.00 H new ATOM 0 HD2 PHE A 8 7.126 2.143 10.152 1.00 0.00 H new ATOM 0 HE1 PHE A 8 5.400 2.357 5.538 1.00 0.00 H new ATOM 0 HE2 PHE A 8 6.401 4.294 9.195 1.00 0.00 H new ATOM 0 HZ PHE A 8 5.735 4.420 6.845 1.00 0.00 H new ATOM 125 N LYS A 9 6.266 -2.802 10.767 1.00 0.00 N ATOM 126 CA LYS A 9 6.864 -3.955 11.365 1.00 0.00 C ATOM 127 C LYS A 9 6.084 -5.216 11.221 1.00 0.00 C ATOM 128 O LYS A 9 6.623 -6.218 10.753 1.00 0.00 O ATOM 129 CB LYS A 9 7.043 -3.758 12.880 1.00 0.00 C ATOM 130 CG LYS A 9 7.968 -4.831 13.457 1.00 0.00 C ATOM 131 CD LYS A 9 8.108 -4.706 14.976 1.00 0.00 C ATOM 132 CE LYS A 9 8.687 -5.919 15.706 1.00 0.00 C ATOM 133 NZ LYS A 9 10.092 -6.053 15.260 1.00 0.00 N ATOM 0 H LYS A 9 6.017 -2.093 11.456 1.00 0.00 H new ATOM 0 HA LYS A 9 7.807 -4.055 10.828 1.00 0.00 H new ATOM 0 HB2 LYS A 9 7.457 -2.769 13.077 1.00 0.00 H new ATOM 0 HB3 LYS A 9 6.073 -3.802 13.375 1.00 0.00 H new ATOM 0 HG2 LYS A 9 7.579 -5.818 13.208 1.00 0.00 H new ATOM 0 HG3 LYS A 9 8.951 -4.750 12.994 1.00 0.00 H new ATOM 0 HD2 LYS A 9 8.739 -3.844 15.191 1.00 0.00 H new ATOM 0 HD3 LYS A 9 7.124 -4.493 15.394 1.00 0.00 H new ATOM 0 HE2 LYS A 9 8.635 -5.782 16.786 1.00 0.00 H new ATOM 0 HE3 LYS A 9 8.119 -6.819 15.472 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 10.530 -6.869 15.732 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 10.117 -6.194 14.230 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 10.617 -5.189 15.504 1.00 0.00 H new ATOM 147 N GLU A 10 4.783 -5.244 11.563 1.00 0.00 N ATOM 148 CA GLU A 10 3.937 -6.345 11.223 1.00 0.00 C ATOM 149 C GLU A 10 3.942 -6.761 9.792 1.00 0.00 C ATOM 150 O GLU A 10 4.102 -7.939 9.476 1.00 0.00 O ATOM 151 CB GLU A 10 2.505 -5.887 11.549 1.00 0.00 C ATOM 152 CG GLU A 10 1.466 -7.006 11.450 1.00 0.00 C ATOM 153 CD GLU A 10 0.018 -6.594 11.671 1.00 0.00 C ATOM 154 OE1 GLU A 10 -0.367 -5.466 11.262 1.00 0.00 O ATOM 155 OE2 GLU A 10 -0.753 -7.408 12.246 1.00 0.00 O ATOM 0 H GLU A 10 4.315 -4.499 12.078 1.00 0.00 H new ATOM 0 HA GLU A 10 4.304 -7.207 11.781 1.00 0.00 H new ATOM 0 HB2 GLU A 10 2.486 -5.473 12.557 1.00 0.00 H new ATOM 0 HB3 GLU A 10 2.226 -5.082 10.869 1.00 0.00 H new ATOM 0 HG2 GLU A 10 1.546 -7.463 10.464 1.00 0.00 H new ATOM 0 HG3 GLU A 10 1.719 -7.775 12.179 1.00 0.00 H new ATOM 162 N ALA A 11 3.835 -5.853 8.806 1.00 0.00 N ATOM 163 CA ALA A 11 3.886 -6.172 7.413 1.00 0.00 C ATOM 164 C ALA A 11 5.174 -6.755 6.940 1.00 0.00 C ATOM 165 O ALA A 11 5.317 -7.648 6.107 1.00 0.00 O ATOM 166 CB ALA A 11 3.609 -4.886 6.617 1.00 0.00 C ATOM 0 H ALA A 11 3.708 -4.857 8.986 1.00 0.00 H new ATOM 0 HA ALA A 11 3.136 -6.946 7.252 1.00 0.00 H new ATOM 0 HB1 ALA A 11 3.643 -5.104 5.550 1.00 0.00 H new ATOM 0 HB2 ALA A 11 2.623 -4.502 6.878 1.00 0.00 H new ATOM 0 HB3 ALA A 11 4.365 -4.139 6.858 1.00 0.00 H new ATOM 172 N PHE A 12 6.251 -6.276 7.587 1.00 0.00 N ATOM 173 CA PHE A 12 7.585 -6.784 7.500 1.00 0.00 C ATOM 174 C PHE A 12 7.652 -8.261 7.683 1.00 0.00 C ATOM 175 O PHE A 12 8.087 -8.997 6.798 1.00 0.00 O ATOM 176 CB PHE A 12 8.612 -5.985 8.319 1.00 0.00 C ATOM 177 CG PHE A 12 10.045 -6.161 7.951 1.00 0.00 C ATOM 178 CD1 PHE A 12 10.478 -5.578 6.783 1.00 0.00 C ATOM 179 CD2 PHE A 12 10.979 -6.699 8.805 1.00 0.00 C ATOM 180 CE1 PHE A 12 11.815 -5.554 6.462 1.00 0.00 C ATOM 181 CE2 PHE A 12 12.313 -6.735 8.471 1.00 0.00 C ATOM 182 CZ PHE A 12 12.732 -6.116 7.317 1.00 0.00 C ATOM 0 H PHE A 12 6.184 -5.476 8.216 1.00 0.00 H new ATOM 0 HA PHE A 12 7.901 -6.617 6.470 1.00 0.00 H new ATOM 0 HB2 PHE A 12 8.366 -4.927 8.233 1.00 0.00 H new ATOM 0 HB3 PHE A 12 8.495 -6.255 9.368 1.00 0.00 H new ATOM 0 HD1 PHE A 12 9.760 -5.134 6.110 1.00 0.00 H new ATOM 0 HD2 PHE A 12 10.659 -7.101 9.755 1.00 0.00 H new ATOM 0 HE1 PHE A 12 12.143 -5.095 5.541 1.00 0.00 H new ATOM 0 HE2 PHE A 12 13.022 -7.243 9.107 1.00 0.00 H new ATOM 0 HZ PHE A 12 13.785 -6.071 7.082 1.00 0.00 H new ATOM 192 N SER A 13 7.222 -8.772 8.850 1.00 0.00 N ATOM 193 CA SER A 13 7.068 -10.138 9.244 1.00 0.00 C ATOM 194 C SER A 13 6.093 -10.990 8.507 1.00 0.00 C ATOM 195 O SER A 13 6.260 -12.206 8.440 1.00 0.00 O ATOM 196 CB SER A 13 6.828 -10.113 10.763 1.00 0.00 C ATOM 197 OG SER A 13 6.509 -11.411 11.242 1.00 0.00 O ATOM 0 H SER A 13 6.950 -8.147 9.608 1.00 0.00 H new ATOM 0 HA SER A 13 7.983 -10.658 8.961 1.00 0.00 H new ATOM 0 HB2 SER A 13 7.718 -9.741 11.271 1.00 0.00 H new ATOM 0 HB3 SER A 13 6.016 -9.424 10.997 1.00 0.00 H new ATOM 0 HG SER A 13 6.361 -11.375 12.210 1.00 0.00 H new ATOM 203 N LEU A 14 4.950 -10.354 8.194 1.00 0.00 N ATOM 204 CA LEU A 14 3.865 -10.901 7.439 1.00 0.00 C ATOM 205 C LEU A 14 4.283 -11.177 6.035 1.00 0.00 C ATOM 206 O LEU A 14 4.090 -12.289 5.546 1.00 0.00 O ATOM 207 CB LEU A 14 2.582 -10.053 7.428 1.00 0.00 C ATOM 208 CG LEU A 14 1.632 -10.358 8.599 1.00 0.00 C ATOM 209 CD1 LEU A 14 2.230 -10.451 10.013 1.00 0.00 C ATOM 210 CD2 LEU A 14 0.450 -9.376 8.547 1.00 0.00 C ATOM 0 H LEU A 14 4.773 -9.394 8.488 1.00 0.00 H new ATOM 0 HA LEU A 14 3.612 -11.825 7.959 1.00 0.00 H new ATOM 0 HB2 LEU A 14 2.854 -8.998 7.457 1.00 0.00 H new ATOM 0 HB3 LEU A 14 2.054 -10.221 6.489 1.00 0.00 H new ATOM 0 HG LEU A 14 1.317 -11.388 8.434 1.00 0.00 H new ATOM 0 HD11 LEU A 14 1.438 -10.671 10.729 1.00 0.00 H new ATOM 0 HD12 LEU A 14 2.976 -11.246 10.041 1.00 0.00 H new ATOM 0 HD13 LEU A 14 2.701 -9.503 10.272 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -0.231 -9.582 9.373 1.00 0.00 H new ATOM 0 HD22 LEU A 14 0.822 -8.355 8.630 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -0.080 -9.494 7.602 1.00 0.00 H new ATOM 222 N PHE A 15 4.972 -10.193 5.430 1.00 0.00 N ATOM 223 CA PHE A 15 5.598 -10.435 4.167 1.00 0.00 C ATOM 224 C PHE A 15 6.554 -11.577 4.125 1.00 0.00 C ATOM 225 O PHE A 15 6.644 -12.317 3.147 1.00 0.00 O ATOM 226 CB PHE A 15 6.499 -9.301 3.649 1.00 0.00 C ATOM 227 CG PHE A 15 6.508 -9.115 2.170 1.00 0.00 C ATOM 228 CD1 PHE A 15 7.397 -9.920 1.498 1.00 0.00 C ATOM 229 CD2 PHE A 15 5.681 -8.264 1.475 1.00 0.00 C ATOM 230 CE1 PHE A 15 7.492 -9.883 0.127 1.00 0.00 C ATOM 231 CE2 PHE A 15 5.772 -8.215 0.104 1.00 0.00 C ATOM 232 CZ PHE A 15 6.638 -9.052 -0.559 1.00 0.00 C ATOM 0 H PHE A 15 5.095 -9.252 5.804 1.00 0.00 H new ATOM 0 HA PHE A 15 4.696 -10.595 3.576 1.00 0.00 H new ATOM 0 HB2 PHE A 15 6.182 -8.367 4.113 1.00 0.00 H new ATOM 0 HB3 PHE A 15 7.520 -9.491 3.980 1.00 0.00 H new ATOM 0 HD1 PHE A 15 8.031 -10.593 2.056 1.00 0.00 H new ATOM 0 HD2 PHE A 15 4.970 -7.643 1.999 1.00 0.00 H new ATOM 0 HE1 PHE A 15 8.217 -10.489 -0.396 1.00 0.00 H new ATOM 0 HE2 PHE A 15 5.163 -7.518 -0.453 1.00 0.00 H new ATOM 0 HZ PHE A 15 6.648 -9.057 -1.639 1.00 0.00 H new ATOM 242 N ASP A 16 7.329 -11.720 5.214 1.00 0.00 N ATOM 243 CA ASP A 16 8.366 -12.705 5.259 1.00 0.00 C ATOM 244 C ASP A 16 7.982 -14.138 5.398 1.00 0.00 C ATOM 245 O ASP A 16 7.101 -14.423 6.207 1.00 0.00 O ATOM 246 CB ASP A 16 9.218 -12.297 6.473 1.00 0.00 C ATOM 247 CG ASP A 16 10.642 -12.827 6.391 1.00 0.00 C ATOM 248 OD1 ASP A 16 10.861 -14.053 6.577 1.00 0.00 O ATOM 249 OD2 ASP A 16 11.590 -12.049 6.100 1.00 0.00 O ATOM 0 H ASP A 16 7.239 -11.157 6.060 1.00 0.00 H new ATOM 0 HA ASP A 16 8.856 -12.696 4.285 1.00 0.00 H new ATOM 0 HB2 ASP A 16 9.242 -11.210 6.547 1.00 0.00 H new ATOM 0 HB3 ASP A 16 8.748 -12.668 7.384 1.00 0.00 H new ATOM 254 N LYS A 17 8.573 -15.083 4.646 1.00 0.00 N ATOM 255 CA LYS A 17 8.085 -16.422 4.532 1.00 0.00 C ATOM 256 C LYS A 17 8.568 -17.194 5.711 1.00 0.00 C ATOM 257 O LYS A 17 7.935 -18.150 6.158 1.00 0.00 O ATOM 258 CB LYS A 17 8.370 -17.131 3.197 1.00 0.00 C ATOM 259 CG LYS A 17 7.670 -16.435 2.028 1.00 0.00 C ATOM 260 CD LYS A 17 6.185 -16.618 1.707 1.00 0.00 C ATOM 261 CE LYS A 17 5.728 -15.462 0.816 1.00 0.00 C ATOM 262 NZ LYS A 17 4.258 -15.409 0.649 1.00 0.00 N ATOM 0 H LYS A 17 9.417 -14.910 4.100 1.00 0.00 H new ATOM 0 HA LYS A 17 6.996 -16.368 4.528 1.00 0.00 H new ATOM 0 HB2 LYS A 17 9.445 -17.152 3.018 1.00 0.00 H new ATOM 0 HB3 LYS A 17 8.037 -18.167 3.256 1.00 0.00 H new ATOM 0 HG2 LYS A 17 7.824 -15.365 2.170 1.00 0.00 H new ATOM 0 HG3 LYS A 17 8.216 -16.720 1.129 1.00 0.00 H new ATOM 0 HD2 LYS A 17 6.022 -17.571 1.203 1.00 0.00 H new ATOM 0 HD3 LYS A 17 5.600 -16.640 2.626 1.00 0.00 H new ATOM 0 HE2 LYS A 17 6.074 -14.521 1.244 1.00 0.00 H new ATOM 0 HE3 LYS A 17 6.197 -15.558 -0.163 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 4.021 -15.470 -0.362 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 3.822 -16.206 1.155 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 3.897 -14.514 1.036 1.00 0.00 H new ATOM 276 N ASP A 18 9.660 -16.726 6.341 1.00 0.00 N ATOM 277 CA ASP A 18 10.384 -17.350 7.405 1.00 0.00 C ATOM 278 C ASP A 18 9.959 -16.772 8.712 1.00 0.00 C ATOM 279 O ASP A 18 9.589 -17.375 9.718 1.00 0.00 O ATOM 280 CB ASP A 18 11.896 -17.127 7.239 1.00 0.00 C ATOM 281 CG ASP A 18 12.514 -17.404 5.875 1.00 0.00 C ATOM 282 OD1 ASP A 18 12.646 -18.556 5.383 1.00 0.00 O ATOM 283 OD2 ASP A 18 13.069 -16.405 5.344 1.00 0.00 O ATOM 0 H ASP A 18 10.072 -15.830 6.081 1.00 0.00 H new ATOM 0 HA ASP A 18 10.172 -18.419 7.378 1.00 0.00 H new ATOM 0 HB2 ASP A 18 12.111 -16.091 7.499 1.00 0.00 H new ATOM 0 HB3 ASP A 18 12.408 -17.752 7.971 1.00 0.00 H new ATOM 288 N GLY A 19 10.165 -15.447 8.806 1.00 0.00 N ATOM 289 CA GLY A 19 9.918 -14.660 9.974 1.00 0.00 C ATOM 290 C GLY A 19 11.160 -14.358 10.739 1.00 0.00 C ATOM 291 O GLY A 19 11.171 -14.574 11.950 1.00 0.00 O ATOM 0 H GLY A 19 10.523 -14.896 8.026 1.00 0.00 H new ATOM 0 HA2 GLY A 19 9.440 -13.725 9.682 1.00 0.00 H new ATOM 0 HA3 GLY A 19 9.217 -15.188 10.621 1.00 0.00 H new ATOM 295 N ASP A 20 12.247 -13.977 10.045 1.00 0.00 N ATOM 296 CA ASP A 20 13.538 -13.757 10.618 1.00 0.00 C ATOM 297 C ASP A 20 13.729 -12.308 10.907 1.00 0.00 C ATOM 298 O ASP A 20 13.120 -11.754 11.821 1.00 0.00 O ATOM 299 CB ASP A 20 14.641 -14.381 9.747 1.00 0.00 C ATOM 300 CG ASP A 20 14.700 -13.863 8.317 1.00 0.00 C ATOM 301 OD1 ASP A 20 13.748 -14.012 7.506 1.00 0.00 O ATOM 302 OD2 ASP A 20 15.620 -13.071 7.979 1.00 0.00 O ATOM 0 H ASP A 20 12.224 -13.815 9.038 1.00 0.00 H new ATOM 0 HA ASP A 20 13.610 -14.269 11.577 1.00 0.00 H new ATOM 0 HB2 ASP A 20 15.605 -14.201 10.223 1.00 0.00 H new ATOM 0 HB3 ASP A 20 14.495 -15.461 9.721 1.00 0.00 H new ATOM 307 N GLY A 21 14.421 -11.553 10.035 1.00 0.00 N ATOM 308 CA GLY A 21 14.417 -10.125 9.965 1.00 0.00 C ATOM 309 C GLY A 21 14.958 -9.522 8.714 1.00 0.00 C ATOM 310 O GLY A 21 15.164 -8.310 8.681 1.00 0.00 O ATOM 0 H GLY A 21 15.026 -11.972 9.329 1.00 0.00 H new ATOM 0 HA2 GLY A 21 13.392 -9.779 10.095 1.00 0.00 H new ATOM 0 HA3 GLY A 21 14.993 -9.740 10.807 1.00 0.00 H new ATOM 314 N THR A 22 15.031 -10.336 7.646 1.00 0.00 N ATOM 315 CA THR A 22 15.299 -9.823 6.338 1.00 0.00 C ATOM 316 C THR A 22 14.462 -10.250 5.181 1.00 0.00 C ATOM 317 O THR A 22 14.185 -11.445 5.096 1.00 0.00 O ATOM 318 CB THR A 22 16.722 -10.088 5.946 1.00 0.00 C ATOM 319 OG1 THR A 22 17.111 -11.442 6.128 1.00 0.00 O ATOM 320 CG2 THR A 22 17.742 -9.280 6.765 1.00 0.00 C ATOM 0 H THR A 22 14.905 -11.347 7.687 1.00 0.00 H new ATOM 0 HA THR A 22 15.044 -8.775 6.495 1.00 0.00 H new ATOM 0 HB THR A 22 16.735 -9.802 4.894 1.00 0.00 H new ATOM 0 HG1 THR A 22 16.472 -11.889 6.721 1.00 0.00 H new ATOM 0 HG21 THR A 22 18.751 -9.521 6.429 1.00 0.00 H new ATOM 0 HG22 THR A 22 17.558 -8.215 6.626 1.00 0.00 H new ATOM 0 HG23 THR A 22 17.642 -9.531 7.821 1.00 0.00 H new ATOM 328 N ILE A 23 14.090 -9.436 4.177 1.00 0.00 N ATOM 329 CA ILE A 23 13.459 -9.868 2.968 1.00 0.00 C ATOM 330 C ILE A 23 14.520 -10.000 1.929 1.00 0.00 C ATOM 331 O ILE A 23 15.396 -9.165 1.710 1.00 0.00 O ATOM 332 CB ILE A 23 12.303 -8.994 2.582 1.00 0.00 C ATOM 333 CG1 ILE A 23 11.298 -9.187 3.730 1.00 0.00 C ATOM 334 CG2 ILE A 23 11.860 -9.387 1.163 1.00 0.00 C ATOM 335 CD1 ILE A 23 10.154 -8.179 3.624 1.00 0.00 C ATOM 0 H ILE A 23 14.236 -8.427 4.210 1.00 0.00 H new ATOM 0 HA ILE A 23 12.991 -10.843 3.102 1.00 0.00 H new ATOM 0 HB ILE A 23 12.493 -7.924 2.492 1.00 0.00 H new ATOM 0 HG12 ILE A 23 10.899 -10.201 3.704 1.00 0.00 H new ATOM 0 HG13 ILE A 23 11.805 -9.069 4.687 1.00 0.00 H new ATOM 0 HG21 ILE A 23 11.019 -8.764 0.859 1.00 0.00 H new ATOM 0 HG22 ILE A 23 12.688 -9.241 0.470 1.00 0.00 H new ATOM 0 HG23 ILE A 23 11.558 -10.434 1.153 1.00 0.00 H new ATOM 0 HD11 ILE A 23 9.455 -8.334 4.446 1.00 0.00 H new ATOM 0 HD12 ILE A 23 10.555 -7.167 3.675 1.00 0.00 H new ATOM 0 HD13 ILE A 23 9.635 -8.316 2.676 1.00 0.00 H new ATOM 347 N THR A 24 14.499 -11.113 1.174 1.00 0.00 N ATOM 348 CA THR A 24 15.383 -11.522 0.127 1.00 0.00 C ATOM 349 C THR A 24 14.639 -11.505 -1.164 1.00 0.00 C ATOM 350 O THR A 24 13.412 -11.474 -1.242 1.00 0.00 O ATOM 351 CB THR A 24 15.934 -12.886 0.419 1.00 0.00 C ATOM 352 OG1 THR A 24 14.853 -13.782 0.631 1.00 0.00 O ATOM 353 CG2 THR A 24 16.790 -12.839 1.696 1.00 0.00 C ATOM 0 H THR A 24 13.769 -11.810 1.320 1.00 0.00 H new ATOM 0 HA THR A 24 16.226 -10.834 0.059 1.00 0.00 H new ATOM 0 HB THR A 24 16.546 -13.216 -0.420 1.00 0.00 H new ATOM 0 HG1 THR A 24 14.464 -13.622 1.516 1.00 0.00 H new ATOM 0 HG21 THR A 24 17.188 -13.832 1.904 1.00 0.00 H new ATOM 0 HG22 THR A 24 17.614 -12.140 1.556 1.00 0.00 H new ATOM 0 HG23 THR A 24 16.175 -12.512 2.534 1.00 0.00 H new ATOM 361 N THR A 25 15.391 -11.727 -2.257 1.00 0.00 N ATOM 362 CA THR A 25 14.894 -11.752 -3.598 1.00 0.00 C ATOM 363 C THR A 25 13.854 -12.788 -3.851 1.00 0.00 C ATOM 364 O THR A 25 12.843 -12.564 -4.515 1.00 0.00 O ATOM 365 CB THR A 25 15.934 -11.909 -4.668 1.00 0.00 C ATOM 366 OG1 THR A 25 16.705 -13.097 -4.575 1.00 0.00 O ATOM 367 CG2 THR A 25 16.977 -10.780 -4.709 1.00 0.00 C ATOM 0 H THR A 25 16.395 -11.897 -2.203 1.00 0.00 H new ATOM 0 HA THR A 25 14.458 -10.755 -3.667 1.00 0.00 H new ATOM 0 HB THR A 25 15.307 -11.911 -5.560 1.00 0.00 H new ATOM 0 HG1 THR A 25 17.356 -13.123 -5.307 1.00 0.00 H new ATOM 0 HG21 THR A 25 17.690 -10.972 -5.511 1.00 0.00 H new ATOM 0 HG22 THR A 25 16.476 -9.829 -4.889 1.00 0.00 H new ATOM 0 HG23 THR A 25 17.505 -10.738 -3.756 1.00 0.00 H new ATOM 375 N LYS A 26 14.012 -13.905 -3.118 1.00 0.00 N ATOM 376 CA LYS A 26 13.156 -15.050 -3.147 1.00 0.00 C ATOM 377 C LYS A 26 11.759 -14.714 -2.751 1.00 0.00 C ATOM 378 O LYS A 26 10.795 -15.089 -3.416 1.00 0.00 O ATOM 379 CB LYS A 26 13.654 -16.170 -2.219 1.00 0.00 C ATOM 380 CG LYS A 26 12.905 -17.505 -2.200 1.00 0.00 C ATOM 381 CD LYS A 26 13.447 -18.405 -1.088 1.00 0.00 C ATOM 382 CE LYS A 26 12.803 -19.782 -0.919 1.00 0.00 C ATOM 383 NZ LYS A 26 12.898 -20.470 -2.226 1.00 0.00 N ATOM 0 H LYS A 26 14.787 -14.014 -2.464 1.00 0.00 H new ATOM 0 HA LYS A 26 13.173 -15.396 -4.181 1.00 0.00 H new ATOM 0 HB2 LYS A 26 14.691 -16.378 -2.481 1.00 0.00 H new ATOM 0 HB3 LYS A 26 13.655 -15.779 -1.202 1.00 0.00 H new ATOM 0 HG2 LYS A 26 11.840 -17.330 -2.048 1.00 0.00 H new ATOM 0 HG3 LYS A 26 13.012 -18.003 -3.164 1.00 0.00 H new ATOM 0 HD2 LYS A 26 14.513 -18.551 -1.263 1.00 0.00 H new ATOM 0 HD3 LYS A 26 13.349 -17.869 -0.144 1.00 0.00 H new ATOM 0 HE2 LYS A 26 13.314 -20.354 -0.145 1.00 0.00 H new ATOM 0 HE3 LYS A 26 11.762 -19.685 -0.609 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 12.627 -21.468 -2.114 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 12.259 -20.012 -2.907 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 13.875 -20.414 -2.577 1.00 0.00 H new ATOM 397 N GLU A 27 11.557 -14.035 -1.608 1.00 0.00 N ATOM 398 CA GLU A 27 10.290 -13.846 -0.972 1.00 0.00 C ATOM 399 C GLU A 27 9.391 -12.958 -1.762 1.00 0.00 C ATOM 400 O GLU A 27 8.181 -13.179 -1.757 1.00 0.00 O ATOM 401 CB GLU A 27 10.474 -13.522 0.520 1.00 0.00 C ATOM 402 CG GLU A 27 11.331 -14.527 1.292 1.00 0.00 C ATOM 403 CD GLU A 27 11.858 -14.033 2.631 1.00 0.00 C ATOM 404 OE1 GLU A 27 11.081 -14.046 3.623 1.00 0.00 O ATOM 405 OE2 GLU A 27 13.060 -13.674 2.755 1.00 0.00 O ATOM 0 H GLU A 27 12.322 -13.593 -1.099 1.00 0.00 H new ATOM 0 HA GLU A 27 9.732 -14.782 -0.966 1.00 0.00 H new ATOM 0 HB2 GLU A 27 10.927 -12.535 0.610 1.00 0.00 H new ATOM 0 HB3 GLU A 27 9.492 -13.467 0.990 1.00 0.00 H new ATOM 0 HG2 GLU A 27 10.742 -15.428 1.461 1.00 0.00 H new ATOM 0 HG3 GLU A 27 12.178 -14.812 0.669 1.00 0.00 H new ATOM 412 N LEU A 28 10.067 -12.051 -2.489 1.00 0.00 N ATOM 413 CA LEU A 28 9.412 -11.147 -3.383 1.00 0.00 C ATOM 414 C LEU A 28 8.975 -11.929 -4.574 1.00 0.00 C ATOM 415 O LEU A 28 7.816 -11.823 -4.970 1.00 0.00 O ATOM 416 CB LEU A 28 10.396 -10.057 -3.839 1.00 0.00 C ATOM 417 CG LEU A 28 11.068 -9.209 -2.746 1.00 0.00 C ATOM 418 CD1 LEU A 28 12.249 -8.508 -3.438 1.00 0.00 C ATOM 419 CD2 LEU A 28 10.204 -8.177 -2.001 1.00 0.00 C ATOM 0 H LEU A 28 11.081 -11.943 -2.456 1.00 0.00 H new ATOM 0 HA LEU A 28 8.564 -10.675 -2.887 1.00 0.00 H new ATOM 0 HB2 LEU A 28 11.181 -10.535 -4.425 1.00 0.00 H new ATOM 0 HB3 LEU A 28 9.864 -9.382 -4.510 1.00 0.00 H new ATOM 0 HG LEU A 28 11.342 -9.893 -1.942 1.00 0.00 H new ATOM 0 HD11 LEU A 28 12.776 -7.884 -2.716 1.00 0.00 H new ATOM 0 HD12 LEU A 28 12.933 -9.257 -3.838 1.00 0.00 H new ATOM 0 HD13 LEU A 28 11.877 -7.886 -4.252 1.00 0.00 H new ATOM 0 HD21 LEU A 28 10.814 -7.657 -1.262 1.00 0.00 H new ATOM 0 HD22 LEU A 28 9.804 -7.456 -2.713 1.00 0.00 H new ATOM 0 HD23 LEU A 28 9.381 -8.686 -1.499 1.00 0.00 H new ATOM 431 N GLY A 29 9.849 -12.691 -5.256 1.00 0.00 N ATOM 432 CA GLY A 29 9.622 -13.390 -6.483 1.00 0.00 C ATOM 433 C GLY A 29 8.595 -14.461 -6.346 1.00 0.00 C ATOM 434 O GLY A 29 7.878 -14.769 -7.297 1.00 0.00 O ATOM 0 H GLY A 29 10.801 -12.829 -4.916 1.00 0.00 H new ATOM 0 HA2 GLY A 29 9.304 -12.682 -7.248 1.00 0.00 H new ATOM 0 HA3 GLY A 29 10.558 -13.830 -6.826 1.00 0.00 H new ATOM 438 N THR A 30 8.457 -15.103 -5.172 1.00 0.00 N ATOM 439 CA THR A 30 7.502 -16.086 -4.763 1.00 0.00 C ATOM 440 C THR A 30 6.173 -15.417 -4.830 1.00 0.00 C ATOM 441 O THR A 30 5.225 -15.858 -5.479 1.00 0.00 O ATOM 442 CB THR A 30 7.806 -16.664 -3.413 1.00 0.00 C ATOM 443 OG1 THR A 30 8.943 -17.508 -3.519 1.00 0.00 O ATOM 444 CG2 THR A 30 6.623 -17.535 -2.957 1.00 0.00 C ATOM 0 H THR A 30 9.105 -14.902 -4.411 1.00 0.00 H new ATOM 0 HA THR A 30 7.527 -16.954 -5.421 1.00 0.00 H new ATOM 0 HB THR A 30 7.985 -15.855 -2.705 1.00 0.00 H new ATOM 0 HG1 THR A 30 9.757 -16.962 -3.513 1.00 0.00 H new ATOM 0 HG21 THR A 30 6.839 -17.958 -1.976 1.00 0.00 H new ATOM 0 HG22 THR A 30 5.722 -16.924 -2.898 1.00 0.00 H new ATOM 0 HG23 THR A 30 6.468 -18.342 -3.673 1.00 0.00 H new ATOM 452 N VAL A 31 5.998 -14.251 -4.182 1.00 0.00 N ATOM 453 CA VAL A 31 4.787 -13.493 -4.132 1.00 0.00 C ATOM 454 C VAL A 31 4.366 -13.125 -5.513 1.00 0.00 C ATOM 455 O VAL A 31 3.262 -13.465 -5.937 1.00 0.00 O ATOM 456 CB VAL A 31 4.814 -12.279 -3.252 1.00 0.00 C ATOM 457 CG1 VAL A 31 3.766 -11.159 -3.367 1.00 0.00 C ATOM 458 CG2 VAL A 31 4.836 -12.782 -1.798 1.00 0.00 C ATOM 0 H VAL A 31 6.754 -13.810 -3.658 1.00 0.00 H new ATOM 0 HA VAL A 31 4.057 -14.152 -3.662 1.00 0.00 H new ATOM 0 HB VAL A 31 5.696 -11.753 -3.617 1.00 0.00 H new ATOM 0 HG11 VAL A 31 3.981 -10.382 -2.633 1.00 0.00 H new ATOM 0 HG12 VAL A 31 3.800 -10.731 -4.369 1.00 0.00 H new ATOM 0 HG13 VAL A 31 2.773 -11.569 -3.181 1.00 0.00 H new ATOM 0 HG21 VAL A 31 4.856 -11.930 -1.119 1.00 0.00 H new ATOM 0 HG22 VAL A 31 3.944 -13.378 -1.606 1.00 0.00 H new ATOM 0 HG23 VAL A 31 5.723 -13.394 -1.638 1.00 0.00 H new ATOM 468 N MET A 32 5.241 -12.462 -6.289 1.00 0.00 N ATOM 469 CA MET A 32 4.993 -12.114 -7.654 1.00 0.00 C ATOM 470 C MET A 32 4.610 -13.275 -8.505 1.00 0.00 C ATOM 471 O MET A 32 3.685 -13.156 -9.306 1.00 0.00 O ATOM 472 CB MET A 32 6.198 -11.342 -8.217 1.00 0.00 C ATOM 473 CG MET A 32 6.524 -9.983 -7.595 1.00 0.00 C ATOM 474 SD MET A 32 8.089 -9.159 -8.013 1.00 0.00 S ATOM 475 CE MET A 32 7.890 -9.089 -9.817 1.00 0.00 C ATOM 0 H MET A 32 6.155 -12.157 -5.954 1.00 0.00 H new ATOM 0 HA MET A 32 4.119 -11.463 -7.675 1.00 0.00 H new ATOM 0 HB2 MET A 32 7.079 -11.976 -8.118 1.00 0.00 H new ATOM 0 HB3 MET A 32 6.032 -11.192 -9.284 1.00 0.00 H new ATOM 0 HG2 MET A 32 5.715 -9.301 -7.858 1.00 0.00 H new ATOM 0 HG3 MET A 32 6.498 -10.105 -6.512 1.00 0.00 H new ATOM 0 HE1 MET A 32 8.785 -8.658 -10.265 1.00 0.00 H new ATOM 0 HE2 MET A 32 7.738 -10.096 -10.206 1.00 0.00 H new ATOM 0 HE3 MET A 32 7.027 -8.471 -10.064 1.00 0.00 H new ATOM 485 N ARG A 33 5.196 -14.472 -8.319 1.00 0.00 N ATOM 486 CA ARG A 33 4.801 -15.628 -9.062 1.00 0.00 C ATOM 487 C ARG A 33 3.445 -16.111 -8.679 1.00 0.00 C ATOM 488 O ARG A 33 2.579 -16.297 -9.533 1.00 0.00 O ATOM 489 CB ARG A 33 5.806 -16.768 -8.822 1.00 0.00 C ATOM 490 CG ARG A 33 5.637 -17.940 -9.790 1.00 0.00 C ATOM 491 CD ARG A 33 6.692 -19.045 -9.716 1.00 0.00 C ATOM 492 NE ARG A 33 7.998 -18.441 -10.102 1.00 0.00 N ATOM 493 CZ ARG A 33 9.015 -18.144 -9.241 1.00 0.00 C ATOM 494 NH1 ARG A 33 8.946 -18.197 -7.878 1.00 0.00 N ATOM 495 NH2 ARG A 33 10.275 -18.051 -9.758 1.00 0.00 N ATOM 0 H ARG A 33 5.948 -14.639 -7.650 1.00 0.00 H new ATOM 0 HA ARG A 33 4.779 -15.339 -10.113 1.00 0.00 H new ATOM 0 HB2 ARG A 33 6.819 -16.375 -8.912 1.00 0.00 H new ATOM 0 HB3 ARG A 33 5.695 -17.131 -7.800 1.00 0.00 H new ATOM 0 HG2 ARG A 33 4.660 -18.389 -9.614 1.00 0.00 H new ATOM 0 HG3 ARG A 33 5.628 -17.545 -10.806 1.00 0.00 H new ATOM 0 HD2 ARG A 33 6.744 -19.460 -8.709 1.00 0.00 H new ATOM 0 HD3 ARG A 33 6.436 -19.866 -10.386 1.00 0.00 H new ATOM 0 HE ARG A 33 8.144 -18.232 -11.090 1.00 0.00 H new ATOM 0 HH11 ARG A 33 8.078 -18.478 -7.422 1.00 0.00 H new ATOM 0 HH12 ARG A 33 9.762 -17.956 -7.316 1.00 0.00 H new ATOM 0 HH21 ARG A 33 10.430 -18.202 -10.755 1.00 0.00 H new ATOM 0 HH22 ARG A 33 11.062 -17.831 -9.147 1.00 0.00 H new ATOM 509 N SER A 34 3.083 -16.241 -7.390 1.00 0.00 N ATOM 510 CA SER A 34 1.847 -16.746 -6.878 1.00 0.00 C ATOM 511 C SER A 34 0.726 -15.861 -7.301 1.00 0.00 C ATOM 512 O SER A 34 -0.411 -16.329 -7.341 1.00 0.00 O ATOM 513 CB SER A 34 1.971 -16.691 -5.346 1.00 0.00 C ATOM 514 OG SER A 34 3.076 -17.443 -4.868 1.00 0.00 O ATOM 0 H SER A 34 3.716 -15.967 -6.639 1.00 0.00 H new ATOM 0 HA SER A 34 1.650 -17.755 -7.241 1.00 0.00 H new ATOM 0 HB2 SER A 34 2.076 -15.653 -5.029 1.00 0.00 H new ATOM 0 HB3 SER A 34 1.054 -17.070 -4.896 1.00 0.00 H new ATOM 0 HG SER A 34 3.893 -16.907 -4.942 1.00 0.00 H new ATOM 520 N LEU A 35 0.983 -14.557 -7.508 1.00 0.00 N ATOM 521 CA LEU A 35 -0.002 -13.664 -8.035 1.00 0.00 C ATOM 522 C LEU A 35 -0.237 -13.921 -9.484 1.00 0.00 C ATOM 523 O LEU A 35 -1.344 -14.240 -9.914 1.00 0.00 O ATOM 524 CB LEU A 35 0.376 -12.190 -7.813 1.00 0.00 C ATOM 525 CG LEU A 35 -0.669 -11.075 -7.984 1.00 0.00 C ATOM 526 CD1 LEU A 35 -1.631 -11.110 -6.785 1.00 0.00 C ATOM 527 CD2 LEU A 35 -0.098 -9.650 -8.079 1.00 0.00 C ATOM 0 H LEU A 35 1.882 -14.118 -7.308 1.00 0.00 H new ATOM 0 HA LEU A 35 -0.925 -13.856 -7.489 1.00 0.00 H new ATOM 0 HB2 LEU A 35 0.768 -12.109 -6.799 1.00 0.00 H new ATOM 0 HB3 LEU A 35 1.199 -11.965 -8.492 1.00 0.00 H new ATOM 0 HG LEU A 35 -1.157 -11.280 -8.937 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -2.378 -10.323 -6.894 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -2.128 -12.079 -6.746 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -1.070 -10.952 -5.864 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -0.915 -8.938 -8.198 1.00 0.00 H new ATOM 0 HD22 LEU A 35 0.456 -9.418 -7.169 1.00 0.00 H new ATOM 0 HD23 LEU A 35 0.570 -9.582 -8.937 1.00 0.00 H new ATOM 539 N GLY A 36 0.852 -13.822 -10.267 1.00 0.00 N ATOM 540 CA GLY A 36 0.863 -14.302 -11.615 1.00 0.00 C ATOM 541 C GLY A 36 1.773 -13.565 -12.536 1.00 0.00 C ATOM 542 O GLY A 36 1.372 -12.964 -13.532 1.00 0.00 O ATOM 0 H GLY A 36 1.732 -13.406 -9.964 1.00 0.00 H new ATOM 0 HA2 GLY A 36 1.150 -15.353 -11.608 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -0.151 -14.251 -12.012 1.00 0.00 H new ATOM 546 N GLN A 37 3.084 -13.538 -12.239 1.00 0.00 N ATOM 547 CA GLN A 37 4.061 -13.095 -13.186 1.00 0.00 C ATOM 548 C GLN A 37 5.116 -14.131 -13.366 1.00 0.00 C ATOM 549 O GLN A 37 5.004 -15.152 -12.689 1.00 0.00 O ATOM 550 CB GLN A 37 4.746 -11.833 -12.635 1.00 0.00 C ATOM 551 CG GLN A 37 3.698 -10.722 -12.531 1.00 0.00 C ATOM 552 CD GLN A 37 4.268 -9.431 -11.961 1.00 0.00 C ATOM 553 OE1 GLN A 37 3.817 -8.872 -10.963 1.00 0.00 O ATOM 554 NE2 GLN A 37 5.365 -8.993 -12.635 1.00 0.00 N ATOM 0 H GLN A 37 3.470 -13.824 -11.339 1.00 0.00 H new ATOM 0 HA GLN A 37 3.564 -12.900 -14.136 1.00 0.00 H new ATOM 0 HB2 GLN A 37 5.183 -12.035 -11.657 1.00 0.00 H new ATOM 0 HB3 GLN A 37 5.560 -11.526 -13.291 1.00 0.00 H new ATOM 0 HG2 GLN A 37 3.282 -10.526 -13.519 1.00 0.00 H new ATOM 0 HG3 GLN A 37 2.876 -11.061 -11.901 1.00 0.00 H new ATOM 0 HE21 GLN A 37 5.694 -9.498 -13.458 1.00 0.00 H new ATOM 0 HE22 GLN A 37 5.859 -8.159 -12.318 1.00 0.00 H new ATOM 563 N ASN A 38 6.128 -13.965 -14.236 1.00 0.00 N ATOM 564 CA ASN A 38 7.306 -14.774 -14.180 1.00 0.00 C ATOM 565 C ASN A 38 8.514 -13.907 -14.078 1.00 0.00 C ATOM 566 O ASN A 38 9.117 -13.545 -15.087 1.00 0.00 O ATOM 567 CB ASN A 38 7.374 -15.568 -15.496 1.00 0.00 C ATOM 568 CG ASN A 38 6.611 -16.874 -15.328 1.00 0.00 C ATOM 569 OD1 ASN A 38 6.771 -17.679 -14.411 1.00 0.00 O ATOM 570 ND2 ASN A 38 5.639 -17.049 -16.263 1.00 0.00 N ATOM 0 H ASN A 38 6.130 -13.268 -14.981 1.00 0.00 H new ATOM 0 HA ASN A 38 7.274 -15.436 -13.314 1.00 0.00 H new ATOM 0 HB2 ASN A 38 6.945 -14.984 -16.310 1.00 0.00 H new ATOM 0 HB3 ASN A 38 8.412 -15.770 -15.760 1.00 0.00 H new ATOM 0 HD21 ASN A 38 5.024 -17.861 -16.213 1.00 0.00 H new ATOM 0 HD22 ASN A 38 5.525 -16.368 -17.014 1.00 0.00 H new ATOM 577 N PRO A 39 8.918 -13.520 -12.905 1.00 0.00 N ATOM 578 CA PRO A 39 10.053 -12.667 -12.705 1.00 0.00 C ATOM 579 C PRO A 39 11.378 -13.342 -12.801 1.00 0.00 C ATOM 580 O PRO A 39 11.534 -14.560 -12.725 1.00 0.00 O ATOM 581 CB PRO A 39 9.860 -12.158 -11.278 1.00 0.00 C ATOM 582 CG PRO A 39 9.211 -13.282 -10.456 1.00 0.00 C ATOM 583 CD PRO A 39 8.378 -13.877 -11.602 1.00 0.00 C ATOM 0 HA PRO A 39 10.084 -11.905 -13.484 1.00 0.00 H new ATOM 0 HB2 PRO A 39 10.818 -11.872 -10.843 1.00 0.00 H new ATOM 0 HB3 PRO A 39 9.229 -11.269 -11.273 1.00 0.00 H new ATOM 0 HG2 PRO A 39 9.933 -13.983 -10.038 1.00 0.00 H new ATOM 0 HG3 PRO A 39 8.605 -12.916 -9.627 1.00 0.00 H new ATOM 0 HD2 PRO A 39 8.350 -14.962 -11.505 1.00 0.00 H new ATOM 0 HD3 PRO A 39 7.350 -13.523 -11.525 1.00 0.00 H new ATOM 591 N THR A 40 12.447 -12.551 -13.003 1.00 0.00 N ATOM 592 CA THR A 40 13.811 -12.936 -13.191 1.00 0.00 C ATOM 593 C THR A 40 14.494 -12.483 -11.947 1.00 0.00 C ATOM 594 O THR A 40 14.335 -11.336 -11.532 1.00 0.00 O ATOM 595 CB THR A 40 14.458 -12.271 -14.369 1.00 0.00 C ATOM 596 OG1 THR A 40 13.849 -12.810 -15.533 1.00 0.00 O ATOM 597 CG2 THR A 40 15.981 -12.477 -14.440 1.00 0.00 C ATOM 0 H THR A 40 12.341 -11.537 -13.038 1.00 0.00 H new ATOM 0 HA THR A 40 13.879 -14.007 -13.382 1.00 0.00 H new ATOM 0 HB THR A 40 14.312 -11.195 -14.279 1.00 0.00 H new ATOM 0 HG1 THR A 40 14.244 -12.398 -16.330 1.00 0.00 H new ATOM 0 HG21 THR A 40 16.377 -11.967 -15.318 1.00 0.00 H new ATOM 0 HG22 THR A 40 16.446 -12.068 -13.543 1.00 0.00 H new ATOM 0 HG23 THR A 40 16.201 -13.542 -14.509 1.00 0.00 H new ATOM 605 N GLU A 41 15.325 -13.341 -11.327 1.00 0.00 N ATOM 606 CA GLU A 41 15.876 -13.001 -10.052 1.00 0.00 C ATOM 607 C GLU A 41 16.922 -11.942 -9.990 1.00 0.00 C ATOM 608 O GLU A 41 17.073 -11.239 -8.992 1.00 0.00 O ATOM 609 CB GLU A 41 16.288 -14.333 -9.401 1.00 0.00 C ATOM 610 CG GLU A 41 16.026 -14.337 -7.894 1.00 0.00 C ATOM 611 CD GLU A 41 16.002 -15.764 -7.367 1.00 0.00 C ATOM 612 OE1 GLU A 41 14.979 -16.388 -7.757 1.00 0.00 O ATOM 613 OE2 GLU A 41 16.979 -16.230 -6.722 1.00 0.00 O ATOM 0 H GLU A 41 15.610 -14.248 -11.697 1.00 0.00 H new ATOM 0 HA GLU A 41 15.102 -12.481 -9.487 1.00 0.00 H new ATOM 0 HB2 GLU A 41 15.738 -15.150 -9.867 1.00 0.00 H new ATOM 0 HB3 GLU A 41 17.347 -14.515 -9.586 1.00 0.00 H new ATOM 0 HG2 GLU A 41 16.800 -13.766 -7.382 1.00 0.00 H new ATOM 0 HG3 GLU A 41 15.076 -13.847 -7.682 1.00 0.00 H new ATOM 620 N ALA A 42 17.766 -11.852 -11.034 1.00 0.00 N ATOM 621 CA ALA A 42 18.677 -10.762 -11.194 1.00 0.00 C ATOM 622 C ALA A 42 18.092 -9.414 -11.443 1.00 0.00 C ATOM 623 O ALA A 42 18.708 -8.350 -11.443 1.00 0.00 O ATOM 624 CB ALA A 42 19.726 -11.136 -12.255 1.00 0.00 C ATOM 0 H ALA A 42 17.816 -12.547 -11.779 1.00 0.00 H new ATOM 0 HA ALA A 42 19.135 -10.629 -10.214 1.00 0.00 H new ATOM 0 HB1 ALA A 42 20.425 -10.309 -12.383 1.00 0.00 H new ATOM 0 HB2 ALA A 42 20.269 -12.024 -11.932 1.00 0.00 H new ATOM 0 HB3 ALA A 42 19.228 -11.340 -13.203 1.00 0.00 H new ATOM 630 N GLU A 43 16.758 -9.298 -11.573 1.00 0.00 N ATOM 631 CA GLU A 43 16.020 -8.073 -11.595 1.00 0.00 C ATOM 632 C GLU A 43 15.596 -7.777 -10.198 1.00 0.00 C ATOM 633 O GLU A 43 15.633 -6.667 -9.670 1.00 0.00 O ATOM 634 CB GLU A 43 14.803 -8.227 -12.522 1.00 0.00 C ATOM 635 CG GLU A 43 15.217 -8.297 -13.993 1.00 0.00 C ATOM 636 CD GLU A 43 14.024 -8.296 -14.938 1.00 0.00 C ATOM 637 OE1 GLU A 43 12.836 -8.494 -14.569 1.00 0.00 O ATOM 638 OE2 GLU A 43 14.238 -7.808 -16.080 1.00 0.00 O ATOM 0 H GLU A 43 16.156 -10.115 -11.669 1.00 0.00 H new ATOM 0 HA GLU A 43 16.627 -7.251 -11.975 1.00 0.00 H new ATOM 0 HB2 GLU A 43 14.254 -9.130 -12.255 1.00 0.00 H new ATOM 0 HB3 GLU A 43 14.125 -7.387 -12.375 1.00 0.00 H new ATOM 0 HG2 GLU A 43 15.861 -7.449 -14.226 1.00 0.00 H new ATOM 0 HG3 GLU A 43 15.806 -9.199 -14.158 1.00 0.00 H new ATOM 645 N LEU A 44 15.290 -8.828 -9.415 1.00 0.00 N ATOM 646 CA LEU A 44 14.797 -8.758 -8.075 1.00 0.00 C ATOM 647 C LEU A 44 15.860 -8.421 -7.087 1.00 0.00 C ATOM 648 O LEU A 44 15.667 -7.738 -6.082 1.00 0.00 O ATOM 649 CB LEU A 44 14.174 -10.143 -7.832 1.00 0.00 C ATOM 650 CG LEU A 44 12.861 -10.533 -8.534 1.00 0.00 C ATOM 651 CD1 LEU A 44 12.547 -12.035 -8.439 1.00 0.00 C ATOM 652 CD2 LEU A 44 11.651 -9.762 -7.981 1.00 0.00 C ATOM 0 H LEU A 44 15.394 -9.789 -9.741 1.00 0.00 H new ATOM 0 HA LEU A 44 14.072 -7.955 -7.946 1.00 0.00 H new ATOM 0 HB2 LEU A 44 14.922 -10.887 -8.107 1.00 0.00 H new ATOM 0 HB3 LEU A 44 14.008 -10.240 -6.759 1.00 0.00 H new ATOM 0 HG LEU A 44 13.025 -10.269 -9.579 1.00 0.00 H new ATOM 0 HD11 LEU A 44 11.609 -12.244 -8.953 1.00 0.00 H new ATOM 0 HD12 LEU A 44 13.351 -12.605 -8.905 1.00 0.00 H new ATOM 0 HD13 LEU A 44 12.458 -12.323 -7.391 1.00 0.00 H new ATOM 0 HD21 LEU A 44 10.749 -10.073 -8.509 1.00 0.00 H new ATOM 0 HD22 LEU A 44 11.540 -9.973 -6.917 1.00 0.00 H new ATOM 0 HD23 LEU A 44 11.805 -8.692 -8.124 1.00 0.00 H new ATOM 664 N GLN A 45 17.058 -8.825 -7.544 1.00 0.00 N ATOM 665 CA GLN A 45 18.257 -8.423 -6.877 1.00 0.00 C ATOM 666 C GLN A 45 18.558 -6.973 -7.038 1.00 0.00 C ATOM 667 O GLN A 45 18.757 -6.260 -6.055 1.00 0.00 O ATOM 668 CB GLN A 45 19.476 -9.233 -7.351 1.00 0.00 C ATOM 669 CG GLN A 45 20.731 -9.052 -6.493 1.00 0.00 C ATOM 670 CD GLN A 45 20.573 -9.515 -5.051 1.00 0.00 C ATOM 671 OE1 GLN A 45 20.336 -10.709 -4.881 1.00 0.00 O ATOM 672 NE2 GLN A 45 20.664 -8.616 -4.034 1.00 0.00 N ATOM 0 H GLN A 45 17.197 -9.420 -8.361 1.00 0.00 H new ATOM 0 HA GLN A 45 18.071 -8.621 -5.821 1.00 0.00 H new ATOM 0 HB2 GLN A 45 19.211 -10.290 -7.366 1.00 0.00 H new ATOM 0 HB3 GLN A 45 19.709 -8.949 -8.377 1.00 0.00 H new ATOM 0 HG2 GLN A 45 21.553 -9.602 -6.951 1.00 0.00 H new ATOM 0 HG3 GLN A 45 21.011 -7.999 -6.496 1.00 0.00 H new ATOM 0 HE21 GLN A 45 20.863 -7.636 -4.236 1.00 0.00 H new ATOM 0 HE22 GLN A 45 20.533 -8.922 -3.070 1.00 0.00 H new ATOM 681 N ASP A 46 18.268 -6.474 -8.253 1.00 0.00 N ATOM 682 CA ASP A 46 18.572 -5.147 -8.691 1.00 0.00 C ATOM 683 C ASP A 46 17.726 -4.204 -7.907 1.00 0.00 C ATOM 684 O ASP A 46 18.134 -3.225 -7.284 1.00 0.00 O ATOM 685 CB ASP A 46 18.307 -5.016 -10.200 1.00 0.00 C ATOM 686 CG ASP A 46 19.065 -3.834 -10.787 1.00 0.00 C ATOM 687 OD1 ASP A 46 20.320 -3.809 -10.683 1.00 0.00 O ATOM 688 OD2 ASP A 46 18.415 -3.003 -11.476 1.00 0.00 O ATOM 0 H ASP A 46 17.796 -7.027 -8.968 1.00 0.00 H new ATOM 0 HA ASP A 46 19.624 -4.915 -8.527 1.00 0.00 H new ATOM 0 HB2 ASP A 46 18.608 -5.933 -10.706 1.00 0.00 H new ATOM 0 HB3 ASP A 46 17.239 -4.891 -10.376 1.00 0.00 H new ATOM 693 N MET A 47 16.436 -4.514 -7.681 1.00 0.00 N ATOM 694 CA MET A 47 15.511 -3.928 -6.761 1.00 0.00 C ATOM 695 C MET A 47 15.904 -3.631 -5.355 1.00 0.00 C ATOM 696 O MET A 47 15.572 -2.565 -4.839 1.00 0.00 O ATOM 697 CB MET A 47 14.208 -4.743 -6.705 1.00 0.00 C ATOM 698 CG MET A 47 13.412 -4.790 -8.011 1.00 0.00 C ATOM 699 SD MET A 47 11.875 -5.751 -7.873 1.00 0.00 S ATOM 700 CE MET A 47 11.828 -6.278 -9.610 1.00 0.00 C ATOM 0 H MET A 47 15.993 -5.266 -8.209 1.00 0.00 H new ATOM 0 HA MET A 47 15.426 -2.939 -7.211 1.00 0.00 H new ATOM 0 HB2 MET A 47 14.449 -5.764 -6.408 1.00 0.00 H new ATOM 0 HB3 MET A 47 13.571 -4.326 -5.925 1.00 0.00 H new ATOM 0 HG2 MET A 47 13.171 -3.773 -8.320 1.00 0.00 H new ATOM 0 HG3 MET A 47 14.035 -5.222 -8.794 1.00 0.00 H new ATOM 0 HE1 MET A 47 10.948 -6.899 -9.778 1.00 0.00 H new ATOM 0 HE2 MET A 47 11.782 -5.401 -10.255 1.00 0.00 H new ATOM 0 HE3 MET A 47 12.726 -6.851 -9.841 1.00 0.00 H new ATOM 710 N ILE A 48 16.601 -4.619 -4.767 1.00 0.00 N ATOM 711 CA ILE A 48 17.018 -4.627 -3.399 1.00 0.00 C ATOM 712 C ILE A 48 18.410 -4.099 -3.320 1.00 0.00 C ATOM 713 O ILE A 48 18.770 -3.456 -2.336 1.00 0.00 O ATOM 714 CB ILE A 48 16.894 -6.006 -2.823 1.00 0.00 C ATOM 715 CG1 ILE A 48 15.468 -6.582 -2.811 1.00 0.00 C ATOM 716 CG2 ILE A 48 17.630 -6.240 -1.493 1.00 0.00 C ATOM 717 CD1 ILE A 48 14.589 -5.853 -1.795 1.00 0.00 C ATOM 0 H ILE A 48 16.889 -5.457 -5.273 1.00 0.00 H new ATOM 0 HA ILE A 48 16.374 -3.982 -2.801 1.00 0.00 H new ATOM 0 HB ILE A 48 17.444 -6.596 -3.557 1.00 0.00 H new ATOM 0 HG12 ILE A 48 15.029 -6.495 -3.805 1.00 0.00 H new ATOM 0 HG13 ILE A 48 15.504 -7.644 -2.570 1.00 0.00 H new ATOM 0 HG21 ILE A 48 17.474 -7.268 -1.167 1.00 0.00 H new ATOM 0 HG22 ILE A 48 18.696 -6.061 -1.631 1.00 0.00 H new ATOM 0 HG23 ILE A 48 17.242 -5.557 -0.737 1.00 0.00 H new ATOM 0 HD11 ILE A 48 13.587 -6.281 -1.808 1.00 0.00 H new ATOM 0 HD12 ILE A 48 15.017 -5.962 -0.799 1.00 0.00 H new ATOM 0 HD13 ILE A 48 14.535 -4.795 -2.053 1.00 0.00 H new ATOM 729 N ASN A 49 19.368 -4.278 -4.247 1.00 0.00 N ATOM 730 CA ASN A 49 20.697 -3.752 -4.193 1.00 0.00 C ATOM 731 C ASN A 49 20.675 -2.265 -4.098 1.00 0.00 C ATOM 732 O ASN A 49 21.570 -1.696 -3.475 1.00 0.00 O ATOM 733 CB ASN A 49 21.430 -4.238 -5.455 1.00 0.00 C ATOM 734 CG ASN A 49 22.157 -5.565 -5.296 1.00 0.00 C ATOM 735 OD1 ASN A 49 22.064 -6.235 -4.269 1.00 0.00 O ATOM 736 ND2 ASN A 49 22.915 -5.939 -6.362 1.00 0.00 N ATOM 0 H ASN A 49 19.202 -4.827 -5.090 1.00 0.00 H new ATOM 0 HA ASN A 49 21.220 -4.104 -3.304 1.00 0.00 H new ATOM 0 HB2 ASN A 49 20.707 -4.330 -6.266 1.00 0.00 H new ATOM 0 HB3 ASN A 49 22.151 -3.478 -5.755 1.00 0.00 H new ATOM 0 HD21 ASN A 49 23.441 -6.813 -6.333 1.00 0.00 H new ATOM 0 HD22 ASN A 49 22.958 -5.346 -7.191 1.00 0.00 H new ATOM 743 N GLU A 50 19.727 -1.589 -4.772 1.00 0.00 N ATOM 744 CA GLU A 50 19.456 -0.186 -4.826 1.00 0.00 C ATOM 745 C GLU A 50 19.185 0.449 -3.506 1.00 0.00 C ATOM 746 O GLU A 50 19.760 1.471 -3.133 1.00 0.00 O ATOM 747 CB GLU A 50 18.170 0.095 -5.621 1.00 0.00 C ATOM 748 CG GLU A 50 17.738 1.553 -5.792 1.00 0.00 C ATOM 749 CD GLU A 50 16.768 1.716 -6.953 1.00 0.00 C ATOM 750 OE1 GLU A 50 15.782 0.937 -7.049 1.00 0.00 O ATOM 751 OE2 GLU A 50 17.029 2.622 -7.789 1.00 0.00 O ATOM 0 H GLU A 50 19.065 -2.100 -5.356 1.00 0.00 H new ATOM 0 HA GLU A 50 20.363 0.222 -5.272 1.00 0.00 H new ATOM 0 HB2 GLU A 50 18.290 -0.337 -6.615 1.00 0.00 H new ATOM 0 HB3 GLU A 50 17.354 -0.441 -5.137 1.00 0.00 H new ATOM 0 HG2 GLU A 50 17.269 1.905 -4.873 1.00 0.00 H new ATOM 0 HG3 GLU A 50 18.616 2.176 -5.960 1.00 0.00 H new ATOM 758 N VAL A 51 18.302 -0.142 -2.681 1.00 0.00 N ATOM 759 CA VAL A 51 17.865 0.427 -1.444 1.00 0.00 C ATOM 760 C VAL A 51 18.599 -0.034 -0.232 1.00 0.00 C ATOM 761 O VAL A 51 18.401 0.397 0.903 1.00 0.00 O ATOM 762 CB VAL A 51 16.374 0.322 -1.322 1.00 0.00 C ATOM 763 CG1 VAL A 51 15.488 0.891 -2.443 1.00 0.00 C ATOM 764 CG2 VAL A 51 15.990 -1.161 -1.187 1.00 0.00 C ATOM 0 H VAL A 51 17.878 -1.047 -2.882 1.00 0.00 H new ATOM 0 HA VAL A 51 18.131 1.483 -1.484 1.00 0.00 H new ATOM 0 HB VAL A 51 16.172 0.951 -0.455 1.00 0.00 H new ATOM 0 HG11 VAL A 51 14.439 0.731 -2.194 1.00 0.00 H new ATOM 0 HG12 VAL A 51 15.677 1.959 -2.549 1.00 0.00 H new ATOM 0 HG13 VAL A 51 15.719 0.387 -3.381 1.00 0.00 H new ATOM 0 HG21 VAL A 51 14.907 -1.250 -1.097 1.00 0.00 H new ATOM 0 HG22 VAL A 51 16.327 -1.706 -2.069 1.00 0.00 H new ATOM 0 HG23 VAL A 51 16.463 -1.580 -0.299 1.00 0.00 H new ATOM 774 N ASP A 52 19.541 -0.966 -0.462 1.00 0.00 N ATOM 775 CA ASP A 52 20.304 -1.552 0.595 1.00 0.00 C ATOM 776 C ASP A 52 21.406 -0.606 0.928 1.00 0.00 C ATOM 777 O ASP A 52 22.237 -0.193 0.120 1.00 0.00 O ATOM 778 CB ASP A 52 20.818 -2.975 0.318 1.00 0.00 C ATOM 779 CG ASP A 52 21.347 -3.757 1.512 1.00 0.00 C ATOM 780 OD1 ASP A 52 21.800 -3.084 2.476 1.00 0.00 O ATOM 781 OD2 ASP A 52 21.377 -5.015 1.448 1.00 0.00 O ATOM 0 H ASP A 52 19.776 -1.316 -1.391 1.00 0.00 H new ATOM 0 HA ASP A 52 19.642 -1.699 1.448 1.00 0.00 H new ATOM 0 HB2 ASP A 52 20.007 -3.548 -0.131 1.00 0.00 H new ATOM 0 HB3 ASP A 52 21.613 -2.911 -0.425 1.00 0.00 H new ATOM 786 N ALA A 53 21.403 -0.112 2.179 1.00 0.00 N ATOM 787 CA ALA A 53 22.225 0.941 2.690 1.00 0.00 C ATOM 788 C ALA A 53 23.629 0.466 2.839 1.00 0.00 C ATOM 789 O ALA A 53 24.628 1.176 2.741 1.00 0.00 O ATOM 790 CB ALA A 53 21.514 1.395 3.976 1.00 0.00 C ATOM 0 H ALA A 53 20.773 -0.481 2.891 1.00 0.00 H new ATOM 0 HA ALA A 53 22.332 1.804 2.033 1.00 0.00 H new ATOM 0 HB1 ALA A 53 22.079 2.205 4.437 1.00 0.00 H new ATOM 0 HB2 ALA A 53 20.511 1.744 3.733 1.00 0.00 H new ATOM 0 HB3 ALA A 53 21.448 0.557 4.670 1.00 0.00 H new ATOM 796 N ASP A 54 23.697 -0.846 3.126 1.00 0.00 N ATOM 797 CA ASP A 54 24.927 -1.526 3.389 1.00 0.00 C ATOM 798 C ASP A 54 25.535 -1.799 2.056 1.00 0.00 C ATOM 799 O ASP A 54 26.673 -1.448 1.748 1.00 0.00 O ATOM 800 CB ASP A 54 24.795 -2.852 4.158 1.00 0.00 C ATOM 801 CG ASP A 54 23.900 -2.667 5.374 1.00 0.00 C ATOM 802 OD1 ASP A 54 24.096 -1.693 6.150 1.00 0.00 O ATOM 803 OD2 ASP A 54 22.895 -3.408 5.543 1.00 0.00 O ATOM 0 H ASP A 54 22.876 -1.449 3.177 1.00 0.00 H new ATOM 0 HA ASP A 54 25.529 -0.889 4.036 1.00 0.00 H new ATOM 0 HB2 ASP A 54 24.380 -3.620 3.505 1.00 0.00 H new ATOM 0 HB3 ASP A 54 25.780 -3.199 4.471 1.00 0.00 H new ATOM 808 N GLY A 55 24.643 -2.289 1.177 1.00 0.00 N ATOM 809 CA GLY A 55 24.917 -2.886 -0.094 1.00 0.00 C ATOM 810 C GLY A 55 25.253 -4.331 0.036 1.00 0.00 C ATOM 811 O GLY A 55 26.254 -4.722 -0.562 1.00 0.00 O ATOM 0 H GLY A 55 23.643 -2.265 1.374 1.00 0.00 H new ATOM 0 HA2 GLY A 55 24.050 -2.771 -0.744 1.00 0.00 H new ATOM 0 HA3 GLY A 55 25.745 -2.362 -0.571 1.00 0.00 H new ATOM 815 N ASN A 56 24.513 -5.205 0.743 1.00 0.00 N ATOM 816 CA ASN A 56 24.838 -6.577 0.981 1.00 0.00 C ATOM 817 C ASN A 56 23.933 -7.395 0.125 1.00 0.00 C ATOM 818 O ASN A 56 24.292 -8.462 -0.371 1.00 0.00 O ATOM 819 CB ASN A 56 24.733 -6.907 2.479 1.00 0.00 C ATOM 820 CG ASN A 56 23.364 -6.897 3.145 1.00 0.00 C ATOM 821 OD1 ASN A 56 22.934 -5.857 3.640 1.00 0.00 O ATOM 822 ND2 ASN A 56 22.723 -8.096 3.161 1.00 0.00 N ATOM 0 H ASN A 56 23.630 -4.934 1.176 1.00 0.00 H new ATOM 0 HA ASN A 56 25.871 -6.801 0.714 1.00 0.00 H new ATOM 0 HB2 ASN A 56 25.164 -7.897 2.628 1.00 0.00 H new ATOM 0 HB3 ASN A 56 25.365 -6.200 3.016 1.00 0.00 H new ATOM 0 HD21 ASN A 56 21.811 -8.181 3.610 1.00 0.00 H new ATOM 0 HD22 ASN A 56 23.154 -8.911 2.724 1.00 0.00 H new ATOM 829 N GLY A 57 22.713 -6.907 -0.162 1.00 0.00 N ATOM 830 CA GLY A 57 21.658 -7.493 -0.929 1.00 0.00 C ATOM 831 C GLY A 57 20.471 -8.027 -0.203 1.00 0.00 C ATOM 832 O GLY A 57 19.725 -8.833 -0.757 1.00 0.00 O ATOM 0 H GLY A 57 22.437 -5.990 0.188 1.00 0.00 H new ATOM 0 HA2 GLY A 57 21.305 -6.743 -1.637 1.00 0.00 H new ATOM 0 HA3 GLY A 57 22.085 -8.308 -1.514 1.00 0.00 H new ATOM 836 N THR A 58 20.155 -7.642 1.046 1.00 0.00 N ATOM 837 CA THR A 58 18.948 -7.946 1.749 1.00 0.00 C ATOM 838 C THR A 58 18.480 -6.757 2.516 1.00 0.00 C ATOM 839 O THR A 58 19.224 -5.954 3.076 1.00 0.00 O ATOM 840 CB THR A 58 19.003 -9.141 2.654 1.00 0.00 C ATOM 841 OG1 THR A 58 19.885 -8.923 3.746 1.00 0.00 O ATOM 842 CG2 THR A 58 19.454 -10.380 1.863 1.00 0.00 C ATOM 0 H THR A 58 20.793 -7.075 1.605 1.00 0.00 H new ATOM 0 HA THR A 58 18.239 -8.213 0.966 1.00 0.00 H new ATOM 0 HB THR A 58 18.002 -9.306 3.052 1.00 0.00 H new ATOM 0 HG1 THR A 58 19.899 -9.718 4.319 1.00 0.00 H new ATOM 0 HG21 THR A 58 19.491 -11.243 2.528 1.00 0.00 H new ATOM 0 HG22 THR A 58 18.747 -10.574 1.056 1.00 0.00 H new ATOM 0 HG23 THR A 58 20.444 -10.203 1.443 1.00 0.00 H new ATOM 850 N ILE A 59 17.158 -6.515 2.487 1.00 0.00 N ATOM 851 CA ILE A 59 16.637 -5.395 3.207 1.00 0.00 C ATOM 852 C ILE A 59 16.350 -5.691 4.638 1.00 0.00 C ATOM 853 O ILE A 59 15.798 -6.742 4.961 1.00 0.00 O ATOM 854 CB ILE A 59 15.454 -4.833 2.475 1.00 0.00 C ATOM 855 CG1 ILE A 59 14.716 -3.747 3.276 1.00 0.00 C ATOM 856 CG2 ILE A 59 14.530 -5.961 1.985 1.00 0.00 C ATOM 857 CD1 ILE A 59 13.903 -2.843 2.350 1.00 0.00 C ATOM 0 H ILE A 59 16.469 -7.073 1.983 1.00 0.00 H new ATOM 0 HA ILE A 59 17.413 -4.631 3.245 1.00 0.00 H new ATOM 0 HB ILE A 59 15.828 -4.318 1.590 1.00 0.00 H new ATOM 0 HG12 ILE A 59 14.055 -4.214 4.006 1.00 0.00 H new ATOM 0 HG13 ILE A 59 15.436 -3.149 3.834 1.00 0.00 H new ATOM 0 HG21 ILE A 59 13.679 -5.531 1.457 1.00 0.00 H new ATOM 0 HG22 ILE A 59 15.082 -6.616 1.311 1.00 0.00 H new ATOM 0 HG23 ILE A 59 14.174 -6.536 2.839 1.00 0.00 H new ATOM 0 HD11 ILE A 59 13.391 -2.084 2.941 1.00 0.00 H new ATOM 0 HD12 ILE A 59 14.570 -2.359 1.636 1.00 0.00 H new ATOM 0 HD13 ILE A 59 13.168 -3.441 1.811 1.00 0.00 H new ATOM 869 N ASP A 60 16.797 -4.874 5.608 1.00 0.00 N ATOM 870 CA ASP A 60 16.561 -4.947 7.017 1.00 0.00 C ATOM 871 C ASP A 60 15.440 -4.056 7.427 1.00 0.00 C ATOM 872 O ASP A 60 15.007 -3.240 6.615 1.00 0.00 O ATOM 873 CB ASP A 60 17.823 -4.455 7.744 1.00 0.00 C ATOM 874 CG ASP A 60 19.066 -5.160 7.219 1.00 0.00 C ATOM 875 OD1 ASP A 60 19.261 -6.383 7.452 1.00 0.00 O ATOM 876 OD2 ASP A 60 19.974 -4.499 6.649 1.00 0.00 O ATOM 0 H ASP A 60 17.388 -4.076 5.377 1.00 0.00 H new ATOM 0 HA ASP A 60 16.313 -5.978 7.269 1.00 0.00 H new ATOM 0 HB2 ASP A 60 17.928 -3.378 7.610 1.00 0.00 H new ATOM 0 HB3 ASP A 60 17.724 -4.635 8.814 1.00 0.00 H new ATOM 881 N PHE A 61 14.958 -4.087 8.683 1.00 0.00 N ATOM 882 CA PHE A 61 13.974 -3.129 9.082 1.00 0.00 C ATOM 883 C PHE A 61 14.293 -1.681 8.936 1.00 0.00 C ATOM 884 O PHE A 61 13.422 -0.979 8.426 1.00 0.00 O ATOM 885 CB PHE A 61 13.410 -3.543 10.452 1.00 0.00 C ATOM 886 CG PHE A 61 12.048 -2.976 10.659 1.00 0.00 C ATOM 887 CD1 PHE A 61 11.011 -3.077 9.762 1.00 0.00 C ATOM 888 CD2 PHE A 61 11.904 -2.215 11.795 1.00 0.00 C ATOM 889 CE1 PHE A 61 9.787 -2.525 10.058 1.00 0.00 C ATOM 890 CE2 PHE A 61 10.684 -1.645 12.077 1.00 0.00 C ATOM 891 CZ PHE A 61 9.617 -1.824 11.228 1.00 0.00 C ATOM 0 H PHE A 61 15.239 -4.753 9.403 1.00 0.00 H new ATOM 0 HA PHE A 61 13.188 -3.177 8.328 1.00 0.00 H new ATOM 0 HB2 PHE A 61 13.370 -4.630 10.520 1.00 0.00 H new ATOM 0 HB3 PHE A 61 14.076 -3.199 11.243 1.00 0.00 H new ATOM 0 HD1 PHE A 61 11.158 -3.591 8.823 1.00 0.00 H new ATOM 0 HD2 PHE A 61 12.742 -2.066 12.460 1.00 0.00 H new ATOM 0 HE1 PHE A 61 8.961 -2.642 9.372 1.00 0.00 H new ATOM 0 HE2 PHE A 61 10.563 -1.053 12.972 1.00 0.00 H new ATOM 0 HZ PHE A 61 8.649 -1.415 11.480 1.00 0.00 H new ATOM 901 N PRO A 62 15.351 -1.026 9.310 1.00 0.00 N ATOM 902 CA PRO A 62 15.455 0.387 9.088 1.00 0.00 C ATOM 903 C PRO A 62 15.585 0.827 7.671 1.00 0.00 C ATOM 904 O PRO A 62 15.257 1.954 7.301 1.00 0.00 O ATOM 905 CB PRO A 62 16.750 0.801 9.784 1.00 0.00 C ATOM 906 CG PRO A 62 16.911 -0.284 10.860 1.00 0.00 C ATOM 907 CD PRO A 62 16.320 -1.566 10.252 1.00 0.00 C ATOM 0 HA PRO A 62 14.531 0.836 9.453 1.00 0.00 H new ATOM 0 HB2 PRO A 62 17.594 0.817 9.094 1.00 0.00 H new ATOM 0 HB3 PRO A 62 16.676 1.797 10.220 1.00 0.00 H new ATOM 0 HG2 PRO A 62 17.960 -0.423 11.122 1.00 0.00 H new ATOM 0 HG3 PRO A 62 16.388 -0.008 11.775 1.00 0.00 H new ATOM 0 HD2 PRO A 62 17.079 -2.172 9.757 1.00 0.00 H new ATOM 0 HD3 PRO A 62 15.850 -2.198 11.006 1.00 0.00 H new ATOM 915 N GLU A 63 16.012 -0.110 6.806 1.00 0.00 N ATOM 916 CA GLU A 63 15.951 -0.015 5.380 1.00 0.00 C ATOM 917 C GLU A 63 14.551 -0.042 4.869 1.00 0.00 C ATOM 918 O GLU A 63 14.279 0.749 3.968 1.00 0.00 O ATOM 919 CB GLU A 63 16.723 -1.150 4.688 1.00 0.00 C ATOM 920 CG GLU A 63 18.204 -0.776 4.773 1.00 0.00 C ATOM 921 CD GLU A 63 19.095 -2.001 4.626 1.00 0.00 C ATOM 922 OE1 GLU A 63 18.607 -3.130 4.350 1.00 0.00 O ATOM 923 OE2 GLU A 63 20.340 -1.819 4.698 1.00 0.00 O ATOM 0 H GLU A 63 16.425 -0.987 7.122 1.00 0.00 H new ATOM 0 HA GLU A 63 16.411 0.944 5.142 1.00 0.00 H new ATOM 0 HB2 GLU A 63 16.534 -2.105 5.179 1.00 0.00 H new ATOM 0 HB3 GLU A 63 16.408 -1.258 3.650 1.00 0.00 H new ATOM 0 HG2 GLU A 63 18.444 -0.054 3.993 1.00 0.00 H new ATOM 0 HG3 GLU A 63 18.404 -0.291 5.728 1.00 0.00 H new ATOM 930 N PHE A 64 13.685 -0.934 5.382 1.00 0.00 N ATOM 931 CA PHE A 64 12.271 -0.964 5.176 1.00 0.00 C ATOM 932 C PHE A 64 11.686 0.361 5.529 1.00 0.00 C ATOM 933 O PHE A 64 10.821 0.864 4.814 1.00 0.00 O ATOM 934 CB PHE A 64 11.616 -2.145 5.912 1.00 0.00 C ATOM 935 CG PHE A 64 10.356 -2.596 5.256 1.00 0.00 C ATOM 936 CD1 PHE A 64 10.355 -3.123 3.986 1.00 0.00 C ATOM 937 CD2 PHE A 64 9.155 -2.425 5.903 1.00 0.00 C ATOM 938 CE1 PHE A 64 9.172 -3.442 3.363 1.00 0.00 C ATOM 939 CE2 PHE A 64 7.977 -2.745 5.268 1.00 0.00 C ATOM 940 CZ PHE A 64 7.964 -3.262 3.994 1.00 0.00 C ATOM 0 H PHE A 64 14.000 -1.692 5.987 1.00 0.00 H new ATOM 0 HA PHE A 64 12.061 -1.138 4.121 1.00 0.00 H new ATOM 0 HB2 PHE A 64 12.318 -2.978 5.954 1.00 0.00 H new ATOM 0 HB3 PHE A 64 11.403 -1.855 6.941 1.00 0.00 H new ATOM 0 HD1 PHE A 64 11.291 -3.288 3.474 1.00 0.00 H new ATOM 0 HD2 PHE A 64 9.136 -2.039 6.911 1.00 0.00 H new ATOM 0 HE1 PHE A 64 9.192 -3.841 2.360 1.00 0.00 H new ATOM 0 HE2 PHE A 64 7.041 -2.586 5.782 1.00 0.00 H new ATOM 0 HZ PHE A 64 7.036 -3.518 3.505 1.00 0.00 H new ATOM 950 N LEU A 65 12.123 1.041 6.604 1.00 0.00 N ATOM 951 CA LEU A 65 11.539 2.268 7.050 1.00 0.00 C ATOM 952 C LEU A 65 11.665 3.495 6.214 1.00 0.00 C ATOM 953 O LEU A 65 10.640 4.081 5.867 1.00 0.00 O ATOM 954 CB LEU A 65 12.031 2.567 8.476 1.00 0.00 C ATOM 955 CG LEU A 65 11.486 1.490 9.430 1.00 0.00 C ATOM 956 CD1 LEU A 65 12.068 1.442 10.853 1.00 0.00 C ATOM 957 CD2 LEU A 65 9.956 1.625 9.513 1.00 0.00 C ATOM 0 H LEU A 65 12.905 0.729 7.180 1.00 0.00 H new ATOM 0 HA LEU A 65 10.472 2.058 6.979 1.00 0.00 H new ATOM 0 HB2 LEU A 65 13.121 2.578 8.504 1.00 0.00 H new ATOM 0 HB3 LEU A 65 11.694 3.555 8.791 1.00 0.00 H new ATOM 0 HG LEU A 65 11.812 0.550 8.984 1.00 0.00 H new ATOM 0 HD11 LEU A 65 11.593 0.637 11.413 1.00 0.00 H new ATOM 0 HD12 LEU A 65 13.142 1.264 10.801 1.00 0.00 H new ATOM 0 HD13 LEU A 65 11.882 2.392 11.354 1.00 0.00 H new ATOM 0 HD21 LEU A 65 9.560 0.866 10.187 1.00 0.00 H new ATOM 0 HD22 LEU A 65 9.698 2.615 9.890 1.00 0.00 H new ATOM 0 HD23 LEU A 65 9.525 1.490 8.521 1.00 0.00 H new ATOM 969 N THR A 66 12.849 3.812 5.660 1.00 0.00 N ATOM 970 CA THR A 66 13.182 4.870 4.758 1.00 0.00 C ATOM 971 C THR A 66 12.708 4.645 3.363 1.00 0.00 C ATOM 972 O THR A 66 12.330 5.560 2.633 1.00 0.00 O ATOM 973 CB THR A 66 14.653 5.167 4.767 1.00 0.00 C ATOM 974 OG1 THR A 66 15.046 6.344 4.077 1.00 0.00 O ATOM 975 CG2 THR A 66 15.519 3.995 4.276 1.00 0.00 C ATOM 0 H THR A 66 13.674 3.252 5.875 1.00 0.00 H new ATOM 0 HA THR A 66 12.643 5.740 5.133 1.00 0.00 H new ATOM 0 HB THR A 66 14.836 5.338 5.828 1.00 0.00 H new ATOM 0 HG1 THR A 66 16.018 6.451 4.141 1.00 0.00 H new ATOM 0 HG21 THR A 66 16.570 4.281 4.309 1.00 0.00 H new ATOM 0 HG22 THR A 66 15.358 3.129 4.918 1.00 0.00 H new ATOM 0 HG23 THR A 66 15.244 3.743 3.252 1.00 0.00 H new ATOM 983 N MET A 67 12.533 3.368 2.979 1.00 0.00 N ATOM 984 CA MET A 67 11.925 3.045 1.726 1.00 0.00 C ATOM 985 C MET A 67 10.458 3.303 1.711 1.00 0.00 C ATOM 986 O MET A 67 9.899 3.900 0.792 1.00 0.00 O ATOM 987 CB MET A 67 12.038 1.556 1.354 1.00 0.00 C ATOM 988 CG MET A 67 11.803 1.256 -0.127 1.00 0.00 C ATOM 989 SD MET A 67 12.136 -0.484 -0.534 1.00 0.00 S ATOM 990 CE MET A 67 10.666 -1.203 0.252 1.00 0.00 C ATOM 0 H MET A 67 12.812 2.560 3.535 1.00 0.00 H new ATOM 0 HA MET A 67 12.469 3.681 1.027 1.00 0.00 H new ATOM 0 HB2 MET A 67 13.030 1.199 1.632 1.00 0.00 H new ATOM 0 HB3 MET A 67 11.318 0.990 1.946 1.00 0.00 H new ATOM 0 HG2 MET A 67 10.772 1.497 -0.386 1.00 0.00 H new ATOM 0 HG3 MET A 67 12.443 1.898 -0.732 1.00 0.00 H new ATOM 0 HE1 MET A 67 10.518 -2.219 -0.114 1.00 0.00 H new ATOM 0 HE2 MET A 67 10.804 -1.223 1.333 1.00 0.00 H new ATOM 0 HE3 MET A 67 9.792 -0.599 0.009 1.00 0.00 H new ATOM 1000 N MET A 68 9.698 2.951 2.763 1.00 0.00 N ATOM 1001 CA MET A 68 8.270 2.907 2.722 1.00 0.00 C ATOM 1002 C MET A 68 7.650 4.148 3.266 1.00 0.00 C ATOM 1003 O MET A 68 6.475 4.412 3.012 1.00 0.00 O ATOM 1004 CB MET A 68 7.721 1.744 3.566 1.00 0.00 C ATOM 1005 CG MET A 68 8.045 0.382 2.947 1.00 0.00 C ATOM 1006 SD MET A 68 7.190 0.037 1.380 1.00 0.00 S ATOM 1007 CE MET A 68 5.652 -0.468 2.204 1.00 0.00 C ATOM 0 H MET A 68 10.088 2.689 3.668 1.00 0.00 H new ATOM 0 HA MET A 68 8.017 2.787 1.669 1.00 0.00 H new ATOM 0 HB2 MET A 68 8.142 1.795 4.570 1.00 0.00 H new ATOM 0 HB3 MET A 68 6.641 1.848 3.667 1.00 0.00 H new ATOM 0 HG2 MET A 68 9.120 0.321 2.780 1.00 0.00 H new ATOM 0 HG3 MET A 68 7.789 -0.398 3.664 1.00 0.00 H new ATOM 0 HE1 MET A 68 4.999 -0.961 1.484 1.00 0.00 H new ATOM 0 HE2 MET A 68 5.884 -1.157 3.016 1.00 0.00 H new ATOM 0 HE3 MET A 68 5.150 0.411 2.607 1.00 0.00 H new ATOM 1017 N ALA A 69 8.493 4.928 3.965 1.00 0.00 N ATOM 1018 CA ALA A 69 7.996 6.087 4.640 1.00 0.00 C ATOM 1019 C ALA A 69 8.231 7.294 3.798 1.00 0.00 C ATOM 1020 O ALA A 69 8.136 8.411 4.304 1.00 0.00 O ATOM 1021 CB ALA A 69 8.499 6.056 6.093 1.00 0.00 C ATOM 0 H ALA A 69 9.495 4.763 4.063 1.00 0.00 H new ATOM 0 HA ALA A 69 6.913 6.114 4.760 1.00 0.00 H new ATOM 0 HB1 ALA A 69 8.130 6.933 6.625 1.00 0.00 H new ATOM 0 HB2 ALA A 69 8.135 5.154 6.585 1.00 0.00 H new ATOM 0 HB3 ALA A 69 9.589 6.059 6.101 1.00 0.00 H new ATOM 1027 N ARG A 70 8.555 7.084 2.510 1.00 0.00 N ATOM 1028 CA ARG A 70 8.617 8.071 1.476 1.00 0.00 C ATOM 1029 C ARG A 70 7.300 8.704 1.185 1.00 0.00 C ATOM 1030 O ARG A 70 6.355 8.040 0.762 1.00 0.00 O ATOM 1031 CB ARG A 70 9.226 7.516 0.178 1.00 0.00 C ATOM 1032 CG ARG A 70 9.332 8.485 -1.002 1.00 0.00 C ATOM 1033 CD ARG A 70 9.387 7.830 -2.383 1.00 0.00 C ATOM 1034 NE ARG A 70 8.129 7.106 -2.719 1.00 0.00 N ATOM 1035 CZ ARG A 70 7.895 6.652 -3.984 1.00 0.00 C ATOM 1036 NH1 ARG A 70 8.735 6.826 -5.046 1.00 0.00 N ATOM 1037 NH2 ARG A 70 6.739 5.988 -4.281 1.00 0.00 N ATOM 0 H ARG A 70 8.791 6.153 2.166 1.00 0.00 H new ATOM 0 HA ARG A 70 9.275 8.846 1.869 1.00 0.00 H new ATOM 0 HB2 ARG A 70 10.225 7.144 0.403 1.00 0.00 H new ATOM 0 HB3 ARG A 70 8.631 6.659 -0.138 1.00 0.00 H new ATOM 0 HG2 ARG A 70 8.478 9.162 -0.973 1.00 0.00 H new ATOM 0 HG3 ARG A 70 10.226 9.094 -0.871 1.00 0.00 H new ATOM 0 HD2 ARG A 70 9.576 8.594 -3.137 1.00 0.00 H new ATOM 0 HD3 ARG A 70 10.225 7.133 -2.419 1.00 0.00 H new ATOM 0 HE ARG A 70 7.432 6.947 -1.992 1.00 0.00 H new ATOM 0 HH11 ARG A 70 9.614 7.329 -4.924 1.00 0.00 H new ATOM 0 HH12 ARG A 70 8.483 6.453 -5.962 1.00 0.00 H new ATOM 0 HH21 ARG A 70 6.042 5.828 -3.554 1.00 0.00 H new ATOM 0 HH22 ARG A 70 6.573 5.652 -5.230 1.00 0.00 H new ATOM 1051 N LYS A 71 7.096 10.011 1.427 1.00 0.00 N ATOM 1052 CA LYS A 71 5.836 10.676 1.307 1.00 0.00 C ATOM 1053 C LYS A 71 5.489 11.129 -0.069 1.00 0.00 C ATOM 1054 O LYS A 71 6.428 11.411 -0.811 1.00 0.00 O ATOM 1055 CB LYS A 71 5.658 11.746 2.398 1.00 0.00 C ATOM 1056 CG LYS A 71 4.222 12.123 2.770 1.00 0.00 C ATOM 1057 CD LYS A 71 4.050 13.222 3.819 1.00 0.00 C ATOM 1058 CE LYS A 71 2.607 13.630 4.122 1.00 0.00 C ATOM 1059 NZ LYS A 71 1.912 12.604 4.932 1.00 0.00 N ATOM 0 H LYS A 71 7.848 10.635 1.721 1.00 0.00 H new ATOM 0 HA LYS A 71 5.078 9.915 1.493 1.00 0.00 H new ATOM 0 HB2 LYS A 71 6.162 11.398 3.300 1.00 0.00 H new ATOM 0 HB3 LYS A 71 6.173 12.650 2.074 1.00 0.00 H new ATOM 0 HG2 LYS A 71 3.706 12.436 1.862 1.00 0.00 H new ATOM 0 HG3 LYS A 71 3.717 11.227 3.131 1.00 0.00 H new ATOM 0 HD2 LYS A 71 4.517 12.890 4.746 1.00 0.00 H new ATOM 0 HD3 LYS A 71 4.596 14.105 3.486 1.00 0.00 H new ATOM 0 HE2 LYS A 71 2.601 14.581 4.654 1.00 0.00 H new ATOM 0 HE3 LYS A 71 2.067 13.784 3.188 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 0.936 12.912 5.119 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 1.897 11.703 4.413 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 2.414 12.475 5.834 1.00 0.00 H new ATOM 1073 N MET A 72 4.215 11.244 -0.485 1.00 0.00 N ATOM 1074 CA MET A 72 3.770 11.697 -1.767 1.00 0.00 C ATOM 1075 C MET A 72 2.843 12.855 -1.628 1.00 0.00 C ATOM 1076 O MET A 72 2.448 13.233 -0.526 1.00 0.00 O ATOM 1077 CB MET A 72 3.003 10.552 -2.450 1.00 0.00 C ATOM 1078 CG MET A 72 3.702 9.193 -2.383 1.00 0.00 C ATOM 1079 SD MET A 72 5.352 9.186 -3.145 1.00 0.00 S ATOM 1080 CE MET A 72 4.847 9.103 -4.888 1.00 0.00 C ATOM 0 H MET A 72 3.435 11.000 0.125 1.00 0.00 H new ATOM 0 HA MET A 72 4.638 12.001 -2.352 1.00 0.00 H new ATOM 0 HB2 MET A 72 2.020 10.464 -1.988 1.00 0.00 H new ATOM 0 HB3 MET A 72 2.842 10.813 -3.496 1.00 0.00 H new ATOM 0 HG2 MET A 72 3.791 8.891 -1.340 1.00 0.00 H new ATOM 0 HG3 MET A 72 3.079 8.448 -2.878 1.00 0.00 H new ATOM 0 HE1 MET A 72 5.699 8.806 -5.500 1.00 0.00 H new ATOM 0 HE2 MET A 72 4.047 8.371 -5.001 1.00 0.00 H new ATOM 0 HE3 MET A 72 4.492 10.082 -5.211 1.00 0.00 H new ATOM 1090 N LYS A 73 2.301 13.335 -2.762 1.00 0.00 N ATOM 1091 CA LYS A 73 1.316 14.369 -2.820 1.00 0.00 C ATOM 1092 C LYS A 73 0.311 13.918 -3.824 1.00 0.00 C ATOM 1093 O LYS A 73 0.455 12.809 -4.337 1.00 0.00 O ATOM 1094 CB LYS A 73 1.904 15.772 -3.047 1.00 0.00 C ATOM 1095 CG LYS A 73 2.478 15.881 -4.461 1.00 0.00 C ATOM 1096 CD LYS A 73 2.609 17.352 -4.864 1.00 0.00 C ATOM 1097 CE LYS A 73 2.960 17.745 -6.300 1.00 0.00 C ATOM 1098 NZ LYS A 73 1.849 17.195 -7.108 1.00 0.00 N ATOM 0 H LYS A 73 2.563 12.984 -3.683 1.00 0.00 H new ATOM 0 HA LYS A 73 0.826 14.510 -1.857 1.00 0.00 H new ATOM 0 HB2 LYS A 73 1.131 16.526 -2.901 1.00 0.00 H new ATOM 0 HB3 LYS A 73 2.685 15.970 -2.313 1.00 0.00 H new ATOM 0 HG2 LYS A 73 3.453 15.396 -4.504 1.00 0.00 H new ATOM 0 HG3 LYS A 73 1.831 15.359 -5.166 1.00 0.00 H new ATOM 0 HD2 LYS A 73 1.662 17.835 -4.623 1.00 0.00 H new ATOM 0 HD3 LYS A 73 3.367 17.794 -4.217 1.00 0.00 H new ATOM 0 HE2 LYS A 73 3.035 18.827 -6.410 1.00 0.00 H new ATOM 0 HE3 LYS A 73 3.919 17.326 -6.604 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 1.980 17.461 -8.105 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 1.839 16.158 -7.025 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 0.946 17.578 -6.763 1.00 0.00 H new ATOM 1112 N ASP A 74 -0.634 14.827 -4.122 1.00 0.00 N ATOM 1113 CA ASP A 74 -1.882 14.807 -4.819 1.00 0.00 C ATOM 1114 C ASP A 74 -2.186 13.648 -5.704 1.00 0.00 C ATOM 1115 O ASP A 74 -2.468 12.520 -5.302 1.00 0.00 O ATOM 1116 CB ASP A 74 -2.312 16.190 -5.338 1.00 0.00 C ATOM 1117 CG ASP A 74 -1.344 16.822 -6.328 1.00 0.00 C ATOM 1118 OD1 ASP A 74 -1.209 16.439 -7.521 1.00 0.00 O ATOM 1119 OD2 ASP A 74 -0.551 17.711 -5.918 1.00 0.00 O ATOM 0 H ASP A 74 -0.474 15.780 -3.796 1.00 0.00 H new ATOM 0 HA ASP A 74 -2.583 14.564 -4.020 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -3.289 16.098 -5.813 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -2.433 16.862 -4.488 1.00 0.00 H new ATOM 1124 N THR A 75 -2.014 13.842 -7.024 1.00 0.00 N ATOM 1125 CA THR A 75 -2.211 12.858 -8.043 1.00 0.00 C ATOM 1126 C THR A 75 -1.420 11.610 -7.858 1.00 0.00 C ATOM 1127 O THR A 75 -1.804 10.492 -8.199 1.00 0.00 O ATOM 1128 CB THR A 75 -1.961 13.418 -9.412 1.00 0.00 C ATOM 1129 OG1 THR A 75 -0.742 14.101 -9.663 1.00 0.00 O ATOM 1130 CG2 THR A 75 -3.045 14.452 -9.761 1.00 0.00 C ATOM 0 H THR A 75 -1.719 14.742 -7.402 1.00 0.00 H new ATOM 0 HA THR A 75 -3.260 12.578 -7.948 1.00 0.00 H new ATOM 0 HB THR A 75 -1.946 12.505 -10.008 1.00 0.00 H new ATOM 0 HG1 THR A 75 -0.705 14.915 -9.118 1.00 0.00 H new ATOM 0 HG21 THR A 75 -2.857 14.854 -10.756 1.00 0.00 H new ATOM 0 HG22 THR A 75 -4.024 13.973 -9.742 1.00 0.00 H new ATOM 0 HG23 THR A 75 -3.023 15.262 -9.032 1.00 0.00 H new ATOM 1138 N ASP A 76 -0.262 11.610 -7.174 1.00 0.00 N ATOM 1139 CA ASP A 76 0.473 10.413 -6.904 1.00 0.00 C ATOM 1140 C ASP A 76 -0.139 9.570 -5.839 1.00 0.00 C ATOM 1141 O ASP A 76 -0.097 8.345 -5.937 1.00 0.00 O ATOM 1142 CB ASP A 76 1.963 10.685 -6.636 1.00 0.00 C ATOM 1143 CG ASP A 76 2.530 11.274 -7.920 1.00 0.00 C ATOM 1144 OD1 ASP A 76 2.508 10.596 -8.981 1.00 0.00 O ATOM 1145 OD2 ASP A 76 3.075 12.398 -7.758 1.00 0.00 O ATOM 0 H ASP A 76 0.171 12.455 -6.802 1.00 0.00 H new ATOM 0 HA ASP A 76 0.415 9.827 -7.821 1.00 0.00 H new ATOM 0 HB2 ASP A 76 2.088 11.377 -5.803 1.00 0.00 H new ATOM 0 HB3 ASP A 76 2.483 9.766 -6.367 1.00 0.00 H new ATOM 1150 N SER A 77 -0.825 10.193 -4.864 1.00 0.00 N ATOM 1151 CA SER A 77 -1.418 9.572 -3.721 1.00 0.00 C ATOM 1152 C SER A 77 -2.684 8.882 -4.097 1.00 0.00 C ATOM 1153 O SER A 77 -3.266 7.985 -3.488 1.00 0.00 O ATOM 1154 CB SER A 77 -1.703 10.628 -2.641 1.00 0.00 C ATOM 1155 OG SER A 77 -1.833 10.093 -1.332 1.00 0.00 O ATOM 0 H SER A 77 -0.975 11.202 -4.877 1.00 0.00 H new ATOM 0 HA SER A 77 -0.721 8.832 -3.328 1.00 0.00 H new ATOM 0 HB2 SER A 77 -0.898 11.363 -2.644 1.00 0.00 H new ATOM 0 HB3 SER A 77 -2.620 11.158 -2.899 1.00 0.00 H new ATOM 0 HG SER A 77 -2.011 10.819 -0.698 1.00 0.00 H new ATOM 1161 N GLU A 78 -3.231 9.271 -5.262 1.00 0.00 N ATOM 1162 CA GLU A 78 -4.333 8.637 -5.917 1.00 0.00 C ATOM 1163 C GLU A 78 -3.938 7.369 -6.594 1.00 0.00 C ATOM 1164 O GLU A 78 -4.499 6.323 -6.273 1.00 0.00 O ATOM 1165 CB GLU A 78 -5.100 9.553 -6.885 1.00 0.00 C ATOM 1166 CG GLU A 78 -5.770 10.772 -6.248 1.00 0.00 C ATOM 1167 CD GLU A 78 -6.775 11.446 -7.172 1.00 0.00 C ATOM 1168 OE1 GLU A 78 -6.325 12.214 -8.064 1.00 0.00 O ATOM 1169 OE2 GLU A 78 -8.009 11.244 -7.014 1.00 0.00 O ATOM 0 H GLU A 78 -2.882 10.078 -5.778 1.00 0.00 H new ATOM 0 HA GLU A 78 -5.025 8.394 -5.110 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -4.409 9.900 -7.653 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -5.865 8.961 -7.388 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -6.275 10.465 -5.332 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -5.004 11.494 -5.964 1.00 0.00 H new ATOM 1176 N GLU A 79 -2.915 7.353 -7.466 1.00 0.00 N ATOM 1177 CA GLU A 79 -2.404 6.243 -8.209 1.00 0.00 C ATOM 1178 C GLU A 79 -1.969 5.175 -7.265 1.00 0.00 C ATOM 1179 O GLU A 79 -2.108 3.996 -7.586 1.00 0.00 O ATOM 1180 CB GLU A 79 -1.169 6.528 -9.080 1.00 0.00 C ATOM 1181 CG GLU A 79 -1.376 7.664 -10.085 1.00 0.00 C ATOM 1182 CD GLU A 79 -2.312 7.202 -11.192 1.00 0.00 C ATOM 1183 OE1 GLU A 79 -2.060 6.163 -11.859 1.00 0.00 O ATOM 1184 OE2 GLU A 79 -3.321 7.919 -11.430 1.00 0.00 O ATOM 0 H GLU A 79 -2.394 8.206 -7.670 1.00 0.00 H new ATOM 0 HA GLU A 79 -3.230 5.969 -8.866 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -0.328 6.776 -8.433 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -0.899 5.621 -9.621 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -1.794 8.536 -9.582 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -0.418 7.968 -10.508 1.00 0.00 H new ATOM 1191 N GLU A 80 -1.431 5.511 -6.079 1.00 0.00 N ATOM 1192 CA GLU A 80 -1.235 4.520 -5.066 1.00 0.00 C ATOM 1193 C GLU A 80 -2.353 3.634 -4.636 1.00 0.00 C ATOM 1194 O GLU A 80 -2.180 2.423 -4.510 1.00 0.00 O ATOM 1195 CB GLU A 80 -0.649 5.116 -3.775 1.00 0.00 C ATOM 1196 CG GLU A 80 0.871 5.289 -3.802 1.00 0.00 C ATOM 1197 CD GLU A 80 1.590 4.689 -2.603 1.00 0.00 C ATOM 1198 OE1 GLU A 80 1.446 3.459 -2.367 1.00 0.00 O ATOM 1199 OE2 GLU A 80 2.132 5.503 -1.808 1.00 0.00 O ATOM 0 H GLU A 80 -1.136 6.453 -5.823 1.00 0.00 H new ATOM 0 HA GLU A 80 -0.560 3.873 -5.626 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -1.111 6.086 -3.593 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -0.916 4.473 -2.936 1.00 0.00 H new ATOM 0 HG2 GLU A 80 1.261 4.832 -4.711 1.00 0.00 H new ATOM 0 HG3 GLU A 80 1.103 6.353 -3.855 1.00 0.00 H new ATOM 1206 N ILE A 81 -3.598 4.094 -4.418 1.00 0.00 N ATOM 1207 CA ILE A 81 -4.747 3.322 -4.059 1.00 0.00 C ATOM 1208 C ILE A 81 -5.189 2.601 -5.286 1.00 0.00 C ATOM 1209 O ILE A 81 -5.602 1.443 -5.300 1.00 0.00 O ATOM 1210 CB ILE A 81 -5.916 4.085 -3.510 1.00 0.00 C ATOM 1211 CG1 ILE A 81 -5.346 4.889 -2.330 1.00 0.00 C ATOM 1212 CG2 ILE A 81 -7.021 3.112 -3.066 1.00 0.00 C ATOM 1213 CD1 ILE A 81 -6.304 5.957 -1.804 1.00 0.00 C ATOM 0 H ILE A 81 -3.817 5.087 -4.500 1.00 0.00 H new ATOM 0 HA ILE A 81 -4.433 2.671 -3.243 1.00 0.00 H new ATOM 0 HB ILE A 81 -6.376 4.744 -4.246 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -5.097 4.204 -1.520 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -4.417 5.366 -2.640 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -7.865 3.676 -2.669 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -7.350 2.520 -3.920 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -6.633 2.449 -2.293 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -5.838 6.486 -0.973 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -6.534 6.664 -2.601 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -7.225 5.484 -1.463 1.00 0.00 H new ATOM 1225 N ARG A 82 -5.118 3.244 -6.465 1.00 0.00 N ATOM 1226 CA ARG A 82 -5.522 2.742 -7.742 1.00 0.00 C ATOM 1227 C ARG A 82 -4.900 1.453 -8.156 1.00 0.00 C ATOM 1228 O ARG A 82 -5.494 0.462 -8.578 1.00 0.00 O ATOM 1229 CB ARG A 82 -5.332 3.873 -8.766 1.00 0.00 C ATOM 1230 CG ARG A 82 -6.280 3.781 -9.963 1.00 0.00 C ATOM 1231 CD ARG A 82 -5.932 4.637 -11.182 1.00 0.00 C ATOM 1232 NE ARG A 82 -5.443 5.954 -10.686 1.00 0.00 N ATOM 1233 CZ ARG A 82 -6.226 7.035 -10.401 1.00 0.00 C ATOM 1234 NH1 ARG A 82 -7.589 7.024 -10.473 1.00 0.00 N ATOM 1235 NH2 ARG A 82 -5.644 8.259 -10.237 1.00 0.00 N ATOM 0 H ARG A 82 -4.748 4.192 -6.529 1.00 0.00 H new ATOM 0 HA ARG A 82 -6.573 2.459 -7.677 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -5.481 4.831 -8.268 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -4.303 3.857 -9.126 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -6.327 2.739 -10.281 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -7.280 4.057 -9.627 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -5.168 4.148 -11.787 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -6.807 4.769 -11.819 1.00 0.00 H new ATOM 0 HE ARG A 82 -4.438 6.057 -10.548 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -8.078 6.174 -10.753 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -8.118 7.866 -10.247 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -4.633 8.359 -10.328 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -6.220 9.073 -10.024 1.00 0.00 H new ATOM 1249 N GLU A 83 -3.589 1.370 -7.868 1.00 0.00 N ATOM 1250 CA GLU A 83 -2.731 0.249 -8.096 1.00 0.00 C ATOM 1251 C GLU A 83 -3.070 -0.964 -7.300 1.00 0.00 C ATOM 1252 O GLU A 83 -2.905 -2.101 -7.739 1.00 0.00 O ATOM 1253 CB GLU A 83 -1.272 0.578 -7.736 1.00 0.00 C ATOM 1254 CG GLU A 83 -0.621 1.455 -8.807 1.00 0.00 C ATOM 1255 CD GLU A 83 -0.113 0.593 -9.953 1.00 0.00 C ATOM 1256 OE1 GLU A 83 -0.953 0.115 -10.762 1.00 0.00 O ATOM 1257 OE2 GLU A 83 1.115 0.317 -10.000 1.00 0.00 O ATOM 0 H GLU A 83 -3.090 2.151 -7.441 1.00 0.00 H new ATOM 0 HA GLU A 83 -2.869 0.039 -9.157 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -1.239 1.090 -6.774 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -0.705 -0.346 -7.625 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -1.343 2.182 -9.181 1.00 0.00 H new ATOM 0 HG3 GLU A 83 0.204 2.020 -8.373 1.00 0.00 H new ATOM 1264 N ALA A 84 -3.457 -0.804 -6.022 1.00 0.00 N ATOM 1265 CA ALA A 84 -3.893 -1.856 -5.157 1.00 0.00 C ATOM 1266 C ALA A 84 -5.206 -2.376 -5.631 1.00 0.00 C ATOM 1267 O ALA A 84 -5.469 -3.542 -5.342 1.00 0.00 O ATOM 1268 CB ALA A 84 -3.982 -1.264 -3.740 1.00 0.00 C ATOM 0 H ALA A 84 -3.466 0.109 -5.568 1.00 0.00 H new ATOM 0 HA ALA A 84 -3.201 -2.698 -5.155 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -4.312 -2.035 -3.044 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -3.001 -0.897 -3.437 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -4.695 -0.440 -3.734 1.00 0.00 H new ATOM 1274 N PHE A 85 -6.020 -1.550 -6.312 1.00 0.00 N ATOM 1275 CA PHE A 85 -7.289 -1.983 -6.808 1.00 0.00 C ATOM 1276 C PHE A 85 -7.077 -2.935 -7.934 1.00 0.00 C ATOM 1277 O PHE A 85 -7.615 -4.040 -7.881 1.00 0.00 O ATOM 1278 CB PHE A 85 -8.263 -0.815 -7.039 1.00 0.00 C ATOM 1279 CG PHE A 85 -9.716 -1.125 -7.153 1.00 0.00 C ATOM 1280 CD1 PHE A 85 -10.198 -1.912 -8.173 1.00 0.00 C ATOM 1281 CD2 PHE A 85 -10.563 -0.597 -6.207 1.00 0.00 C ATOM 1282 CE1 PHE A 85 -11.534 -2.237 -8.178 1.00 0.00 C ATOM 1283 CE2 PHE A 85 -11.896 -0.930 -6.236 1.00 0.00 C ATOM 1284 CZ PHE A 85 -12.404 -1.673 -7.275 1.00 0.00 C ATOM 0 H PHE A 85 -5.797 -0.577 -6.520 1.00 0.00 H new ATOM 0 HA PHE A 85 -7.826 -2.555 -6.052 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -8.136 -0.108 -6.219 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -7.959 -0.303 -7.952 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -9.541 -2.267 -8.953 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -10.184 0.073 -5.449 1.00 0.00 H new ATOM 0 HE1 PHE A 85 -11.906 -2.946 -8.903 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -12.548 -0.606 -5.438 1.00 0.00 H new ATOM 0 HZ PHE A 85 -13.470 -1.812 -7.380 1.00 0.00 H new ATOM 1294 N ARG A 86 -6.206 -2.560 -8.887 1.00 0.00 N ATOM 1295 CA ARG A 86 -5.781 -3.373 -9.984 1.00 0.00 C ATOM 1296 C ARG A 86 -5.336 -4.744 -9.611 1.00 0.00 C ATOM 1297 O ARG A 86 -5.734 -5.700 -10.275 1.00 0.00 O ATOM 1298 CB ARG A 86 -4.932 -2.703 -11.078 1.00 0.00 C ATOM 1299 CG ARG A 86 -4.481 -3.568 -12.256 1.00 0.00 C ATOM 1300 CD ARG A 86 -3.906 -2.754 -13.417 1.00 0.00 C ATOM 1301 NE ARG A 86 -2.655 -2.146 -12.884 1.00 0.00 N ATOM 1302 CZ ARG A 86 -1.720 -1.680 -13.763 1.00 0.00 C ATOM 1303 NH1 ARG A 86 -1.951 -1.604 -15.106 1.00 0.00 N ATOM 1304 NH2 ARG A 86 -0.618 -1.067 -13.242 1.00 0.00 N ATOM 0 H ARG A 86 -5.774 -1.636 -8.892 1.00 0.00 H new ATOM 0 HA ARG A 86 -6.726 -3.515 -10.507 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -5.501 -1.863 -11.477 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -4.041 -2.289 -10.605 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -3.729 -4.277 -11.910 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -5.329 -4.152 -12.615 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -3.700 -3.389 -14.279 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -4.607 -1.987 -13.746 1.00 0.00 H new ATOM 0 HE ARG A 86 -2.499 -2.079 -11.878 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -2.849 -1.902 -15.487 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -1.225 -1.250 -15.729 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -0.517 -0.972 -12.231 1.00 0.00 H new ATOM 0 HH22 ARG A 86 0.105 -0.704 -13.863 1.00 0.00 H new ATOM 1318 N VAL A 87 -4.570 -4.908 -8.517 1.00 0.00 N ATOM 1319 CA VAL A 87 -4.273 -6.188 -7.953 1.00 0.00 C ATOM 1320 C VAL A 87 -5.423 -7.037 -7.534 1.00 0.00 C ATOM 1321 O VAL A 87 -5.568 -8.212 -7.869 1.00 0.00 O ATOM 1322 CB VAL A 87 -3.262 -6.009 -6.859 1.00 0.00 C ATOM 1323 CG1 VAL A 87 -2.831 -7.335 -6.210 1.00 0.00 C ATOM 1324 CG2 VAL A 87 -1.965 -5.425 -7.443 1.00 0.00 C ATOM 0 H VAL A 87 -4.146 -4.130 -8.012 1.00 0.00 H new ATOM 0 HA VAL A 87 -3.866 -6.780 -8.773 1.00 0.00 H new ATOM 0 HB VAL A 87 -3.744 -5.365 -6.123 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -2.099 -7.136 -5.427 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -3.701 -7.828 -5.776 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -2.387 -7.983 -6.966 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -1.233 -5.296 -6.646 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -1.566 -6.105 -8.196 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -2.175 -4.459 -7.902 1.00 0.00 H new ATOM 1334 N PHE A 88 -6.414 -6.522 -6.784 1.00 0.00 N ATOM 1335 CA PHE A 88 -7.622 -7.167 -6.374 1.00 0.00 C ATOM 1336 C PHE A 88 -8.606 -7.579 -7.415 1.00 0.00 C ATOM 1337 O PHE A 88 -9.156 -8.679 -7.404 1.00 0.00 O ATOM 1338 CB PHE A 88 -8.307 -6.303 -5.302 1.00 0.00 C ATOM 1339 CG PHE A 88 -7.675 -6.160 -3.961 1.00 0.00 C ATOM 1340 CD1 PHE A 88 -7.402 -7.173 -3.071 1.00 0.00 C ATOM 1341 CD2 PHE A 88 -7.453 -4.877 -3.519 1.00 0.00 C ATOM 1342 CE1 PHE A 88 -6.770 -6.954 -1.870 1.00 0.00 C ATOM 1343 CE2 PHE A 88 -6.683 -4.675 -2.398 1.00 0.00 C ATOM 1344 CZ PHE A 88 -6.413 -5.680 -1.499 1.00 0.00 C ATOM 0 H PHE A 88 -6.362 -5.565 -6.434 1.00 0.00 H new ATOM 0 HA PHE A 88 -7.281 -8.131 -5.997 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -8.425 -5.302 -5.716 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -9.309 -6.705 -5.150 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -7.696 -8.180 -3.326 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -7.879 -4.037 -4.047 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -6.553 -7.786 -1.216 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -6.275 -3.691 -2.217 1.00 0.00 H new ATOM 0 HZ PHE A 88 -5.943 -5.478 -0.548 1.00 0.00 H new ATOM 1354 N ASP A 89 -8.877 -6.652 -8.350 1.00 0.00 N ATOM 1355 CA ASP A 89 -9.996 -6.828 -9.224 1.00 0.00 C ATOM 1356 C ASP A 89 -9.568 -7.587 -10.432 1.00 0.00 C ATOM 1357 O ASP A 89 -8.608 -7.238 -11.118 1.00 0.00 O ATOM 1358 CB ASP A 89 -10.459 -5.432 -9.673 1.00 0.00 C ATOM 1359 CG ASP A 89 -11.909 -5.337 -10.126 1.00 0.00 C ATOM 1360 OD1 ASP A 89 -12.735 -5.953 -9.399 1.00 0.00 O ATOM 1361 OD2 ASP A 89 -12.222 -4.603 -11.101 1.00 0.00 O ATOM 0 H ASP A 89 -8.337 -5.800 -8.500 1.00 0.00 H new ATOM 0 HA ASP A 89 -10.793 -7.369 -8.714 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -10.308 -4.735 -8.848 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -9.819 -5.102 -10.491 1.00 0.00 H new ATOM 1366 N LYS A 90 -10.048 -8.801 -10.753 1.00 0.00 N ATOM 1367 CA LYS A 90 -9.554 -9.614 -11.821 1.00 0.00 C ATOM 1368 C LYS A 90 -10.093 -9.424 -13.197 1.00 0.00 C ATOM 1369 O LYS A 90 -9.323 -9.377 -14.154 1.00 0.00 O ATOM 1370 CB LYS A 90 -9.917 -11.014 -11.297 1.00 0.00 C ATOM 1371 CG LYS A 90 -9.587 -12.209 -12.193 1.00 0.00 C ATOM 1372 CD LYS A 90 -8.083 -12.411 -12.391 1.00 0.00 C ATOM 1373 CE LYS A 90 -7.196 -12.529 -11.150 1.00 0.00 C ATOM 1374 NZ LYS A 90 -7.441 -13.793 -10.421 1.00 0.00 N ATOM 0 H LYS A 90 -10.817 -9.237 -10.244 1.00 0.00 H new ATOM 0 HA LYS A 90 -8.506 -9.376 -12.003 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -9.410 -11.158 -10.343 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -10.988 -11.031 -11.095 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -10.015 -13.112 -11.757 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -10.060 -12.069 -13.165 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -7.945 -13.314 -12.985 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -7.711 -11.577 -12.987 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -6.148 -12.476 -11.445 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -7.383 -11.684 -10.487 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -6.563 -14.102 -9.957 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -8.178 -13.642 -9.702 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -7.755 -14.525 -11.090 1.00 0.00 H new ATOM 1388 N ASP A 91 -11.416 -9.203 -13.295 1.00 0.00 N ATOM 1389 CA ASP A 91 -12.056 -8.744 -14.488 1.00 0.00 C ATOM 1390 C ASP A 91 -11.739 -7.365 -14.955 1.00 0.00 C ATOM 1391 O ASP A 91 -11.271 -7.221 -16.084 1.00 0.00 O ATOM 1392 CB ASP A 91 -13.534 -8.837 -14.072 1.00 0.00 C ATOM 1393 CG ASP A 91 -13.975 -8.425 -12.675 1.00 0.00 C ATOM 1394 OD1 ASP A 91 -13.808 -7.231 -12.310 1.00 0.00 O ATOM 1395 OD2 ASP A 91 -14.424 -9.216 -11.803 1.00 0.00 O ATOM 0 H ASP A 91 -12.061 -9.349 -12.518 1.00 0.00 H new ATOM 0 HA ASP A 91 -11.731 -9.333 -15.345 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -14.105 -8.235 -14.779 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -13.842 -9.873 -14.213 1.00 0.00 H new ATOM 1400 N GLY A 92 -11.915 -6.308 -14.142 1.00 0.00 N ATOM 1401 CA GLY A 92 -11.517 -4.976 -14.474 1.00 0.00 C ATOM 1402 C GLY A 92 -12.543 -3.938 -14.171 1.00 0.00 C ATOM 1403 O GLY A 92 -12.332 -2.764 -14.471 1.00 0.00 O ATOM 0 H GLY A 92 -12.349 -6.384 -13.222 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -10.603 -4.736 -13.931 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -11.277 -4.935 -15.537 1.00 0.00 H new ATOM 1407 N ASN A 93 -13.657 -4.352 -13.542 1.00 0.00 N ATOM 1408 CA ASN A 93 -14.937 -3.713 -13.533 1.00 0.00 C ATOM 1409 C ASN A 93 -15.050 -2.601 -12.548 1.00 0.00 C ATOM 1410 O ASN A 93 -15.887 -1.730 -12.779 1.00 0.00 O ATOM 1411 CB ASN A 93 -16.095 -4.724 -13.477 1.00 0.00 C ATOM 1412 CG ASN A 93 -16.316 -5.580 -12.238 1.00 0.00 C ATOM 1413 OD1 ASN A 93 -15.766 -5.456 -11.145 1.00 0.00 O ATOM 1414 ND2 ASN A 93 -17.242 -6.560 -12.421 1.00 0.00 N ATOM 0 H ASN A 93 -13.661 -5.210 -12.991 1.00 0.00 H new ATOM 0 HA ASN A 93 -15.029 -3.214 -14.498 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -17.016 -4.168 -13.652 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -15.969 -5.404 -14.319 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -17.478 -7.189 -11.653 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -17.700 -6.666 -13.326 1.00 0.00 H new ATOM 1421 N GLY A 94 -14.208 -2.549 -11.501 1.00 0.00 N ATOM 1422 CA GLY A 94 -14.225 -1.558 -10.469 1.00 0.00 C ATOM 1423 C GLY A 94 -15.049 -2.009 -9.312 1.00 0.00 C ATOM 1424 O GLY A 94 -15.495 -1.217 -8.484 1.00 0.00 O ATOM 0 H GLY A 94 -13.471 -3.241 -11.367 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -13.207 -1.355 -10.138 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -14.625 -0.624 -10.863 1.00 0.00 H new ATOM 1428 N TYR A 95 -15.339 -3.316 -9.181 1.00 0.00 N ATOM 1429 CA TYR A 95 -16.138 -3.886 -8.140 1.00 0.00 C ATOM 1430 C TYR A 95 -15.434 -5.108 -7.661 1.00 0.00 C ATOM 1431 O TYR A 95 -15.438 -6.135 -8.338 1.00 0.00 O ATOM 1432 CB TYR A 95 -17.480 -4.399 -8.689 1.00 0.00 C ATOM 1433 CG TYR A 95 -18.373 -3.277 -9.093 1.00 0.00 C ATOM 1434 CD1 TYR A 95 -19.170 -2.704 -8.130 1.00 0.00 C ATOM 1435 CD2 TYR A 95 -18.503 -2.858 -10.396 1.00 0.00 C ATOM 1436 CE1 TYR A 95 -20.065 -1.711 -8.454 1.00 0.00 C ATOM 1437 CE2 TYR A 95 -19.436 -1.913 -10.754 1.00 0.00 C ATOM 1438 CZ TYR A 95 -20.191 -1.324 -9.767 1.00 0.00 C ATOM 1439 OH TYR A 95 -21.114 -0.317 -10.120 1.00 0.00 O ATOM 0 H TYR A 95 -14.996 -4.015 -9.840 1.00 0.00 H new ATOM 0 HA TYR A 95 -16.297 -3.127 -7.374 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -17.299 -5.047 -9.546 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -17.976 -5.005 -7.931 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -19.092 -3.038 -7.106 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -17.859 -3.280 -11.154 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -20.662 -1.241 -7.686 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -19.573 -1.639 -11.790 1.00 0.00 H new ATOM 0 HH TYR A 95 -21.076 -0.163 -11.087 1.00 0.00 H new ATOM 1449 N ILE A 96 -14.835 -5.185 -6.459 1.00 0.00 N ATOM 1450 CA ILE A 96 -14.252 -6.359 -5.887 1.00 0.00 C ATOM 1451 C ILE A 96 -15.216 -7.251 -5.185 1.00 0.00 C ATOM 1452 O ILE A 96 -15.869 -6.925 -4.195 1.00 0.00 O ATOM 1453 CB ILE A 96 -13.122 -5.932 -4.998 1.00 0.00 C ATOM 1454 CG1 ILE A 96 -12.055 -5.124 -5.756 1.00 0.00 C ATOM 1455 CG2 ILE A 96 -12.482 -7.088 -4.212 1.00 0.00 C ATOM 1456 CD1 ILE A 96 -11.197 -4.309 -4.789 1.00 0.00 C ATOM 0 H ILE A 96 -14.753 -4.373 -5.847 1.00 0.00 H new ATOM 0 HA ILE A 96 -13.882 -6.981 -6.702 1.00 0.00 H new ATOM 0 HB ILE A 96 -13.581 -5.274 -4.259 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -11.421 -5.800 -6.329 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -12.538 -4.457 -6.470 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -11.673 -6.702 -3.592 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -13.234 -7.557 -3.577 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -12.085 -7.826 -4.909 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -10.450 -3.747 -5.350 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -11.831 -3.617 -4.235 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -10.697 -4.981 -4.092 1.00 0.00 H new ATOM 1468 N SER A 97 -15.400 -8.488 -5.681 1.00 0.00 N ATOM 1469 CA SER A 97 -16.219 -9.498 -5.087 1.00 0.00 C ATOM 1470 C SER A 97 -15.517 -10.217 -3.986 1.00 0.00 C ATOM 1471 O SER A 97 -14.306 -10.031 -3.881 1.00 0.00 O ATOM 1472 CB SER A 97 -16.675 -10.605 -6.052 1.00 0.00 C ATOM 1473 OG SER A 97 -15.588 -11.315 -6.627 1.00 0.00 O ATOM 0 H SER A 97 -14.953 -8.799 -6.543 1.00 0.00 H new ATOM 0 HA SER A 97 -17.079 -8.927 -4.737 1.00 0.00 H new ATOM 0 HB2 SER A 97 -17.318 -11.304 -5.518 1.00 0.00 H new ATOM 0 HB3 SER A 97 -17.276 -10.163 -6.847 1.00 0.00 H new ATOM 0 HG SER A 97 -15.098 -10.725 -7.237 1.00 0.00 H new ATOM 1479 N ALA A 98 -16.092 -11.129 -3.183 1.00 0.00 N ATOM 1480 CA ALA A 98 -15.382 -11.889 -2.201 1.00 0.00 C ATOM 1481 C ALA A 98 -14.443 -12.951 -2.659 1.00 0.00 C ATOM 1482 O ALA A 98 -13.384 -13.170 -2.073 1.00 0.00 O ATOM 1483 CB ALA A 98 -16.349 -12.379 -1.110 1.00 0.00 C ATOM 0 H ALA A 98 -17.088 -11.346 -3.218 1.00 0.00 H new ATOM 0 HA ALA A 98 -14.671 -11.171 -1.792 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -15.798 -12.956 -0.368 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -16.818 -11.521 -0.628 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -17.118 -13.007 -1.560 1.00 0.00 H new ATOM 1489 N ALA A 99 -14.800 -13.552 -3.808 1.00 0.00 N ATOM 1490 CA ALA A 99 -14.064 -14.460 -4.632 1.00 0.00 C ATOM 1491 C ALA A 99 -12.778 -13.859 -5.085 1.00 0.00 C ATOM 1492 O ALA A 99 -11.708 -14.458 -4.996 1.00 0.00 O ATOM 1493 CB ALA A 99 -14.861 -14.800 -5.903 1.00 0.00 C ATOM 0 H ALA A 99 -15.723 -13.376 -4.206 1.00 0.00 H new ATOM 0 HA ALA A 99 -13.879 -15.349 -4.029 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -14.286 -15.492 -6.519 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -15.808 -15.262 -5.626 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -15.054 -13.887 -6.467 1.00 0.00 H new ATOM 1499 N GLU A 100 -12.763 -12.610 -5.584 1.00 0.00 N ATOM 1500 CA GLU A 100 -11.577 -11.893 -5.936 1.00 0.00 C ATOM 1501 C GLU A 100 -10.705 -11.471 -4.805 1.00 0.00 C ATOM 1502 O GLU A 100 -9.484 -11.602 -4.875 1.00 0.00 O ATOM 1503 CB GLU A 100 -11.980 -10.595 -6.656 1.00 0.00 C ATOM 1504 CG GLU A 100 -12.576 -10.988 -8.009 1.00 0.00 C ATOM 1505 CD GLU A 100 -13.152 -9.736 -8.656 1.00 0.00 C ATOM 1506 OE1 GLU A 100 -14.202 -9.230 -8.176 1.00 0.00 O ATOM 1507 OE2 GLU A 100 -12.682 -9.239 -9.714 1.00 0.00 O ATOM 0 H GLU A 100 -13.616 -12.076 -5.749 1.00 0.00 H new ATOM 0 HA GLU A 100 -11.007 -12.598 -6.541 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -12.706 -10.037 -6.064 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -11.114 -9.947 -6.792 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -11.811 -11.429 -8.648 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -13.354 -11.740 -7.878 1.00 0.00 H new ATOM 1514 N LEU A 101 -11.345 -11.045 -3.702 1.00 0.00 N ATOM 1515 CA LEU A 101 -10.676 -10.701 -2.486 1.00 0.00 C ATOM 1516 C LEU A 101 -9.860 -11.770 -1.845 1.00 0.00 C ATOM 1517 O LEU A 101 -8.634 -11.715 -1.752 1.00 0.00 O ATOM 1518 CB LEU A 101 -11.662 -10.001 -1.535 1.00 0.00 C ATOM 1519 CG LEU A 101 -11.052 -9.257 -0.334 1.00 0.00 C ATOM 1520 CD1 LEU A 101 -10.331 -7.997 -0.841 1.00 0.00 C ATOM 1521 CD2 LEU A 101 -12.261 -8.739 0.464 1.00 0.00 C ATOM 0 H LEU A 101 -12.358 -10.937 -3.654 1.00 0.00 H new ATOM 0 HA LEU A 101 -9.891 -9.997 -2.763 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -12.247 -9.288 -2.116 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -12.357 -10.749 -1.155 1.00 0.00 H new ATOM 0 HG LEU A 101 -10.373 -9.897 0.229 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -9.895 -7.463 0.003 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -9.541 -8.284 -1.535 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -11.045 -7.350 -1.351 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -11.912 -8.194 1.341 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -12.854 -8.074 -0.164 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -12.876 -9.581 0.781 1.00 0.00 H new ATOM 1533 N ARG A 102 -10.445 -12.940 -1.535 1.00 0.00 N ATOM 1534 CA ARG A 102 -9.822 -14.160 -1.124 1.00 0.00 C ATOM 1535 C ARG A 102 -8.683 -14.581 -1.987 1.00 0.00 C ATOM 1536 O ARG A 102 -7.643 -14.937 -1.435 1.00 0.00 O ATOM 1537 CB ARG A 102 -10.938 -15.208 -1.278 1.00 0.00 C ATOM 1538 CG ARG A 102 -10.602 -16.596 -0.728 1.00 0.00 C ATOM 1539 CD ARG A 102 -11.780 -17.571 -0.678 1.00 0.00 C ATOM 1540 NE ARG A 102 -11.154 -18.743 -0.006 1.00 0.00 N ATOM 1541 CZ ARG A 102 -11.846 -19.530 0.869 1.00 0.00 C ATOM 1542 NH1 ARG A 102 -13.145 -19.276 1.204 1.00 0.00 N ATOM 1543 NH2 ARG A 102 -11.187 -20.608 1.386 1.00 0.00 N ATOM 0 H ARG A 102 -11.459 -13.039 -1.577 1.00 0.00 H new ATOM 0 HA ARG A 102 -9.411 -14.045 -0.121 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -11.832 -14.841 -0.775 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -11.184 -15.302 -2.336 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -9.813 -17.033 -1.341 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -10.199 -16.484 0.278 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -12.621 -17.172 -0.111 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -12.154 -17.817 -1.672 1.00 0.00 H new ATOM 0 HE ARG A 102 -10.179 -18.965 -0.205 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -13.630 -18.476 0.797 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -13.631 -19.886 1.862 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -10.222 -20.794 1.114 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -11.660 -21.227 2.044 1.00 0.00 H new ATOM 1557 N HIS A 103 -8.744 -14.492 -3.328 1.00 0.00 N ATOM 1558 CA HIS A 103 -7.657 -14.723 -4.228 1.00 0.00 C ATOM 1559 C HIS A 103 -6.396 -14.003 -3.893 1.00 0.00 C ATOM 1560 O HIS A 103 -5.362 -14.653 -3.745 1.00 0.00 O ATOM 1561 CB HIS A 103 -8.163 -14.349 -5.632 1.00 0.00 C ATOM 1562 CG HIS A 103 -7.245 -14.688 -6.769 1.00 0.00 C ATOM 1563 ND1 HIS A 103 -7.255 -15.958 -7.307 1.00 0.00 N ATOM 1564 CD2 HIS A 103 -6.265 -14.005 -7.419 1.00 0.00 C ATOM 1565 CE1 HIS A 103 -6.318 -15.963 -8.294 1.00 0.00 C ATOM 1566 NE2 HIS A 103 -5.694 -14.803 -8.389 1.00 0.00 N ATOM 0 H HIS A 103 -9.606 -14.243 -3.813 1.00 0.00 H new ATOM 0 HA HIS A 103 -7.370 -15.772 -4.159 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -9.117 -14.849 -5.799 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -8.357 -13.277 -5.654 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -5.976 -12.986 -7.207 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -6.109 -16.815 -8.925 1.00 0.00 H new ATOM 0 HE2 HIS A 103 -4.950 -14.551 -9.040 1.00 0.00 H new ATOM 1574 N VAL A 104 -6.451 -12.680 -3.659 1.00 0.00 N ATOM 1575 CA VAL A 104 -5.310 -11.847 -3.436 1.00 0.00 C ATOM 1576 C VAL A 104 -4.687 -12.224 -2.136 1.00 0.00 C ATOM 1577 O VAL A 104 -3.483 -12.341 -1.910 1.00 0.00 O ATOM 1578 CB VAL A 104 -5.440 -10.361 -3.593 1.00 0.00 C ATOM 1579 CG1 VAL A 104 -4.195 -9.496 -3.334 1.00 0.00 C ATOM 1580 CG2 VAL A 104 -6.008 -10.168 -5.009 1.00 0.00 C ATOM 0 H VAL A 104 -7.332 -12.167 -3.624 1.00 0.00 H new ATOM 0 HA VAL A 104 -4.662 -12.063 -4.286 1.00 0.00 H new ATOM 0 HB VAL A 104 -6.087 -9.989 -2.798 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -4.444 -8.446 -3.487 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -3.856 -9.644 -2.308 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -3.401 -9.785 -4.023 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -6.135 -9.104 -5.208 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -5.319 -10.594 -5.739 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -6.973 -10.669 -5.085 1.00 0.00 H new ATOM 1590 N MET A 105 -5.504 -12.559 -1.122 1.00 0.00 N ATOM 1591 CA MET A 105 -5.115 -12.970 0.192 1.00 0.00 C ATOM 1592 C MET A 105 -4.488 -14.321 0.216 1.00 0.00 C ATOM 1593 O MET A 105 -3.460 -14.482 0.871 1.00 0.00 O ATOM 1594 CB MET A 105 -6.447 -12.995 0.960 1.00 0.00 C ATOM 1595 CG MET A 105 -7.196 -11.701 1.282 1.00 0.00 C ATOM 1596 SD MET A 105 -8.149 -11.724 2.830 1.00 0.00 S ATOM 1597 CE MET A 105 -9.692 -12.308 2.071 1.00 0.00 C ATOM 0 H MET A 105 -6.518 -12.541 -1.231 1.00 0.00 H new ATOM 0 HA MET A 105 -4.363 -12.303 0.614 1.00 0.00 H new ATOM 0 HB2 MET A 105 -7.131 -13.627 0.393 1.00 0.00 H new ATOM 0 HB3 MET A 105 -6.259 -13.499 1.908 1.00 0.00 H new ATOM 0 HG2 MET A 105 -6.475 -10.885 1.330 1.00 0.00 H new ATOM 0 HG3 MET A 105 -7.875 -11.479 0.459 1.00 0.00 H new ATOM 0 HE1 MET A 105 -10.543 -11.923 2.633 1.00 0.00 H new ATOM 0 HE2 MET A 105 -9.748 -11.954 1.041 1.00 0.00 H new ATOM 0 HE3 MET A 105 -9.713 -13.398 2.082 1.00 0.00 H new ATOM 1607 N THR A 106 -4.952 -15.354 -0.510 1.00 0.00 N ATOM 1608 CA THR A 106 -4.321 -16.636 -0.559 1.00 0.00 C ATOM 1609 C THR A 106 -3.023 -16.608 -1.290 1.00 0.00 C ATOM 1610 O THR A 106 -2.055 -17.191 -0.804 1.00 0.00 O ATOM 1611 CB THR A 106 -5.214 -17.714 -1.097 1.00 0.00 C ATOM 1612 OG1 THR A 106 -6.222 -18.092 -0.172 1.00 0.00 O ATOM 1613 CG2 THR A 106 -4.499 -18.975 -1.612 1.00 0.00 C ATOM 0 H THR A 106 -5.795 -15.295 -1.082 1.00 0.00 H new ATOM 0 HA THR A 106 -4.110 -16.887 0.481 1.00 0.00 H new ATOM 0 HB THR A 106 -5.666 -17.240 -1.969 1.00 0.00 H new ATOM 0 HG1 THR A 106 -6.780 -18.795 -0.566 1.00 0.00 H new ATOM 0 HG21 THR A 106 -5.238 -19.688 -1.978 1.00 0.00 H new ATOM 0 HG22 THR A 106 -3.823 -18.704 -2.423 1.00 0.00 H new ATOM 0 HG23 THR A 106 -3.929 -19.427 -0.800 1.00 0.00 H new ATOM 1621 N ASN A 107 -2.884 -15.867 -2.404 1.00 0.00 N ATOM 1622 CA ASN A 107 -1.694 -15.544 -3.128 1.00 0.00 C ATOM 1623 C ASN A 107 -0.618 -14.908 -2.318 1.00 0.00 C ATOM 1624 O ASN A 107 0.523 -15.367 -2.276 1.00 0.00 O ATOM 1625 CB ASN A 107 -1.995 -14.581 -4.290 1.00 0.00 C ATOM 1626 CG ASN A 107 -2.838 -15.347 -5.300 1.00 0.00 C ATOM 1627 OD1 ASN A 107 -3.047 -16.553 -5.184 1.00 0.00 O ATOM 1628 ND2 ASN A 107 -3.349 -14.581 -6.301 1.00 0.00 N ATOM 0 H ASN A 107 -3.703 -15.448 -2.845 1.00 0.00 H new ATOM 0 HA ASN A 107 -1.336 -16.514 -3.474 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -2.529 -13.700 -3.932 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -1.071 -14.229 -4.748 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -3.945 -15.003 -7.013 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -3.136 -13.584 -6.340 1.00 0.00 H new ATOM 1635 N LEU A 108 -0.856 -13.823 -1.561 1.00 0.00 N ATOM 1636 CA LEU A 108 0.108 -13.247 -0.675 1.00 0.00 C ATOM 1637 C LEU A 108 0.452 -14.134 0.472 1.00 0.00 C ATOM 1638 O LEU A 108 1.615 -14.169 0.871 1.00 0.00 O ATOM 1639 CB LEU A 108 -0.436 -11.983 0.011 1.00 0.00 C ATOM 1640 CG LEU A 108 -0.871 -10.791 -0.859 1.00 0.00 C ATOM 1641 CD1 LEU A 108 -1.767 -9.810 -0.086 1.00 0.00 C ATOM 1642 CD2 LEU A 108 0.302 -9.970 -1.422 1.00 0.00 C ATOM 0 H LEU A 108 -1.749 -13.330 -1.565 1.00 0.00 H new ATOM 0 HA LEU A 108 0.967 -13.057 -1.318 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -1.293 -12.280 0.615 1.00 0.00 H new ATOM 0 HB3 LEU A 108 0.331 -11.626 0.699 1.00 0.00 H new ATOM 0 HG LEU A 108 -1.413 -11.256 -1.682 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -2.050 -8.984 -0.739 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -2.664 -10.327 0.255 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -1.223 -9.422 0.775 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -0.085 -9.148 -2.024 1.00 0.00 H new ATOM 0 HD22 LEU A 108 0.894 -9.570 -0.599 1.00 0.00 H new ATOM 0 HD23 LEU A 108 0.929 -10.610 -2.042 1.00 0.00 H new ATOM 1654 N GLY A 109 -0.468 -14.963 0.996 1.00 0.00 N ATOM 1655 CA GLY A 109 -0.119 -16.015 1.899 1.00 0.00 C ATOM 1656 C GLY A 109 -0.831 -15.877 3.200 1.00 0.00 C ATOM 1657 O GLY A 109 -0.222 -16.053 4.254 1.00 0.00 O ATOM 0 H GLY A 109 -1.465 -14.903 0.791 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -0.363 -16.978 1.450 1.00 0.00 H new ATOM 0 HA3 GLY A 109 0.958 -16.007 2.070 1.00 0.00 H new ATOM 1661 N GLU A 110 -2.142 -15.577 3.164 1.00 0.00 N ATOM 1662 CA GLU A 110 -2.867 -15.285 4.362 1.00 0.00 C ATOM 1663 C GLU A 110 -3.590 -16.489 4.858 1.00 0.00 C ATOM 1664 O GLU A 110 -4.078 -17.303 4.076 1.00 0.00 O ATOM 1665 CB GLU A 110 -3.868 -14.158 4.056 1.00 0.00 C ATOM 1666 CG GLU A 110 -4.801 -13.518 5.087 1.00 0.00 C ATOM 1667 CD GLU A 110 -3.964 -12.810 6.143 1.00 0.00 C ATOM 1668 OE1 GLU A 110 -3.295 -11.772 5.893 1.00 0.00 O ATOM 1669 OE2 GLU A 110 -4.048 -13.241 7.324 1.00 0.00 O ATOM 0 H GLU A 110 -2.698 -15.537 2.310 1.00 0.00 H new ATOM 0 HA GLU A 110 -2.170 -14.975 5.141 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -3.282 -13.342 3.633 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -4.511 -14.535 3.261 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -5.470 -12.809 4.600 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -5.427 -14.280 5.552 1.00 0.00 H new ATOM 1676 N LYS A 111 -3.748 -16.594 6.189 1.00 0.00 N ATOM 1677 CA LYS A 111 -4.425 -17.683 6.821 1.00 0.00 C ATOM 1678 C LYS A 111 -5.806 -17.227 7.142 1.00 0.00 C ATOM 1679 O LYS A 111 -6.147 -17.103 8.318 1.00 0.00 O ATOM 1680 CB LYS A 111 -3.684 -18.183 8.073 1.00 0.00 C ATOM 1681 CG LYS A 111 -2.190 -18.457 7.888 1.00 0.00 C ATOM 1682 CD LYS A 111 -1.558 -19.011 9.166 1.00 0.00 C ATOM 1683 CE LYS A 111 -0.036 -19.141 9.082 1.00 0.00 C ATOM 1684 NZ LYS A 111 0.356 -19.994 7.938 1.00 0.00 N ATOM 0 H LYS A 111 -3.394 -15.899 6.846 1.00 0.00 H new ATOM 0 HA LYS A 111 -4.457 -18.538 6.145 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -3.805 -17.444 8.865 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -4.164 -19.099 8.416 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -2.048 -19.167 7.073 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -1.683 -17.536 7.600 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -1.814 -18.360 10.002 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -1.988 -19.989 9.381 1.00 0.00 H new ATOM 0 HE2 LYS A 111 0.413 -18.153 8.976 1.00 0.00 H new ATOM 0 HE3 LYS A 111 0.349 -19.568 10.008 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 1.372 -20.208 7.997 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -0.187 -20.881 7.964 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 0.159 -19.493 7.048 1.00 0.00 H new ATOM 1698 N LEU A 112 -6.654 -16.948 6.136 1.00 0.00 N ATOM 1699 CA LEU A 112 -8.057 -16.669 6.160 1.00 0.00 C ATOM 1700 C LEU A 112 -8.937 -17.861 6.312 1.00 0.00 C ATOM 1701 O LEU A 112 -8.542 -18.996 6.049 1.00 0.00 O ATOM 1702 CB LEU A 112 -8.520 -15.935 4.890 1.00 0.00 C ATOM 1703 CG LEU A 112 -8.243 -16.695 3.582 1.00 0.00 C ATOM 1704 CD1 LEU A 112 -9.453 -17.474 3.042 1.00 0.00 C ATOM 1705 CD2 LEU A 112 -7.763 -15.801 2.426 1.00 0.00 C ATOM 0 H LEU A 112 -6.303 -16.915 5.179 1.00 0.00 H new ATOM 0 HA LEU A 112 -8.164 -16.047 7.049 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -9.590 -15.743 4.965 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -8.025 -14.965 4.844 1.00 0.00 H new ATOM 0 HG LEU A 112 -7.452 -17.381 3.886 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -9.176 -17.982 2.118 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -9.770 -18.211 3.780 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -10.272 -16.783 2.844 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -7.590 -16.413 1.541 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -8.523 -15.051 2.206 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -6.835 -15.305 2.711 1.00 0.00 H new ATOM 1717 N THR A 113 -10.157 -17.595 6.813 1.00 0.00 N ATOM 1718 CA THR A 113 -11.208 -18.562 6.737 1.00 0.00 C ATOM 1719 C THR A 113 -12.323 -18.099 5.864 1.00 0.00 C ATOM 1720 O THR A 113 -12.368 -16.999 5.314 1.00 0.00 O ATOM 1721 CB THR A 113 -11.739 -19.002 8.069 1.00 0.00 C ATOM 1722 OG1 THR A 113 -12.052 -17.842 8.826 1.00 0.00 O ATOM 1723 CG2 THR A 113 -10.689 -19.746 8.911 1.00 0.00 C ATOM 0 H THR A 113 -10.414 -16.719 7.267 1.00 0.00 H new ATOM 0 HA THR A 113 -10.743 -19.439 6.288 1.00 0.00 H new ATOM 0 HB THR A 113 -12.589 -19.654 7.869 1.00 0.00 H new ATOM 0 HG1 THR A 113 -12.403 -18.108 9.702 1.00 0.00 H new ATOM 0 HG21 THR A 113 -11.129 -20.041 9.864 1.00 0.00 H new ATOM 0 HG22 THR A 113 -10.356 -20.635 8.375 1.00 0.00 H new ATOM 0 HG23 THR A 113 -9.837 -19.091 9.092 1.00 0.00 H new ATOM 1731 N ASP A 114 -13.416 -18.850 5.641 1.00 0.00 N ATOM 1732 CA ASP A 114 -14.648 -18.408 5.064 1.00 0.00 C ATOM 1733 C ASP A 114 -15.173 -17.178 5.719 1.00 0.00 C ATOM 1734 O ASP A 114 -15.407 -16.204 5.005 1.00 0.00 O ATOM 1735 CB ASP A 114 -15.697 -19.531 5.008 1.00 0.00 C ATOM 1736 CG ASP A 114 -15.212 -20.713 4.179 1.00 0.00 C ATOM 1737 OD1 ASP A 114 -14.796 -20.510 3.007 1.00 0.00 O ATOM 1738 OD2 ASP A 114 -15.190 -21.847 4.728 1.00 0.00 O ATOM 0 H ASP A 114 -13.439 -19.841 5.883 1.00 0.00 H new ATOM 0 HA ASP A 114 -14.426 -18.135 4.032 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -15.926 -19.866 6.020 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -16.623 -19.144 4.583 1.00 0.00 H new ATOM 1743 N GLU A 115 -15.410 -17.236 7.042 1.00 0.00 N ATOM 1744 CA GLU A 115 -15.753 -16.181 7.944 1.00 0.00 C ATOM 1745 C GLU A 115 -14.998 -14.897 7.890 1.00 0.00 C ATOM 1746 O GLU A 115 -15.615 -13.835 7.949 1.00 0.00 O ATOM 1747 CB GLU A 115 -15.811 -16.641 9.410 1.00 0.00 C ATOM 1748 CG GLU A 115 -16.829 -17.756 9.662 1.00 0.00 C ATOM 1749 CD GLU A 115 -16.795 -17.975 11.167 1.00 0.00 C ATOM 1750 OE1 GLU A 115 -15.983 -18.824 11.622 1.00 0.00 O ATOM 1751 OE2 GLU A 115 -17.584 -17.333 11.911 1.00 0.00 O ATOM 0 H GLU A 115 -15.354 -18.128 7.533 1.00 0.00 H new ATOM 0 HA GLU A 115 -16.738 -15.937 7.546 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -14.823 -16.987 9.713 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -16.057 -15.787 10.041 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -17.825 -17.467 9.326 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -16.562 -18.665 9.123 1.00 0.00 H new ATOM 1758 N GLU A 116 -13.654 -14.944 7.877 1.00 0.00 N ATOM 1759 CA GLU A 116 -12.719 -13.886 7.652 1.00 0.00 C ATOM 1760 C GLU A 116 -13.044 -13.140 6.404 1.00 0.00 C ATOM 1761 O GLU A 116 -13.042 -11.911 6.447 1.00 0.00 O ATOM 1762 CB GLU A 116 -11.239 -14.268 7.485 1.00 0.00 C ATOM 1763 CG GLU A 116 -10.541 -14.710 8.773 1.00 0.00 C ATOM 1764 CD GLU A 116 -10.382 -13.586 9.786 1.00 0.00 C ATOM 1765 OE1 GLU A 116 -11.317 -13.194 10.534 1.00 0.00 O ATOM 1766 OE2 GLU A 116 -9.238 -13.057 9.776 1.00 0.00 O ATOM 0 H GLU A 116 -13.171 -15.827 8.044 1.00 0.00 H new ATOM 0 HA GLU A 116 -12.825 -13.316 8.575 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -11.166 -15.074 6.754 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -10.702 -13.414 7.072 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -11.110 -15.521 9.227 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -9.557 -15.110 8.527 1.00 0.00 H new ATOM 1773 N VAL A 117 -13.411 -13.778 5.278 1.00 0.00 N ATOM 1774 CA VAL A 117 -13.730 -13.104 4.057 1.00 0.00 C ATOM 1775 C VAL A 117 -15.078 -12.474 3.968 1.00 0.00 C ATOM 1776 O VAL A 117 -15.157 -11.319 3.553 1.00 0.00 O ATOM 1777 CB VAL A 117 -13.648 -14.028 2.879 1.00 0.00 C ATOM 1778 CG1 VAL A 117 -14.033 -13.329 1.564 1.00 0.00 C ATOM 1779 CG2 VAL A 117 -12.296 -14.744 2.716 1.00 0.00 C ATOM 0 H VAL A 117 -13.488 -14.793 5.215 1.00 0.00 H new ATOM 0 HA VAL A 117 -12.982 -12.311 4.047 1.00 0.00 H new ATOM 0 HB VAL A 117 -14.382 -14.802 3.103 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -13.958 -14.038 0.740 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -15.056 -12.960 1.634 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -13.357 -12.492 1.385 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -12.330 -15.390 1.839 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -11.505 -14.004 2.591 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -12.094 -15.345 3.602 1.00 0.00 H new ATOM 1789 N ASP A 118 -16.142 -13.024 4.579 1.00 0.00 N ATOM 1790 CA ASP A 118 -17.433 -12.533 4.951 1.00 0.00 C ATOM 1791 C ASP A 118 -17.309 -11.291 5.764 1.00 0.00 C ATOM 1792 O ASP A 118 -17.887 -10.255 5.439 1.00 0.00 O ATOM 1793 CB ASP A 118 -18.247 -13.595 5.708 1.00 0.00 C ATOM 1794 CG ASP A 118 -19.737 -13.350 5.901 1.00 0.00 C ATOM 1795 OD1 ASP A 118 -20.394 -13.388 4.826 1.00 0.00 O ATOM 1796 OD2 ASP A 118 -20.326 -13.174 7.001 1.00 0.00 O ATOM 0 H ASP A 118 -16.072 -14.001 4.862 1.00 0.00 H new ATOM 0 HA ASP A 118 -17.971 -12.297 4.033 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -18.130 -14.543 5.183 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -17.799 -13.719 6.694 1.00 0.00 H new ATOM 1801 N GLU A 119 -16.478 -11.352 6.819 1.00 0.00 N ATOM 1802 CA GLU A 119 -16.278 -10.224 7.675 1.00 0.00 C ATOM 1803 C GLU A 119 -15.622 -9.004 7.127 1.00 0.00 C ATOM 1804 O GLU A 119 -15.886 -7.864 7.506 1.00 0.00 O ATOM 1805 CB GLU A 119 -15.523 -10.714 8.923 1.00 0.00 C ATOM 1806 CG GLU A 119 -15.336 -9.708 10.060 1.00 0.00 C ATOM 1807 CD GLU A 119 -14.679 -10.427 11.229 1.00 0.00 C ATOM 1808 OE1 GLU A 119 -15.174 -11.490 11.690 1.00 0.00 O ATOM 1809 OE2 GLU A 119 -13.551 -10.035 11.633 1.00 0.00 O ATOM 0 H GLU A 119 -15.945 -12.182 7.080 1.00 0.00 H new ATOM 0 HA GLU A 119 -17.285 -9.857 7.873 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -16.052 -11.580 9.321 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -14.537 -11.058 8.610 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -14.717 -8.873 9.731 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -16.297 -9.292 10.361 1.00 0.00 H new ATOM 1816 N MET A 120 -14.677 -9.285 6.213 1.00 0.00 N ATOM 1817 CA MET A 120 -13.979 -8.378 5.356 1.00 0.00 C ATOM 1818 C MET A 120 -14.842 -7.584 4.438 1.00 0.00 C ATOM 1819 O MET A 120 -14.787 -6.356 4.395 1.00 0.00 O ATOM 1820 CB MET A 120 -12.859 -9.165 4.655 1.00 0.00 C ATOM 1821 CG MET A 120 -11.820 -8.198 4.084 1.00 0.00 C ATOM 1822 SD MET A 120 -10.315 -9.134 3.677 1.00 0.00 S ATOM 1823 CE MET A 120 -9.493 -7.746 2.844 1.00 0.00 C ATOM 0 H MET A 120 -14.373 -10.247 6.061 1.00 0.00 H new ATOM 0 HA MET A 120 -13.541 -7.588 5.966 1.00 0.00 H new ATOM 0 HB2 MET A 120 -12.385 -9.846 5.361 1.00 0.00 H new ATOM 0 HB3 MET A 120 -13.278 -9.776 3.855 1.00 0.00 H new ATOM 0 HG2 MET A 120 -12.211 -7.705 3.194 1.00 0.00 H new ATOM 0 HG3 MET A 120 -11.594 -7.415 4.808 1.00 0.00 H new ATOM 0 HE1 MET A 120 -8.902 -8.121 2.008 1.00 0.00 H new ATOM 0 HE2 MET A 120 -10.244 -7.048 2.473 1.00 0.00 H new ATOM 0 HE3 MET A 120 -8.839 -7.234 3.550 1.00 0.00 H new ATOM 1833 N ILE A 121 -15.841 -8.211 3.791 1.00 0.00 N ATOM 1834 CA ILE A 121 -16.856 -7.447 3.134 1.00 0.00 C ATOM 1835 C ILE A 121 -17.681 -6.614 4.054 1.00 0.00 C ATOM 1836 O ILE A 121 -17.942 -5.474 3.673 1.00 0.00 O ATOM 1837 CB ILE A 121 -17.779 -8.213 2.233 1.00 0.00 C ATOM 1838 CG1 ILE A 121 -16.986 -9.212 1.374 1.00 0.00 C ATOM 1839 CG2 ILE A 121 -18.728 -7.401 1.336 1.00 0.00 C ATOM 1840 CD1 ILE A 121 -16.207 -8.543 0.242 1.00 0.00 C ATOM 0 H ILE A 121 -15.946 -9.223 3.723 1.00 0.00 H new ATOM 0 HA ILE A 121 -16.246 -6.802 2.502 1.00 0.00 H new ATOM 0 HB ILE A 121 -18.444 -8.717 2.934 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -16.291 -9.759 2.012 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -17.674 -9.944 0.951 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -19.336 -8.081 0.739 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -19.377 -6.784 1.957 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -18.144 -6.761 0.674 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -15.669 -9.301 -0.327 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -16.900 -8.019 -0.416 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -15.496 -7.831 0.661 1.00 0.00 H new ATOM 1852 N ARG A 122 -18.112 -7.145 5.212 1.00 0.00 N ATOM 1853 CA ARG A 122 -18.957 -6.497 6.167 1.00 0.00 C ATOM 1854 C ARG A 122 -18.431 -5.312 6.901 1.00 0.00 C ATOM 1855 O ARG A 122 -19.041 -4.260 7.086 1.00 0.00 O ATOM 1856 CB ARG A 122 -19.446 -7.489 7.236 1.00 0.00 C ATOM 1857 CG ARG A 122 -20.393 -8.574 6.719 1.00 0.00 C ATOM 1858 CD ARG A 122 -21.120 -9.277 7.867 1.00 0.00 C ATOM 1859 NE ARG A 122 -21.692 -10.491 7.220 1.00 0.00 N ATOM 1860 CZ ARG A 122 -22.631 -10.475 6.229 1.00 0.00 C ATOM 1861 NH1 ARG A 122 -23.470 -9.419 6.017 1.00 0.00 N ATOM 1862 NH2 ARG A 122 -22.757 -11.616 5.491 1.00 0.00 N ATOM 0 H ARG A 122 -17.853 -8.089 5.499 1.00 0.00 H new ATOM 0 HA ARG A 122 -19.743 -6.117 5.514 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -18.579 -7.969 7.690 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -19.951 -6.932 8.025 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -21.123 -8.129 6.043 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -19.829 -9.306 6.142 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -20.437 -9.537 8.676 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -21.898 -8.646 8.296 1.00 0.00 H new ATOM 0 HE ARG A 122 -21.358 -11.400 7.541 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -23.411 -8.593 6.613 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -24.155 -9.456 5.262 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -22.166 -12.422 5.693 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -23.442 -11.663 4.737 1.00 0.00 H new ATOM 1876 N GLU A 123 -17.147 -5.369 7.298 1.00 0.00 N ATOM 1877 CA GLU A 123 -16.471 -4.262 7.899 1.00 0.00 C ATOM 1878 C GLU A 123 -16.222 -3.113 6.983 1.00 0.00 C ATOM 1879 O GLU A 123 -16.374 -1.944 7.333 1.00 0.00 O ATOM 1880 CB GLU A 123 -15.123 -4.716 8.483 1.00 0.00 C ATOM 1881 CG GLU A 123 -14.006 -5.147 7.531 1.00 0.00 C ATOM 1882 CD GLU A 123 -12.751 -5.577 8.277 1.00 0.00 C ATOM 1883 OE1 GLU A 123 -12.788 -6.324 9.291 1.00 0.00 O ATOM 1884 OE2 GLU A 123 -11.708 -4.958 7.934 1.00 0.00 O ATOM 0 H GLU A 123 -16.567 -6.202 7.199 1.00 0.00 H new ATOM 0 HA GLU A 123 -17.148 -3.908 8.676 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -14.738 -3.899 9.093 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -15.321 -5.550 9.156 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -14.358 -5.971 6.910 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -13.764 -4.323 6.860 1.00 0.00 H new ATOM 1891 N ALA A 124 -15.918 -3.395 5.703 1.00 0.00 N ATOM 1892 CA ALA A 124 -15.811 -2.431 4.652 1.00 0.00 C ATOM 1893 C ALA A 124 -17.144 -1.832 4.362 1.00 0.00 C ATOM 1894 O ALA A 124 -17.261 -0.613 4.482 1.00 0.00 O ATOM 1895 CB ALA A 124 -15.264 -3.015 3.338 1.00 0.00 C ATOM 0 H ALA A 124 -15.737 -4.347 5.385 1.00 0.00 H new ATOM 0 HA ALA A 124 -15.106 -1.682 5.013 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -15.210 -2.229 2.585 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -14.268 -3.424 3.508 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -15.926 -3.807 2.988 1.00 0.00 H new ATOM 1901 N ASP A 125 -18.162 -2.579 3.900 1.00 0.00 N ATOM 1902 CA ASP A 125 -19.400 -2.109 3.361 1.00 0.00 C ATOM 1903 C ASP A 125 -20.396 -1.622 4.357 1.00 0.00 C ATOM 1904 O ASP A 125 -21.014 -2.357 5.126 1.00 0.00 O ATOM 1905 CB ASP A 125 -19.983 -3.072 2.313 1.00 0.00 C ATOM 1906 CG ASP A 125 -20.867 -2.377 1.287 1.00 0.00 C ATOM 1907 OD1 ASP A 125 -20.634 -1.181 0.969 1.00 0.00 O ATOM 1908 OD2 ASP A 125 -21.791 -2.923 0.627 1.00 0.00 O ATOM 0 H ASP A 125 -18.113 -3.598 3.905 1.00 0.00 H new ATOM 0 HA ASP A 125 -19.136 -1.194 2.831 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -19.166 -3.576 1.797 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -20.563 -3.843 2.820 1.00 0.00 H new ATOM 1913 N ILE A 126 -20.783 -0.334 4.328 1.00 0.00 N ATOM 1914 CA ILE A 126 -21.827 0.203 5.143 1.00 0.00 C ATOM 1915 C ILE A 126 -23.160 -0.328 4.742 1.00 0.00 C ATOM 1916 O ILE A 126 -23.904 -0.833 5.581 1.00 0.00 O ATOM 1917 CB ILE A 126 -21.843 1.691 4.951 1.00 0.00 C ATOM 1918 CG1 ILE A 126 -20.486 2.271 5.381 1.00 0.00 C ATOM 1919 CG2 ILE A 126 -23.082 2.260 5.663 1.00 0.00 C ATOM 1920 CD1 ILE A 126 -20.309 2.367 6.896 1.00 0.00 C ATOM 0 H ILE A 126 -20.353 0.358 3.715 1.00 0.00 H new ATOM 0 HA ILE A 126 -21.640 -0.075 6.180 1.00 0.00 H new ATOM 0 HB ILE A 126 -21.949 1.984 3.907 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -19.690 1.651 4.970 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -20.372 3.265 4.947 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -23.111 3.342 5.534 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -23.982 1.820 5.234 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -23.032 2.022 6.726 1.00 0.00 H new ATOM 0 HD11 ILE A 126 -19.328 2.785 7.122 1.00 0.00 H new ATOM 0 HD12 ILE A 126 -21.083 3.012 7.313 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -20.390 1.373 7.335 1.00 0.00 H new ATOM 1932 N ASP A 127 -23.520 -0.388 3.447 1.00 0.00 N ATOM 1933 CA ASP A 127 -24.768 -0.807 2.890 1.00 0.00 C ATOM 1934 C ASP A 127 -24.848 -2.295 2.914 1.00 0.00 C ATOM 1935 O ASP A 127 -25.663 -2.820 3.671 1.00 0.00 O ATOM 1936 CB ASP A 127 -25.166 -0.200 1.534 1.00 0.00 C ATOM 1937 CG ASP A 127 -24.031 -0.456 0.552 1.00 0.00 C ATOM 1938 OD1 ASP A 127 -22.933 0.156 0.638 1.00 0.00 O ATOM 1939 OD2 ASP A 127 -24.152 -1.354 -0.323 1.00 0.00 O ATOM 0 H ASP A 127 -22.864 -0.113 2.716 1.00 0.00 H new ATOM 0 HA ASP A 127 -25.533 -0.383 3.540 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -26.091 -0.649 1.172 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -25.349 0.870 1.634 1.00 0.00 H new ATOM 1944 N GLY A 128 -24.077 -3.081 2.142 1.00 0.00 N ATOM 1945 CA GLY A 128 -24.391 -4.465 1.964 1.00 0.00 C ATOM 1946 C GLY A 128 -24.953 -4.935 0.666 1.00 0.00 C ATOM 1947 O GLY A 128 -25.818 -5.810 0.657 1.00 0.00 O ATOM 0 H GLY A 128 -23.245 -2.763 1.646 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -23.478 -5.032 2.148 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -25.100 -4.741 2.745 1.00 0.00 H new ATOM 1951 N ASP A 129 -24.402 -4.515 -0.486 1.00 0.00 N ATOM 1952 CA ASP A 129 -24.753 -5.100 -1.743 1.00 0.00 C ATOM 1953 C ASP A 129 -24.377 -6.528 -1.940 1.00 0.00 C ATOM 1954 O ASP A 129 -25.218 -7.392 -2.183 1.00 0.00 O ATOM 1955 CB ASP A 129 -24.303 -4.281 -2.965 1.00 0.00 C ATOM 1956 CG ASP A 129 -22.816 -3.972 -3.064 1.00 0.00 C ATOM 1957 OD1 ASP A 129 -22.272 -3.216 -2.216 1.00 0.00 O ATOM 1958 OD2 ASP A 129 -22.161 -4.577 -3.954 1.00 0.00 O ATOM 0 H ASP A 129 -23.711 -3.767 -0.547 1.00 0.00 H new ATOM 0 HA ASP A 129 -25.841 -5.076 -1.677 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -24.600 -4.819 -3.865 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -24.848 -3.337 -2.963 1.00 0.00 H new ATOM 1963 N GLY A 130 -23.068 -6.829 -1.885 1.00 0.00 N ATOM 1964 CA GLY A 130 -22.558 -8.119 -2.230 1.00 0.00 C ATOM 1965 C GLY A 130 -21.106 -7.936 -2.511 1.00 0.00 C ATOM 1966 O GLY A 130 -20.302 -8.793 -2.148 1.00 0.00 O ATOM 0 H GLY A 130 -22.350 -6.164 -1.596 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -22.710 -8.827 -1.415 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -23.075 -8.520 -3.102 1.00 0.00 H new ATOM 1970 N GLN A 131 -20.626 -6.882 -3.194 1.00 0.00 N ATOM 1971 CA GLN A 131 -19.245 -6.663 -3.493 1.00 0.00 C ATOM 1972 C GLN A 131 -18.775 -5.439 -2.785 1.00 0.00 C ATOM 1973 O GLN A 131 -19.541 -4.867 -2.011 1.00 0.00 O ATOM 1974 CB GLN A 131 -19.038 -6.402 -4.994 1.00 0.00 C ATOM 1975 CG GLN A 131 -19.654 -7.564 -5.776 1.00 0.00 C ATOM 1976 CD GLN A 131 -19.315 -7.433 -7.254 1.00 0.00 C ATOM 1977 OE1 GLN A 131 -18.312 -7.876 -7.810 1.00 0.00 O ATOM 1978 NE2 GLN A 131 -20.253 -6.794 -8.004 1.00 0.00 N ATOM 0 H GLN A 131 -21.232 -6.145 -3.556 1.00 0.00 H new ATOM 0 HA GLN A 131 -18.697 -7.553 -3.183 1.00 0.00 H new ATOM 0 HB2 GLN A 131 -19.505 -5.461 -5.283 1.00 0.00 H new ATOM 0 HB3 GLN A 131 -17.975 -6.313 -5.221 1.00 0.00 H new ATOM 0 HG2 GLN A 131 -19.279 -8.512 -5.391 1.00 0.00 H new ATOM 0 HG3 GLN A 131 -20.736 -7.571 -5.642 1.00 0.00 H new ATOM 0 HE21 GLN A 131 -21.092 -6.420 -7.561 1.00 0.00 H new ATOM 0 HE22 GLN A 131 -20.117 -6.689 -9.010 1.00 0.00 H new ATOM 1987 N VAL A 132 -17.525 -4.987 -2.988 1.00 0.00 N ATOM 1988 CA VAL A 132 -17.123 -3.675 -2.585 1.00 0.00 C ATOM 1989 C VAL A 132 -16.758 -2.882 -3.793 1.00 0.00 C ATOM 1990 O VAL A 132 -16.061 -3.338 -4.698 1.00 0.00 O ATOM 1991 CB VAL A 132 -15.947 -3.822 -1.665 1.00 0.00 C ATOM 1992 CG1 VAL A 132 -15.880 -2.509 -0.866 1.00 0.00 C ATOM 1993 CG2 VAL A 132 -16.185 -5.048 -0.767 1.00 0.00 C ATOM 0 H VAL A 132 -16.788 -5.534 -3.434 1.00 0.00 H new ATOM 0 HA VAL A 132 -17.929 -3.154 -2.068 1.00 0.00 H new ATOM 0 HB VAL A 132 -15.002 -3.985 -2.183 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -15.040 -2.548 -0.172 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -15.746 -1.672 -1.552 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -16.807 -2.375 -0.308 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -15.340 -5.172 -0.090 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -17.096 -4.903 -0.187 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -16.287 -5.939 -1.387 1.00 0.00 H new ATOM 2003 N ASN A 133 -17.233 -1.626 -3.875 1.00 0.00 N ATOM 2004 CA ASN A 133 -17.027 -0.736 -4.974 1.00 0.00 C ATOM 2005 C ASN A 133 -15.835 0.159 -4.987 1.00 0.00 C ATOM 2006 O ASN A 133 -14.939 0.080 -4.148 1.00 0.00 O ATOM 2007 CB ASN A 133 -18.322 -0.062 -5.459 1.00 0.00 C ATOM 2008 CG ASN A 133 -18.713 1.253 -4.801 1.00 0.00 C ATOM 2009 OD1 ASN A 133 -17.865 1.844 -4.134 1.00 0.00 O ATOM 2010 ND2 ASN A 133 -19.967 1.762 -4.935 1.00 0.00 N ATOM 0 H ASN A 133 -17.793 -1.209 -3.131 1.00 0.00 H new ATOM 0 HA ASN A 133 -16.708 -1.448 -5.736 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -18.231 0.111 -6.531 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -19.142 -0.766 -5.319 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -20.212 2.642 -4.480 1.00 0.00 H new ATOM 0 HD22 ASN A 133 -20.663 1.264 -5.490 1.00 0.00 H new ATOM 2017 N TYR A 134 -15.697 0.974 -6.048 1.00 0.00 N ATOM 2018 CA TYR A 134 -14.551 1.829 -6.068 1.00 0.00 C ATOM 2019 C TYR A 134 -14.432 2.814 -4.957 1.00 0.00 C ATOM 2020 O TYR A 134 -13.430 2.886 -4.247 1.00 0.00 O ATOM 2021 CB TYR A 134 -14.431 2.446 -7.472 1.00 0.00 C ATOM 2022 CG TYR A 134 -13.090 2.418 -8.121 1.00 0.00 C ATOM 2023 CD1 TYR A 134 -12.107 3.262 -7.660 1.00 0.00 C ATOM 2024 CD2 TYR A 134 -12.726 1.419 -8.992 1.00 0.00 C ATOM 2025 CE1 TYR A 134 -10.812 3.202 -8.120 1.00 0.00 C ATOM 2026 CE2 TYR A 134 -11.474 1.388 -9.558 1.00 0.00 C ATOM 2027 CZ TYR A 134 -10.547 2.310 -9.132 1.00 0.00 C ATOM 2028 OH TYR A 134 -9.196 2.033 -9.430 1.00 0.00 O ATOM 0 H TYR A 134 -16.332 1.043 -6.843 1.00 0.00 H new ATOM 0 HA TYR A 134 -13.683 1.203 -5.862 1.00 0.00 H new ATOM 0 HB2 TYR A 134 -15.133 1.931 -8.127 1.00 0.00 H new ATOM 0 HB3 TYR A 134 -14.755 3.485 -7.412 1.00 0.00 H new ATOM 0 HD1 TYR A 134 -12.361 3.997 -6.911 1.00 0.00 H new ATOM 0 HD2 TYR A 134 -13.437 0.644 -9.236 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -10.037 3.829 -7.704 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -11.225 0.660 -10.316 1.00 0.00 H new ATOM 0 HH TYR A 134 -9.149 1.386 -10.164 1.00 0.00 H new ATOM 2038 N GLU A 135 -15.464 3.675 -4.900 1.00 0.00 N ATOM 2039 CA GLU A 135 -15.509 4.603 -3.813 1.00 0.00 C ATOM 2040 C GLU A 135 -15.382 4.012 -2.451 1.00 0.00 C ATOM 2041 O GLU A 135 -14.736 4.594 -1.581 1.00 0.00 O ATOM 2042 CB GLU A 135 -16.674 5.603 -3.900 1.00 0.00 C ATOM 2043 CG GLU A 135 -16.438 6.970 -3.256 1.00 0.00 C ATOM 2044 CD GLU A 135 -15.269 7.646 -3.957 1.00 0.00 C ATOM 2045 OE1 GLU A 135 -15.278 7.661 -5.217 1.00 0.00 O ATOM 2046 OE2 GLU A 135 -14.448 8.335 -3.295 1.00 0.00 O ATOM 0 H GLU A 135 -16.232 3.731 -5.569 1.00 0.00 H new ATOM 0 HA GLU A 135 -14.589 5.171 -3.953 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -16.916 5.757 -4.952 1.00 0.00 H new ATOM 0 HB3 GLU A 135 -17.550 5.151 -3.434 1.00 0.00 H new ATOM 0 HG2 GLU A 135 -17.334 7.585 -3.337 1.00 0.00 H new ATOM 0 HG3 GLU A 135 -16.226 6.855 -2.193 1.00 0.00 H new ATOM 2053 N GLU A 136 -16.026 2.853 -2.225 1.00 0.00 N ATOM 2054 CA GLU A 136 -16.097 2.081 -1.024 1.00 0.00 C ATOM 2055 C GLU A 136 -14.835 1.471 -0.520 1.00 0.00 C ATOM 2056 O GLU A 136 -14.556 1.402 0.676 1.00 0.00 O ATOM 2057 CB GLU A 136 -17.150 0.960 -1.035 1.00 0.00 C ATOM 2058 CG GLU A 136 -18.576 1.512 -1.097 1.00 0.00 C ATOM 2059 CD GLU A 136 -19.718 0.644 -1.605 1.00 0.00 C ATOM 2060 OE1 GLU A 136 -19.660 -0.546 -2.016 1.00 0.00 O ATOM 2061 OE2 GLU A 136 -20.861 1.174 -1.591 1.00 0.00 O ATOM 0 H GLU A 136 -16.557 2.409 -2.974 1.00 0.00 H new ATOM 0 HA GLU A 136 -16.381 2.882 -0.342 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -16.976 0.308 -1.891 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -17.037 0.348 -0.140 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -18.840 1.835 -0.090 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -18.549 2.405 -1.721 1.00 0.00 H new ATOM 2068 N PHE A 137 -13.976 1.179 -1.513 1.00 0.00 N ATOM 2069 CA PHE A 137 -12.592 0.868 -1.333 1.00 0.00 C ATOM 2070 C PHE A 137 -11.811 2.116 -1.101 1.00 0.00 C ATOM 2071 O PHE A 137 -11.034 2.254 -0.158 1.00 0.00 O ATOM 2072 CB PHE A 137 -12.137 0.221 -2.652 1.00 0.00 C ATOM 2073 CG PHE A 137 -10.777 -0.389 -2.622 1.00 0.00 C ATOM 2074 CD1 PHE A 137 -9.654 0.372 -2.846 1.00 0.00 C ATOM 2075 CD2 PHE A 137 -10.656 -1.752 -2.492 1.00 0.00 C ATOM 2076 CE1 PHE A 137 -8.424 -0.233 -2.963 1.00 0.00 C ATOM 2077 CE2 PHE A 137 -9.413 -2.336 -2.436 1.00 0.00 C ATOM 2078 CZ PHE A 137 -8.310 -1.591 -2.780 1.00 0.00 C ATOM 0 H PHE A 137 -14.262 1.159 -2.492 1.00 0.00 H new ATOM 0 HA PHE A 137 -12.439 0.212 -0.476 1.00 0.00 H new ATOM 0 HB2 PHE A 137 -12.857 -0.549 -2.928 1.00 0.00 H new ATOM 0 HB3 PHE A 137 -12.162 0.977 -3.437 1.00 0.00 H new ATOM 0 HD1 PHE A 137 -9.738 1.445 -2.930 1.00 0.00 H new ATOM 0 HD2 PHE A 137 -11.542 -2.367 -2.434 1.00 0.00 H new ATOM 0 HE1 PHE A 137 -7.550 0.357 -3.198 1.00 0.00 H new ATOM 0 HE2 PHE A 137 -9.304 -3.365 -2.126 1.00 0.00 H new ATOM 0 HZ PHE A 137 -7.352 -2.073 -2.907 1.00 0.00 H new ATOM 2088 N VAL A 138 -11.946 3.170 -1.926 1.00 0.00 N ATOM 2089 CA VAL A 138 -11.025 4.262 -1.861 1.00 0.00 C ATOM 2090 C VAL A 138 -11.179 5.253 -0.759 1.00 0.00 C ATOM 2091 O VAL A 138 -10.171 5.670 -0.191 1.00 0.00 O ATOM 2092 CB VAL A 138 -11.006 4.990 -3.172 1.00 0.00 C ATOM 2093 CG1 VAL A 138 -10.012 6.153 -3.011 1.00 0.00 C ATOM 2094 CG2 VAL A 138 -10.551 4.134 -4.366 1.00 0.00 C ATOM 0 H VAL A 138 -12.680 3.266 -2.627 1.00 0.00 H new ATOM 0 HA VAL A 138 -10.082 3.766 -1.630 1.00 0.00 H new ATOM 0 HB VAL A 138 -12.026 5.304 -3.394 1.00 0.00 H new ATOM 0 HG11 VAL A 138 -9.960 6.718 -3.941 1.00 0.00 H new ATOM 0 HG12 VAL A 138 -10.346 6.808 -2.206 1.00 0.00 H new ATOM 0 HG13 VAL A 138 -9.025 5.758 -2.771 1.00 0.00 H new ATOM 0 HG21 VAL A 138 -10.567 4.738 -5.273 1.00 0.00 H new ATOM 0 HG22 VAL A 138 -9.538 3.771 -4.189 1.00 0.00 H new ATOM 0 HG23 VAL A 138 -11.225 3.285 -4.483 1.00 0.00 H new ATOM 2104 N GLN A 139 -12.405 5.521 -0.276 1.00 0.00 N ATOM 2105 CA GLN A 139 -12.728 6.319 0.866 1.00 0.00 C ATOM 2106 C GLN A 139 -12.418 5.580 2.122 1.00 0.00 C ATOM 2107 O GLN A 139 -12.165 6.208 3.148 1.00 0.00 O ATOM 2108 CB GLN A 139 -14.168 6.806 0.629 1.00 0.00 C ATOM 2109 CG GLN A 139 -14.640 7.837 1.657 1.00 0.00 C ATOM 2110 CD GLN A 139 -16.134 8.033 1.871 1.00 0.00 C ATOM 2111 OE1 GLN A 139 -16.755 7.351 2.685 1.00 0.00 O ATOM 2112 NE2 GLN A 139 -16.748 8.971 1.102 1.00 0.00 N ATOM 0 H GLN A 139 -13.241 5.146 -0.724 1.00 0.00 H new ATOM 0 HA GLN A 139 -12.119 7.213 0.999 1.00 0.00 H new ATOM 0 HB2 GLN A 139 -14.237 7.241 -0.368 1.00 0.00 H new ATOM 0 HB3 GLN A 139 -14.841 5.949 0.650 1.00 0.00 H new ATOM 0 HG2 GLN A 139 -14.202 7.568 2.618 1.00 0.00 H new ATOM 0 HG3 GLN A 139 -14.219 8.801 1.374 1.00 0.00 H new ATOM 0 HE21 GLN A 139 -16.204 9.520 0.436 1.00 0.00 H new ATOM 0 HE22 GLN A 139 -17.752 9.126 1.191 1.00 0.00 H new ATOM 2121 N MET A 140 -12.354 4.241 2.004 1.00 0.00 N ATOM 2122 CA MET A 140 -11.704 3.467 3.015 1.00 0.00 C ATOM 2123 C MET A 140 -10.239 3.725 3.097 1.00 0.00 C ATOM 2124 O MET A 140 -9.768 3.865 4.225 1.00 0.00 O ATOM 2125 CB MET A 140 -12.043 1.970 3.105 1.00 0.00 C ATOM 2126 CG MET A 140 -11.275 1.119 4.118 1.00 0.00 C ATOM 2127 SD MET A 140 -12.020 -0.536 4.216 1.00 0.00 S ATOM 2128 CE MET A 140 -12.019 -0.770 2.415 1.00 0.00 C ATOM 0 H MET A 140 -12.742 3.705 1.228 1.00 0.00 H new ATOM 0 HA MET A 140 -12.172 3.861 3.917 1.00 0.00 H new ATOM 0 HB2 MET A 140 -13.105 1.881 3.332 1.00 0.00 H new ATOM 0 HB3 MET A 140 -11.890 1.533 2.118 1.00 0.00 H new ATOM 0 HG2 MET A 140 -10.229 1.041 3.823 1.00 0.00 H new ATOM 0 HG3 MET A 140 -11.295 1.596 5.098 1.00 0.00 H new ATOM 0 HE1 MET A 140 -12.131 -1.830 2.186 1.00 0.00 H new ATOM 0 HE2 MET A 140 -12.847 -0.214 1.975 1.00 0.00 H new ATOM 0 HE3 MET A 140 -11.078 -0.407 2.001 1.00 0.00 H new ATOM 2138 N MET A 141 -9.471 3.571 2.003 1.00 0.00 N ATOM 2139 CA MET A 141 -8.044 3.657 1.975 1.00 0.00 C ATOM 2140 C MET A 141 -7.373 4.955 2.266 1.00 0.00 C ATOM 2141 O MET A 141 -6.237 4.982 2.737 1.00 0.00 O ATOM 2142 CB MET A 141 -7.360 3.007 0.761 1.00 0.00 C ATOM 2143 CG MET A 141 -7.763 1.543 0.571 1.00 0.00 C ATOM 2144 SD MET A 141 -6.521 0.481 -0.225 1.00 0.00 S ATOM 2145 CE MET A 141 -7.019 -1.069 0.581 1.00 0.00 C ATOM 0 H MET A 141 -9.870 3.375 1.085 1.00 0.00 H new ATOM 0 HA MET A 141 -7.884 3.053 2.868 1.00 0.00 H new ATOM 0 HB2 MET A 141 -7.613 3.569 -0.138 1.00 0.00 H new ATOM 0 HB3 MET A 141 -6.279 3.069 0.882 1.00 0.00 H new ATOM 0 HG2 MET A 141 -8.003 1.122 1.547 1.00 0.00 H new ATOM 0 HG3 MET A 141 -8.676 1.511 -0.023 1.00 0.00 H new ATOM 0 HE1 MET A 141 -6.379 -1.881 0.236 1.00 0.00 H new ATOM 0 HE2 MET A 141 -6.922 -0.965 1.662 1.00 0.00 H new ATOM 0 HE3 MET A 141 -8.056 -1.293 0.330 1.00 0.00 H new ATOM 2155 N THR A 142 -8.066 6.085 2.036 1.00 0.00 N ATOM 2156 CA THR A 142 -7.569 7.385 2.364 1.00 0.00 C ATOM 2157 C THR A 142 -7.755 7.692 3.843 1.00 0.00 C ATOM 2158 O THR A 142 -6.817 8.298 4.426 1.00 0.00 O ATOM 2159 CB THR A 142 -8.328 8.425 1.595 1.00 0.00 C ATOM 2160 OG1 THR A 142 -9.710 8.494 1.915 1.00 0.00 O ATOM 2161 CG2 THR A 142 -8.356 8.400 0.057 1.00 0.00 C ATOM 0 H THR A 142 -8.994 6.095 1.612 1.00 0.00 H new ATOM 0 HA THR A 142 -6.508 7.400 2.114 1.00 0.00 H new ATOM 0 HB THR A 142 -7.714 9.262 1.926 1.00 0.00 H new ATOM 0 HG1 THR A 142 -10.102 9.291 1.501 1.00 0.00 H new ATOM 0 HG21 THR A 142 -8.956 9.233 -0.310 1.00 0.00 H new ATOM 0 HG22 THR A 142 -7.340 8.489 -0.327 1.00 0.00 H new ATOM 0 HG23 THR A 142 -8.792 7.461 -0.284 1.00 0.00 H new ATOM 2170 N ARG B 1 -11.697 -2.361 8.895 1.00 0.00 N ATOM 2171 CA ARG B 1 -10.464 -1.676 8.445 1.00 0.00 C ATOM 2172 C ARG B 1 -9.168 -2.409 8.472 1.00 0.00 C ATOM 2173 O ARG B 1 -8.449 -2.478 7.476 1.00 0.00 O ATOM 2174 CB ARG B 1 -10.382 -0.340 9.202 1.00 0.00 C ATOM 2175 CG ARG B 1 -9.636 0.753 8.433 1.00 0.00 C ATOM 2176 CD ARG B 1 -9.482 2.082 9.174 1.00 0.00 C ATOM 2177 NE ARG B 1 -8.808 1.851 10.483 1.00 0.00 N ATOM 2178 CZ ARG B 1 -8.167 2.871 11.124 1.00 0.00 C ATOM 2179 NH1 ARG B 1 -8.423 4.174 10.805 1.00 0.00 N ATOM 2180 NH2 ARG B 1 -7.232 2.551 12.065 1.00 0.00 N ATOM 0 H1 ARG B 1 -12.523 -1.771 8.671 1.00 0.00 H new ATOM 0 H2 ARG B 1 -11.783 -3.276 8.408 1.00 0.00 H new ATOM 0 H3 ARG B 1 -11.652 -2.518 9.922 1.00 0.00 H new ATOM 0 HA ARG B 1 -10.584 -1.562 7.368 1.00 0.00 H new ATOM 0 HB2 ARG B 1 -11.392 0.006 9.422 1.00 0.00 H new ATOM 0 HB3 ARG B 1 -9.886 -0.503 10.159 1.00 0.00 H new ATOM 0 HG2 ARG B 1 -8.644 0.382 8.176 1.00 0.00 H new ATOM 0 HG3 ARG B 1 -10.160 0.937 7.495 1.00 0.00 H new ATOM 0 HD2 ARG B 1 -8.900 2.780 8.572 1.00 0.00 H new ATOM 0 HD3 ARG B 1 -10.460 2.537 9.333 1.00 0.00 H new ATOM 0 HE ARG B 1 -8.826 0.922 10.904 1.00 0.00 H new ATOM 0 HH11 ARG B 1 -9.102 4.397 10.078 1.00 0.00 H new ATOM 0 HH12 ARG B 1 -7.935 4.924 11.294 1.00 0.00 H new ATOM 0 HH21 ARG B 1 -7.030 1.573 12.271 1.00 0.00 H new ATOM 0 HH22 ARG B 1 -6.735 3.290 12.562 1.00 0.00 H new ATOM 2193 N ARG B 2 -8.740 -3.084 9.554 1.00 0.00 N ATOM 2194 CA ARG B 2 -7.488 -3.776 9.561 1.00 0.00 C ATOM 2195 C ARG B 2 -7.255 -4.801 8.505 1.00 0.00 C ATOM 2196 O ARG B 2 -6.198 -4.745 7.879 1.00 0.00 O ATOM 2197 CB ARG B 2 -7.269 -4.437 10.932 1.00 0.00 C ATOM 2198 CG ARG B 2 -5.838 -4.543 11.463 1.00 0.00 C ATOM 2199 CD ARG B 2 -5.578 -5.221 12.810 1.00 0.00 C ATOM 2200 NE ARG B 2 -4.130 -5.516 13.004 1.00 0.00 N ATOM 2201 CZ ARG B 2 -3.626 -6.056 14.152 1.00 0.00 C ATOM 2202 NH1 ARG B 2 -4.317 -6.028 15.329 1.00 0.00 N ATOM 2203 NH2 ARG B 2 -2.401 -6.652 14.067 1.00 0.00 N ATOM 0 H ARG B 2 -9.263 -3.151 10.427 1.00 0.00 H new ATOM 0 HA ARG B 2 -6.770 -2.986 9.339 1.00 0.00 H new ATOM 0 HB2 ARG B 2 -7.856 -3.885 11.666 1.00 0.00 H new ATOM 0 HB3 ARG B 2 -7.683 -5.444 10.886 1.00 0.00 H new ATOM 0 HG2 ARG B 2 -5.251 -5.073 10.713 1.00 0.00 H new ATOM 0 HG3 ARG B 2 -5.438 -3.531 11.525 1.00 0.00 H new ATOM 0 HD2 ARG B 2 -5.930 -4.577 13.616 1.00 0.00 H new ATOM 0 HD3 ARG B 2 -6.150 -6.147 12.868 1.00 0.00 H new ATOM 0 HE ARG B 2 -3.485 -5.304 12.243 1.00 0.00 H new ATOM 0 HH11 ARG B 2 -5.239 -5.594 15.369 1.00 0.00 H new ATOM 0 HH12 ARG B 2 -3.911 -6.441 16.169 1.00 0.00 H new ATOM 0 HH21 ARG B 2 -1.907 -6.678 13.175 1.00 0.00 H new ATOM 0 HH22 ARG B 2 -1.979 -7.071 14.896 1.00 0.00 H new ATOM 2217 N LYS B 3 -8.138 -5.744 8.131 1.00 0.00 N ATOM 2218 CA LYS B 3 -7.947 -6.708 7.092 1.00 0.00 C ATOM 2219 C LYS B 3 -7.566 -6.139 5.768 1.00 0.00 C ATOM 2220 O LYS B 3 -6.590 -6.676 5.245 1.00 0.00 O ATOM 2221 CB LYS B 3 -9.259 -7.483 6.883 1.00 0.00 C ATOM 2222 CG LYS B 3 -9.809 -8.249 8.087 1.00 0.00 C ATOM 2223 CD LYS B 3 -11.119 -8.978 7.783 1.00 0.00 C ATOM 2224 CE LYS B 3 -11.727 -9.688 8.994 1.00 0.00 C ATOM 2225 NZ LYS B 3 -11.978 -8.745 10.107 1.00 0.00 N ATOM 0 H LYS B 3 -9.046 -5.839 8.586 1.00 0.00 H new ATOM 0 HA LYS B 3 -7.120 -7.333 7.429 1.00 0.00 H new ATOM 0 HB2 LYS B 3 -10.021 -6.777 6.553 1.00 0.00 H new ATOM 0 HB3 LYS B 3 -9.108 -8.193 6.069 1.00 0.00 H new ATOM 0 HG2 LYS B 3 -9.066 -8.973 8.421 1.00 0.00 H new ATOM 0 HG3 LYS B 3 -9.969 -7.554 8.911 1.00 0.00 H new ATOM 0 HD2 LYS B 3 -11.841 -8.260 7.394 1.00 0.00 H new ATOM 0 HD3 LYS B 3 -10.942 -9.710 6.995 1.00 0.00 H new ATOM 0 HE2 LYS B 3 -12.662 -10.167 8.704 1.00 0.00 H new ATOM 0 HE3 LYS B 3 -11.055 -10.478 9.329 1.00 0.00 H new ATOM 0 HZ1 LYS B 3 -12.803 -9.065 10.654 1.00 0.00 H new ATOM 0 HZ2 LYS B 3 -11.144 -8.710 10.727 1.00 0.00 H new ATOM 0 HZ3 LYS B 3 -12.164 -7.796 9.723 1.00 0.00 H new ATOM 2239 N TRP B 4 -8.101 -4.996 5.304 1.00 0.00 N ATOM 2240 CA TRP B 4 -7.816 -4.342 4.064 1.00 0.00 C ATOM 2241 C TRP B 4 -6.480 -3.685 4.093 1.00 0.00 C ATOM 2242 O TRP B 4 -5.733 -3.926 3.146 1.00 0.00 O ATOM 2243 CB TRP B 4 -8.887 -3.273 3.788 1.00 0.00 C ATOM 2244 CG TRP B 4 -10.284 -3.821 3.619 1.00 0.00 C ATOM 2245 CD1 TRP B 4 -11.129 -4.126 4.647 1.00 0.00 C ATOM 2246 CD2 TRP B 4 -10.886 -4.231 2.377 1.00 0.00 C ATOM 2247 NE1 TRP B 4 -12.253 -4.683 4.097 1.00 0.00 N ATOM 2248 CE2 TRP B 4 -12.123 -4.782 2.731 1.00 0.00 C ATOM 2249 CE3 TRP B 4 -10.534 -4.181 1.056 1.00 0.00 C ATOM 2250 CZ2 TRP B 4 -13.024 -5.266 1.822 1.00 0.00 C ATOM 2251 CZ3 TRP B 4 -11.437 -4.663 0.138 1.00 0.00 C ATOM 2252 CH2 TRP B 4 -12.698 -5.075 0.500 1.00 0.00 C ATOM 0 H TRP B 4 -8.796 -4.484 5.847 1.00 0.00 H new ATOM 0 HA TRP B 4 -7.818 -5.097 3.278 1.00 0.00 H new ATOM 0 HB2 TRP B 4 -8.888 -2.556 4.609 1.00 0.00 H new ATOM 0 HB3 TRP B 4 -8.613 -2.725 2.886 1.00 0.00 H new ATOM 0 HD1 TRP B 4 -10.945 -3.959 5.698 1.00 0.00 H new ATOM 0 HE1 TRP B 4 -13.072 -4.983 4.626 1.00 0.00 H new ATOM 0 HE3 TRP B 4 -9.581 -3.778 0.745 1.00 0.00 H new ATOM 0 HZ2 TRP B 4 -13.933 -5.766 2.124 1.00 0.00 H new ATOM 0 HZ3 TRP B 4 -11.147 -4.720 -0.901 1.00 0.00 H new ATOM 0 HH2 TRP B 4 -13.441 -5.251 -0.263 1.00 0.00 H new ATOM 2263 N GLN B 5 -6.140 -2.863 5.102 1.00 0.00 N ATOM 2264 CA GLN B 5 -4.859 -2.243 5.246 1.00 0.00 C ATOM 2265 C GLN B 5 -3.708 -3.187 5.311 1.00 0.00 C ATOM 2266 O GLN B 5 -2.696 -3.138 4.614 1.00 0.00 O ATOM 2267 CB GLN B 5 -4.787 -1.408 6.535 1.00 0.00 C ATOM 2268 CG GLN B 5 -5.913 -0.374 6.603 1.00 0.00 C ATOM 2269 CD GLN B 5 -5.752 0.303 7.956 1.00 0.00 C ATOM 2270 OE1 GLN B 5 -5.229 -0.259 8.917 1.00 0.00 O ATOM 2271 NE2 GLN B 5 -6.008 1.633 8.078 1.00 0.00 N ATOM 0 H GLN B 5 -6.788 -2.620 5.851 1.00 0.00 H new ATOM 0 HA GLN B 5 -4.771 -1.638 4.344 1.00 0.00 H new ATOM 0 HB2 GLN B 5 -4.847 -2.068 7.400 1.00 0.00 H new ATOM 0 HB3 GLN B 5 -3.824 -0.901 6.587 1.00 0.00 H new ATOM 0 HG2 GLN B 5 -5.835 0.348 5.790 1.00 0.00 H new ATOM 0 HG3 GLN B 5 -6.890 -0.849 6.514 1.00 0.00 H new ATOM 0 HE21 GLN B 5 -6.441 2.142 7.307 1.00 0.00 H new ATOM 0 HE22 GLN B 5 -5.767 2.122 8.940 1.00 0.00 H new ATOM 2280 N LYS B 6 -3.824 -4.231 6.151 1.00 0.00 N ATOM 2281 CA LYS B 6 -2.928 -5.307 6.443 1.00 0.00 C ATOM 2282 C LYS B 6 -2.555 -5.970 5.162 1.00 0.00 C ATOM 2283 O LYS B 6 -1.386 -6.226 4.879 1.00 0.00 O ATOM 2284 CB LYS B 6 -3.528 -6.300 7.452 1.00 0.00 C ATOM 2285 CG LYS B 6 -2.567 -7.417 7.866 1.00 0.00 C ATOM 2286 CD LYS B 6 -2.808 -7.811 9.325 1.00 0.00 C ATOM 2287 CE LYS B 6 -4.172 -8.394 9.698 1.00 0.00 C ATOM 2288 NZ LYS B 6 -4.266 -9.769 9.158 1.00 0.00 N ATOM 0 H LYS B 6 -4.675 -4.329 6.704 1.00 0.00 H new ATOM 0 HA LYS B 6 -2.032 -4.911 6.920 1.00 0.00 H new ATOM 0 HB2 LYS B 6 -3.841 -5.754 8.342 1.00 0.00 H new ATOM 0 HB3 LYS B 6 -4.424 -6.746 7.020 1.00 0.00 H new ATOM 0 HG2 LYS B 6 -2.706 -8.284 7.220 1.00 0.00 H new ATOM 0 HG3 LYS B 6 -1.537 -7.086 7.737 1.00 0.00 H new ATOM 0 HD2 LYS B 6 -2.047 -8.539 9.604 1.00 0.00 H new ATOM 0 HD3 LYS B 6 -2.644 -6.927 9.941 1.00 0.00 H new ATOM 0 HE2 LYS B 6 -4.295 -8.405 10.781 1.00 0.00 H new ATOM 0 HE3 LYS B 6 -4.971 -7.774 9.293 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 -5.190 -10.177 9.405 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 -4.165 -9.743 8.123 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 -3.509 -10.354 9.565 1.00 0.00 H new ATOM 2302 N THR B 7 -3.557 -6.274 4.318 1.00 0.00 N ATOM 2303 CA THR B 7 -3.364 -6.834 3.016 1.00 0.00 C ATOM 2304 C THR B 7 -2.756 -5.904 2.023 1.00 0.00 C ATOM 2305 O THR B 7 -1.830 -6.228 1.282 1.00 0.00 O ATOM 2306 CB THR B 7 -4.662 -7.380 2.501 1.00 0.00 C ATOM 2307 OG1 THR B 7 -5.274 -8.416 3.255 1.00 0.00 O ATOM 2308 CG2 THR B 7 -4.414 -8.090 1.159 1.00 0.00 C ATOM 0 H THR B 7 -4.539 -6.124 4.551 1.00 0.00 H new ATOM 0 HA THR B 7 -2.635 -7.635 3.139 1.00 0.00 H new ATOM 0 HB THR B 7 -5.299 -6.496 2.499 1.00 0.00 H new ATOM 0 HG1 THR B 7 -5.780 -8.025 3.997 1.00 0.00 H new ATOM 0 HG21 THR B 7 -5.354 -8.489 0.779 1.00 0.00 H new ATOM 0 HG22 THR B 7 -4.006 -7.379 0.441 1.00 0.00 H new ATOM 0 HG23 THR B 7 -3.706 -8.906 1.304 1.00 0.00 H new ATOM 2316 N GLY B 8 -3.272 -4.662 2.024 1.00 0.00 N ATOM 2317 CA GLY B 8 -2.752 -3.678 1.126 1.00 0.00 C ATOM 2318 C GLY B 8 -1.322 -3.273 1.233 1.00 0.00 C ATOM 2319 O GLY B 8 -0.687 -2.985 0.220 1.00 0.00 O ATOM 0 H GLY B 8 -4.029 -4.344 2.629 1.00 0.00 H new ATOM 0 HA2 GLY B 8 -2.914 -4.043 0.112 1.00 0.00 H new ATOM 0 HA3 GLY B 8 -3.356 -2.778 1.241 1.00 0.00 H new ATOM 2323 N HIS B 9 -0.767 -3.254 2.458 1.00 0.00 N ATOM 2324 CA HIS B 9 0.555 -2.911 2.880 1.00 0.00 C ATOM 2325 C HIS B 9 1.515 -3.857 2.244 1.00 0.00 C ATOM 2326 O HIS B 9 2.596 -3.552 1.745 1.00 0.00 O ATOM 2327 CB HIS B 9 0.703 -3.058 4.404 1.00 0.00 C ATOM 2328 CG HIS B 9 1.905 -2.374 4.983 1.00 0.00 C ATOM 2329 ND1 HIS B 9 3.169 -2.177 4.520 1.00 0.00 N flip ATOM 2330 CD2 HIS B 9 1.864 -1.748 6.212 1.00 0.00 C flip ATOM 2331 CE1 HIS B 9 3.852 -1.344 5.382 1.00 0.00 C flip ATOM 2332 NE2 HIS B 9 3.049 -1.109 6.403 1.00 0.00 N flip ATOM 0 H HIS B 9 -1.333 -3.519 3.264 1.00 0.00 H new ATOM 0 HA HIS B 9 0.751 -1.878 2.594 1.00 0.00 H new ATOM 0 HB2 HIS B 9 -0.191 -2.659 4.883 1.00 0.00 H new ATOM 0 HB3 HIS B 9 0.751 -4.119 4.651 1.00 0.00 H new ATOM 0 HD1 HIS B 9 3.553 -2.583 3.667 1.00 0.00 H new ATOM 0 HD2 HIS B 9 1.034 -1.763 6.903 1.00 0.00 H new ATOM 0 HE1 HIS B 9 4.852 -0.958 5.247 1.00 0.00 H new ATOM 2340 N ALA B 10 1.138 -5.128 2.015 1.00 0.00 N ATOM 2341 CA ALA B 10 1.955 -6.084 1.334 1.00 0.00 C ATOM 2342 C ALA B 10 1.976 -5.825 -0.133 1.00 0.00 C ATOM 2343 O ALA B 10 3.064 -5.908 -0.700 1.00 0.00 O ATOM 2344 CB ALA B 10 1.456 -7.521 1.563 1.00 0.00 C ATOM 0 H ALA B 10 0.237 -5.502 2.313 1.00 0.00 H new ATOM 0 HA ALA B 10 2.960 -5.979 1.744 1.00 0.00 H new ATOM 0 HB1 ALA B 10 2.101 -8.219 1.030 1.00 0.00 H new ATOM 0 HB2 ALA B 10 1.477 -7.748 2.629 1.00 0.00 H new ATOM 0 HB3 ALA B 10 0.435 -7.615 1.192 1.00 0.00 H new ATOM 2350 N VAL B 11 0.804 -5.532 -0.726 1.00 0.00 N ATOM 2351 CA VAL B 11 0.645 -5.225 -2.113 1.00 0.00 C ATOM 2352 C VAL B 11 1.506 -4.041 -2.391 1.00 0.00 C ATOM 2353 O VAL B 11 2.384 -4.022 -3.252 1.00 0.00 O ATOM 2354 CB VAL B 11 -0.749 -4.858 -2.528 1.00 0.00 C ATOM 2355 CG1 VAL B 11 -0.794 -4.491 -4.021 1.00 0.00 C ATOM 2356 CG2 VAL B 11 -1.569 -6.124 -2.228 1.00 0.00 C ATOM 0 H VAL B 11 -0.076 -5.508 -0.211 1.00 0.00 H new ATOM 0 HA VAL B 11 0.908 -6.126 -2.667 1.00 0.00 H new ATOM 0 HB VAL B 11 -1.135 -3.985 -2.003 1.00 0.00 H new ATOM 0 HG11 VAL B 11 -1.814 -4.228 -4.300 1.00 0.00 H new ATOM 0 HG12 VAL B 11 -0.137 -3.642 -4.207 1.00 0.00 H new ATOM 0 HG13 VAL B 11 -0.463 -5.343 -4.615 1.00 0.00 H new ATOM 0 HG21 VAL B 11 -2.611 -5.955 -2.499 1.00 0.00 H new ATOM 0 HG22 VAL B 11 -1.174 -6.959 -2.807 1.00 0.00 H new ATOM 0 HG23 VAL B 11 -1.504 -6.356 -1.165 1.00 0.00 H new ATOM 2366 N ARG B 12 1.392 -2.983 -1.569 1.00 0.00 N ATOM 2367 CA ARG B 12 2.220 -1.822 -1.672 1.00 0.00 C ATOM 2368 C ARG B 12 3.679 -2.108 -1.580 1.00 0.00 C ATOM 2369 O ARG B 12 4.462 -1.505 -2.312 1.00 0.00 O ATOM 2370 CB ARG B 12 1.917 -0.920 -0.463 1.00 0.00 C ATOM 2371 CG ARG B 12 2.378 0.525 -0.660 1.00 0.00 C ATOM 2372 CD ARG B 12 1.855 1.376 0.499 1.00 0.00 C ATOM 2373 NE ARG B 12 2.268 2.767 0.161 1.00 0.00 N ATOM 2374 CZ ARG B 12 2.856 3.657 1.012 1.00 0.00 C ATOM 2375 NH1 ARG B 12 3.330 3.288 2.237 1.00 0.00 N ATOM 2376 NH2 ARG B 12 3.047 4.969 0.686 1.00 0.00 N ATOM 0 H ARG B 12 0.708 -2.933 -0.814 1.00 0.00 H new ATOM 0 HA ARG B 12 2.005 -1.380 -2.645 1.00 0.00 H new ATOM 0 HB2 ARG B 12 0.844 -0.929 -0.270 1.00 0.00 H new ATOM 0 HB3 ARG B 12 2.403 -1.333 0.421 1.00 0.00 H new ATOM 0 HG2 ARG B 12 3.466 0.571 -0.700 1.00 0.00 H new ATOM 0 HG3 ARG B 12 2.007 0.913 -1.609 1.00 0.00 H new ATOM 0 HD2 ARG B 12 0.772 1.296 0.592 1.00 0.00 H new ATOM 0 HD3 ARG B 12 2.281 1.056 1.450 1.00 0.00 H new ATOM 0 HE ARG B 12 2.096 3.083 -0.793 1.00 0.00 H new ATOM 0 HH11 ARG B 12 3.251 2.318 2.544 1.00 0.00 H new ATOM 0 HH12 ARG B 12 3.764 3.982 2.846 1.00 0.00 H new ATOM 0 HH21 ARG B 12 2.746 5.317 -0.224 1.00 0.00 H new ATOM 0 HH22 ARG B 12 3.491 5.601 1.352 1.00 0.00 H new ATOM 2390 N ALA B 13 4.143 -2.989 -0.676 1.00 0.00 N ATOM 2391 CA ALA B 13 5.519 -3.335 -0.502 1.00 0.00 C ATOM 2392 C ALA B 13 6.142 -3.939 -1.713 1.00 0.00 C ATOM 2393 O ALA B 13 7.221 -3.540 -2.147 1.00 0.00 O ATOM 2394 CB ALA B 13 5.617 -4.206 0.762 1.00 0.00 C ATOM 0 H ALA B 13 3.526 -3.485 -0.033 1.00 0.00 H new ATOM 0 HA ALA B 13 6.114 -2.432 -0.362 1.00 0.00 H new ATOM 0 HB1 ALA B 13 6.656 -4.491 0.928 1.00 0.00 H new ATOM 0 HB2 ALA B 13 5.253 -3.642 1.621 1.00 0.00 H new ATOM 0 HB3 ALA B 13 5.011 -5.103 0.634 1.00 0.00 H new ATOM 2400 N ILE B 14 5.586 -5.013 -2.303 1.00 0.00 N ATOM 2401 CA ILE B 14 6.074 -5.600 -3.511 1.00 0.00 C ATOM 2402 C ILE B 14 6.159 -4.638 -4.646 1.00 0.00 C ATOM 2403 O ILE B 14 7.064 -4.546 -5.475 1.00 0.00 O ATOM 2404 CB ILE B 14 5.288 -6.835 -3.836 1.00 0.00 C ATOM 2405 CG1 ILE B 14 5.925 -7.655 -4.971 1.00 0.00 C ATOM 2406 CG2 ILE B 14 3.768 -6.637 -3.962 1.00 0.00 C ATOM 2407 CD1 ILE B 14 7.308 -8.155 -4.556 1.00 0.00 C ATOM 0 H ILE B 14 4.767 -5.489 -1.924 1.00 0.00 H new ATOM 0 HA ILE B 14 7.109 -5.898 -3.341 1.00 0.00 H new ATOM 0 HB ILE B 14 5.362 -7.456 -2.943 1.00 0.00 H new ATOM 0 HG12 ILE B 14 5.285 -8.501 -5.220 1.00 0.00 H new ATOM 0 HG13 ILE B 14 6.007 -7.042 -5.869 1.00 0.00 H new ATOM 0 HG21 ILE B 14 3.295 -7.590 -4.198 1.00 0.00 H new ATOM 0 HG22 ILE B 14 3.371 -6.259 -3.020 1.00 0.00 H new ATOM 0 HG23 ILE B 14 3.559 -5.921 -4.757 1.00 0.00 H new ATOM 0 HD11 ILE B 14 7.745 -8.733 -5.370 1.00 0.00 H new ATOM 0 HD12 ILE B 14 7.950 -7.304 -4.330 1.00 0.00 H new ATOM 0 HD13 ILE B 14 7.217 -8.785 -3.671 1.00 0.00 H new ATOM 2419 N GLY B 15 5.127 -3.780 -4.730 1.00 0.00 N ATOM 2420 CA GLY B 15 4.798 -2.751 -5.667 1.00 0.00 C ATOM 2421 C GLY B 15 5.636 -1.525 -5.547 1.00 0.00 C ATOM 2422 O GLY B 15 5.678 -0.717 -6.473 1.00 0.00 O ATOM 0 H GLY B 15 4.403 -3.823 -4.012 1.00 0.00 H new ATOM 0 HA2 GLY B 15 4.899 -3.149 -6.677 1.00 0.00 H new ATOM 0 HA3 GLY B 15 3.751 -2.476 -5.535 1.00 0.00 H new ATOM 2426 N ARG B 16 6.460 -1.364 -4.496 1.00 0.00 N ATOM 2427 CA ARG B 16 7.249 -0.206 -4.214 1.00 0.00 C ATOM 2428 C ARG B 16 8.606 -0.419 -4.791 1.00 0.00 C ATOM 2429 O ARG B 16 9.336 0.518 -5.112 1.00 0.00 O ATOM 2430 CB ARG B 16 7.307 -0.107 -2.680 1.00 0.00 C ATOM 2431 CG ARG B 16 8.078 1.116 -2.179 1.00 0.00 C ATOM 2432 CD ARG B 16 7.521 2.516 -2.445 1.00 0.00 C ATOM 2433 NE ARG B 16 8.512 3.484 -1.896 1.00 0.00 N ATOM 2434 CZ ARG B 16 9.671 3.812 -2.538 1.00 0.00 C ATOM 2435 NH1 ARG B 16 9.898 3.705 -3.880 1.00 0.00 N ATOM 2436 NH2 ARG B 16 10.620 4.422 -1.769 1.00 0.00 N ATOM 0 H ARG B 16 6.582 -2.095 -3.795 1.00 0.00 H new ATOM 0 HA ARG B 16 6.840 0.710 -4.639 1.00 0.00 H new ATOM 0 HB2 ARG B 16 6.291 -0.073 -2.287 1.00 0.00 H new ATOM 0 HB3 ARG B 16 7.773 -1.009 -2.282 1.00 0.00 H new ATOM 0 HG2 ARG B 16 8.195 1.010 -1.100 1.00 0.00 H new ATOM 0 HG3 ARG B 16 9.077 1.073 -2.613 1.00 0.00 H new ATOM 0 HD2 ARG B 16 7.374 2.677 -3.513 1.00 0.00 H new ATOM 0 HD3 ARG B 16 6.550 2.643 -1.966 1.00 0.00 H new ATOM 0 HE ARG B 16 8.315 3.923 -0.997 1.00 0.00 H new ATOM 0 HH11 ARG B 16 9.164 3.353 -4.495 1.00 0.00 H new ATOM 0 HH12 ARG B 16 10.802 3.977 -4.268 1.00 0.00 H new ATOM 0 HH21 ARG B 16 10.437 4.604 -0.782 1.00 0.00 H new ATOM 0 HH22 ARG B 16 11.512 4.696 -2.181 1.00 0.00 H new