USER MOD reduce.3.24.130724 H: found=0, std=0, add=900, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 900 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 83 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0274) USER MOD Set 1.2: A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 68 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 104 TYR OH : rot 14:sc= 1.19 USER MOD Set 3.1: A 33 GLN : amide:sc= -0.767 K(o=-3.9,f=-4.7) USER MOD Set 3.2: A 36 ASN : amide:sc= -3.16 K(o=-3.9,f=-4.8!) USER MOD Set 4.1: A 30 GLN : amide:sc= 0 K(o=-1.3,f=-0.54) USER MOD Set 4.2: A 32 ASN : amide:sc= -1.33 X(o=-1.3,f=-1.8) USER MOD Set 5.1: A 12 TYR OH : rot 30:sc= 0 USER MOD Set 5.2: A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 11 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0575) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0.032 USER MOD Single : A 18 HIS : no HD1:sc= -0.0513 X(o=-0.051,f=-0.038) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot -124:sc= 1.17 USER MOD Single : A 53 LYS NZ :NH3+ -131:sc= -0.917 (180deg=-1.3) USER MOD Single : A 55 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0409) USER MOD Single : A 57 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 60 GLN : amide:sc= -0.0408 X(o=-0.041,f=0) USER MOD Single : A 61 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 63 THR OG1 : rot 180:sc= 0.00876 USER MOD Single : A 65 MET CE :methyl -134:sc= -1.53 (180deg=-1.7) USER MOD Single : A 67 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 69 GLN : amide:sc= -0.342 K(o=-0.34,f=-2.3!) USER MOD Single : A 73 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 75 GLN : amide:sc= -0.0231 X(o=-0.023,f=-0.16) USER MOD Single : A 76 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 MET CE :methyl -107:sc= -0.561 (180deg=-2.49!) USER MOD Single : A 91 ASN : amide:sc= -1.04 X(o=-1,f=-1.1!) USER MOD Single : A 93 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 100 ASN : amide:sc= -0.522 K(o=-0.52,f=0) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 LYS NZ :NH3+ -154:sc= -0.104 (180deg=-0.651) USER MOD Single : A 107 SER OG : rot -52:sc= 0.114 USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 10.502 28.227 4.045 1.00 0.00 N ATOM 2 CA GLY A 1 10.070 28.041 2.632 1.00 0.00 C ATOM 3 C GLY A 1 9.504 26.658 2.375 1.00 0.00 C ATOM 4 O GLY A 1 8.405 26.520 1.838 1.00 0.00 O ATOM 0 H1 GLY A 1 10.881 29.188 4.169 1.00 0.00 H new ATOM 0 H2 GLY A 1 9.688 28.092 4.678 1.00 0.00 H new ATOM 0 H3 GLY A 1 11.240 27.531 4.277 1.00 0.00 H new ATOM 0 HA2 GLY A 1 9.318 28.790 2.384 1.00 0.00 H new ATOM 0 HA3 GLY A 1 10.919 28.211 1.970 1.00 0.00 H new ATOM 10 N SER A 2 10.257 25.632 2.759 1.00 0.00 N ATOM 11 CA SER A 2 9.825 24.253 2.568 1.00 0.00 C ATOM 12 C SER A 2 9.791 23.505 3.897 1.00 0.00 C ATOM 13 O SER A 2 10.797 23.428 4.603 1.00 0.00 O ATOM 14 CB SER A 2 10.757 23.537 1.590 1.00 0.00 C ATOM 15 OG SER A 2 12.081 24.034 1.688 1.00 0.00 O ATOM 0 H SER A 2 11.169 25.730 3.204 1.00 0.00 H new ATOM 0 HA SER A 2 8.817 24.267 2.154 1.00 0.00 H new ATOM 0 HB2 SER A 2 10.751 22.467 1.795 1.00 0.00 H new ATOM 0 HB3 SER A 2 10.391 23.668 0.572 1.00 0.00 H new ATOM 0 HG SER A 2 12.657 23.558 1.054 1.00 0.00 H new ATOM 21 N SER A 3 8.629 22.956 4.233 1.00 0.00 N ATOM 22 CA SER A 3 8.464 22.215 5.477 1.00 0.00 C ATOM 23 C SER A 3 8.702 20.723 5.258 1.00 0.00 C ATOM 24 O SER A 3 7.777 19.977 4.936 1.00 0.00 O ATOM 25 CB SER A 3 7.062 22.440 6.048 1.00 0.00 C ATOM 26 OG SER A 3 6.990 22.025 7.402 1.00 0.00 O ATOM 0 H SER A 3 7.787 23.011 3.660 1.00 0.00 H new ATOM 0 HA SER A 3 9.203 22.582 6.189 1.00 0.00 H new ATOM 0 HB2 SER A 3 6.801 23.496 5.973 1.00 0.00 H new ATOM 0 HB3 SER A 3 6.332 21.888 5.456 1.00 0.00 H new ATOM 0 HG SER A 3 6.085 22.180 7.744 1.00 0.00 H new ATOM 32 N GLY A 4 9.947 20.297 5.436 1.00 0.00 N ATOM 33 CA GLY A 4 10.286 18.897 5.254 1.00 0.00 C ATOM 34 C GLY A 4 9.870 18.042 6.434 1.00 0.00 C ATOM 35 O GLY A 4 10.476 18.110 7.503 1.00 0.00 O ATOM 0 H GLY A 4 10.728 20.896 5.703 1.00 0.00 H new ATOM 0 HA2 GLY A 4 9.803 18.524 4.351 1.00 0.00 H new ATOM 0 HA3 GLY A 4 11.361 18.803 5.103 1.00 0.00 H new ATOM 39 N SER A 5 8.832 17.235 6.241 1.00 0.00 N ATOM 40 CA SER A 5 8.335 16.362 7.298 1.00 0.00 C ATOM 41 C SER A 5 9.170 15.089 7.390 1.00 0.00 C ATOM 42 O SER A 5 9.367 14.391 6.396 1.00 0.00 O ATOM 43 CB SER A 5 6.868 16.007 7.048 1.00 0.00 C ATOM 44 OG SER A 5 6.003 16.950 7.655 1.00 0.00 O ATOM 0 H SER A 5 8.319 17.167 5.362 1.00 0.00 H new ATOM 0 HA SER A 5 8.416 16.897 8.244 1.00 0.00 H new ATOM 0 HB2 SER A 5 6.677 15.972 5.975 1.00 0.00 H new ATOM 0 HB3 SER A 5 6.660 15.012 7.442 1.00 0.00 H new ATOM 0 HG SER A 5 5.072 16.701 7.479 1.00 0.00 H new ATOM 50 N SER A 6 9.657 14.792 8.590 1.00 0.00 N ATOM 51 CA SER A 6 10.471 13.603 8.813 1.00 0.00 C ATOM 52 C SER A 6 9.614 12.443 9.308 1.00 0.00 C ATOM 53 O SER A 6 8.667 12.638 10.070 1.00 0.00 O ATOM 54 CB SER A 6 11.580 13.900 9.824 1.00 0.00 C ATOM 55 OG SER A 6 12.591 12.907 9.778 1.00 0.00 O ATOM 0 H SER A 6 9.502 15.359 9.424 1.00 0.00 H new ATOM 0 HA SER A 6 10.922 13.319 7.862 1.00 0.00 H new ATOM 0 HB2 SER A 6 12.016 14.877 9.614 1.00 0.00 H new ATOM 0 HB3 SER A 6 11.158 13.948 10.828 1.00 0.00 H new ATOM 0 HG SER A 6 13.289 13.120 10.432 1.00 0.00 H new ATOM 61 N GLY A 7 9.952 11.235 8.870 1.00 0.00 N ATOM 62 CA GLY A 7 9.204 10.061 9.280 1.00 0.00 C ATOM 63 C GLY A 7 8.061 9.743 8.335 1.00 0.00 C ATOM 64 O GLY A 7 7.021 9.237 8.757 1.00 0.00 O ATOM 0 H GLY A 7 10.731 11.048 8.238 1.00 0.00 H new ATOM 0 HA2 GLY A 7 9.877 9.205 9.332 1.00 0.00 H new ATOM 0 HA3 GLY A 7 8.809 10.218 10.284 1.00 0.00 H new ATOM 68 N ILE A 8 8.255 10.039 7.055 1.00 0.00 N ATOM 69 CA ILE A 8 7.232 9.781 6.048 1.00 0.00 C ATOM 70 C ILE A 8 7.429 8.413 5.403 1.00 0.00 C ATOM 71 O ILE A 8 8.525 7.853 5.435 1.00 0.00 O ATOM 72 CB ILE A 8 7.238 10.860 4.950 1.00 0.00 C ATOM 73 CG1 ILE A 8 7.247 12.256 5.575 1.00 0.00 C ATOM 74 CG2 ILE A 8 6.036 10.691 4.033 1.00 0.00 C ATOM 75 CD1 ILE A 8 6.011 12.560 6.394 1.00 0.00 C ATOM 0 H ILE A 8 9.111 10.458 6.690 1.00 0.00 H new ATOM 0 HA ILE A 8 6.271 9.803 6.561 1.00 0.00 H new ATOM 0 HB ILE A 8 8.143 10.744 4.354 1.00 0.00 H new ATOM 0 HG12 ILE A 8 8.127 12.355 6.210 1.00 0.00 H new ATOM 0 HG13 ILE A 8 7.340 12.999 4.783 1.00 0.00 H new ATOM 0 HG21 ILE A 8 6.055 11.462 3.262 1.00 0.00 H new ATOM 0 HG22 ILE A 8 6.072 9.708 3.564 1.00 0.00 H new ATOM 0 HG23 ILE A 8 5.119 10.782 4.615 1.00 0.00 H new ATOM 0 HD11 ILE A 8 6.086 13.566 6.807 1.00 0.00 H new ATOM 0 HD12 ILE A 8 5.128 12.494 5.758 1.00 0.00 H new ATOM 0 HD13 ILE A 8 5.927 11.840 7.208 1.00 0.00 H new ATOM 87 N SER A 9 6.363 7.882 4.815 1.00 0.00 N ATOM 88 CA SER A 9 6.420 6.580 4.161 1.00 0.00 C ATOM 89 C SER A 9 6.798 5.487 5.156 1.00 0.00 C ATOM 90 O SER A 9 7.396 5.761 6.196 1.00 0.00 O ATOM 91 CB SER A 9 7.427 6.608 3.010 1.00 0.00 C ATOM 92 OG SER A 9 6.809 7.011 1.800 1.00 0.00 O ATOM 0 H SER A 9 5.449 8.333 4.778 1.00 0.00 H new ATOM 0 HA SER A 9 5.430 6.358 3.763 1.00 0.00 H new ATOM 0 HB2 SER A 9 8.241 7.292 3.251 1.00 0.00 H new ATOM 0 HB3 SER A 9 7.868 5.619 2.885 1.00 0.00 H new ATOM 0 HG SER A 9 7.475 7.022 1.081 1.00 0.00 H new ATOM 98 N LEU A 10 6.445 4.249 4.829 1.00 0.00 N ATOM 99 CA LEU A 10 6.747 3.114 5.695 1.00 0.00 C ATOM 100 C LEU A 10 7.841 2.243 5.086 1.00 0.00 C ATOM 101 O LEU A 10 7.934 2.106 3.866 1.00 0.00 O ATOM 102 CB LEU A 10 5.487 2.280 5.935 1.00 0.00 C ATOM 103 CG LEU A 10 4.647 2.709 7.139 1.00 0.00 C ATOM 104 CD1 LEU A 10 3.285 2.033 7.108 1.00 0.00 C ATOM 105 CD2 LEU A 10 5.374 2.390 8.437 1.00 0.00 C ATOM 0 H LEU A 10 5.950 4.005 3.971 1.00 0.00 H new ATOM 0 HA LEU A 10 7.105 3.500 6.649 1.00 0.00 H new ATOM 0 HB2 LEU A 10 4.864 2.325 5.042 1.00 0.00 H new ATOM 0 HB3 LEU A 10 5.779 1.238 6.067 1.00 0.00 H new ATOM 0 HG LEU A 10 4.495 3.787 7.087 1.00 0.00 H new ATOM 0 HD11 LEU A 10 2.702 2.350 7.972 1.00 0.00 H new ATOM 0 HD12 LEU A 10 2.761 2.312 6.194 1.00 0.00 H new ATOM 0 HD13 LEU A 10 3.415 0.951 7.135 1.00 0.00 H new ATOM 0 HD21 LEU A 10 4.762 2.702 9.283 1.00 0.00 H new ATOM 0 HD22 LEU A 10 5.557 1.317 8.497 1.00 0.00 H new ATOM 0 HD23 LEU A 10 6.325 2.922 8.462 1.00 0.00 H new ATOM 117 N LYS A 11 8.667 1.654 5.945 1.00 0.00 N ATOM 118 CA LYS A 11 9.755 0.795 5.492 1.00 0.00 C ATOM 119 C LYS A 11 9.740 -0.539 6.232 1.00 0.00 C ATOM 120 O LYS A 11 9.877 -0.584 7.455 1.00 0.00 O ATOM 121 CB LYS A 11 11.102 1.490 5.699 1.00 0.00 C ATOM 122 CG LYS A 11 11.254 2.772 4.897 1.00 0.00 C ATOM 123 CD LYS A 11 12.085 2.549 3.644 1.00 0.00 C ATOM 124 CE LYS A 11 13.558 2.836 3.891 1.00 0.00 C ATOM 125 NZ LYS A 11 14.435 1.795 3.288 1.00 0.00 N ATOM 0 H LYS A 11 8.604 1.756 6.958 1.00 0.00 H new ATOM 0 HA LYS A 11 9.613 0.602 4.429 1.00 0.00 H new ATOM 0 HB2 LYS A 11 11.226 1.717 6.758 1.00 0.00 H new ATOM 0 HB3 LYS A 11 11.902 0.803 5.425 1.00 0.00 H new ATOM 0 HG2 LYS A 11 10.269 3.148 4.620 1.00 0.00 H new ATOM 0 HG3 LYS A 11 11.724 3.536 5.516 1.00 0.00 H new ATOM 0 HD2 LYS A 11 11.966 1.520 3.306 1.00 0.00 H new ATOM 0 HD3 LYS A 11 11.718 3.192 2.844 1.00 0.00 H new ATOM 0 HE2 LYS A 11 13.813 3.811 3.475 1.00 0.00 H new ATOM 0 HE3 LYS A 11 13.743 2.889 4.964 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 15.427 2.102 3.344 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 14.319 0.901 3.806 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 14.172 1.654 2.292 1.00 0.00 H new ATOM 139 N TYR A 12 9.570 -1.623 5.482 1.00 0.00 N ATOM 140 CA TYR A 12 9.536 -2.959 6.068 1.00 0.00 C ATOM 141 C TYR A 12 10.042 -4.001 5.074 1.00 0.00 C ATOM 142 O TYR A 12 9.570 -4.070 3.939 1.00 0.00 O ATOM 143 CB TYR A 12 8.114 -3.308 6.512 1.00 0.00 C ATOM 144 CG TYR A 12 7.842 -3.004 7.968 1.00 0.00 C ATOM 145 CD1 TYR A 12 8.665 -3.508 8.969 1.00 0.00 C ATOM 146 CD2 TYR A 12 6.764 -2.214 8.343 1.00 0.00 C ATOM 147 CE1 TYR A 12 8.420 -3.232 10.300 1.00 0.00 C ATOM 148 CE2 TYR A 12 6.512 -1.933 9.673 1.00 0.00 C ATOM 149 CZ TYR A 12 7.343 -2.445 10.646 1.00 0.00 C ATOM 150 OH TYR A 12 7.095 -2.168 11.972 1.00 0.00 O ATOM 0 H TYR A 12 9.454 -1.603 4.469 1.00 0.00 H new ATOM 0 HA TYR A 12 10.192 -2.964 6.939 1.00 0.00 H new ATOM 0 HB2 TYR A 12 7.404 -2.756 5.896 1.00 0.00 H new ATOM 0 HB3 TYR A 12 7.936 -4.368 6.332 1.00 0.00 H new ATOM 0 HD1 TYR A 12 9.510 -4.125 8.701 1.00 0.00 H new ATOM 0 HD2 TYR A 12 6.111 -1.812 7.583 1.00 0.00 H new ATOM 0 HE1 TYR A 12 9.069 -3.631 11.066 1.00 0.00 H new ATOM 0 HE2 TYR A 12 5.669 -1.316 9.948 1.00 0.00 H new ATOM 0 HH TYR A 12 7.940 -2.161 12.468 1.00 0.00 H new ATOM 160 N THR A 13 11.003 -4.809 5.510 1.00 0.00 N ATOM 161 CA THR A 13 11.573 -5.847 4.660 1.00 0.00 C ATOM 162 C THR A 13 10.622 -7.035 4.541 1.00 0.00 C ATOM 163 O THR A 13 9.697 -7.184 5.339 1.00 0.00 O ATOM 164 CB THR A 13 12.919 -6.312 5.217 1.00 0.00 C ATOM 165 OG1 THR A 13 12.871 -6.407 6.629 1.00 0.00 O ATOM 166 CG2 THR A 13 14.065 -5.390 4.857 1.00 0.00 C ATOM 0 H THR A 13 11.403 -4.765 6.447 1.00 0.00 H new ATOM 0 HA THR A 13 11.726 -5.424 3.667 1.00 0.00 H new ATOM 0 HB THR A 13 13.100 -7.286 4.762 1.00 0.00 H new ATOM 0 HG1 THR A 13 13.741 -6.708 6.966 1.00 0.00 H new ATOM 0 HG21 THR A 13 14.991 -5.777 5.283 1.00 0.00 H new ATOM 0 HG22 THR A 13 14.160 -5.334 3.773 1.00 0.00 H new ATOM 0 HG23 THR A 13 13.870 -4.395 5.256 1.00 0.00 H new ATOM 174 N ALA A 14 10.856 -7.875 3.539 1.00 0.00 N ATOM 175 CA ALA A 14 10.021 -9.049 3.315 1.00 0.00 C ATOM 176 C ALA A 14 10.068 -9.994 4.509 1.00 0.00 C ATOM 177 O ALA A 14 9.073 -10.636 4.845 1.00 0.00 O ATOM 178 CB ALA A 14 10.458 -9.773 2.050 1.00 0.00 C ATOM 0 H ALA A 14 11.617 -7.765 2.869 1.00 0.00 H new ATOM 0 HA ALA A 14 8.991 -8.713 3.192 1.00 0.00 H new ATOM 0 HB1 ALA A 14 9.826 -10.648 1.895 1.00 0.00 H new ATOM 0 HB2 ALA A 14 10.365 -9.102 1.196 1.00 0.00 H new ATOM 0 HB3 ALA A 14 11.496 -10.089 2.152 1.00 0.00 H new ATOM 184 N ALA A 15 11.230 -10.074 5.150 1.00 0.00 N ATOM 185 CA ALA A 15 11.407 -10.941 6.308 1.00 0.00 C ATOM 186 C ALA A 15 10.484 -10.527 7.449 1.00 0.00 C ATOM 187 O ALA A 15 10.013 -11.368 8.215 1.00 0.00 O ATOM 188 CB ALA A 15 12.857 -10.921 6.765 1.00 0.00 C ATOM 0 H ALA A 15 12.063 -9.548 4.886 1.00 0.00 H new ATOM 0 HA ALA A 15 11.145 -11.957 6.014 1.00 0.00 H new ATOM 0 HB1 ALA A 15 12.975 -11.573 7.631 1.00 0.00 H new ATOM 0 HB2 ALA A 15 13.498 -11.272 5.956 1.00 0.00 H new ATOM 0 HB3 ALA A 15 13.139 -9.904 7.036 1.00 0.00 H new ATOM 194 N ARG A 16 10.231 -9.227 7.557 1.00 0.00 N ATOM 195 CA ARG A 16 9.364 -8.702 8.606 1.00 0.00 C ATOM 196 C ARG A 16 7.917 -9.125 8.379 1.00 0.00 C ATOM 197 O ARG A 16 7.319 -9.801 9.216 1.00 0.00 O ATOM 198 CB ARG A 16 9.460 -7.176 8.659 1.00 0.00 C ATOM 199 CG ARG A 16 10.593 -6.667 9.534 1.00 0.00 C ATOM 200 CD ARG A 16 10.267 -6.819 11.012 1.00 0.00 C ATOM 201 NE ARG A 16 11.432 -6.578 11.858 1.00 0.00 N ATOM 202 CZ ARG A 16 11.488 -6.894 13.150 1.00 0.00 C ATOM 203 NH1 ARG A 16 10.449 -7.462 13.747 1.00 0.00 N ATOM 204 NH2 ARG A 16 12.588 -6.642 13.847 1.00 0.00 N ATOM 0 H ARG A 16 10.614 -8.518 6.932 1.00 0.00 H new ATOM 0 HA ARG A 16 9.698 -9.114 9.559 1.00 0.00 H new ATOM 0 HB2 ARG A 16 9.594 -6.794 7.647 1.00 0.00 H new ATOM 0 HB3 ARG A 16 8.517 -6.774 9.030 1.00 0.00 H new ATOM 0 HG2 ARG A 16 11.507 -7.215 9.304 1.00 0.00 H new ATOM 0 HG3 ARG A 16 10.785 -5.618 9.309 1.00 0.00 H new ATOM 0 HD2 ARG A 16 9.473 -6.122 11.281 1.00 0.00 H new ATOM 0 HD3 ARG A 16 9.886 -7.823 11.198 1.00 0.00 H new ATOM 0 HE ARG A 16 12.251 -6.142 11.434 1.00 0.00 H new ATOM 0 HH11 ARG A 16 9.601 -7.659 13.216 1.00 0.00 H new ATOM 0 HH12 ARG A 16 10.498 -7.702 14.737 1.00 0.00 H new ATOM 0 HH21 ARG A 16 13.391 -6.206 13.393 1.00 0.00 H new ATOM 0 HH22 ARG A 16 12.631 -6.884 14.837 1.00 0.00 H new ATOM 218 N LEU A 17 7.360 -8.724 7.240 1.00 0.00 N ATOM 219 CA LEU A 17 5.982 -9.063 6.902 1.00 0.00 C ATOM 220 C LEU A 17 5.793 -10.575 6.834 1.00 0.00 C ATOM 221 O LEU A 17 4.716 -11.091 7.129 1.00 0.00 O ATOM 222 CB LEU A 17 5.591 -8.428 5.567 1.00 0.00 C ATOM 223 CG LEU A 17 5.820 -6.918 5.477 1.00 0.00 C ATOM 224 CD1 LEU A 17 5.763 -6.455 4.030 1.00 0.00 C ATOM 225 CD2 LEU A 17 4.795 -6.173 6.319 1.00 0.00 C ATOM 0 H LEU A 17 7.842 -8.164 6.536 1.00 0.00 H new ATOM 0 HA LEU A 17 5.336 -8.670 7.687 1.00 0.00 H new ATOM 0 HB2 LEU A 17 6.156 -8.914 4.772 1.00 0.00 H new ATOM 0 HB3 LEU A 17 4.537 -8.632 5.380 1.00 0.00 H new ATOM 0 HG LEU A 17 6.813 -6.696 5.868 1.00 0.00 H new ATOM 0 HD11 LEU A 17 5.928 -5.378 3.986 1.00 0.00 H new ATOM 0 HD12 LEU A 17 6.536 -6.965 3.454 1.00 0.00 H new ATOM 0 HD13 LEU A 17 4.784 -6.690 3.611 1.00 0.00 H new ATOM 0 HD21 LEU A 17 4.973 -5.100 6.243 1.00 0.00 H new ATOM 0 HD22 LEU A 17 3.792 -6.401 5.958 1.00 0.00 H new ATOM 0 HD23 LEU A 17 4.885 -6.483 7.360 1.00 0.00 H new ATOM 237 N HIS A 18 6.849 -11.280 6.442 1.00 0.00 N ATOM 238 CA HIS A 18 6.801 -12.734 6.334 1.00 0.00 C ATOM 239 C HIS A 18 6.740 -13.380 7.714 1.00 0.00 C ATOM 240 O HIS A 18 5.941 -14.286 7.950 1.00 0.00 O ATOM 241 CB HIS A 18 8.022 -13.250 5.569 1.00 0.00 C ATOM 242 CG HIS A 18 7.953 -14.710 5.246 1.00 0.00 C ATOM 243 ND1 HIS A 18 8.921 -15.613 5.628 1.00 0.00 N ATOM 244 CD2 HIS A 18 7.021 -15.425 4.571 1.00 0.00 C ATOM 245 CE1 HIS A 18 8.590 -16.819 5.203 1.00 0.00 C ATOM 246 NE2 HIS A 18 7.442 -16.732 4.559 1.00 0.00 N ATOM 0 H HIS A 18 7.749 -10.868 6.194 1.00 0.00 H new ATOM 0 HA HIS A 18 5.898 -13.004 5.787 1.00 0.00 H new ATOM 0 HB2 HIS A 18 8.125 -12.686 4.642 1.00 0.00 H new ATOM 0 HB3 HIS A 18 8.918 -13.059 6.160 1.00 0.00 H new ATOM 0 HD2 HIS A 18 6.116 -15.039 4.126 1.00 0.00 H new ATOM 0 HE1 HIS A 18 9.162 -17.722 5.357 1.00 0.00 H new ATOM 0 HE2 HIS A 18 6.947 -17.510 4.123 1.00 0.00 H new ATOM 255 N GLU A 19 7.589 -12.909 8.621 1.00 0.00 N ATOM 256 CA GLU A 19 7.632 -13.441 9.978 1.00 0.00 C ATOM 257 C GLU A 19 6.318 -13.178 10.707 1.00 0.00 C ATOM 258 O GLU A 19 5.767 -14.067 11.356 1.00 0.00 O ATOM 259 CB GLU A 19 8.794 -12.820 10.755 1.00 0.00 C ATOM 260 CG GLU A 19 10.142 -13.445 10.438 1.00 0.00 C ATOM 261 CD GLU A 19 10.286 -14.841 11.013 1.00 0.00 C ATOM 262 OE1 GLU A 19 9.584 -15.756 10.534 1.00 0.00 O ATOM 263 OE2 GLU A 19 11.103 -15.018 11.942 1.00 0.00 O ATOM 0 H GLU A 19 8.257 -12.159 8.441 1.00 0.00 H new ATOM 0 HA GLU A 19 7.782 -14.519 9.915 1.00 0.00 H new ATOM 0 HB2 GLU A 19 8.837 -11.753 10.536 1.00 0.00 H new ATOM 0 HB3 GLU A 19 8.600 -12.919 11.823 1.00 0.00 H new ATOM 0 HG2 GLU A 19 10.274 -13.486 9.357 1.00 0.00 H new ATOM 0 HG3 GLU A 19 10.935 -12.810 10.833 1.00 0.00 H new ATOM 270 N LYS A 20 5.823 -11.950 10.597 1.00 0.00 N ATOM 271 CA LYS A 20 4.574 -11.567 11.246 1.00 0.00 C ATOM 272 C LYS A 20 3.415 -12.420 10.744 1.00 0.00 C ATOM 273 O LYS A 20 2.479 -12.712 11.488 1.00 0.00 O ATOM 274 CB LYS A 20 4.278 -10.087 10.997 1.00 0.00 C ATOM 275 CG LYS A 20 5.318 -9.151 11.591 1.00 0.00 C ATOM 276 CD LYS A 20 4.980 -7.694 11.311 1.00 0.00 C ATOM 277 CE LYS A 20 5.465 -6.787 12.430 1.00 0.00 C ATOM 278 NZ LYS A 20 4.373 -6.451 13.385 1.00 0.00 N ATOM 0 H LYS A 20 6.268 -11.202 10.064 1.00 0.00 H new ATOM 0 HA LYS A 20 4.686 -11.733 12.317 1.00 0.00 H new ATOM 0 HB2 LYS A 20 4.216 -9.913 9.923 1.00 0.00 H new ATOM 0 HB3 LYS A 20 3.301 -9.845 11.416 1.00 0.00 H new ATOM 0 HG2 LYS A 20 5.381 -9.311 12.667 1.00 0.00 H new ATOM 0 HG3 LYS A 20 6.299 -9.385 11.176 1.00 0.00 H new ATOM 0 HD2 LYS A 20 5.435 -7.388 10.369 1.00 0.00 H new ATOM 0 HD3 LYS A 20 3.902 -7.585 11.194 1.00 0.00 H new ATOM 0 HE2 LYS A 20 6.279 -7.275 12.966 1.00 0.00 H new ATOM 0 HE3 LYS A 20 5.870 -5.869 12.004 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 4.744 -5.831 14.133 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 3.607 -5.962 12.879 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 4.004 -7.325 13.811 1.00 0.00 H new ATOM 292 N GLY A 21 3.483 -12.818 9.478 1.00 0.00 N ATOM 293 CA GLY A 21 2.432 -13.634 8.899 1.00 0.00 C ATOM 294 C GLY A 21 1.789 -12.987 7.687 1.00 0.00 C ATOM 295 O GLY A 21 1.165 -13.665 6.872 1.00 0.00 O ATOM 0 H GLY A 21 4.247 -12.590 8.842 1.00 0.00 H new ATOM 0 HA2 GLY A 21 2.845 -14.602 8.613 1.00 0.00 H new ATOM 0 HA3 GLY A 21 1.668 -13.824 9.653 1.00 0.00 H new ATOM 299 N VAL A 22 1.941 -11.670 7.566 1.00 0.00 N ATOM 300 CA VAL A 22 1.370 -10.934 6.444 1.00 0.00 C ATOM 301 C VAL A 22 1.830 -11.514 5.111 1.00 0.00 C ATOM 302 O VAL A 22 1.032 -12.069 4.355 1.00 0.00 O ATOM 303 CB VAL A 22 1.747 -9.442 6.499 1.00 0.00 C ATOM 304 CG1 VAL A 22 0.978 -8.657 5.448 1.00 0.00 C ATOM 305 CG2 VAL A 22 1.495 -8.878 7.889 1.00 0.00 C ATOM 0 H VAL A 22 2.455 -11.092 8.231 1.00 0.00 H new ATOM 0 HA VAL A 22 0.287 -11.031 6.524 1.00 0.00 H new ATOM 0 HB VAL A 22 2.811 -9.347 6.282 1.00 0.00 H new ATOM 0 HG11 VAL A 22 1.258 -7.605 5.503 1.00 0.00 H new ATOM 0 HG12 VAL A 22 1.216 -9.045 4.458 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -0.092 -8.758 5.629 1.00 0.00 H new ATOM 0 HG21 VAL A 22 1.767 -7.823 7.908 1.00 0.00 H new ATOM 0 HG22 VAL A 22 0.440 -8.985 8.139 1.00 0.00 H new ATOM 0 HG23 VAL A 22 2.097 -9.422 8.617 1.00 0.00 H new ATOM 315 N LEU A 23 3.123 -11.382 4.827 1.00 0.00 N ATOM 316 CA LEU A 23 3.688 -11.896 3.584 1.00 0.00 C ATOM 317 C LEU A 23 3.690 -13.421 3.579 1.00 0.00 C ATOM 318 O LEU A 23 4.012 -14.055 4.583 1.00 0.00 O ATOM 319 CB LEU A 23 5.112 -11.370 3.393 1.00 0.00 C ATOM 320 CG LEU A 23 5.582 -11.290 1.939 1.00 0.00 C ATOM 321 CD1 LEU A 23 4.828 -10.200 1.195 1.00 0.00 C ATOM 322 CD2 LEU A 23 7.082 -11.041 1.878 1.00 0.00 C ATOM 0 H LEU A 23 3.798 -10.924 5.440 1.00 0.00 H new ATOM 0 HA LEU A 23 3.067 -11.549 2.758 1.00 0.00 H new ATOM 0 HB2 LEU A 23 5.179 -10.376 3.836 1.00 0.00 H new ATOM 0 HB3 LEU A 23 5.798 -12.012 3.946 1.00 0.00 H new ATOM 0 HG LEU A 23 5.372 -12.244 1.455 1.00 0.00 H new ATOM 0 HD11 LEU A 23 5.175 -10.157 0.163 1.00 0.00 H new ATOM 0 HD12 LEU A 23 3.761 -10.421 1.210 1.00 0.00 H new ATOM 0 HD13 LEU A 23 5.007 -9.239 1.678 1.00 0.00 H new ATOM 0 HD21 LEU A 23 7.400 -10.987 0.837 1.00 0.00 H new ATOM 0 HD22 LEU A 23 7.315 -10.101 2.378 1.00 0.00 H new ATOM 0 HD23 LEU A 23 7.607 -11.857 2.376 1.00 0.00 H new ATOM 334 N LEU A 24 3.329 -14.004 2.440 1.00 0.00 N ATOM 335 CA LEU A 24 3.289 -15.456 2.305 1.00 0.00 C ATOM 336 C LEU A 24 4.552 -15.976 1.624 1.00 0.00 C ATOM 337 O LEU A 24 5.409 -16.584 2.266 1.00 0.00 O ATOM 338 CB LEU A 24 2.054 -15.883 1.510 1.00 0.00 C ATOM 339 CG LEU A 24 0.715 -15.487 2.133 1.00 0.00 C ATOM 340 CD1 LEU A 24 -0.440 -16.022 1.298 1.00 0.00 C ATOM 341 CD2 LEU A 24 0.622 -15.996 3.563 1.00 0.00 C ATOM 0 H LEU A 24 3.060 -13.494 1.598 1.00 0.00 H new ATOM 0 HA LEU A 24 3.235 -15.886 3.305 1.00 0.00 H new ATOM 0 HB2 LEU A 24 2.115 -15.449 0.512 1.00 0.00 H new ATOM 0 HB3 LEU A 24 2.075 -16.966 1.389 1.00 0.00 H new ATOM 0 HG LEU A 24 0.651 -14.399 2.151 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -1.385 -15.731 1.756 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -0.382 -15.609 0.291 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -0.380 -17.109 1.249 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -0.337 -15.705 3.991 1.00 0.00 H new ATOM 0 HD22 LEU A 24 0.707 -17.083 3.569 1.00 0.00 H new ATOM 0 HD23 LEU A 24 1.429 -15.565 4.156 1.00 0.00 H new ATOM 353 N GLU A 25 4.660 -15.733 0.322 1.00 0.00 N ATOM 354 CA GLU A 25 5.818 -16.178 -0.444 1.00 0.00 C ATOM 355 C GLU A 25 5.983 -15.349 -1.714 1.00 0.00 C ATOM 356 O GLU A 25 5.197 -14.440 -1.980 1.00 0.00 O ATOM 357 CB GLU A 25 5.680 -17.659 -0.805 1.00 0.00 C ATOM 358 CG GLU A 25 6.009 -18.597 0.345 1.00 0.00 C ATOM 359 CD GLU A 25 6.073 -20.049 -0.088 1.00 0.00 C ATOM 360 OE1 GLU A 25 5.049 -20.567 -0.583 1.00 0.00 O ATOM 361 OE2 GLU A 25 7.146 -20.668 0.068 1.00 0.00 O ATOM 0 H GLU A 25 3.960 -15.231 -0.224 1.00 0.00 H new ATOM 0 HA GLU A 25 6.704 -16.042 0.176 1.00 0.00 H new ATOM 0 HB2 GLU A 25 4.660 -17.850 -1.139 1.00 0.00 H new ATOM 0 HB3 GLU A 25 6.337 -17.883 -1.645 1.00 0.00 H new ATOM 0 HG2 GLU A 25 6.965 -18.309 0.782 1.00 0.00 H new ATOM 0 HG3 GLU A 25 5.256 -18.487 1.126 1.00 0.00 H new ATOM 368 N ILE A 26 7.010 -15.671 -2.492 1.00 0.00 N ATOM 369 CA ILE A 26 7.281 -14.958 -3.734 1.00 0.00 C ATOM 370 C ILE A 26 7.715 -15.920 -4.834 1.00 0.00 C ATOM 371 O ILE A 26 8.549 -16.799 -4.611 1.00 0.00 O ATOM 372 CB ILE A 26 8.375 -13.890 -3.539 1.00 0.00 C ATOM 373 CG1 ILE A 26 8.064 -13.029 -2.314 1.00 0.00 C ATOM 374 CG2 ILE A 26 8.498 -13.026 -4.785 1.00 0.00 C ATOM 375 CD1 ILE A 26 9.101 -11.960 -2.047 1.00 0.00 C ATOM 0 H ILE A 26 7.669 -16.422 -2.284 1.00 0.00 H new ATOM 0 HA ILE A 26 6.353 -14.468 -4.029 1.00 0.00 H new ATOM 0 HB ILE A 26 9.328 -14.392 -3.373 1.00 0.00 H new ATOM 0 HG12 ILE A 26 7.092 -12.555 -2.451 1.00 0.00 H new ATOM 0 HG13 ILE A 26 7.984 -13.673 -1.438 1.00 0.00 H new ATOM 0 HG21 ILE A 26 9.274 -12.276 -4.633 1.00 0.00 H new ATOM 0 HG22 ILE A 26 8.761 -13.652 -5.638 1.00 0.00 H new ATOM 0 HG23 ILE A 26 7.547 -12.530 -4.979 1.00 0.00 H new ATOM 0 HD11 ILE A 26 8.815 -11.388 -1.164 1.00 0.00 H new ATOM 0 HD12 ILE A 26 10.071 -12.428 -1.878 1.00 0.00 H new ATOM 0 HD13 ILE A 26 9.165 -11.292 -2.906 1.00 0.00 H new ATOM 387 N GLU A 27 7.143 -15.751 -6.022 1.00 0.00 N ATOM 388 CA GLU A 27 7.471 -16.607 -7.156 1.00 0.00 C ATOM 389 C GLU A 27 8.687 -16.071 -7.908 1.00 0.00 C ATOM 390 O GLU A 27 8.634 -15.845 -9.117 1.00 0.00 O ATOM 391 CB GLU A 27 6.274 -16.713 -8.104 1.00 0.00 C ATOM 392 CG GLU A 27 5.236 -17.731 -7.660 1.00 0.00 C ATOM 393 CD GLU A 27 5.663 -19.159 -7.938 1.00 0.00 C ATOM 394 OE1 GLU A 27 5.718 -19.540 -9.126 1.00 0.00 O ATOM 395 OE2 GLU A 27 5.942 -19.895 -6.968 1.00 0.00 O ATOM 0 H GLU A 27 6.451 -15.030 -6.224 1.00 0.00 H new ATOM 0 HA GLU A 27 7.712 -17.599 -6.774 1.00 0.00 H new ATOM 0 HB2 GLU A 27 5.800 -15.735 -8.188 1.00 0.00 H new ATOM 0 HB3 GLU A 27 6.631 -16.980 -9.099 1.00 0.00 H new ATOM 0 HG2 GLU A 27 5.050 -17.613 -6.593 1.00 0.00 H new ATOM 0 HG3 GLU A 27 4.295 -17.531 -8.172 1.00 0.00 H new ATOM 402 N ASP A 28 9.784 -15.871 -7.184 1.00 0.00 N ATOM 403 CA ASP A 28 11.014 -15.363 -7.780 1.00 0.00 C ATOM 404 C ASP A 28 12.119 -15.249 -6.735 1.00 0.00 C ATOM 405 O ASP A 28 13.275 -15.575 -7.000 1.00 0.00 O ATOM 406 CB ASP A 28 10.767 -14.001 -8.432 1.00 0.00 C ATOM 407 CG ASP A 28 10.623 -14.098 -9.939 1.00 0.00 C ATOM 408 OD1 ASP A 28 11.639 -14.356 -10.616 1.00 0.00 O ATOM 409 OD2 ASP A 28 9.493 -13.915 -10.439 1.00 0.00 O ATOM 0 H ASP A 28 9.846 -16.053 -6.182 1.00 0.00 H new ATOM 0 HA ASP A 28 11.335 -16.070 -8.545 1.00 0.00 H new ATOM 0 HB2 ASP A 28 9.864 -13.558 -8.011 1.00 0.00 H new ATOM 0 HB3 ASP A 28 11.592 -13.331 -8.191 1.00 0.00 H new ATOM 414 N LEU A 29 11.753 -14.784 -5.544 1.00 0.00 N ATOM 415 CA LEU A 29 12.712 -14.627 -4.458 1.00 0.00 C ATOM 416 C LEU A 29 12.476 -15.669 -3.369 1.00 0.00 C ATOM 417 O LEU A 29 11.338 -16.060 -3.106 1.00 0.00 O ATOM 418 CB LEU A 29 12.614 -13.221 -3.863 1.00 0.00 C ATOM 419 CG LEU A 29 13.284 -12.120 -4.689 1.00 0.00 C ATOM 420 CD1 LEU A 29 14.795 -12.294 -4.685 1.00 0.00 C ATOM 421 CD2 LEU A 29 12.749 -12.125 -6.113 1.00 0.00 C ATOM 0 H LEU A 29 10.799 -14.510 -5.308 1.00 0.00 H new ATOM 0 HA LEU A 29 13.712 -14.773 -4.866 1.00 0.00 H new ATOM 0 HB2 LEU A 29 11.561 -12.969 -3.736 1.00 0.00 H new ATOM 0 HB3 LEU A 29 13.061 -13.232 -2.869 1.00 0.00 H new ATOM 0 HG LEU A 29 13.049 -11.157 -4.236 1.00 0.00 H new ATOM 0 HD11 LEU A 29 15.254 -11.502 -5.277 1.00 0.00 H new ATOM 0 HD12 LEU A 29 15.165 -12.242 -3.661 1.00 0.00 H new ATOM 0 HD13 LEU A 29 15.051 -13.263 -5.114 1.00 0.00 H new ATOM 0 HD21 LEU A 29 13.235 -11.336 -6.687 1.00 0.00 H new ATOM 0 HD22 LEU A 29 12.955 -13.090 -6.576 1.00 0.00 H new ATOM 0 HD23 LEU A 29 11.673 -11.952 -6.098 1.00 0.00 H new ATOM 433 N GLN A 30 13.558 -16.114 -2.739 1.00 0.00 N ATOM 434 CA GLN A 30 13.468 -17.110 -1.678 1.00 0.00 C ATOM 435 C GLN A 30 13.366 -16.441 -0.311 1.00 0.00 C ATOM 436 O GLN A 30 13.614 -15.244 -0.175 1.00 0.00 O ATOM 437 CB GLN A 30 14.685 -18.037 -1.715 1.00 0.00 C ATOM 438 CG GLN A 30 14.654 -19.033 -2.864 1.00 0.00 C ATOM 439 CD GLN A 30 16.035 -19.330 -3.415 1.00 0.00 C ATOM 440 OE1 GLN A 30 17.026 -19.308 -2.684 1.00 0.00 O ATOM 441 NE2 GLN A 30 16.108 -19.608 -4.712 1.00 0.00 N ATOM 0 H GLN A 30 14.507 -15.801 -2.945 1.00 0.00 H new ATOM 0 HA GLN A 30 12.566 -17.699 -1.843 1.00 0.00 H new ATOM 0 HB2 GLN A 30 15.589 -17.433 -1.792 1.00 0.00 H new ATOM 0 HB3 GLN A 30 14.745 -18.582 -0.773 1.00 0.00 H new ATOM 0 HG2 GLN A 30 14.195 -19.961 -2.523 1.00 0.00 H new ATOM 0 HG3 GLN A 30 14.025 -18.641 -3.663 1.00 0.00 H new ATOM 0 HE21 GLN A 30 15.261 -19.615 -5.280 1.00 0.00 H new ATOM 0 HE22 GLN A 30 17.011 -19.814 -5.139 1.00 0.00 H new ATOM 450 N VAL A 31 13.000 -17.223 0.700 1.00 0.00 N ATOM 451 CA VAL A 31 12.865 -16.707 2.057 1.00 0.00 C ATOM 452 C VAL A 31 14.163 -16.063 2.536 1.00 0.00 C ATOM 453 O VAL A 31 14.147 -15.150 3.360 1.00 0.00 O ATOM 454 CB VAL A 31 12.464 -17.820 3.044 1.00 0.00 C ATOM 455 CG1 VAL A 31 12.135 -17.232 4.407 1.00 0.00 C ATOM 456 CG2 VAL A 31 11.287 -18.615 2.500 1.00 0.00 C ATOM 0 H VAL A 31 12.792 -18.217 0.605 1.00 0.00 H new ATOM 0 HA VAL A 31 12.078 -15.953 2.030 1.00 0.00 H new ATOM 0 HB VAL A 31 13.309 -18.499 3.162 1.00 0.00 H new ATOM 0 HG11 VAL A 31 11.854 -18.033 5.091 1.00 0.00 H new ATOM 0 HG12 VAL A 31 13.008 -16.710 4.799 1.00 0.00 H new ATOM 0 HG13 VAL A 31 11.306 -16.530 4.310 1.00 0.00 H new ATOM 0 HG21 VAL A 31 11.017 -19.397 3.210 1.00 0.00 H new ATOM 0 HG22 VAL A 31 10.436 -17.950 2.352 1.00 0.00 H new ATOM 0 HG23 VAL A 31 11.563 -19.069 1.548 1.00 0.00 H new ATOM 466 N ASN A 32 15.286 -16.547 2.013 1.00 0.00 N ATOM 467 CA ASN A 32 16.592 -16.017 2.387 1.00 0.00 C ATOM 468 C ASN A 32 16.826 -14.645 1.762 1.00 0.00 C ATOM 469 O ASN A 32 17.556 -13.819 2.311 1.00 0.00 O ATOM 470 CB ASN A 32 17.698 -16.982 1.957 1.00 0.00 C ATOM 471 CG ASN A 32 17.593 -17.368 0.494 1.00 0.00 C ATOM 472 OD1 ASN A 32 16.952 -18.359 0.146 1.00 0.00 O ATOM 473 ND2 ASN A 32 18.224 -16.583 -0.372 1.00 0.00 N ATOM 0 H ASN A 32 15.317 -17.304 1.330 1.00 0.00 H new ATOM 0 HA ASN A 32 16.614 -15.908 3.471 1.00 0.00 H new ATOM 0 HB2 ASN A 32 18.669 -16.522 2.140 1.00 0.00 H new ATOM 0 HB3 ASN A 32 17.651 -17.881 2.571 1.00 0.00 H new ATOM 0 HD21 ASN A 32 18.188 -16.792 -1.370 1.00 0.00 H new ATOM 0 HD22 ASN A 32 18.744 -15.771 -0.039 1.00 0.00 H new ATOM 480 N GLN A 33 16.204 -14.408 0.611 1.00 0.00 N ATOM 481 CA GLN A 33 16.346 -13.136 -0.087 1.00 0.00 C ATOM 482 C GLN A 33 15.422 -12.072 0.502 1.00 0.00 C ATOM 483 O GLN A 33 15.605 -10.879 0.263 1.00 0.00 O ATOM 484 CB GLN A 33 16.051 -13.315 -1.578 1.00 0.00 C ATOM 485 CG GLN A 33 16.927 -14.356 -2.252 1.00 0.00 C ATOM 486 CD GLN A 33 17.347 -13.948 -3.650 1.00 0.00 C ATOM 487 OE1 GLN A 33 17.937 -12.886 -3.850 1.00 0.00 O ATOM 488 NE2 GLN A 33 17.044 -14.793 -4.629 1.00 0.00 N ATOM 0 H GLN A 33 15.597 -15.081 0.142 1.00 0.00 H new ATOM 0 HA GLN A 33 17.375 -12.799 0.039 1.00 0.00 H new ATOM 0 HB2 GLN A 33 15.006 -13.598 -1.701 1.00 0.00 H new ATOM 0 HB3 GLN A 33 16.184 -12.358 -2.083 1.00 0.00 H new ATOM 0 HG2 GLN A 33 17.816 -14.526 -1.645 1.00 0.00 H new ATOM 0 HG3 GLN A 33 16.388 -15.302 -2.300 1.00 0.00 H new ATOM 0 HE21 GLN A 33 16.554 -15.663 -4.419 1.00 0.00 H new ATOM 0 HE22 GLN A 33 17.301 -14.572 -5.591 1.00 0.00 H new ATOM 497 N PHE A 34 14.427 -12.509 1.274 1.00 0.00 N ATOM 498 CA PHE A 34 13.479 -11.589 1.894 1.00 0.00 C ATOM 499 C PHE A 34 14.202 -10.469 2.638 1.00 0.00 C ATOM 500 O PHE A 34 13.698 -9.352 2.742 1.00 0.00 O ATOM 501 CB PHE A 34 12.559 -12.345 2.856 1.00 0.00 C ATOM 502 CG PHE A 34 11.333 -12.915 2.198 1.00 0.00 C ATOM 503 CD1 PHE A 34 11.404 -13.473 0.931 1.00 0.00 C ATOM 504 CD2 PHE A 34 10.110 -12.893 2.849 1.00 0.00 C ATOM 505 CE1 PHE A 34 10.279 -13.997 0.326 1.00 0.00 C ATOM 506 CE2 PHE A 34 8.980 -13.416 2.248 1.00 0.00 C ATOM 507 CZ PHE A 34 9.065 -13.969 0.984 1.00 0.00 C ATOM 0 H PHE A 34 14.258 -13.493 1.484 1.00 0.00 H new ATOM 0 HA PHE A 34 12.880 -11.141 1.101 1.00 0.00 H new ATOM 0 HB2 PHE A 34 13.121 -13.155 3.321 1.00 0.00 H new ATOM 0 HB3 PHE A 34 12.251 -11.671 3.655 1.00 0.00 H new ATOM 0 HD1 PHE A 34 12.350 -13.498 0.411 1.00 0.00 H new ATOM 0 HD2 PHE A 34 10.039 -12.463 3.837 1.00 0.00 H new ATOM 0 HE1 PHE A 34 10.348 -14.429 -0.662 1.00 0.00 H new ATOM 0 HE2 PHE A 34 8.032 -13.392 2.765 1.00 0.00 H new ATOM 0 HZ PHE A 34 8.184 -14.378 0.512 1.00 0.00 H new ATOM 517 N LYS A 35 15.389 -10.778 3.151 1.00 0.00 N ATOM 518 CA LYS A 35 16.183 -9.799 3.883 1.00 0.00 C ATOM 519 C LYS A 35 16.612 -8.656 2.968 1.00 0.00 C ATOM 520 O LYS A 35 16.760 -7.517 3.409 1.00 0.00 O ATOM 521 CB LYS A 35 17.415 -10.467 4.498 1.00 0.00 C ATOM 522 CG LYS A 35 17.212 -10.909 5.939 1.00 0.00 C ATOM 523 CD LYS A 35 16.977 -9.720 6.858 1.00 0.00 C ATOM 524 CE LYS A 35 18.244 -9.334 7.603 1.00 0.00 C ATOM 525 NZ LYS A 35 18.204 -7.921 8.072 1.00 0.00 N ATOM 0 H LYS A 35 15.821 -11.698 3.073 1.00 0.00 H new ATOM 0 HA LYS A 35 15.565 -9.389 4.682 1.00 0.00 H new ATOM 0 HB2 LYS A 35 17.687 -11.334 3.896 1.00 0.00 H new ATOM 0 HB3 LYS A 35 18.254 -9.773 4.454 1.00 0.00 H new ATOM 0 HG2 LYS A 35 16.361 -11.588 5.996 1.00 0.00 H new ATOM 0 HG3 LYS A 35 18.087 -11.464 6.277 1.00 0.00 H new ATOM 0 HD2 LYS A 35 16.624 -8.871 6.273 1.00 0.00 H new ATOM 0 HD3 LYS A 35 16.192 -9.962 7.574 1.00 0.00 H new ATOM 0 HE2 LYS A 35 18.379 -9.997 8.458 1.00 0.00 H new ATOM 0 HE3 LYS A 35 19.106 -9.476 6.951 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 19.086 -7.697 8.575 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 18.101 -7.287 7.254 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 17.397 -7.791 8.714 1.00 0.00 H new ATOM 539 N ASN A 36 16.808 -8.970 1.692 1.00 0.00 N ATOM 540 CA ASN A 36 17.219 -7.970 0.713 1.00 0.00 C ATOM 541 C ASN A 36 16.026 -7.486 -0.105 1.00 0.00 C ATOM 542 O ASN A 36 16.170 -7.105 -1.267 1.00 0.00 O ATOM 543 CB ASN A 36 18.290 -8.545 -0.216 1.00 0.00 C ATOM 544 CG ASN A 36 17.788 -9.736 -1.010 1.00 0.00 C ATOM 545 OD1 ASN A 36 16.769 -9.654 -1.695 1.00 0.00 O ATOM 546 ND2 ASN A 36 18.505 -10.849 -0.921 1.00 0.00 N ATOM 0 H ASN A 36 16.689 -9.909 1.311 1.00 0.00 H new ATOM 0 HA ASN A 36 17.635 -7.119 1.253 1.00 0.00 H new ATOM 0 HB2 ASN A 36 18.625 -7.769 -0.904 1.00 0.00 H new ATOM 0 HB3 ASN A 36 19.156 -8.844 0.374 1.00 0.00 H new ATOM 0 HD21 ASN A 36 18.218 -11.683 -1.433 1.00 0.00 H new ATOM 0 HD22 ASN A 36 19.343 -10.871 -0.340 1.00 0.00 H new ATOM 553 N VAL A 37 14.846 -7.505 0.507 1.00 0.00 N ATOM 554 CA VAL A 37 13.628 -7.068 -0.165 1.00 0.00 C ATOM 555 C VAL A 37 12.851 -6.081 0.698 1.00 0.00 C ATOM 556 O VAL A 37 12.134 -6.475 1.619 1.00 0.00 O ATOM 557 CB VAL A 37 12.717 -8.262 -0.511 1.00 0.00 C ATOM 558 CG1 VAL A 37 11.527 -7.804 -1.341 1.00 0.00 C ATOM 559 CG2 VAL A 37 13.501 -9.341 -1.242 1.00 0.00 C ATOM 0 H VAL A 37 14.708 -7.819 1.468 1.00 0.00 H new ATOM 0 HA VAL A 37 13.934 -6.577 -1.089 1.00 0.00 H new ATOM 0 HB VAL A 37 12.340 -8.687 0.419 1.00 0.00 H new ATOM 0 HG11 VAL A 37 10.895 -8.661 -1.575 1.00 0.00 H new ATOM 0 HG12 VAL A 37 10.950 -7.072 -0.776 1.00 0.00 H new ATOM 0 HG13 VAL A 37 11.882 -7.351 -2.267 1.00 0.00 H new ATOM 0 HG21 VAL A 37 12.840 -10.175 -1.477 1.00 0.00 H new ATOM 0 HG22 VAL A 37 13.910 -8.931 -2.165 1.00 0.00 H new ATOM 0 HG23 VAL A 37 14.316 -9.691 -0.608 1.00 0.00 H new ATOM 569 N ILE A 38 12.995 -4.796 0.393 1.00 0.00 N ATOM 570 CA ILE A 38 12.307 -3.751 1.140 1.00 0.00 C ATOM 571 C ILE A 38 11.049 -3.291 0.407 1.00 0.00 C ATOM 572 O ILE A 38 11.081 -3.024 -0.794 1.00 0.00 O ATOM 573 CB ILE A 38 13.225 -2.536 1.384 1.00 0.00 C ATOM 574 CG1 ILE A 38 12.523 -1.501 2.268 1.00 0.00 C ATOM 575 CG2 ILE A 38 13.649 -1.914 0.060 1.00 0.00 C ATOM 576 CD1 ILE A 38 13.028 -1.484 3.694 1.00 0.00 C ATOM 0 H ILE A 38 13.583 -4.453 -0.367 1.00 0.00 H new ATOM 0 HA ILE A 38 12.026 -4.180 2.102 1.00 0.00 H new ATOM 0 HB ILE A 38 14.120 -2.878 1.904 1.00 0.00 H new ATOM 0 HG12 ILE A 38 12.657 -0.511 1.832 1.00 0.00 H new ATOM 0 HG13 ILE A 38 11.452 -1.705 2.272 1.00 0.00 H new ATOM 0 HG21 ILE A 38 14.296 -1.058 0.251 1.00 0.00 H new ATOM 0 HG22 ILE A 38 14.189 -2.652 -0.532 1.00 0.00 H new ATOM 0 HG23 ILE A 38 12.765 -1.586 -0.487 1.00 0.00 H new ATOM 0 HD11 ILE A 38 12.487 -0.728 4.263 1.00 0.00 H new ATOM 0 HD12 ILE A 38 12.869 -2.462 4.148 1.00 0.00 H new ATOM 0 HD13 ILE A 38 14.093 -1.250 3.700 1.00 0.00 H new ATOM 588 N PHE A 39 9.943 -3.202 1.138 1.00 0.00 N ATOM 589 CA PHE A 39 8.675 -2.775 0.558 1.00 0.00 C ATOM 590 C PHE A 39 8.311 -1.368 1.022 1.00 0.00 C ATOM 591 O PHE A 39 7.838 -1.176 2.141 1.00 0.00 O ATOM 592 CB PHE A 39 7.561 -3.752 0.933 1.00 0.00 C ATOM 593 CG PHE A 39 7.638 -5.062 0.201 1.00 0.00 C ATOM 594 CD1 PHE A 39 7.300 -5.141 -1.140 1.00 0.00 C ATOM 595 CD2 PHE A 39 8.049 -6.213 0.854 1.00 0.00 C ATOM 596 CE1 PHE A 39 7.369 -6.344 -1.816 1.00 0.00 C ATOM 597 CE2 PHE A 39 8.121 -7.419 0.183 1.00 0.00 C ATOM 598 CZ PHE A 39 7.781 -7.485 -1.154 1.00 0.00 C ATOM 0 H PHE A 39 9.899 -3.420 2.133 1.00 0.00 H new ATOM 0 HA PHE A 39 8.787 -2.764 -0.526 1.00 0.00 H new ATOM 0 HB2 PHE A 39 7.601 -3.942 2.006 1.00 0.00 H new ATOM 0 HB3 PHE A 39 6.597 -3.287 0.728 1.00 0.00 H new ATOM 0 HD1 PHE A 39 6.979 -4.252 -1.663 1.00 0.00 H new ATOM 0 HD2 PHE A 39 8.316 -6.167 1.899 1.00 0.00 H new ATOM 0 HE1 PHE A 39 7.101 -6.393 -2.861 1.00 0.00 H new ATOM 0 HE2 PHE A 39 8.443 -8.309 0.704 1.00 0.00 H new ATOM 0 HZ PHE A 39 7.837 -8.426 -1.681 1.00 0.00 H new ATOM 608 N GLU A 40 8.537 -0.387 0.154 1.00 0.00 N ATOM 609 CA GLU A 40 8.234 1.003 0.475 1.00 0.00 C ATOM 610 C GLU A 40 6.770 1.320 0.189 1.00 0.00 C ATOM 611 O GLU A 40 6.311 1.204 -0.949 1.00 0.00 O ATOM 612 CB GLU A 40 9.138 1.943 -0.324 1.00 0.00 C ATOM 613 CG GLU A 40 8.956 3.409 0.032 1.00 0.00 C ATOM 614 CD GLU A 40 9.431 4.339 -1.068 1.00 0.00 C ATOM 615 OE1 GLU A 40 8.843 4.304 -2.169 1.00 0.00 O ATOM 616 OE2 GLU A 40 10.390 5.101 -0.828 1.00 0.00 O ATOM 0 H GLU A 40 8.929 -0.529 -0.777 1.00 0.00 H new ATOM 0 HA GLU A 40 8.418 1.152 1.539 1.00 0.00 H new ATOM 0 HB2 GLU A 40 10.178 1.663 -0.156 1.00 0.00 H new ATOM 0 HB3 GLU A 40 8.939 1.808 -1.387 1.00 0.00 H new ATOM 0 HG2 GLU A 40 7.903 3.602 0.236 1.00 0.00 H new ATOM 0 HG3 GLU A 40 9.503 3.627 0.949 1.00 0.00 H new ATOM 623 N ILE A 41 6.042 1.720 1.226 1.00 0.00 N ATOM 624 CA ILE A 41 4.632 2.054 1.086 1.00 0.00 C ATOM 625 C ILE A 41 4.384 3.528 1.388 1.00 0.00 C ATOM 626 O ILE A 41 4.446 3.955 2.540 1.00 0.00 O ATOM 627 CB ILE A 41 3.754 1.196 2.017 1.00 0.00 C ATOM 628 CG1 ILE A 41 4.138 -0.280 1.902 1.00 0.00 C ATOM 629 CG2 ILE A 41 2.282 1.392 1.686 1.00 0.00 C ATOM 630 CD1 ILE A 41 3.680 -1.117 3.078 1.00 0.00 C ATOM 0 H ILE A 41 6.407 1.820 2.173 1.00 0.00 H new ATOM 0 HA ILE A 41 4.360 1.846 0.051 1.00 0.00 H new ATOM 0 HB ILE A 41 3.922 1.516 3.045 1.00 0.00 H new ATOM 0 HG12 ILE A 41 3.709 -0.688 0.987 1.00 0.00 H new ATOM 0 HG13 ILE A 41 5.221 -0.359 1.810 1.00 0.00 H new ATOM 0 HG21 ILE A 41 1.675 0.779 2.352 1.00 0.00 H new ATOM 0 HG22 ILE A 41 2.017 2.441 1.815 1.00 0.00 H new ATOM 0 HG23 ILE A 41 2.099 1.096 0.653 1.00 0.00 H new ATOM 0 HD11 ILE A 41 3.987 -2.152 2.929 1.00 0.00 H new ATOM 0 HD12 ILE A 41 4.129 -0.734 3.994 1.00 0.00 H new ATOM 0 HD13 ILE A 41 2.594 -1.068 3.158 1.00 0.00 H new ATOM 642 N SER A 42 4.102 4.301 0.344 1.00 0.00 N ATOM 643 CA SER A 42 3.846 5.729 0.498 1.00 0.00 C ATOM 644 C SER A 42 2.360 5.992 0.737 1.00 0.00 C ATOM 645 O SER A 42 1.525 5.684 -0.113 1.00 0.00 O ATOM 646 CB SER A 42 4.315 6.487 -0.745 1.00 0.00 C ATOM 647 OG SER A 42 5.421 5.840 -1.352 1.00 0.00 O ATOM 0 H SER A 42 4.045 3.963 -0.617 1.00 0.00 H new ATOM 0 HA SER A 42 4.404 6.083 1.365 1.00 0.00 H new ATOM 0 HB2 SER A 42 3.496 6.561 -1.460 1.00 0.00 H new ATOM 0 HB3 SER A 42 4.591 7.505 -0.471 1.00 0.00 H new ATOM 0 HG SER A 42 5.700 6.344 -2.145 1.00 0.00 H new ATOM 653 N PRO A 43 2.005 6.568 1.901 1.00 0.00 N ATOM 654 CA PRO A 43 0.609 6.867 2.237 1.00 0.00 C ATOM 655 C PRO A 43 0.046 8.012 1.402 1.00 0.00 C ATOM 656 O PRO A 43 0.757 8.616 0.599 1.00 0.00 O ATOM 657 CB PRO A 43 0.676 7.264 3.712 1.00 0.00 C ATOM 658 CG PRO A 43 2.060 7.775 3.904 1.00 0.00 C ATOM 659 CD PRO A 43 2.930 6.971 2.978 1.00 0.00 C ATOM 0 HA PRO A 43 -0.048 6.020 2.040 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -0.064 8.028 3.950 1.00 0.00 H new ATOM 0 HB3 PRO A 43 0.475 6.412 4.361 1.00 0.00 H new ATOM 0 HG2 PRO A 43 2.119 8.838 3.671 1.00 0.00 H new ATOM 0 HG3 PRO A 43 2.379 7.658 4.940 1.00 0.00 H new ATOM 0 HD2 PRO A 43 3.761 7.562 2.593 1.00 0.00 H new ATOM 0 HD3 PRO A 43 3.361 6.106 3.482 1.00 0.00 H new ATOM 667 N THR A 44 -1.236 8.305 1.596 1.00 0.00 N ATOM 668 CA THR A 44 -1.895 9.379 0.861 1.00 0.00 C ATOM 669 C THR A 44 -2.661 10.295 1.808 1.00 0.00 C ATOM 670 O THR A 44 -2.809 9.998 2.993 1.00 0.00 O ATOM 671 CB THR A 44 -2.846 8.797 -0.187 1.00 0.00 C ATOM 672 OG1 THR A 44 -3.889 8.067 0.433 1.00 0.00 O ATOM 673 CG2 THR A 44 -2.160 7.874 -1.171 1.00 0.00 C ATOM 0 H THR A 44 -1.839 7.814 2.256 1.00 0.00 H new ATOM 0 HA THR A 44 -1.127 9.968 0.358 1.00 0.00 H new ATOM 0 HB THR A 44 -3.236 9.656 -0.732 1.00 0.00 H new ATOM 0 HG1 THR A 44 -3.901 7.152 0.082 1.00 0.00 H new ATOM 0 HG21 THR A 44 -2.891 7.496 -1.886 1.00 0.00 H new ATOM 0 HG22 THR A 44 -1.382 8.422 -1.702 1.00 0.00 H new ATOM 0 HG23 THR A 44 -1.712 7.038 -0.634 1.00 0.00 H new ATOM 681 N GLU A 45 -3.147 11.414 1.276 1.00 0.00 N ATOM 682 CA GLU A 45 -3.898 12.376 2.074 1.00 0.00 C ATOM 683 C GLU A 45 -5.302 11.856 2.371 1.00 0.00 C ATOM 684 O GLU A 45 -5.877 12.157 3.418 1.00 0.00 O ATOM 685 CB GLU A 45 -3.979 13.719 1.347 1.00 0.00 C ATOM 686 CG GLU A 45 -3.693 14.914 2.243 1.00 0.00 C ATOM 687 CD GLU A 45 -2.846 15.967 1.556 1.00 0.00 C ATOM 688 OE1 GLU A 45 -3.058 16.206 0.348 1.00 0.00 O ATOM 689 OE2 GLU A 45 -1.971 16.555 2.226 1.00 0.00 O ATOM 0 H GLU A 45 -3.034 11.675 0.297 1.00 0.00 H new ATOM 0 HA GLU A 45 -3.375 12.516 3.020 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -3.270 13.718 0.519 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -4.973 13.829 0.915 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -4.636 15.361 2.559 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -3.183 14.574 3.144 1.00 0.00 H new ATOM 696 N GLU A 46 -5.848 11.075 1.446 1.00 0.00 N ATOM 697 CA GLU A 46 -7.184 10.515 1.608 1.00 0.00 C ATOM 698 C GLU A 46 -7.114 9.095 2.162 1.00 0.00 C ATOM 699 O GLU A 46 -6.048 8.481 2.189 1.00 0.00 O ATOM 700 CB GLU A 46 -7.927 10.518 0.271 1.00 0.00 C ATOM 701 CG GLU A 46 -8.694 11.803 0.004 1.00 0.00 C ATOM 702 CD GLU A 46 -8.043 12.661 -1.064 1.00 0.00 C ATOM 703 OE1 GLU A 46 -7.856 12.161 -2.194 1.00 0.00 O ATOM 704 OE2 GLU A 46 -7.719 13.831 -0.771 1.00 0.00 O ATOM 0 H GLU A 46 -5.385 10.815 0.575 1.00 0.00 H new ATOM 0 HA GLU A 46 -7.728 11.137 2.319 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -7.210 10.359 -0.534 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -8.622 9.679 0.249 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -9.711 11.558 -0.303 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -8.769 12.375 0.929 1.00 0.00 H new ATOM 711 N VAL A 47 -8.258 8.580 2.601 1.00 0.00 N ATOM 712 CA VAL A 47 -8.327 7.232 3.153 1.00 0.00 C ATOM 713 C VAL A 47 -8.882 6.248 2.129 1.00 0.00 C ATOM 714 O VAL A 47 -9.900 6.511 1.488 1.00 0.00 O ATOM 715 CB VAL A 47 -9.199 7.190 4.423 1.00 0.00 C ATOM 716 CG1 VAL A 47 -10.628 7.606 4.109 1.00 0.00 C ATOM 717 CG2 VAL A 47 -9.164 5.804 5.051 1.00 0.00 C ATOM 0 H VAL A 47 -9.149 9.076 2.585 1.00 0.00 H new ATOM 0 HA VAL A 47 -7.309 6.942 3.414 1.00 0.00 H new ATOM 0 HB VAL A 47 -8.791 7.900 5.142 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -11.226 7.569 5.020 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -10.633 8.621 3.713 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -11.051 6.926 3.369 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -9.786 5.794 5.946 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -9.543 5.072 4.338 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -8.138 5.552 5.319 1.00 0.00 H new ATOM 727 N GLY A 48 -8.208 5.111 1.981 1.00 0.00 N ATOM 728 CA GLY A 48 -8.650 4.105 1.034 1.00 0.00 C ATOM 729 C GLY A 48 -7.632 3.851 -0.061 1.00 0.00 C ATOM 730 O GLY A 48 -7.405 2.707 -0.454 1.00 0.00 O ATOM 0 H GLY A 48 -7.364 4.869 2.500 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -8.848 3.174 1.564 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -9.591 4.422 0.584 1.00 0.00 H new ATOM 734 N ASP A 49 -7.018 4.921 -0.554 1.00 0.00 N ATOM 735 CA ASP A 49 -6.019 4.810 -1.609 1.00 0.00 C ATOM 736 C ASP A 49 -4.612 4.754 -1.024 1.00 0.00 C ATOM 737 O ASP A 49 -4.218 5.620 -0.244 1.00 0.00 O ATOM 738 CB ASP A 49 -6.133 5.990 -2.577 1.00 0.00 C ATOM 739 CG ASP A 49 -5.408 5.738 -3.884 1.00 0.00 C ATOM 740 OD1 ASP A 49 -5.412 4.578 -4.350 1.00 0.00 O ATOM 741 OD2 ASP A 49 -4.837 6.698 -4.441 1.00 0.00 O ATOM 0 H ASP A 49 -7.195 5.875 -0.239 1.00 0.00 H new ATOM 0 HA ASP A 49 -6.205 3.883 -2.152 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -7.185 6.189 -2.781 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -5.725 6.884 -2.105 1.00 0.00 H new ATOM 746 N PHE A 50 -3.858 3.728 -1.406 1.00 0.00 N ATOM 747 CA PHE A 50 -2.493 3.558 -0.918 1.00 0.00 C ATOM 748 C PHE A 50 -1.509 3.455 -2.079 1.00 0.00 C ATOM 749 O PHE A 50 -1.878 3.063 -3.186 1.00 0.00 O ATOM 750 CB PHE A 50 -2.395 2.310 -0.039 1.00 0.00 C ATOM 751 CG PHE A 50 -3.355 2.312 1.116 1.00 0.00 C ATOM 752 CD1 PHE A 50 -3.383 3.372 2.009 1.00 0.00 C ATOM 753 CD2 PHE A 50 -4.229 1.254 1.309 1.00 0.00 C ATOM 754 CE1 PHE A 50 -4.265 3.377 3.072 1.00 0.00 C ATOM 755 CE2 PHE A 50 -5.113 1.253 2.371 1.00 0.00 C ATOM 756 CZ PHE A 50 -5.132 2.316 3.254 1.00 0.00 C ATOM 0 H PHE A 50 -4.169 3.002 -2.052 1.00 0.00 H new ATOM 0 HA PHE A 50 -2.235 4.434 -0.323 1.00 0.00 H new ATOM 0 HB2 PHE A 50 -2.579 1.428 -0.653 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -1.378 2.225 0.344 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -2.707 4.203 1.872 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -4.219 0.421 0.622 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -4.277 4.209 3.760 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -5.789 0.422 2.511 1.00 0.00 H new ATOM 0 HZ PHE A 50 -5.823 2.318 4.084 1.00 0.00 H new ATOM 766 N GLU A 51 -0.255 3.808 -1.817 1.00 0.00 N ATOM 767 CA GLU A 51 0.784 3.755 -2.840 1.00 0.00 C ATOM 768 C GLU A 51 1.870 2.754 -2.460 1.00 0.00 C ATOM 769 O GLU A 51 2.723 3.036 -1.618 1.00 0.00 O ATOM 770 CB GLU A 51 1.398 5.143 -3.044 1.00 0.00 C ATOM 771 CG GLU A 51 1.108 5.740 -4.411 1.00 0.00 C ATOM 772 CD GLU A 51 0.886 7.239 -4.358 1.00 0.00 C ATOM 773 OE1 GLU A 51 1.863 7.974 -4.107 1.00 0.00 O ATOM 774 OE2 GLU A 51 -0.264 7.677 -4.567 1.00 0.00 O ATOM 0 H GLU A 51 0.067 4.134 -0.906 1.00 0.00 H new ATOM 0 HA GLU A 51 0.326 3.428 -3.773 1.00 0.00 H new ATOM 0 HB2 GLU A 51 1.019 5.816 -2.275 1.00 0.00 H new ATOM 0 HB3 GLU A 51 2.477 5.078 -2.907 1.00 0.00 H new ATOM 0 HG2 GLU A 51 1.939 5.523 -5.082 1.00 0.00 H new ATOM 0 HG3 GLU A 51 0.225 5.260 -4.833 1.00 0.00 H new ATOM 781 N VAL A 52 1.833 1.582 -3.087 1.00 0.00 N ATOM 782 CA VAL A 52 2.814 0.538 -2.816 1.00 0.00 C ATOM 783 C VAL A 52 4.014 0.656 -3.749 1.00 0.00 C ATOM 784 O VAL A 52 3.912 1.221 -4.839 1.00 0.00 O ATOM 785 CB VAL A 52 2.198 -0.865 -2.967 1.00 0.00 C ATOM 786 CG1 VAL A 52 3.171 -1.931 -2.490 1.00 0.00 C ATOM 787 CG2 VAL A 52 0.882 -0.954 -2.209 1.00 0.00 C ATOM 0 H VAL A 52 1.134 1.332 -3.786 1.00 0.00 H new ATOM 0 HA VAL A 52 3.143 0.673 -1.786 1.00 0.00 H new ATOM 0 HB VAL A 52 1.995 -1.041 -4.023 1.00 0.00 H new ATOM 0 HG11 VAL A 52 2.717 -2.915 -2.605 1.00 0.00 H new ATOM 0 HG12 VAL A 52 4.084 -1.881 -3.083 1.00 0.00 H new ATOM 0 HG13 VAL A 52 3.410 -1.762 -1.440 1.00 0.00 H new ATOM 0 HG21 VAL A 52 0.461 -1.952 -2.327 1.00 0.00 H new ATOM 0 HG22 VAL A 52 1.057 -0.757 -1.151 1.00 0.00 H new ATOM 0 HG23 VAL A 52 0.184 -0.217 -2.605 1.00 0.00 H new ATOM 797 N LYS A 53 5.150 0.121 -3.315 1.00 0.00 N ATOM 798 CA LYS A 53 6.370 0.166 -4.114 1.00 0.00 C ATOM 799 C LYS A 53 7.263 -1.032 -3.810 1.00 0.00 C ATOM 800 O LYS A 53 7.358 -1.474 -2.665 1.00 0.00 O ATOM 801 CB LYS A 53 7.132 1.466 -3.846 1.00 0.00 C ATOM 802 CG LYS A 53 8.308 1.684 -4.783 1.00 0.00 C ATOM 803 CD LYS A 53 7.846 1.936 -6.209 1.00 0.00 C ATOM 804 CE LYS A 53 9.024 2.126 -7.151 1.00 0.00 C ATOM 805 NZ LYS A 53 9.813 0.873 -7.311 1.00 0.00 N ATOM 0 H LYS A 53 5.252 -0.349 -2.415 1.00 0.00 H new ATOM 0 HA LYS A 53 6.088 0.128 -5.166 1.00 0.00 H new ATOM 0 HB2 LYS A 53 6.444 2.306 -3.938 1.00 0.00 H new ATOM 0 HB3 LYS A 53 7.493 1.461 -2.818 1.00 0.00 H new ATOM 0 HG2 LYS A 53 8.899 2.532 -4.436 1.00 0.00 H new ATOM 0 HG3 LYS A 53 8.960 0.811 -4.760 1.00 0.00 H new ATOM 0 HD2 LYS A 53 7.238 1.098 -6.549 1.00 0.00 H new ATOM 0 HD3 LYS A 53 7.211 2.821 -6.236 1.00 0.00 H new ATOM 0 HE2 LYS A 53 8.661 2.454 -8.125 1.00 0.00 H new ATOM 0 HE3 LYS A 53 9.671 2.916 -6.769 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 10.823 1.080 -7.177 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 9.506 0.176 -6.603 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 9.662 0.487 -8.265 1.00 0.00 H new ATOM 819 N ALA A 54 7.916 -1.554 -4.843 1.00 0.00 N ATOM 820 CA ALA A 54 8.801 -2.702 -4.688 1.00 0.00 C ATOM 821 C ALA A 54 10.084 -2.516 -5.489 1.00 0.00 C ATOM 822 O ALA A 54 10.104 -2.716 -6.704 1.00 0.00 O ATOM 823 CB ALA A 54 8.091 -3.977 -5.113 1.00 0.00 C ATOM 0 H ALA A 54 7.849 -1.200 -5.797 1.00 0.00 H new ATOM 0 HA ALA A 54 9.069 -2.784 -3.635 1.00 0.00 H new ATOM 0 HB1 ALA A 54 8.764 -4.826 -4.992 1.00 0.00 H new ATOM 0 HB2 ALA A 54 7.206 -4.124 -4.494 1.00 0.00 H new ATOM 0 HB3 ALA A 54 7.793 -3.896 -6.158 1.00 0.00 H new ATOM 829 N LYS A 55 11.156 -2.133 -4.802 1.00 0.00 N ATOM 830 CA LYS A 55 12.444 -1.921 -5.451 1.00 0.00 C ATOM 831 C LYS A 55 13.590 -2.360 -4.545 1.00 0.00 C ATOM 832 O LYS A 55 13.370 -2.765 -3.403 1.00 0.00 O ATOM 833 CB LYS A 55 12.614 -0.448 -5.831 1.00 0.00 C ATOM 834 CG LYS A 55 12.146 0.519 -4.755 1.00 0.00 C ATOM 835 CD LYS A 55 13.112 0.559 -3.583 1.00 0.00 C ATOM 836 CE LYS A 55 12.732 1.639 -2.582 1.00 0.00 C ATOM 837 NZ LYS A 55 12.826 1.153 -1.178 1.00 0.00 N ATOM 0 H LYS A 55 11.158 -1.963 -3.796 1.00 0.00 H new ATOM 0 HA LYS A 55 12.468 -2.527 -6.357 1.00 0.00 H new ATOM 0 HB2 LYS A 55 13.665 -0.257 -6.047 1.00 0.00 H new ATOM 0 HB3 LYS A 55 12.060 -0.252 -6.749 1.00 0.00 H new ATOM 0 HG2 LYS A 55 12.047 1.518 -5.180 1.00 0.00 H new ATOM 0 HG3 LYS A 55 11.158 0.223 -4.403 1.00 0.00 H new ATOM 0 HD2 LYS A 55 13.123 -0.411 -3.086 1.00 0.00 H new ATOM 0 HD3 LYS A 55 14.122 0.741 -3.949 1.00 0.00 H new ATOM 0 HE2 LYS A 55 13.386 2.501 -2.712 1.00 0.00 H new ATOM 0 HE3 LYS A 55 11.715 1.977 -2.782 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 12.658 1.945 -0.525 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 12.112 0.414 -1.018 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 13.774 0.760 -1.009 1.00 0.00 H new ATOM 851 N PHE A 56 14.811 -2.277 -5.061 1.00 0.00 N ATOM 852 CA PHE A 56 15.991 -2.666 -4.299 1.00 0.00 C ATOM 853 C PHE A 56 16.794 -1.439 -3.877 1.00 0.00 C ATOM 854 O PHE A 56 17.046 -1.228 -2.690 1.00 0.00 O ATOM 855 CB PHE A 56 16.872 -3.605 -5.125 1.00 0.00 C ATOM 856 CG PHE A 56 16.373 -5.022 -5.156 1.00 0.00 C ATOM 857 CD1 PHE A 56 16.683 -5.902 -4.131 1.00 0.00 C ATOM 858 CD2 PHE A 56 15.596 -5.474 -6.211 1.00 0.00 C ATOM 859 CE1 PHE A 56 16.226 -7.207 -4.158 1.00 0.00 C ATOM 860 CE2 PHE A 56 15.136 -6.777 -6.242 1.00 0.00 C ATOM 861 CZ PHE A 56 15.453 -7.645 -5.214 1.00 0.00 C ATOM 0 H PHE A 56 15.009 -1.944 -6.004 1.00 0.00 H new ATOM 0 HA PHE A 56 15.657 -3.188 -3.402 1.00 0.00 H new ATOM 0 HB2 PHE A 56 16.934 -3.228 -6.146 1.00 0.00 H new ATOM 0 HB3 PHE A 56 17.883 -3.593 -4.718 1.00 0.00 H new ATOM 0 HD1 PHE A 56 17.288 -5.565 -3.302 1.00 0.00 H new ATOM 0 HD2 PHE A 56 15.347 -4.801 -7.018 1.00 0.00 H new ATOM 0 HE1 PHE A 56 16.474 -7.883 -3.353 1.00 0.00 H new ATOM 0 HE2 PHE A 56 14.530 -7.117 -7.069 1.00 0.00 H new ATOM 0 HZ PHE A 56 15.096 -8.664 -5.237 1.00 0.00 H new ATOM 871 N MET A 57 17.193 -0.635 -4.856 1.00 0.00 N ATOM 872 CA MET A 57 17.968 0.572 -4.586 1.00 0.00 C ATOM 873 C MET A 57 17.054 1.725 -4.183 1.00 0.00 C ATOM 874 O MET A 57 17.081 2.180 -3.040 1.00 0.00 O ATOM 875 CB MET A 57 18.788 0.961 -5.816 1.00 0.00 C ATOM 876 CG MET A 57 19.789 2.075 -5.551 1.00 0.00 C ATOM 877 SD MET A 57 19.960 3.202 -6.950 1.00 0.00 S ATOM 878 CE MET A 57 21.443 4.092 -6.487 1.00 0.00 C ATOM 0 H MET A 57 16.993 -0.796 -5.843 1.00 0.00 H new ATOM 0 HA MET A 57 18.645 0.363 -3.758 1.00 0.00 H new ATOM 0 HB2 MET A 57 19.322 0.083 -6.180 1.00 0.00 H new ATOM 0 HB3 MET A 57 18.110 1.274 -6.610 1.00 0.00 H new ATOM 0 HG2 MET A 57 19.476 2.638 -4.672 1.00 0.00 H new ATOM 0 HG3 MET A 57 20.761 1.638 -5.320 1.00 0.00 H new ATOM 0 HE1 MET A 57 21.680 4.828 -7.255 1.00 0.00 H new ATOM 0 HE2 MET A 57 21.281 4.599 -5.536 1.00 0.00 H new ATOM 0 HE3 MET A 57 22.272 3.391 -6.388 1.00 0.00 H new ATOM 888 N GLY A 58 16.247 2.192 -5.130 1.00 0.00 N ATOM 889 CA GLY A 58 15.337 3.288 -4.854 1.00 0.00 C ATOM 890 C GLY A 58 14.886 4.000 -6.115 1.00 0.00 C ATOM 891 O GLY A 58 15.049 5.213 -6.243 1.00 0.00 O ATOM 0 H GLY A 58 16.207 1.831 -6.083 1.00 0.00 H new ATOM 0 HA2 GLY A 58 14.464 2.907 -4.324 1.00 0.00 H new ATOM 0 HA3 GLY A 58 15.825 4.003 -4.192 1.00 0.00 H new ATOM 895 N VAL A 59 14.316 3.242 -7.047 1.00 0.00 N ATOM 896 CA VAL A 59 13.839 3.807 -8.303 1.00 0.00 C ATOM 897 C VAL A 59 12.414 4.331 -8.166 1.00 0.00 C ATOM 898 O VAL A 59 11.449 3.603 -8.401 1.00 0.00 O ATOM 899 CB VAL A 59 13.884 2.769 -9.441 1.00 0.00 C ATOM 900 CG1 VAL A 59 15.320 2.503 -9.866 1.00 0.00 C ATOM 901 CG2 VAL A 59 13.200 1.479 -9.013 1.00 0.00 C ATOM 0 H VAL A 59 14.174 2.236 -6.956 1.00 0.00 H new ATOM 0 HA VAL A 59 14.505 4.634 -8.549 1.00 0.00 H new ATOM 0 HB VAL A 59 13.345 3.173 -10.298 1.00 0.00 H new ATOM 0 HG11 VAL A 59 15.331 1.767 -10.670 1.00 0.00 H new ATOM 0 HG12 VAL A 59 15.774 3.430 -10.216 1.00 0.00 H new ATOM 0 HG13 VAL A 59 15.886 2.120 -9.017 1.00 0.00 H new ATOM 0 HG21 VAL A 59 13.241 0.757 -9.829 1.00 0.00 H new ATOM 0 HG22 VAL A 59 13.709 1.070 -8.140 1.00 0.00 H new ATOM 0 HG23 VAL A 59 12.159 1.685 -8.763 1.00 0.00 H new ATOM 911 N GLN A 60 12.288 5.597 -7.783 1.00 0.00 N ATOM 912 CA GLN A 60 10.980 6.218 -7.614 1.00 0.00 C ATOM 913 C GLN A 60 10.480 6.802 -8.931 1.00 0.00 C ATOM 914 O GLN A 60 10.631 7.996 -9.190 1.00 0.00 O ATOM 915 CB GLN A 60 11.046 7.315 -6.549 1.00 0.00 C ATOM 916 CG GLN A 60 10.778 6.813 -5.140 1.00 0.00 C ATOM 917 CD GLN A 60 11.980 6.964 -4.227 1.00 0.00 C ATOM 918 OE1 GLN A 60 12.035 7.871 -3.399 1.00 0.00 O ATOM 919 NE2 GLN A 60 12.952 6.071 -4.376 1.00 0.00 N ATOM 0 H GLN A 60 13.076 6.213 -7.584 1.00 0.00 H new ATOM 0 HA GLN A 60 10.280 5.448 -7.290 1.00 0.00 H new ATOM 0 HB2 GLN A 60 12.032 7.780 -6.579 1.00 0.00 H new ATOM 0 HB3 GLN A 60 10.320 8.091 -6.793 1.00 0.00 H new ATOM 0 HG2 GLN A 60 9.935 7.360 -4.718 1.00 0.00 H new ATOM 0 HG3 GLN A 60 10.488 5.763 -5.182 1.00 0.00 H new ATOM 0 HE21 GLN A 60 12.865 5.334 -5.076 1.00 0.00 H new ATOM 0 HE22 GLN A 60 13.786 6.122 -3.790 1.00 0.00 H new ATOM 928 N MET A 61 9.883 5.952 -9.760 1.00 0.00 N ATOM 929 CA MET A 61 9.361 6.383 -11.052 1.00 0.00 C ATOM 930 C MET A 61 7.852 6.168 -11.129 1.00 0.00 C ATOM 931 O MET A 61 7.109 7.057 -11.544 1.00 0.00 O ATOM 932 CB MET A 61 10.054 5.624 -12.185 1.00 0.00 C ATOM 933 CG MET A 61 11.447 6.141 -12.502 1.00 0.00 C ATOM 934 SD MET A 61 11.877 5.960 -14.243 1.00 0.00 S ATOM 935 CE MET A 61 11.523 7.605 -14.853 1.00 0.00 C ATOM 0 H MET A 61 9.749 4.961 -9.560 1.00 0.00 H new ATOM 0 HA MET A 61 9.564 7.448 -11.160 1.00 0.00 H new ATOM 0 HB2 MET A 61 10.119 4.569 -11.918 1.00 0.00 H new ATOM 0 HB3 MET A 61 9.439 5.688 -13.083 1.00 0.00 H new ATOM 0 HG2 MET A 61 11.512 7.193 -12.224 1.00 0.00 H new ATOM 0 HG3 MET A 61 12.176 5.605 -11.894 1.00 0.00 H new ATOM 0 HE1 MET A 61 11.740 7.652 -15.920 1.00 0.00 H new ATOM 0 HE2 MET A 61 10.471 7.836 -14.686 1.00 0.00 H new ATOM 0 HE3 MET A 61 12.142 8.330 -14.325 1.00 0.00 H new ATOM 945 N GLU A 62 7.408 4.982 -10.725 1.00 0.00 N ATOM 946 CA GLU A 62 5.988 4.650 -10.749 1.00 0.00 C ATOM 947 C GLU A 62 5.610 3.796 -9.542 1.00 0.00 C ATOM 948 O GLU A 62 6.179 2.725 -9.324 1.00 0.00 O ATOM 949 CB GLU A 62 5.635 3.916 -12.045 1.00 0.00 C ATOM 950 CG GLU A 62 4.920 4.789 -13.062 1.00 0.00 C ATOM 951 CD GLU A 62 5.491 4.646 -14.459 1.00 0.00 C ATOM 952 OE1 GLU A 62 6.106 3.598 -14.744 1.00 0.00 O ATOM 953 OE2 GLU A 62 5.322 5.582 -15.269 1.00 0.00 O ATOM 0 H GLU A 62 8.010 4.236 -10.378 1.00 0.00 H new ATOM 0 HA GLU A 62 5.421 5.580 -10.704 1.00 0.00 H new ATOM 0 HB2 GLU A 62 6.549 3.526 -12.492 1.00 0.00 H new ATOM 0 HB3 GLU A 62 5.005 3.059 -11.807 1.00 0.00 H new ATOM 0 HG2 GLU A 62 3.862 4.529 -13.078 1.00 0.00 H new ATOM 0 HG3 GLU A 62 4.987 5.832 -12.751 1.00 0.00 H new ATOM 960 N THR A 63 4.646 4.275 -8.763 1.00 0.00 N ATOM 961 CA THR A 63 4.192 3.555 -7.579 1.00 0.00 C ATOM 962 C THR A 63 2.860 2.860 -7.842 1.00 0.00 C ATOM 963 O THR A 63 2.003 3.387 -8.552 1.00 0.00 O ATOM 964 CB THR A 63 4.054 4.514 -6.395 1.00 0.00 C ATOM 965 OG1 THR A 63 3.763 5.825 -6.844 1.00 0.00 O ATOM 966 CG2 THR A 63 5.299 4.588 -5.538 1.00 0.00 C ATOM 0 H THR A 63 4.164 5.158 -8.930 1.00 0.00 H new ATOM 0 HA THR A 63 4.936 2.796 -7.339 1.00 0.00 H new ATOM 0 HB THR A 63 3.240 4.114 -5.791 1.00 0.00 H new ATOM 0 HG1 THR A 63 3.677 6.423 -6.073 1.00 0.00 H new ATOM 0 HG21 THR A 63 5.134 5.285 -4.716 1.00 0.00 H new ATOM 0 HG22 THR A 63 5.523 3.600 -5.136 1.00 0.00 H new ATOM 0 HG23 THR A 63 6.138 4.932 -6.143 1.00 0.00 H new ATOM 974 N PHE A 64 2.691 1.675 -7.265 1.00 0.00 N ATOM 975 CA PHE A 64 1.463 0.909 -7.437 1.00 0.00 C ATOM 976 C PHE A 64 0.353 1.453 -6.545 1.00 0.00 C ATOM 977 O PHE A 64 0.618 2.034 -5.491 1.00 0.00 O ATOM 978 CB PHE A 64 1.709 -0.567 -7.121 1.00 0.00 C ATOM 979 CG PHE A 64 0.505 -1.438 -7.342 1.00 0.00 C ATOM 980 CD1 PHE A 64 -0.125 -1.471 -8.575 1.00 0.00 C ATOM 981 CD2 PHE A 64 0.004 -2.224 -6.317 1.00 0.00 C ATOM 982 CE1 PHE A 64 -1.233 -2.272 -8.783 1.00 0.00 C ATOM 983 CE2 PHE A 64 -1.103 -3.026 -6.517 1.00 0.00 C ATOM 984 CZ PHE A 64 -1.722 -3.050 -7.752 1.00 0.00 C ATOM 0 H PHE A 64 3.390 1.224 -6.674 1.00 0.00 H new ATOM 0 HA PHE A 64 1.149 1.003 -8.476 1.00 0.00 H new ATOM 0 HB2 PHE A 64 2.529 -0.931 -7.740 1.00 0.00 H new ATOM 0 HB3 PHE A 64 2.028 -0.659 -6.083 1.00 0.00 H new ATOM 0 HD1 PHE A 64 0.254 -0.864 -9.384 1.00 0.00 H new ATOM 0 HD2 PHE A 64 0.485 -2.210 -5.350 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -1.715 -2.289 -9.749 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -1.484 -3.633 -5.709 1.00 0.00 H new ATOM 0 HZ PHE A 64 -2.587 -3.676 -7.911 1.00 0.00 H new ATOM 994 N MET A 65 -0.892 1.263 -6.972 1.00 0.00 N ATOM 995 CA MET A 65 -2.042 1.736 -6.210 1.00 0.00 C ATOM 996 C MET A 65 -2.873 0.564 -5.697 1.00 0.00 C ATOM 997 O MET A 65 -3.481 -0.168 -6.476 1.00 0.00 O ATOM 998 CB MET A 65 -2.911 2.652 -7.074 1.00 0.00 C ATOM 999 CG MET A 65 -2.357 4.061 -7.215 1.00 0.00 C ATOM 1000 SD MET A 65 -3.346 5.089 -8.318 1.00 0.00 S ATOM 1001 CE MET A 65 -4.888 5.173 -7.410 1.00 0.00 C ATOM 0 H MET A 65 -1.130 0.785 -7.841 1.00 0.00 H new ATOM 0 HA MET A 65 -1.672 2.299 -5.353 1.00 0.00 H new ATOM 0 HB2 MET A 65 -3.016 2.211 -8.065 1.00 0.00 H new ATOM 0 HB3 MET A 65 -3.910 2.705 -6.642 1.00 0.00 H new ATOM 0 HG2 MET A 65 -2.311 4.529 -6.232 1.00 0.00 H new ATOM 0 HG3 MET A 65 -1.335 4.010 -7.591 1.00 0.00 H new ATOM 0 HE1 MET A 65 -5.721 4.992 -8.090 1.00 0.00 H new ATOM 0 HE2 MET A 65 -4.890 4.417 -6.625 1.00 0.00 H new ATOM 0 HE3 MET A 65 -4.993 6.161 -6.962 1.00 0.00 H new ATOM 1011 N LEU A 66 -2.893 0.393 -4.378 1.00 0.00 N ATOM 1012 CA LEU A 66 -3.648 -0.690 -3.760 1.00 0.00 C ATOM 1013 C LEU A 66 -4.990 -0.187 -3.237 1.00 0.00 C ATOM 1014 O LEU A 66 -5.050 0.528 -2.238 1.00 0.00 O ATOM 1015 CB LEU A 66 -2.844 -1.312 -2.617 1.00 0.00 C ATOM 1016 CG LEU A 66 -3.451 -2.578 -2.012 1.00 0.00 C ATOM 1017 CD1 LEU A 66 -3.708 -3.617 -3.092 1.00 0.00 C ATOM 1018 CD2 LEU A 66 -2.539 -3.142 -0.933 1.00 0.00 C ATOM 0 H LEU A 66 -2.395 0.991 -3.718 1.00 0.00 H new ATOM 0 HA LEU A 66 -3.835 -1.449 -4.519 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -1.844 -1.546 -2.982 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -2.730 -0.569 -1.827 1.00 0.00 H new ATOM 0 HG LEU A 66 -4.405 -2.317 -1.554 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -4.140 -4.511 -2.642 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -4.400 -3.211 -3.830 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -2.768 -3.875 -3.580 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -2.986 -4.043 -0.513 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -1.570 -3.387 -1.367 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -2.407 -2.401 -0.145 1.00 0.00 H new ATOM 1030 N HIS A 67 -6.065 -0.568 -3.920 1.00 0.00 N ATOM 1031 CA HIS A 67 -7.407 -0.156 -3.526 1.00 0.00 C ATOM 1032 C HIS A 67 -7.876 -0.930 -2.297 1.00 0.00 C ATOM 1033 O HIS A 67 -7.879 -2.161 -2.291 1.00 0.00 O ATOM 1034 CB HIS A 67 -8.388 -0.367 -4.680 1.00 0.00 C ATOM 1035 CG HIS A 67 -8.224 0.621 -5.793 1.00 0.00 C ATOM 1036 ND1 HIS A 67 -7.292 0.475 -6.799 1.00 0.00 N ATOM 1037 CD2 HIS A 67 -8.880 1.777 -6.055 1.00 0.00 C ATOM 1038 CE1 HIS A 67 -7.383 1.498 -7.631 1.00 0.00 C ATOM 1039 NE2 HIS A 67 -8.338 2.301 -7.203 1.00 0.00 N ATOM 0 H HIS A 67 -6.032 -1.161 -4.749 1.00 0.00 H new ATOM 0 HA HIS A 67 -7.375 0.904 -3.275 1.00 0.00 H new ATOM 0 HB2 HIS A 67 -8.258 -1.374 -5.077 1.00 0.00 H new ATOM 0 HB3 HIS A 67 -9.406 -0.304 -4.296 1.00 0.00 H new ATOM 0 HD2 HIS A 67 -9.680 2.206 -5.470 1.00 0.00 H new ATOM 0 HE1 HIS A 67 -6.778 1.651 -8.512 1.00 0.00 H new ATOM 0 HE2 HIS A 67 -8.627 3.170 -7.652 1.00 0.00 H new ATOM 1048 N TYR A 68 -8.269 -0.201 -1.259 1.00 0.00 N ATOM 1049 CA TYR A 68 -8.740 -0.817 -0.025 1.00 0.00 C ATOM 1050 C TYR A 68 -9.979 -1.669 -0.278 1.00 0.00 C ATOM 1051 O TYR A 68 -10.215 -2.661 0.412 1.00 0.00 O ATOM 1052 CB TYR A 68 -9.050 0.255 1.021 1.00 0.00 C ATOM 1053 CG TYR A 68 -9.373 -0.306 2.388 1.00 0.00 C ATOM 1054 CD1 TYR A 68 -8.536 -1.235 2.994 1.00 0.00 C ATOM 1055 CD2 TYR A 68 -10.514 0.094 3.071 1.00 0.00 C ATOM 1056 CE1 TYR A 68 -8.829 -1.750 4.242 1.00 0.00 C ATOM 1057 CE2 TYR A 68 -10.813 -0.417 4.320 1.00 0.00 C ATOM 1058 CZ TYR A 68 -9.967 -1.337 4.901 1.00 0.00 C ATOM 1059 OH TYR A 68 -10.262 -1.848 6.145 1.00 0.00 O ATOM 0 H TYR A 68 -8.271 0.819 -1.248 1.00 0.00 H new ATOM 0 HA TYR A 68 -7.947 -1.464 0.351 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -8.195 0.926 1.106 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -9.892 0.855 0.676 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -7.642 -1.559 2.481 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -11.178 0.816 2.619 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -8.169 -2.473 4.699 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -11.705 -0.097 4.838 1.00 0.00 H new ATOM 0 HH TYR A 68 -11.097 -1.453 6.471 1.00 0.00 H new ATOM 1069 N GLN A 69 -10.769 -1.276 -1.273 1.00 0.00 N ATOM 1070 CA GLN A 69 -11.985 -2.004 -1.618 1.00 0.00 C ATOM 1071 C GLN A 69 -11.670 -3.450 -1.987 1.00 0.00 C ATOM 1072 O GLN A 69 -12.358 -4.375 -1.557 1.00 0.00 O ATOM 1073 CB GLN A 69 -12.705 -1.315 -2.778 1.00 0.00 C ATOM 1074 CG GLN A 69 -13.499 -0.089 -2.358 1.00 0.00 C ATOM 1075 CD GLN A 69 -12.637 0.959 -1.680 1.00 0.00 C ATOM 1076 OE1 GLN A 69 -11.575 1.326 -2.182 1.00 0.00 O ATOM 1077 NE2 GLN A 69 -13.092 1.446 -0.531 1.00 0.00 N ATOM 0 H GLN A 69 -10.589 -0.457 -1.854 1.00 0.00 H new ATOM 0 HA GLN A 69 -12.636 -2.006 -0.744 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -11.971 -1.023 -3.528 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -13.378 -2.029 -3.252 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -13.975 0.349 -3.235 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -14.297 -0.392 -1.680 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -13.978 1.113 -0.151 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -12.555 2.153 -0.029 1.00 0.00 H new ATOM 1086 N ASP A 70 -10.623 -3.637 -2.786 1.00 0.00 N ATOM 1087 CA ASP A 70 -10.216 -4.971 -3.211 1.00 0.00 C ATOM 1088 C ASP A 70 -9.854 -5.838 -2.010 1.00 0.00 C ATOM 1089 O ASP A 70 -10.164 -7.029 -1.974 1.00 0.00 O ATOM 1090 CB ASP A 70 -9.028 -4.883 -4.171 1.00 0.00 C ATOM 1091 CG ASP A 70 -9.457 -4.900 -5.625 1.00 0.00 C ATOM 1092 OD1 ASP A 70 -9.997 -5.934 -6.072 1.00 0.00 O ATOM 1093 OD2 ASP A 70 -9.254 -3.880 -6.316 1.00 0.00 O ATOM 0 H ASP A 70 -10.042 -2.882 -3.151 1.00 0.00 H new ATOM 0 HA ASP A 70 -11.057 -5.433 -3.728 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -8.469 -3.969 -3.971 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -8.351 -5.717 -3.985 1.00 0.00 H new ATOM 1098 N LEU A 71 -9.196 -5.232 -1.027 1.00 0.00 N ATOM 1099 CA LEU A 71 -8.790 -5.948 0.177 1.00 0.00 C ATOM 1100 C LEU A 71 -10.007 -6.470 0.935 1.00 0.00 C ATOM 1101 O LEU A 71 -9.988 -7.576 1.474 1.00 0.00 O ATOM 1102 CB LEU A 71 -7.963 -5.036 1.084 1.00 0.00 C ATOM 1103 CG LEU A 71 -6.650 -4.538 0.478 1.00 0.00 C ATOM 1104 CD1 LEU A 71 -6.023 -3.474 1.366 1.00 0.00 C ATOM 1105 CD2 LEU A 71 -5.687 -5.698 0.272 1.00 0.00 C ATOM 0 H LEU A 71 -8.933 -4.247 -1.041 1.00 0.00 H new ATOM 0 HA LEU A 71 -8.179 -6.799 -0.125 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -8.570 -4.173 1.356 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -7.739 -5.572 2.006 1.00 0.00 H new ATOM 0 HG LEU A 71 -6.864 -4.091 -0.493 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -5.090 -3.131 0.919 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -6.709 -2.632 1.465 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -5.821 -3.895 2.351 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -4.758 -5.327 -0.160 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -5.478 -6.172 1.231 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -6.135 -6.427 -0.403 1.00 0.00 H new ATOM 1117 N LEU A 72 -11.064 -5.665 0.970 1.00 0.00 N ATOM 1118 CA LEU A 72 -12.290 -6.045 1.663 1.00 0.00 C ATOM 1119 C LEU A 72 -13.143 -6.965 0.795 1.00 0.00 C ATOM 1120 O LEU A 72 -13.812 -7.866 1.300 1.00 0.00 O ATOM 1121 CB LEU A 72 -13.091 -4.798 2.046 1.00 0.00 C ATOM 1122 CG LEU A 72 -12.385 -3.849 3.016 1.00 0.00 C ATOM 1123 CD1 LEU A 72 -13.253 -2.633 3.298 1.00 0.00 C ATOM 1124 CD2 LEU A 72 -12.038 -4.572 4.308 1.00 0.00 C ATOM 0 H LEU A 72 -11.096 -4.747 0.527 1.00 0.00 H new ATOM 0 HA LEU A 72 -12.014 -6.584 2.569 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -13.336 -4.248 1.137 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -14.034 -5.113 2.492 1.00 0.00 H new ATOM 0 HG LEU A 72 -11.459 -3.508 2.554 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -12.735 -1.969 3.990 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -13.451 -2.103 2.366 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -14.196 -2.954 3.740 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -11.536 -3.883 4.987 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -12.951 -4.941 4.775 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -11.378 -5.411 4.089 1.00 0.00 H new ATOM 1136 N GLN A 73 -13.114 -6.731 -0.512 1.00 0.00 N ATOM 1137 CA GLN A 73 -13.885 -7.539 -1.451 1.00 0.00 C ATOM 1138 C GLN A 73 -13.425 -8.993 -1.421 1.00 0.00 C ATOM 1139 O GLN A 73 -14.220 -9.910 -1.630 1.00 0.00 O ATOM 1140 CB GLN A 73 -13.756 -6.976 -2.867 1.00 0.00 C ATOM 1141 CG GLN A 73 -15.076 -6.913 -3.619 1.00 0.00 C ATOM 1142 CD GLN A 73 -14.983 -7.504 -5.013 1.00 0.00 C ATOM 1143 OE1 GLN A 73 -14.262 -6.993 -5.869 1.00 0.00 O ATOM 1144 NE2 GLN A 73 -15.716 -8.587 -5.246 1.00 0.00 N ATOM 0 H GLN A 73 -12.565 -5.989 -0.946 1.00 0.00 H new ATOM 0 HA GLN A 73 -14.932 -7.503 -1.150 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -13.330 -5.974 -2.813 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -13.055 -7.591 -3.431 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -15.838 -7.447 -3.052 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -15.400 -5.875 -3.690 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -16.300 -8.977 -4.506 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -15.695 -9.029 -6.165 1.00 0.00 H new ATOM 1153 N LEU A 74 -12.138 -9.196 -1.162 1.00 0.00 N ATOM 1154 CA LEU A 74 -11.573 -10.539 -1.106 1.00 0.00 C ATOM 1155 C LEU A 74 -12.104 -11.304 0.103 1.00 0.00 C ATOM 1156 O LEU A 74 -12.357 -12.506 0.026 1.00 0.00 O ATOM 1157 CB LEU A 74 -10.045 -10.471 -1.048 1.00 0.00 C ATOM 1158 CG LEU A 74 -9.367 -10.041 -2.350 1.00 0.00 C ATOM 1159 CD1 LEU A 74 -7.888 -9.772 -2.118 1.00 0.00 C ATOM 1160 CD2 LEU A 74 -9.556 -11.100 -3.425 1.00 0.00 C ATOM 0 H LEU A 74 -11.467 -8.448 -0.988 1.00 0.00 H new ATOM 0 HA LEU A 74 -11.873 -11.069 -2.010 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -9.757 -9.776 -0.259 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -9.663 -11.452 -0.764 1.00 0.00 H new ATOM 0 HG LEU A 74 -9.834 -9.118 -2.692 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -7.422 -9.467 -3.055 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -7.774 -8.977 -1.381 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -7.406 -10.679 -1.751 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -9.067 -10.777 -4.344 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -9.116 -12.040 -3.091 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -10.620 -11.243 -3.611 1.00 0.00 H new ATOM 1172 N GLN A 75 -12.272 -10.598 1.216 1.00 0.00 N ATOM 1173 CA GLN A 75 -12.775 -11.210 2.441 1.00 0.00 C ATOM 1174 C GLN A 75 -14.249 -11.577 2.300 1.00 0.00 C ATOM 1175 O GLN A 75 -14.712 -12.562 2.875 1.00 0.00 O ATOM 1176 CB GLN A 75 -12.580 -10.263 3.627 1.00 0.00 C ATOM 1177 CG GLN A 75 -11.364 -10.595 4.477 1.00 0.00 C ATOM 1178 CD GLN A 75 -11.702 -10.734 5.949 1.00 0.00 C ATOM 1179 OE1 GLN A 75 -12.660 -11.413 6.317 1.00 0.00 O ATOM 1180 NE2 GLN A 75 -10.912 -10.090 6.801 1.00 0.00 N ATOM 0 H GLN A 75 -12.067 -9.602 1.295 1.00 0.00 H new ATOM 0 HA GLN A 75 -12.209 -12.124 2.621 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -12.485 -9.243 3.255 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -13.471 -10.292 4.255 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -10.919 -11.524 4.121 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -10.614 -9.814 4.352 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -10.128 -9.538 6.452 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -11.089 -10.148 7.804 1.00 0.00 H new ATOM 1189 N TYR A 76 -14.982 -10.777 1.532 1.00 0.00 N ATOM 1190 CA TYR A 76 -16.403 -11.017 1.315 1.00 0.00 C ATOM 1191 C TYR A 76 -16.620 -12.252 0.446 1.00 0.00 C ATOM 1192 O TYR A 76 -17.569 -13.009 0.651 1.00 0.00 O ATOM 1193 CB TYR A 76 -17.055 -9.798 0.662 1.00 0.00 C ATOM 1194 CG TYR A 76 -18.565 -9.871 0.613 1.00 0.00 C ATOM 1195 CD1 TYR A 76 -19.304 -10.121 1.762 1.00 0.00 C ATOM 1196 CD2 TYR A 76 -19.250 -9.691 -0.582 1.00 0.00 C ATOM 1197 CE1 TYR A 76 -20.685 -10.189 1.722 1.00 0.00 C ATOM 1198 CE2 TYR A 76 -20.630 -9.758 -0.630 1.00 0.00 C ATOM 1199 CZ TYR A 76 -21.342 -10.007 0.524 1.00 0.00 C ATOM 1200 OH TYR A 76 -22.716 -10.074 0.480 1.00 0.00 O ATOM 0 H TYR A 76 -14.615 -9.957 1.050 1.00 0.00 H new ATOM 0 HA TYR A 76 -16.868 -11.192 2.285 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -16.761 -8.902 1.209 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -16.672 -9.692 -0.353 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -18.792 -10.265 2.702 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -18.696 -9.496 -1.488 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -21.245 -10.384 2.624 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -21.148 -9.616 -1.567 1.00 0.00 H new ATOM 0 HH TYR A 76 -23.022 -9.922 -0.439 1.00 0.00 H new ATOM 1210 N GLU A 77 -15.733 -12.449 -0.524 1.00 0.00 N ATOM 1211 CA GLU A 77 -15.826 -13.592 -1.424 1.00 0.00 C ATOM 1212 C GLU A 77 -15.278 -14.852 -0.761 1.00 0.00 C ATOM 1213 O GLU A 77 -15.952 -15.881 -0.708 1.00 0.00 O ATOM 1214 CB GLU A 77 -15.065 -13.312 -2.721 1.00 0.00 C ATOM 1215 CG GLU A 77 -15.912 -12.643 -3.791 1.00 0.00 C ATOM 1216 CD GLU A 77 -15.649 -13.202 -5.176 1.00 0.00 C ATOM 1217 OE1 GLU A 77 -14.673 -12.759 -5.819 1.00 0.00 O ATOM 1218 OE2 GLU A 77 -16.417 -14.082 -5.617 1.00 0.00 O ATOM 0 H GLU A 77 -14.942 -11.832 -0.707 1.00 0.00 H new ATOM 0 HA GLU A 77 -16.878 -13.753 -1.657 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -14.207 -12.677 -2.499 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -14.674 -14.251 -3.113 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -16.967 -12.769 -3.546 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -15.711 -11.572 -3.791 1.00 0.00 H new ATOM 1225 N GLY A 78 -14.052 -14.763 -0.256 1.00 0.00 N ATOM 1226 CA GLY A 78 -13.434 -15.902 0.397 1.00 0.00 C ATOM 1227 C GLY A 78 -12.033 -16.175 -0.113 1.00 0.00 C ATOM 1228 O GLY A 78 -11.727 -17.289 -0.541 1.00 0.00 O ATOM 0 H GLY A 78 -13.475 -13.922 -0.287 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -13.398 -15.725 1.472 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -14.053 -16.786 0.241 1.00 0.00 H new ATOM 1232 N VAL A 79 -11.180 -15.157 -0.070 1.00 0.00 N ATOM 1233 CA VAL A 79 -9.803 -15.292 -0.531 1.00 0.00 C ATOM 1234 C VAL A 79 -8.817 -14.924 0.571 1.00 0.00 C ATOM 1235 O VAL A 79 -8.914 -13.854 1.173 1.00 0.00 O ATOM 1236 CB VAL A 79 -9.534 -14.408 -1.764 1.00 0.00 C ATOM 1237 CG1 VAL A 79 -8.146 -14.679 -2.324 1.00 0.00 C ATOM 1238 CG2 VAL A 79 -10.598 -14.631 -2.828 1.00 0.00 C ATOM 0 H VAL A 79 -11.418 -14.229 0.280 1.00 0.00 H new ATOM 0 HA VAL A 79 -9.662 -16.337 -0.806 1.00 0.00 H new ATOM 0 HB VAL A 79 -9.579 -13.364 -1.453 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -7.975 -14.045 -3.194 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -7.397 -14.460 -1.563 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -8.070 -15.726 -2.617 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -10.389 -13.997 -3.690 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -10.591 -15.677 -3.136 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -11.578 -14.379 -2.421 1.00 0.00 H new ATOM 1248 N ALA A 80 -7.867 -15.816 0.831 1.00 0.00 N ATOM 1249 CA ALA A 80 -6.861 -15.584 1.860 1.00 0.00 C ATOM 1250 C ALA A 80 -5.530 -15.170 1.243 1.00 0.00 C ATOM 1251 O ALA A 80 -4.776 -14.395 1.832 1.00 0.00 O ATOM 1252 CB ALA A 80 -6.685 -16.830 2.715 1.00 0.00 C ATOM 0 H ALA A 80 -7.773 -16.707 0.343 1.00 0.00 H new ATOM 0 HA ALA A 80 -7.206 -14.767 2.494 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -5.931 -16.643 3.480 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -7.632 -17.080 3.193 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -6.366 -17.661 2.086 1.00 0.00 H new ATOM 1258 N VAL A 81 -5.248 -15.692 0.053 1.00 0.00 N ATOM 1259 CA VAL A 81 -4.006 -15.376 -0.644 1.00 0.00 C ATOM 1260 C VAL A 81 -4.241 -14.348 -1.745 1.00 0.00 C ATOM 1261 O VAL A 81 -5.268 -14.374 -2.424 1.00 0.00 O ATOM 1262 CB VAL A 81 -3.373 -16.636 -1.261 1.00 0.00 C ATOM 1263 CG1 VAL A 81 -1.988 -16.325 -1.809 1.00 0.00 C ATOM 1264 CG2 VAL A 81 -3.309 -17.759 -0.236 1.00 0.00 C ATOM 0 H VAL A 81 -5.862 -16.335 -0.448 1.00 0.00 H new ATOM 0 HA VAL A 81 -3.323 -14.961 0.097 1.00 0.00 H new ATOM 0 HB VAL A 81 -4.000 -16.966 -2.089 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -1.556 -17.228 -2.241 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -2.065 -15.556 -2.578 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -1.349 -15.968 -1.001 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -2.859 -18.641 -0.691 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -2.706 -17.441 0.615 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -4.316 -18.000 0.103 1.00 0.00 H new ATOM 1274 N MET A 82 -3.283 -13.443 -1.917 1.00 0.00 N ATOM 1275 CA MET A 82 -3.386 -12.405 -2.937 1.00 0.00 C ATOM 1276 C MET A 82 -2.224 -12.495 -3.922 1.00 0.00 C ATOM 1277 O MET A 82 -1.131 -12.936 -3.570 1.00 0.00 O ATOM 1278 CB MET A 82 -3.410 -11.021 -2.285 1.00 0.00 C ATOM 1279 CG MET A 82 -3.696 -9.894 -3.263 1.00 0.00 C ATOM 1280 SD MET A 82 -4.726 -8.599 -2.548 1.00 0.00 S ATOM 1281 CE MET A 82 -3.918 -7.132 -3.184 1.00 0.00 C ATOM 0 H MET A 82 -2.427 -13.407 -1.364 1.00 0.00 H new ATOM 0 HA MET A 82 -4.316 -12.558 -3.484 1.00 0.00 H new ATOM 0 HB2 MET A 82 -4.167 -11.011 -1.500 1.00 0.00 H new ATOM 0 HB3 MET A 82 -2.449 -10.838 -1.804 1.00 0.00 H new ATOM 0 HG2 MET A 82 -2.754 -9.460 -3.597 1.00 0.00 H new ATOM 0 HG3 MET A 82 -4.190 -10.300 -4.145 1.00 0.00 H new ATOM 0 HE1 MET A 82 -3.375 -6.638 -2.379 1.00 0.00 H new ATOM 0 HE2 MET A 82 -3.221 -7.414 -3.973 1.00 0.00 H new ATOM 0 HE3 MET A 82 -4.667 -6.450 -3.588 1.00 0.00 H new ATOM 1291 N LYS A 83 -2.471 -12.076 -5.159 1.00 0.00 N ATOM 1292 CA LYS A 83 -1.446 -12.109 -6.196 1.00 0.00 C ATOM 1293 C LYS A 83 -0.969 -10.700 -6.535 1.00 0.00 C ATOM 1294 O LYS A 83 -1.613 -9.983 -7.300 1.00 0.00 O ATOM 1295 CB LYS A 83 -1.987 -12.793 -7.453 1.00 0.00 C ATOM 1296 CG LYS A 83 -0.964 -12.902 -8.573 1.00 0.00 C ATOM 1297 CD LYS A 83 -0.279 -14.258 -8.572 1.00 0.00 C ATOM 1298 CE LYS A 83 0.632 -14.421 -7.365 1.00 0.00 C ATOM 1299 NZ LYS A 83 1.878 -15.161 -7.706 1.00 0.00 N ATOM 0 H LYS A 83 -3.372 -11.710 -5.468 1.00 0.00 H new ATOM 0 HA LYS A 83 -0.598 -12.678 -5.816 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -2.336 -13.792 -7.192 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -2.852 -12.238 -7.815 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -1.455 -12.742 -9.533 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -0.217 -12.116 -8.463 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -1.031 -15.047 -8.571 1.00 0.00 H new ATOM 0 HD3 LYS A 83 0.303 -14.374 -9.487 1.00 0.00 H new ATOM 0 HE2 LYS A 83 0.890 -13.439 -6.970 1.00 0.00 H new ATOM 0 HE3 LYS A 83 0.099 -14.952 -6.577 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 2.544 -15.105 -6.909 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 1.649 -16.157 -7.897 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 2.313 -14.738 -8.551 1.00 0.00 H new ATOM 1313 N LEU A 84 0.165 -10.312 -5.961 1.00 0.00 N ATOM 1314 CA LEU A 84 0.729 -8.989 -6.203 1.00 0.00 C ATOM 1315 C LEU A 84 1.936 -9.074 -7.132 1.00 0.00 C ATOM 1316 O LEU A 84 2.862 -9.848 -6.894 1.00 0.00 O ATOM 1317 CB LEU A 84 1.133 -8.334 -4.881 1.00 0.00 C ATOM 1318 CG LEU A 84 0.031 -7.519 -4.199 1.00 0.00 C ATOM 1319 CD1 LEU A 84 0.175 -7.589 -2.687 1.00 0.00 C ATOM 1320 CD2 LEU A 84 0.067 -6.074 -4.673 1.00 0.00 C ATOM 0 H LEU A 84 0.711 -10.894 -5.326 1.00 0.00 H new ATOM 0 HA LEU A 84 -0.035 -8.378 -6.684 1.00 0.00 H new ATOM 0 HB2 LEU A 84 1.466 -9.112 -4.194 1.00 0.00 H new ATOM 0 HB3 LEU A 84 1.987 -7.682 -5.062 1.00 0.00 H new ATOM 0 HG LEU A 84 -0.934 -7.947 -4.472 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -0.617 -7.004 -2.219 1.00 0.00 H new ATOM 0 HD12 LEU A 84 0.100 -8.627 -2.362 1.00 0.00 H new ATOM 0 HD13 LEU A 84 1.145 -7.186 -2.395 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -0.723 -5.509 -4.178 1.00 0.00 H new ATOM 0 HD22 LEU A 84 1.034 -5.635 -4.429 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -0.085 -6.041 -5.752 1.00 0.00 H new ATOM 1332 N PHE A 85 1.916 -8.273 -8.193 1.00 0.00 N ATOM 1333 CA PHE A 85 3.008 -8.256 -9.160 1.00 0.00 C ATOM 1334 C PHE A 85 3.187 -9.627 -9.808 1.00 0.00 C ATOM 1335 O PHE A 85 4.263 -9.945 -10.316 1.00 0.00 O ATOM 1336 CB PHE A 85 4.310 -7.826 -8.482 1.00 0.00 C ATOM 1337 CG PHE A 85 4.220 -6.489 -7.803 1.00 0.00 C ATOM 1338 CD1 PHE A 85 3.737 -5.383 -8.485 1.00 0.00 C ATOM 1339 CD2 PHE A 85 4.618 -6.338 -6.486 1.00 0.00 C ATOM 1340 CE1 PHE A 85 3.653 -4.152 -7.864 1.00 0.00 C ATOM 1341 CE2 PHE A 85 4.537 -5.109 -5.858 1.00 0.00 C ATOM 1342 CZ PHE A 85 4.052 -4.014 -6.549 1.00 0.00 C ATOM 0 H PHE A 85 1.155 -7.627 -8.405 1.00 0.00 H new ATOM 0 HA PHE A 85 2.757 -7.537 -9.940 1.00 0.00 H new ATOM 0 HB2 PHE A 85 4.593 -8.579 -7.747 1.00 0.00 H new ATOM 0 HB3 PHE A 85 5.105 -7.793 -9.227 1.00 0.00 H new ATOM 0 HD1 PHE A 85 3.423 -5.485 -9.513 1.00 0.00 H new ATOM 0 HD2 PHE A 85 4.997 -7.191 -5.942 1.00 0.00 H new ATOM 0 HE1 PHE A 85 3.275 -3.298 -8.407 1.00 0.00 H new ATOM 0 HE2 PHE A 85 4.852 -5.005 -4.830 1.00 0.00 H new ATOM 0 HZ PHE A 85 3.985 -3.053 -6.061 1.00 0.00 H new ATOM 1352 N ASP A 86 2.130 -10.435 -9.789 1.00 0.00 N ATOM 1353 CA ASP A 86 2.174 -11.769 -10.377 1.00 0.00 C ATOM 1354 C ASP A 86 3.337 -12.581 -9.813 1.00 0.00 C ATOM 1355 O ASP A 86 3.888 -13.447 -10.492 1.00 0.00 O ATOM 1356 CB ASP A 86 2.297 -11.673 -11.900 1.00 0.00 C ATOM 1357 CG ASP A 86 1.517 -12.762 -12.612 1.00 0.00 C ATOM 1358 OD1 ASP A 86 1.419 -13.878 -12.061 1.00 0.00 O ATOM 1359 OD2 ASP A 86 1.006 -12.496 -13.721 1.00 0.00 O ATOM 0 H ASP A 86 1.232 -10.188 -9.372 1.00 0.00 H new ATOM 0 HA ASP A 86 1.245 -12.279 -10.123 1.00 0.00 H new ATOM 0 HB2 ASP A 86 1.939 -10.698 -12.230 1.00 0.00 H new ATOM 0 HB3 ASP A 86 3.348 -11.739 -12.182 1.00 0.00 H new ATOM 1364 N ARG A 87 3.705 -12.296 -8.568 1.00 0.00 N ATOM 1365 CA ARG A 87 4.802 -13.000 -7.915 1.00 0.00 C ATOM 1366 C ARG A 87 4.652 -12.955 -6.397 1.00 0.00 C ATOM 1367 O ARG A 87 4.458 -13.985 -5.752 1.00 0.00 O ATOM 1368 CB ARG A 87 6.144 -12.388 -8.325 1.00 0.00 C ATOM 1369 CG ARG A 87 6.804 -13.099 -9.496 1.00 0.00 C ATOM 1370 CD ARG A 87 7.418 -12.111 -10.475 1.00 0.00 C ATOM 1371 NE ARG A 87 7.557 -12.682 -11.813 1.00 0.00 N ATOM 1372 CZ ARG A 87 7.724 -11.954 -12.915 1.00 0.00 C ATOM 1373 NH1 ARG A 87 7.772 -10.630 -12.844 1.00 0.00 N ATOM 1374 NH2 ARG A 87 7.843 -12.553 -14.092 1.00 0.00 N ATOM 0 H ARG A 87 3.259 -11.582 -7.991 1.00 0.00 H new ATOM 0 HA ARG A 87 4.772 -14.042 -8.234 1.00 0.00 H new ATOM 0 HB2 ARG A 87 5.992 -11.341 -8.586 1.00 0.00 H new ATOM 0 HB3 ARG A 87 6.820 -12.409 -7.470 1.00 0.00 H new ATOM 0 HG2 ARG A 87 7.576 -13.773 -9.125 1.00 0.00 H new ATOM 0 HG3 ARG A 87 6.066 -13.713 -10.012 1.00 0.00 H new ATOM 0 HD2 ARG A 87 6.797 -11.217 -10.525 1.00 0.00 H new ATOM 0 HD3 ARG A 87 8.397 -11.800 -10.110 1.00 0.00 H new ATOM 0 HE ARG A 87 7.524 -13.697 -11.908 1.00 0.00 H new ATOM 0 HH11 ARG A 87 7.681 -10.164 -11.941 1.00 0.00 H new ATOM 0 HH12 ARG A 87 7.900 -10.078 -13.692 1.00 0.00 H new ATOM 0 HH21 ARG A 87 7.807 -13.571 -14.152 1.00 0.00 H new ATOM 0 HH22 ARG A 87 7.971 -11.996 -14.937 1.00 0.00 H new ATOM 1388 N ALA A 88 4.743 -11.754 -5.835 1.00 0.00 N ATOM 1389 CA ALA A 88 4.619 -11.574 -4.393 1.00 0.00 C ATOM 1390 C ALA A 88 3.222 -11.945 -3.911 1.00 0.00 C ATOM 1391 O ALA A 88 2.228 -11.373 -4.356 1.00 0.00 O ATOM 1392 CB ALA A 88 4.947 -10.139 -4.013 1.00 0.00 C ATOM 0 H ALA A 88 4.902 -10.892 -6.356 1.00 0.00 H new ATOM 0 HA ALA A 88 5.330 -12.240 -3.905 1.00 0.00 H new ATOM 0 HB1 ALA A 88 4.851 -10.017 -2.934 1.00 0.00 H new ATOM 0 HB2 ALA A 88 5.968 -9.907 -4.315 1.00 0.00 H new ATOM 0 HB3 ALA A 88 4.257 -9.462 -4.517 1.00 0.00 H new ATOM 1398 N LYS A 89 3.154 -12.907 -2.995 1.00 0.00 N ATOM 1399 CA LYS A 89 1.879 -13.355 -2.449 1.00 0.00 C ATOM 1400 C LYS A 89 1.703 -12.868 -1.015 1.00 0.00 C ATOM 1401 O LYS A 89 2.483 -13.221 -0.129 1.00 0.00 O ATOM 1402 CB LYS A 89 1.785 -14.881 -2.498 1.00 0.00 C ATOM 1403 CG LYS A 89 1.534 -15.430 -3.893 1.00 0.00 C ATOM 1404 CD LYS A 89 1.600 -16.949 -3.914 1.00 0.00 C ATOM 1405 CE LYS A 89 0.714 -17.533 -5.003 1.00 0.00 C ATOM 1406 NZ LYS A 89 1.512 -18.210 -6.064 1.00 0.00 N ATOM 0 H LYS A 89 3.968 -13.391 -2.616 1.00 0.00 H new ATOM 0 HA LYS A 89 1.081 -12.931 -3.059 1.00 0.00 H new ATOM 0 HB2 LYS A 89 2.711 -15.306 -2.110 1.00 0.00 H new ATOM 0 HB3 LYS A 89 0.982 -15.209 -1.838 1.00 0.00 H new ATOM 0 HG2 LYS A 89 0.555 -15.102 -4.243 1.00 0.00 H new ATOM 0 HG3 LYS A 89 2.273 -15.023 -4.584 1.00 0.00 H new ATOM 0 HD2 LYS A 89 2.630 -17.267 -4.073 1.00 0.00 H new ATOM 0 HD3 LYS A 89 1.292 -17.341 -2.945 1.00 0.00 H new ATOM 0 HE2 LYS A 89 0.018 -18.246 -4.561 1.00 0.00 H new ATOM 0 HE3 LYS A 89 0.116 -16.739 -5.450 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 0.872 -18.595 -6.788 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 2.158 -17.524 -6.503 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 2.063 -18.985 -5.643 1.00 0.00 H new ATOM 1420 N VAL A 90 0.675 -12.056 -0.790 1.00 0.00 N ATOM 1421 CA VAL A 90 0.399 -11.521 0.537 1.00 0.00 C ATOM 1422 C VAL A 90 -0.916 -12.061 1.087 1.00 0.00 C ATOM 1423 O VAL A 90 -1.807 -12.445 0.329 1.00 0.00 O ATOM 1424 CB VAL A 90 0.340 -9.981 0.521 1.00 0.00 C ATOM 1425 CG1 VAL A 90 0.270 -9.435 1.939 1.00 0.00 C ATOM 1426 CG2 VAL A 90 1.538 -9.408 -0.221 1.00 0.00 C ATOM 0 H VAL A 90 0.019 -11.754 -1.511 1.00 0.00 H new ATOM 0 HA VAL A 90 1.218 -11.841 1.182 1.00 0.00 H new ATOM 0 HB VAL A 90 -0.564 -9.675 -0.006 1.00 0.00 H new ATOM 0 HG11 VAL A 90 0.229 -8.346 1.908 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -0.623 -9.818 2.433 1.00 0.00 H new ATOM 0 HG13 VAL A 90 1.154 -9.749 2.494 1.00 0.00 H new ATOM 0 HG21 VAL A 90 1.479 -8.320 -0.222 1.00 0.00 H new ATOM 0 HG22 VAL A 90 2.457 -9.721 0.275 1.00 0.00 H new ATOM 0 HG23 VAL A 90 1.538 -9.772 -1.248 1.00 0.00 H new ATOM 1436 N ASN A 91 -1.031 -12.086 2.411 1.00 0.00 N ATOM 1437 CA ASN A 91 -2.239 -12.577 3.065 1.00 0.00 C ATOM 1438 C ASN A 91 -3.219 -11.437 3.319 1.00 0.00 C ATOM 1439 O ASN A 91 -2.953 -10.546 4.124 1.00 0.00 O ATOM 1440 CB ASN A 91 -1.886 -13.266 4.385 1.00 0.00 C ATOM 1441 CG ASN A 91 -2.966 -14.224 4.846 1.00 0.00 C ATOM 1442 OD1 ASN A 91 -3.686 -14.804 4.032 1.00 0.00 O ATOM 1443 ND2 ASN A 91 -3.085 -14.395 6.157 1.00 0.00 N ATOM 0 H ASN A 91 -0.302 -11.772 3.052 1.00 0.00 H new ATOM 0 HA ASN A 91 -2.714 -13.301 2.402 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -0.948 -13.809 4.268 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -1.723 -12.510 5.153 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -3.795 -15.028 6.526 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -2.467 -13.894 6.795 1.00 0.00 H new ATOM 1450 N VAL A 92 -4.352 -11.471 2.626 1.00 0.00 N ATOM 1451 CA VAL A 92 -5.372 -10.439 2.775 1.00 0.00 C ATOM 1452 C VAL A 92 -5.953 -10.435 4.186 1.00 0.00 C ATOM 1453 O VAL A 92 -6.437 -9.409 4.664 1.00 0.00 O ATOM 1454 CB VAL A 92 -6.516 -10.630 1.761 1.00 0.00 C ATOM 1455 CG1 VAL A 92 -7.486 -9.460 1.820 1.00 0.00 C ATOM 1456 CG2 VAL A 92 -5.963 -10.801 0.354 1.00 0.00 C ATOM 0 H VAL A 92 -4.587 -12.202 1.955 1.00 0.00 H new ATOM 0 HA VAL A 92 -4.883 -9.483 2.586 1.00 0.00 H new ATOM 0 HB VAL A 92 -7.060 -11.537 2.026 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -8.286 -9.614 1.096 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -7.911 -9.390 2.821 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -6.957 -8.537 1.585 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -6.787 -10.935 -0.347 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -5.391 -9.915 0.078 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -5.314 -11.676 0.322 1.00 0.00 H new ATOM 1466 N ASN A 93 -5.907 -11.587 4.846 1.00 0.00 N ATOM 1467 CA ASN A 93 -6.433 -11.714 6.201 1.00 0.00 C ATOM 1468 C ASN A 93 -5.600 -10.909 7.193 1.00 0.00 C ATOM 1469 O ASN A 93 -6.112 -10.436 8.208 1.00 0.00 O ATOM 1470 CB ASN A 93 -6.464 -13.184 6.621 1.00 0.00 C ATOM 1471 CG ASN A 93 -7.759 -13.869 6.234 1.00 0.00 C ATOM 1472 OD1 ASN A 93 -8.133 -13.899 5.061 1.00 0.00 O ATOM 1473 ND2 ASN A 93 -8.453 -14.426 7.219 1.00 0.00 N ATOM 0 H ASN A 93 -5.511 -12.446 4.465 1.00 0.00 H new ATOM 0 HA ASN A 93 -7.448 -11.317 6.205 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -5.627 -13.708 6.160 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -6.328 -13.253 7.700 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -9.332 -14.902 7.018 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -8.107 -14.378 8.177 1.00 0.00 H new ATOM 1480 N LEU A 94 -4.313 -10.757 6.898 1.00 0.00 N ATOM 1481 CA LEU A 94 -3.411 -10.012 7.770 1.00 0.00 C ATOM 1482 C LEU A 94 -3.023 -8.674 7.146 1.00 0.00 C ATOM 1483 O LEU A 94 -2.701 -7.719 7.855 1.00 0.00 O ATOM 1484 CB LEU A 94 -2.155 -10.834 8.061 1.00 0.00 C ATOM 1485 CG LEU A 94 -2.364 -12.025 8.997 1.00 0.00 C ATOM 1486 CD1 LEU A 94 -1.089 -12.846 9.109 1.00 0.00 C ATOM 1487 CD2 LEU A 94 -2.816 -11.549 10.370 1.00 0.00 C ATOM 0 H LEU A 94 -3.871 -11.140 6.062 1.00 0.00 H new ATOM 0 HA LEU A 94 -3.935 -9.815 8.705 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -1.752 -11.200 7.117 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -1.402 -10.177 8.496 1.00 0.00 H new ATOM 0 HG LEU A 94 -3.145 -12.660 8.578 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -1.257 -13.689 9.779 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -0.807 -13.216 8.123 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -0.288 -12.222 9.505 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -2.960 -12.409 11.024 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -2.057 -10.893 10.796 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -3.755 -11.004 10.275 1.00 0.00 H new ATOM 1499 N LEU A 95 -3.051 -8.610 5.819 1.00 0.00 N ATOM 1500 CA LEU A 95 -2.698 -7.389 5.103 1.00 0.00 C ATOM 1501 C LEU A 95 -3.561 -6.217 5.559 1.00 0.00 C ATOM 1502 O LEU A 95 -3.093 -5.080 5.632 1.00 0.00 O ATOM 1503 CB LEU A 95 -2.855 -7.594 3.596 1.00 0.00 C ATOM 1504 CG LEU A 95 -2.359 -6.436 2.729 1.00 0.00 C ATOM 1505 CD1 LEU A 95 -0.921 -6.086 3.077 1.00 0.00 C ATOM 1506 CD2 LEU A 95 -2.482 -6.785 1.253 1.00 0.00 C ATOM 0 H LEU A 95 -3.315 -9.390 5.217 1.00 0.00 H new ATOM 0 HA LEU A 95 -1.657 -7.157 5.327 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -2.317 -8.498 3.310 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -3.909 -7.767 3.376 1.00 0.00 H new ATOM 0 HG LEU A 95 -2.982 -5.564 2.930 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -0.586 -5.260 2.450 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -0.861 -5.793 4.125 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -0.284 -6.954 2.906 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -2.125 -5.950 0.651 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -1.884 -7.670 1.037 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -3.526 -6.985 1.012 1.00 0.00 H new ATOM 1518 N ILE A 96 -4.822 -6.500 5.866 1.00 0.00 N ATOM 1519 CA ILE A 96 -5.750 -5.470 6.314 1.00 0.00 C ATOM 1520 C ILE A 96 -5.563 -5.167 7.797 1.00 0.00 C ATOM 1521 O ILE A 96 -5.806 -4.048 8.247 1.00 0.00 O ATOM 1522 CB ILE A 96 -7.213 -5.885 6.066 1.00 0.00 C ATOM 1523 CG1 ILE A 96 -7.389 -6.378 4.629 1.00 0.00 C ATOM 1524 CG2 ILE A 96 -8.150 -4.723 6.353 1.00 0.00 C ATOM 1525 CD1 ILE A 96 -8.658 -7.174 4.415 1.00 0.00 C ATOM 0 H ILE A 96 -5.225 -7.436 5.812 1.00 0.00 H new ATOM 0 HA ILE A 96 -5.531 -4.574 5.733 1.00 0.00 H new ATOM 0 HB ILE A 96 -7.463 -6.702 6.743 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -7.390 -5.520 3.957 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -6.532 -6.995 4.357 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -9.179 -5.033 6.173 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -8.040 -4.415 7.393 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -7.903 -3.887 5.699 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -8.717 -7.491 3.374 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -8.651 -8.051 5.062 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -9.521 -6.554 4.655 1.00 0.00 H new ATOM 1537 N PHE A 97 -5.131 -6.172 8.553 1.00 0.00 N ATOM 1538 CA PHE A 97 -4.912 -6.012 9.986 1.00 0.00 C ATOM 1539 C PHE A 97 -3.786 -5.019 10.257 1.00 0.00 C ATOM 1540 O PHE A 97 -3.942 -4.090 11.050 1.00 0.00 O ATOM 1541 CB PHE A 97 -4.582 -7.362 10.625 1.00 0.00 C ATOM 1542 CG PHE A 97 -4.869 -7.414 12.099 1.00 0.00 C ATOM 1543 CD1 PHE A 97 -4.170 -6.607 12.983 1.00 0.00 C ATOM 1544 CD2 PHE A 97 -5.837 -8.270 12.600 1.00 0.00 C ATOM 1545 CE1 PHE A 97 -4.432 -6.654 14.339 1.00 0.00 C ATOM 1546 CE2 PHE A 97 -6.103 -8.320 13.955 1.00 0.00 C ATOM 1547 CZ PHE A 97 -5.399 -7.511 14.826 1.00 0.00 C ATOM 0 H PHE A 97 -4.926 -7.105 8.197 1.00 0.00 H new ATOM 0 HA PHE A 97 -5.829 -5.622 10.428 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -5.155 -8.142 10.124 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -3.528 -7.585 10.460 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -3.413 -5.934 12.608 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -6.390 -8.905 11.924 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -3.880 -6.020 15.018 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -6.860 -8.991 14.333 1.00 0.00 H new ATOM 0 HZ PHE A 97 -5.605 -7.549 15.886 1.00 0.00 H new ATOM 1557 N LEU A 98 -2.652 -5.222 9.595 1.00 0.00 N ATOM 1558 CA LEU A 98 -1.499 -4.345 9.765 1.00 0.00 C ATOM 1559 C LEU A 98 -1.850 -2.905 9.400 1.00 0.00 C ATOM 1560 O LEU A 98 -1.422 -1.963 10.065 1.00 0.00 O ATOM 1561 CB LEU A 98 -0.331 -4.830 8.905 1.00 0.00 C ATOM 1562 CG LEU A 98 1.019 -4.185 9.224 1.00 0.00 C ATOM 1563 CD1 LEU A 98 1.764 -4.997 10.271 1.00 0.00 C ATOM 1564 CD2 LEU A 98 1.856 -4.048 7.960 1.00 0.00 C ATOM 0 H LEU A 98 -2.507 -5.986 8.935 1.00 0.00 H new ATOM 0 HA LEU A 98 -1.206 -4.374 10.814 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -0.237 -5.910 9.022 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -0.568 -4.642 7.858 1.00 0.00 H new ATOM 0 HG LEU A 98 0.838 -3.189 9.627 1.00 0.00 H new ATOM 0 HD11 LEU A 98 2.722 -4.523 10.485 1.00 0.00 H new ATOM 0 HD12 LEU A 98 1.171 -5.045 11.184 1.00 0.00 H new ATOM 0 HD13 LEU A 98 1.934 -6.006 9.895 1.00 0.00 H new ATOM 0 HD21 LEU A 98 2.813 -3.587 8.205 1.00 0.00 H new ATOM 0 HD22 LEU A 98 2.028 -5.034 7.529 1.00 0.00 H new ATOM 0 HD23 LEU A 98 1.327 -3.424 7.239 1.00 0.00 H new ATOM 1576 N LEU A 99 -2.631 -2.745 8.337 1.00 0.00 N ATOM 1577 CA LEU A 99 -3.041 -1.422 7.882 1.00 0.00 C ATOM 1578 C LEU A 99 -4.132 -0.845 8.781 1.00 0.00 C ATOM 1579 O LEU A 99 -4.287 0.372 8.879 1.00 0.00 O ATOM 1580 CB LEU A 99 -3.539 -1.489 6.437 1.00 0.00 C ATOM 1581 CG LEU A 99 -2.565 -2.127 5.445 1.00 0.00 C ATOM 1582 CD1 LEU A 99 -3.276 -2.473 4.146 1.00 0.00 C ATOM 1583 CD2 LEU A 99 -1.390 -1.197 5.180 1.00 0.00 C ATOM 0 H LEU A 99 -2.993 -3.515 7.775 1.00 0.00 H new ATOM 0 HA LEU A 99 -2.172 -0.766 7.932 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -4.474 -2.050 6.417 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -3.766 -0.478 6.100 1.00 0.00 H new ATOM 0 HG LEU A 99 -2.182 -3.049 5.882 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -2.567 -2.926 3.453 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -4.084 -3.176 4.349 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -3.687 -1.566 3.703 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -0.707 -1.666 4.472 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -1.756 -0.258 4.763 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -0.865 -0.999 6.114 1.00 0.00 H new ATOM 1595 N ASN A 100 -4.885 -1.725 9.434 1.00 0.00 N ATOM 1596 CA ASN A 100 -5.963 -1.303 10.321 1.00 0.00 C ATOM 1597 C ASN A 100 -5.447 -0.368 11.413 1.00 0.00 C ATOM 1598 O ASN A 100 -6.193 0.461 11.935 1.00 0.00 O ATOM 1599 CB ASN A 100 -6.637 -2.524 10.953 1.00 0.00 C ATOM 1600 CG ASN A 100 -8.147 -2.481 10.824 1.00 0.00 C ATOM 1601 OD1 ASN A 100 -8.840 -1.941 11.687 1.00 0.00 O ATOM 1602 ND2 ASN A 100 -8.665 -3.053 9.744 1.00 0.00 N ATOM 0 H ASN A 100 -4.768 -2.736 9.365 1.00 0.00 H new ATOM 0 HA ASN A 100 -6.694 -0.758 9.724 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -6.260 -3.430 10.479 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -6.366 -2.580 12.007 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -9.675 -3.057 9.604 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -8.053 -3.489 9.054 1.00 0.00 H new ATOM 1609 N LYS A 101 -4.171 -0.507 11.757 1.00 0.00 N ATOM 1610 CA LYS A 101 -3.565 0.327 12.790 1.00 0.00 C ATOM 1611 C LYS A 101 -2.472 1.219 12.206 1.00 0.00 C ATOM 1612 O LYS A 101 -2.266 2.343 12.664 1.00 0.00 O ATOM 1613 CB LYS A 101 -2.988 -0.548 13.906 1.00 0.00 C ATOM 1614 CG LYS A 101 -3.550 -0.226 15.282 1.00 0.00 C ATOM 1615 CD LYS A 101 -3.010 -1.174 16.341 1.00 0.00 C ATOM 1616 CE LYS A 101 -1.940 -0.509 17.194 1.00 0.00 C ATOM 1617 NZ LYS A 101 -0.826 -1.442 17.517 1.00 0.00 N ATOM 0 H LYS A 101 -3.537 -1.187 11.337 1.00 0.00 H new ATOM 0 HA LYS A 101 -4.343 0.968 13.205 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -3.188 -1.595 13.676 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -1.905 -0.428 13.928 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -3.297 0.800 15.548 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -4.638 -0.290 15.256 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -3.827 -1.512 16.979 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -2.594 -2.059 15.860 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -1.544 0.360 16.668 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -2.388 -0.145 18.119 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -0.119 -0.950 18.099 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -1.199 -2.259 18.042 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -0.381 -1.770 16.636 1.00 0.00 H new ATOM 1631 N LYS A 102 -1.772 0.710 11.198 1.00 0.00 N ATOM 1632 CA LYS A 102 -0.698 1.461 10.558 1.00 0.00 C ATOM 1633 C LYS A 102 -1.236 2.717 9.878 1.00 0.00 C ATOM 1634 O LYS A 102 -1.011 3.833 10.347 1.00 0.00 O ATOM 1635 CB LYS A 102 0.026 0.585 9.534 1.00 0.00 C ATOM 1636 CG LYS A 102 1.059 -0.343 10.152 1.00 0.00 C ATOM 1637 CD LYS A 102 2.255 0.430 10.683 1.00 0.00 C ATOM 1638 CE LYS A 102 3.376 -0.503 11.111 1.00 0.00 C ATOM 1639 NZ LYS A 102 4.530 0.241 11.688 1.00 0.00 N ATOM 0 H LYS A 102 -1.929 -0.219 10.807 1.00 0.00 H new ATOM 0 HA LYS A 102 0.007 1.764 11.332 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -0.709 -0.011 8.993 1.00 0.00 H new ATOM 0 HB3 LYS A 102 0.517 1.226 8.802 1.00 0.00 H new ATOM 0 HG2 LYS A 102 0.602 -0.910 10.963 1.00 0.00 H new ATOM 0 HG3 LYS A 102 1.393 -1.065 9.407 1.00 0.00 H new ATOM 0 HD2 LYS A 102 2.620 1.110 9.914 1.00 0.00 H new ATOM 0 HD3 LYS A 102 1.947 1.043 11.530 1.00 0.00 H new ATOM 0 HE2 LYS A 102 2.997 -1.212 11.847 1.00 0.00 H new ATOM 0 HE3 LYS A 102 3.712 -1.084 10.252 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 5.272 -0.432 11.967 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 4.909 0.899 10.978 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 4.216 0.776 12.523 1.00 0.00 H new ATOM 1653 N PHE A 103 -1.942 2.530 8.768 1.00 0.00 N ATOM 1654 CA PHE A 103 -2.506 3.650 8.022 1.00 0.00 C ATOM 1655 C PHE A 103 -3.824 4.113 8.636 1.00 0.00 C ATOM 1656 O PHE A 103 -4.052 5.311 8.805 1.00 0.00 O ATOM 1657 CB PHE A 103 -2.720 3.258 6.559 1.00 0.00 C ATOM 1658 CG PHE A 103 -1.442 3.072 5.794 1.00 0.00 C ATOM 1659 CD1 PHE A 103 -0.656 1.948 5.993 1.00 0.00 C ATOM 1660 CD2 PHE A 103 -1.023 4.023 4.877 1.00 0.00 C ATOM 1661 CE1 PHE A 103 0.522 1.775 5.292 1.00 0.00 C ATOM 1662 CE2 PHE A 103 0.153 3.855 4.172 1.00 0.00 C ATOM 1663 CZ PHE A 103 0.926 2.730 4.380 1.00 0.00 C ATOM 0 H PHE A 103 -2.138 1.614 8.365 1.00 0.00 H new ATOM 0 HA PHE A 103 -1.798 4.477 8.071 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -3.295 2.333 6.520 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -3.318 4.026 6.069 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -0.968 1.198 6.705 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -1.623 4.906 4.712 1.00 0.00 H new ATOM 0 HE1 PHE A 103 1.126 0.895 5.457 1.00 0.00 H new ATOM 0 HE2 PHE A 103 0.467 4.603 3.459 1.00 0.00 H new ATOM 0 HZ PHE A 103 1.846 2.597 3.830 1.00 0.00 H new ATOM 1673 N TYR A 104 -4.689 3.159 8.964 1.00 0.00 N ATOM 1674 CA TYR A 104 -5.985 3.475 9.558 1.00 0.00 C ATOM 1675 C TYR A 104 -5.818 4.299 10.831 1.00 0.00 C ATOM 1676 O TYR A 104 -5.179 3.860 11.787 1.00 0.00 O ATOM 1677 CB TYR A 104 -6.758 2.189 9.862 1.00 0.00 C ATOM 1678 CG TYR A 104 -7.960 1.978 8.970 1.00 0.00 C ATOM 1679 CD1 TYR A 104 -7.834 2.002 7.586 1.00 0.00 C ATOM 1680 CD2 TYR A 104 -9.220 1.756 9.510 1.00 0.00 C ATOM 1681 CE1 TYR A 104 -8.931 1.811 6.767 1.00 0.00 C ATOM 1682 CE2 TYR A 104 -10.321 1.563 8.698 1.00 0.00 C ATOM 1683 CZ TYR A 104 -10.171 1.592 7.328 1.00 0.00 C ATOM 1684 OH TYR A 104 -11.265 1.400 6.515 1.00 0.00 O ATOM 0 H TYR A 104 -4.518 2.163 8.829 1.00 0.00 H new ATOM 0 HA TYR A 104 -6.550 4.068 8.839 1.00 0.00 H new ATOM 0 HB2 TYR A 104 -6.085 1.338 9.758 1.00 0.00 H new ATOM 0 HB3 TYR A 104 -7.087 2.210 10.901 1.00 0.00 H new ATOM 0 HD1 TYR A 104 -6.864 2.173 7.144 1.00 0.00 H new ATOM 0 HD2 TYR A 104 -9.341 1.734 10.583 1.00 0.00 H new ATOM 0 HE1 TYR A 104 -8.817 1.833 5.693 1.00 0.00 H new ATOM 0 HE2 TYR A 104 -11.294 1.390 9.134 1.00 0.00 H new ATOM 0 HH TYR A 104 -10.965 1.228 5.598 1.00 0.00 H new ATOM 1694 N GLY A 105 -6.396 5.495 10.835 1.00 0.00 N ATOM 1695 CA GLY A 105 -6.301 6.362 11.995 1.00 0.00 C ATOM 1696 C GLY A 105 -6.414 7.830 11.632 1.00 0.00 C ATOM 1697 O GLY A 105 -7.132 8.583 12.289 1.00 0.00 O ATOM 0 H GLY A 105 -6.929 5.880 10.055 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -7.089 6.104 12.703 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -5.350 6.187 12.498 1.00 0.00 H new ATOM 1701 N LYS A 106 -5.703 8.234 10.582 1.00 0.00 N ATOM 1702 CA LYS A 106 -5.723 9.621 10.127 1.00 0.00 C ATOM 1703 C LYS A 106 -5.151 10.555 11.191 1.00 0.00 C ATOM 1704 O LYS A 106 -4.009 11.001 11.088 1.00 0.00 O ATOM 1705 CB LYS A 106 -7.149 10.046 9.768 1.00 0.00 C ATOM 1706 CG LYS A 106 -7.538 9.721 8.335 1.00 0.00 C ATOM 1707 CD LYS A 106 -7.180 10.856 7.387 1.00 0.00 C ATOM 1708 CE LYS A 106 -8.292 11.117 6.384 1.00 0.00 C ATOM 1709 NZ LYS A 106 -7.761 11.355 5.014 1.00 0.00 N ATOM 0 H LYS A 106 -5.105 7.619 10.030 1.00 0.00 H new ATOM 0 HA LYS A 106 -5.098 9.691 9.237 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -7.847 9.555 10.446 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -7.251 11.119 9.929 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -7.033 8.808 8.018 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -8.609 9.527 8.283 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -6.986 11.762 7.960 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -6.260 10.611 6.856 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -8.972 10.265 6.367 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -8.873 11.982 6.703 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -8.434 11.938 4.477 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -6.848 11.849 5.077 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -7.629 10.444 4.530 1.00 0.00 H new ATOM 1723 N SER A 107 -5.952 10.845 12.211 1.00 0.00 N ATOM 1724 CA SER A 107 -5.527 11.725 13.295 1.00 0.00 C ATOM 1725 C SER A 107 -5.305 13.147 12.787 1.00 0.00 C ATOM 1726 O SER A 107 -4.446 13.870 13.291 1.00 0.00 O ATOM 1727 CB SER A 107 -4.245 11.195 13.940 1.00 0.00 C ATOM 1728 OG SER A 107 -4.049 11.761 15.225 1.00 0.00 O ATOM 0 H SER A 107 -6.900 10.483 12.310 1.00 0.00 H new ATOM 0 HA SER A 107 -6.319 11.745 14.043 1.00 0.00 H new ATOM 0 HB2 SER A 107 -4.297 10.109 14.021 1.00 0.00 H new ATOM 0 HB3 SER A 107 -3.391 11.426 13.303 1.00 0.00 H new ATOM 0 HG SER A 107 -4.108 12.737 15.165 1.00 0.00 H new ATOM 1734 N GLY A 108 -6.088 13.541 11.788 1.00 0.00 N ATOM 1735 CA GLY A 108 -5.963 14.874 11.230 1.00 0.00 C ATOM 1736 C GLY A 108 -7.310 15.508 10.935 1.00 0.00 C ATOM 1737 O GLY A 108 -7.965 16.023 11.841 1.00 0.00 O ATOM 0 H GLY A 108 -6.807 12.961 11.355 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -5.412 15.506 11.927 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -5.378 14.827 10.311 1.00 0.00 H new ATOM 1741 N PRO A 109 -7.757 15.487 9.667 1.00 0.00 N ATOM 1742 CA PRO A 109 -9.046 16.070 9.276 1.00 0.00 C ATOM 1743 C PRO A 109 -10.201 15.526 10.108 1.00 0.00 C ATOM 1744 O PRO A 109 -10.122 14.425 10.654 1.00 0.00 O ATOM 1745 CB PRO A 109 -9.200 15.654 7.811 1.00 0.00 C ATOM 1746 CG PRO A 109 -7.809 15.420 7.332 1.00 0.00 C ATOM 1747 CD PRO A 109 -7.047 14.896 8.517 1.00 0.00 C ATOM 0 HA PRO A 109 -9.067 17.149 9.428 1.00 0.00 H new ATOM 0 HB2 PRO A 109 -9.807 14.753 7.718 1.00 0.00 H new ATOM 0 HB3 PRO A 109 -9.693 16.433 7.229 1.00 0.00 H new ATOM 0 HG2 PRO A 109 -7.794 14.704 6.511 1.00 0.00 H new ATOM 0 HG3 PRO A 109 -7.364 16.342 6.959 1.00 0.00 H new ATOM 0 HD2 PRO A 109 -7.060 13.807 8.553 1.00 0.00 H new ATOM 0 HD3 PRO A 109 -6.001 15.202 8.490 1.00 0.00 H new ATOM 1755 N SER A 110 -11.275 16.304 10.204 1.00 0.00 N ATOM 1756 CA SER A 110 -12.447 15.897 10.970 1.00 0.00 C ATOM 1757 C SER A 110 -13.722 16.080 10.154 1.00 0.00 C ATOM 1758 O SER A 110 -13.887 17.081 9.457 1.00 0.00 O ATOM 1759 CB SER A 110 -12.539 16.704 12.267 1.00 0.00 C ATOM 1760 OG SER A 110 -12.754 18.079 11.999 1.00 0.00 O ATOM 0 H SER A 110 -11.357 17.219 9.761 1.00 0.00 H new ATOM 0 HA SER A 110 -12.341 14.840 11.213 1.00 0.00 H new ATOM 0 HB2 SER A 110 -13.353 16.319 12.882 1.00 0.00 H new ATOM 0 HB3 SER A 110 -11.620 16.582 12.841 1.00 0.00 H new ATOM 0 HG SER A 110 -12.811 18.572 12.844 1.00 0.00 H new ATOM 1766 N SER A 111 -14.621 15.106 10.244 1.00 0.00 N ATOM 1767 CA SER A 111 -15.882 15.159 9.514 1.00 0.00 C ATOM 1768 C SER A 111 -17.000 14.493 10.309 1.00 0.00 C ATOM 1769 O SER A 111 -16.923 13.309 10.637 1.00 0.00 O ATOM 1770 CB SER A 111 -15.735 14.479 8.151 1.00 0.00 C ATOM 1771 OG SER A 111 -14.748 13.462 8.192 1.00 0.00 O ATOM 0 H SER A 111 -14.500 14.270 10.816 1.00 0.00 H new ATOM 0 HA SER A 111 -16.142 16.207 9.364 1.00 0.00 H new ATOM 0 HB2 SER A 111 -16.691 14.050 7.850 1.00 0.00 H new ATOM 0 HB3 SER A 111 -15.467 15.220 7.398 1.00 0.00 H new ATOM 0 HG SER A 111 -14.674 13.042 7.310 1.00 0.00 H new ATOM 1777 N GLY A 112 -18.040 15.263 10.617 1.00 0.00 N ATOM 1778 CA GLY A 112 -19.158 14.730 11.371 1.00 0.00 C ATOM 1779 C GLY A 112 -20.107 15.815 11.846 1.00 0.00 C ATOM 1780 O GLY A 112 -21.224 15.474 12.286 1.00 0.00 O ATOM 1781 OXT GLY A 112 -19.730 17.003 11.778 1.00 0.00 O ATOM 0 H GLY A 112 -18.127 16.246 10.358 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -19.705 14.019 10.751 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -18.781 14.178 12.232 1.00 0.00 H new TER 1785 GLY A 112