USER MOD reduce.3.24.130724 H: found=0, std=0, add=946, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 943 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 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 1.2: A -3 GLY N :NH3+ -133:sc= 0.00169 (180deg=0) USER MOD Single : A 3 ASN : amide:sc= -0.776 K(o=-0.78,f=-5!) USER MOD Single : A 7 TYR OH : rot 180:sc= 0 USER MOD Single : A -1 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A -2 SER OG : rot 180:sc= 0 USER MOD Single : A 12 THR OG1 : rot 180:sc= -0.893 USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 ASN : amide:sc= -0.0192 K(o=-0.019,f=-3.1!) USER MOD Single : A 25 ASN : amide:sc= -1.05 K(o=-1,f=-0.11) USER MOD Single : A 30 THR OG1 : rot -89:sc= -0.559 USER MOD Single : A 32 THR OG1 : rot 74:sc= 1.1 USER MOD Single : A 34 MET CE :methyl 172:sc= -3.15! (180deg=-3.54!) USER MOD Single : A 38 LYS NZ :NH3+ -111:sc=0.000123 (180deg=-2.45!) USER MOD Single : A 40 SER OG : rot 180:sc= 0.133 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 CYS SG : rot 70:sc= -1.42 USER MOD Single : A 48 SER OG : rot 171:sc= -0.702 USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 GLN : amide:sc= -1.12 K(o=-1.1,f=-4.9!) USER MOD Single : A 66 ASN : amide:sc= -0.738 X(o=-0.74,f=-0.95) USER MOD Single : A 69 GLN : amide:sc= -0.271 X(o=-0.27,f=-0.45) USER MOD Single : A 70 ASN : amide:sc= 0.906 K(o=0.91,f=-0.48) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 GLN : amide:sc= -0.788 K(o=-0.79,f=-1.7) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 ASN : amide:sc= -0.236 X(o=-0.24,f=-0.063) USER MOD Single : A 101 TYR OH : rot 180:sc= -0.0327 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 ASN : amide:sc= 0.803 K(o=0.8,f=-2.8!) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -3 1.330 0.000 0.000 1.00 0.00 N ATOM 2 CA GLY A -3 2.072 0.001 -1.247 1.00 0.00 C ATOM 3 C GLY A -3 3.057 1.149 -1.335 1.00 0.00 C ATOM 4 O GLY A -3 3.717 1.486 -0.352 1.00 0.00 O ATOM 0 H1 GLY A -3 1.329 -0.959 0.403 1.00 0.00 H new ATOM 0 H2 GLY A -3 1.778 0.657 0.671 1.00 0.00 H new ATOM 0 H3 GLY A -3 0.351 0.301 -0.178 1.00 0.00 H new ATOM 0 HA2 GLY A -3 2.609 -0.942 -1.348 1.00 0.00 H new ATOM 0 HA3 GLY A -3 1.374 0.061 -2.082 1.00 0.00 H new ATOM 8 N SER A -2 3.158 1.752 -2.515 1.00 0.00 N ATOM 9 CA SER A -2 4.075 2.865 -2.729 1.00 0.00 C ATOM 10 C SER A -2 3.335 4.078 -3.285 1.00 0.00 C ATOM 11 O SER A -2 3.928 5.137 -3.500 1.00 0.00 O ATOM 12 CB SER A -2 5.196 2.455 -3.686 1.00 0.00 C ATOM 13 OG SER A -2 5.315 1.044 -3.756 1.00 0.00 O ATOM 0 H SER A -2 2.616 1.488 -3.338 1.00 0.00 H new ATOM 0 HA SER A -2 4.510 3.135 -1.767 1.00 0.00 H new ATOM 0 HB2 SER A -2 4.995 2.856 -4.679 1.00 0.00 H new ATOM 0 HB3 SER A -2 6.140 2.887 -3.352 1.00 0.00 H new ATOM 0 HG SER A -2 6.037 0.807 -4.375 1.00 0.00 H new ATOM 19 N HIS A -1 2.036 3.917 -3.517 1.00 0.00 N ATOM 20 CA HIS A -1 1.214 4.998 -4.048 1.00 0.00 C ATOM 21 C HIS A -1 0.796 5.958 -2.938 1.00 0.00 C ATOM 22 O HIS A -1 0.098 6.941 -3.185 1.00 0.00 O ATOM 23 CB HIS A -1 -0.025 4.432 -4.742 1.00 0.00 C ATOM 24 CG HIS A -1 0.221 4.014 -6.159 1.00 0.00 C ATOM 25 ND1 HIS A -1 1.125 3.034 -6.509 1.00 0.00 N ATOM 26 CD2 HIS A -1 -0.327 4.450 -7.318 1.00 0.00 C ATOM 27 CE1 HIS A -1 1.124 2.885 -7.822 1.00 0.00 C ATOM 28 NE2 HIS A -1 0.251 3.732 -8.336 1.00 0.00 N ATOM 0 H HIS A -1 1.530 3.048 -3.345 1.00 0.00 H new ATOM 0 HA HIS A -1 1.809 5.549 -4.776 1.00 0.00 H new ATOM 0 HB2 HIS A -1 -0.388 3.574 -4.176 1.00 0.00 H new ATOM 0 HB3 HIS A -1 -0.815 5.182 -4.725 1.00 0.00 H new ATOM 0 HD2 HIS A -1 -1.078 5.219 -7.422 1.00 0.00 H new ATOM 0 HE1 HIS A -1 1.733 2.189 -8.380 1.00 0.00 H new ATOM 0 HE2 HIS A -1 0.040 3.836 -9.329 1.00 0.00 H new ATOM 36 N MET A 1 1.227 5.665 -1.715 1.00 0.00 N ATOM 37 CA MET A 1 0.897 6.502 -0.568 1.00 0.00 C ATOM 38 C MET A 1 2.080 6.604 0.389 1.00 0.00 C ATOM 39 O MET A 1 1.937 7.068 1.521 1.00 0.00 O ATOM 40 CB MET A 1 -0.321 5.940 0.167 1.00 0.00 C ATOM 41 CG MET A 1 -0.360 4.421 0.208 1.00 0.00 C ATOM 42 SD MET A 1 -1.667 3.787 1.276 1.00 0.00 S ATOM 43 CE MET A 1 -1.475 2.023 1.035 1.00 0.00 C ATOM 0 H MET A 1 1.805 4.855 -1.493 1.00 0.00 H new ATOM 0 HA MET A 1 0.662 7.501 -0.935 1.00 0.00 H new ATOM 0 HB2 MET A 1 -0.328 6.323 1.188 1.00 0.00 H new ATOM 0 HB3 MET A 1 -1.227 6.305 -0.316 1.00 0.00 H new ATOM 0 HG2 MET A 1 -0.504 4.038 -0.802 1.00 0.00 H new ATOM 0 HG3 MET A 1 0.602 4.046 0.557 1.00 0.00 H new ATOM 0 HE1 MET A 1 -2.216 1.491 1.632 1.00 0.00 H new ATOM 0 HE2 MET A 1 -1.618 1.782 -0.018 1.00 0.00 H new ATOM 0 HE3 MET A 1 -0.475 1.720 1.344 1.00 0.00 H new ATOM 53 N ILE A 2 3.248 6.169 -0.073 1.00 0.00 N ATOM 54 CA ILE A 2 4.455 6.212 0.743 1.00 0.00 C ATOM 55 C ILE A 2 5.681 6.529 -0.107 1.00 0.00 C ATOM 56 O ILE A 2 5.562 7.029 -1.225 1.00 0.00 O ATOM 57 CB ILE A 2 4.685 4.880 1.480 1.00 0.00 C ATOM 58 CG1 ILE A 2 3.402 4.047 1.486 1.00 0.00 C ATOM 59 CG2 ILE A 2 5.165 5.136 2.901 1.00 0.00 C ATOM 60 CD1 ILE A 2 3.530 2.745 2.246 1.00 0.00 C ATOM 0 H ILE A 2 3.384 5.783 -1.007 1.00 0.00 H new ATOM 0 HA ILE A 2 4.311 7.003 1.479 1.00 0.00 H new ATOM 0 HB ILE A 2 5.457 4.319 0.953 1.00 0.00 H new ATOM 0 HG12 ILE A 2 2.597 4.637 1.925 1.00 0.00 H new ATOM 0 HG13 ILE A 2 3.114 3.831 0.457 1.00 0.00 H new ATOM 0 HG21 ILE A 2 5.323 4.184 3.409 1.00 0.00 H new ATOM 0 HG22 ILE A 2 6.102 5.693 2.874 1.00 0.00 H new ATOM 0 HG23 ILE A 2 4.415 5.715 3.440 1.00 0.00 H new ATOM 0 HD11 ILE A 2 2.583 2.207 2.208 1.00 0.00 H new ATOM 0 HD12 ILE A 2 4.312 2.135 1.794 1.00 0.00 H new ATOM 0 HD13 ILE A 2 3.788 2.954 3.284 1.00 0.00 H new ATOM 72 N ASN A 3 6.860 6.231 0.430 1.00 0.00 N ATOM 73 CA ASN A 3 8.109 6.483 -0.279 1.00 0.00 C ATOM 74 C ASN A 3 9.300 5.950 0.511 1.00 0.00 C ATOM 75 O ASN A 3 9.386 6.134 1.726 1.00 0.00 O ATOM 76 CB ASN A 3 8.281 7.981 -0.535 1.00 0.00 C ATOM 77 CG ASN A 3 9.558 8.296 -1.291 1.00 0.00 C ATOM 78 OD1 ASN A 3 10.156 7.418 -1.913 1.00 0.00 O ATOM 79 ND2 ASN A 3 9.982 9.553 -1.239 1.00 0.00 N ATOM 0 H ASN A 3 6.976 5.815 1.354 1.00 0.00 H new ATOM 0 HA ASN A 3 8.067 5.961 -1.235 1.00 0.00 H new ATOM 0 HB2 ASN A 3 7.426 8.350 -1.101 1.00 0.00 H new ATOM 0 HB3 ASN A 3 8.286 8.511 0.417 1.00 0.00 H new ATOM 0 HD21 ASN A 3 10.836 9.824 -1.727 1.00 0.00 H new ATOM 0 HD22 ASN A 3 9.454 10.248 -0.711 1.00 0.00 H new ATOM 86 N LEU A 4 10.218 5.290 -0.187 1.00 0.00 N ATOM 87 CA LEU A 4 11.406 4.730 0.449 1.00 0.00 C ATOM 88 C LEU A 4 12.306 5.836 0.990 1.00 0.00 C ATOM 89 O LEU A 4 12.963 5.667 2.016 1.00 0.00 O ATOM 90 CB LEU A 4 12.182 3.867 -0.547 1.00 0.00 C ATOM 91 CG LEU A 4 12.867 4.614 -1.692 1.00 0.00 C ATOM 92 CD1 LEU A 4 14.348 4.798 -1.398 1.00 0.00 C ATOM 93 CD2 LEU A 4 12.671 3.872 -3.006 1.00 0.00 C ATOM 0 H LEU A 4 10.163 5.130 -1.193 1.00 0.00 H new ATOM 0 HA LEU A 4 11.083 4.109 1.284 1.00 0.00 H new ATOM 0 HB2 LEU A 4 12.941 3.309 0.001 1.00 0.00 H new ATOM 0 HB3 LEU A 4 11.496 3.136 -0.976 1.00 0.00 H new ATOM 0 HG LEU A 4 12.410 5.599 -1.783 1.00 0.00 H new ATOM 0 HD11 LEU A 4 14.819 5.331 -2.224 1.00 0.00 H new ATOM 0 HD12 LEU A 4 14.468 5.372 -0.479 1.00 0.00 H new ATOM 0 HD13 LEU A 4 14.820 3.822 -1.280 1.00 0.00 H new ATOM 0 HD21 LEU A 4 13.165 4.418 -3.809 1.00 0.00 H new ATOM 0 HD22 LEU A 4 13.101 2.874 -2.928 1.00 0.00 H new ATOM 0 HD23 LEU A 4 11.606 3.792 -3.223 1.00 0.00 H new ATOM 105 N GLU A 5 12.328 6.968 0.293 1.00 0.00 N ATOM 106 CA GLU A 5 13.147 8.102 0.706 1.00 0.00 C ATOM 107 C GLU A 5 12.366 9.027 1.635 1.00 0.00 C ATOM 108 O GLU A 5 12.803 10.140 1.931 1.00 0.00 O ATOM 109 CB GLU A 5 13.632 8.882 -0.518 1.00 0.00 C ATOM 110 CG GLU A 5 15.127 8.762 -0.763 1.00 0.00 C ATOM 111 CD GLU A 5 15.951 9.226 0.422 1.00 0.00 C ATOM 112 OE1 GLU A 5 15.762 10.380 0.861 1.00 0.00 O ATOM 113 OE2 GLU A 5 16.784 8.434 0.910 1.00 0.00 O ATOM 0 H GLU A 5 11.789 7.124 -0.559 1.00 0.00 H new ATOM 0 HA GLU A 5 14.011 7.716 1.247 1.00 0.00 H new ATOM 0 HB2 GLU A 5 13.098 8.527 -1.400 1.00 0.00 H new ATOM 0 HB3 GLU A 5 13.376 9.934 -0.393 1.00 0.00 H new ATOM 0 HG2 GLU A 5 15.372 7.724 -0.987 1.00 0.00 H new ATOM 0 HG3 GLU A 5 15.396 9.350 -1.640 1.00 0.00 H new ATOM 120 N ASP A 6 11.210 8.559 2.091 1.00 0.00 N ATOM 121 CA ASP A 6 10.368 9.343 2.988 1.00 0.00 C ATOM 122 C ASP A 6 9.612 8.437 3.954 1.00 0.00 C ATOM 123 O ASP A 6 8.504 8.758 4.385 1.00 0.00 O ATOM 124 CB ASP A 6 9.380 10.189 2.183 1.00 0.00 C ATOM 125 CG ASP A 6 9.049 11.500 2.868 1.00 0.00 C ATOM 126 OD1 ASP A 6 8.263 11.482 3.838 1.00 0.00 O ATOM 127 OD2 ASP A 6 9.578 12.545 2.435 1.00 0.00 O ATOM 0 H ASP A 6 10.834 7.641 1.855 1.00 0.00 H new ATOM 0 HA ASP A 6 11.013 10.004 3.568 1.00 0.00 H new ATOM 0 HB2 ASP A 6 9.799 10.393 1.198 1.00 0.00 H new ATOM 0 HB3 ASP A 6 8.462 9.622 2.028 1.00 0.00 H new ATOM 132 N TYR A 7 10.217 7.303 4.290 1.00 0.00 N ATOM 133 CA TYR A 7 9.599 6.348 5.202 1.00 0.00 C ATOM 134 C TYR A 7 10.575 5.233 5.568 1.00 0.00 C ATOM 135 O TYR A 7 10.172 4.097 5.817 1.00 0.00 O ATOM 136 CB TYR A 7 8.339 5.751 4.573 1.00 0.00 C ATOM 137 CG TYR A 7 7.443 5.044 5.565 1.00 0.00 C ATOM 138 CD1 TYR A 7 6.983 5.696 6.703 1.00 0.00 C ATOM 139 CD2 TYR A 7 7.056 3.725 5.364 1.00 0.00 C ATOM 140 CE1 TYR A 7 6.166 5.053 7.613 1.00 0.00 C ATOM 141 CE2 TYR A 7 6.237 3.075 6.268 1.00 0.00 C ATOM 142 CZ TYR A 7 5.795 3.743 7.390 1.00 0.00 C ATOM 143 OH TYR A 7 4.979 3.100 8.293 1.00 0.00 O ATOM 0 H TYR A 7 11.135 7.023 3.944 1.00 0.00 H new ATOM 0 HA TYR A 7 9.325 6.880 6.113 1.00 0.00 H new ATOM 0 HB2 TYR A 7 7.773 6.547 4.088 1.00 0.00 H new ATOM 0 HB3 TYR A 7 8.631 5.047 3.794 1.00 0.00 H new ATOM 0 HD1 TYR A 7 7.269 6.722 6.879 1.00 0.00 H new ATOM 0 HD2 TYR A 7 7.401 3.198 4.486 1.00 0.00 H new ATOM 0 HE1 TYR A 7 5.820 5.573 8.494 1.00 0.00 H new ATOM 0 HE2 TYR A 7 5.945 2.050 6.096 1.00 0.00 H new ATOM 0 HH TYR A 7 4.811 2.184 7.988 1.00 0.00 H new ATOM 153 N TRP A 8 11.859 5.568 5.597 1.00 0.00 N ATOM 154 CA TRP A 8 12.895 4.597 5.932 1.00 0.00 C ATOM 155 C TRP A 8 13.312 4.728 7.393 1.00 0.00 C ATOM 156 O TRP A 8 13.893 3.807 7.966 1.00 0.00 O ATOM 157 CB TRP A 8 14.111 4.782 5.023 1.00 0.00 C ATOM 158 CG TRP A 8 14.562 3.511 4.369 1.00 0.00 C ATOM 159 CD1 TRP A 8 14.086 2.974 3.206 1.00 0.00 C ATOM 160 CD2 TRP A 8 15.577 2.618 4.840 1.00 0.00 C ATOM 161 NE1 TRP A 8 14.745 1.801 2.927 1.00 0.00 N ATOM 162 CE2 TRP A 8 15.664 1.561 3.913 1.00 0.00 C ATOM 163 CE3 TRP A 8 16.421 2.609 5.953 1.00 0.00 C ATOM 164 CZ2 TRP A 8 16.562 0.507 4.069 1.00 0.00 C ATOM 165 CZ3 TRP A 8 17.311 1.563 6.106 1.00 0.00 C ATOM 166 CH2 TRP A 8 17.376 0.524 5.168 1.00 0.00 C ATOM 0 H TRP A 8 12.208 6.504 5.393 1.00 0.00 H new ATOM 0 HA TRP A 8 12.485 3.599 5.779 1.00 0.00 H new ATOM 0 HB2 TRP A 8 13.871 5.514 4.252 1.00 0.00 H new ATOM 0 HB3 TRP A 8 14.934 5.193 5.608 1.00 0.00 H new ATOM 0 HD1 TRP A 8 13.307 3.407 2.596 1.00 0.00 H new ATOM 0 HE1 TRP A 8 14.577 1.205 2.116 1.00 0.00 H new ATOM 0 HE3 TRP A 8 16.379 3.406 6.681 1.00 0.00 H new ATOM 0 HZ2 TRP A 8 16.613 -0.295 3.348 1.00 0.00 H new ATOM 0 HZ3 TRP A 8 17.968 1.546 6.963 1.00 0.00 H new ATOM 0 HH2 TRP A 8 18.083 -0.279 5.316 1.00 0.00 H new ATOM 177 N GLU A 9 13.011 5.878 7.989 1.00 0.00 N ATOM 178 CA GLU A 9 13.356 6.128 9.383 1.00 0.00 C ATOM 179 C GLU A 9 12.888 7.513 9.820 1.00 0.00 C ATOM 180 O GLU A 9 13.054 8.493 9.095 1.00 0.00 O ATOM 181 CB GLU A 9 14.867 6.000 9.589 1.00 0.00 C ATOM 182 CG GLU A 9 15.688 6.618 8.468 1.00 0.00 C ATOM 183 CD GLU A 9 17.167 6.680 8.795 1.00 0.00 C ATOM 184 OE1 GLU A 9 17.639 5.824 9.573 1.00 0.00 O ATOM 185 OE2 GLU A 9 17.853 7.583 8.273 1.00 0.00 O ATOM 0 H GLU A 9 12.529 6.650 7.528 1.00 0.00 H new ATOM 0 HA GLU A 9 12.849 5.382 9.995 1.00 0.00 H new ATOM 0 HB2 GLU A 9 15.138 6.475 10.532 1.00 0.00 H new ATOM 0 HB3 GLU A 9 15.125 4.945 9.678 1.00 0.00 H new ATOM 0 HG2 GLU A 9 15.545 6.038 7.556 1.00 0.00 H new ATOM 0 HG3 GLU A 9 15.322 7.625 8.267 1.00 0.00 H new ATOM 192 N ASP A 10 12.301 7.584 11.010 1.00 0.00 N ATOM 193 CA ASP A 10 11.808 8.848 11.544 1.00 0.00 C ATOM 194 C ASP A 10 11.996 8.909 13.057 1.00 0.00 C ATOM 195 O ASP A 10 11.374 9.724 13.737 1.00 0.00 O ATOM 196 CB ASP A 10 10.330 9.033 11.194 1.00 0.00 C ATOM 197 CG ASP A 10 10.115 10.095 10.134 1.00 0.00 C ATOM 198 OD1 ASP A 10 10.286 11.291 10.449 1.00 0.00 O ATOM 199 OD2 ASP A 10 9.776 9.729 8.989 1.00 0.00 O ATOM 0 H ASP A 10 12.155 6.782 11.623 1.00 0.00 H new ATOM 0 HA ASP A 10 12.384 9.655 11.091 1.00 0.00 H new ATOM 0 HB2 ASP A 10 9.921 8.085 10.843 1.00 0.00 H new ATOM 0 HB3 ASP A 10 9.778 9.305 12.094 1.00 0.00 H new ATOM 204 N GLU A 11 12.858 8.039 13.576 1.00 0.00 N ATOM 205 CA GLU A 11 13.126 7.994 15.009 1.00 0.00 C ATOM 206 C GLU A 11 11.826 7.910 15.803 1.00 0.00 C ATOM 207 O GLU A 11 11.748 8.377 16.941 1.00 0.00 O ATOM 208 CB GLU A 11 13.922 9.227 15.440 1.00 0.00 C ATOM 209 CG GLU A 11 15.342 9.255 14.900 1.00 0.00 C ATOM 210 CD GLU A 11 16.055 10.559 15.200 1.00 0.00 C ATOM 211 OE1 GLU A 11 16.041 10.987 16.372 1.00 0.00 O ATOM 212 OE2 GLU A 11 16.628 11.151 14.261 1.00 0.00 O ATOM 0 H GLU A 11 13.381 7.357 13.027 1.00 0.00 H new ATOM 0 HA GLU A 11 13.715 7.100 15.215 1.00 0.00 H new ATOM 0 HB2 GLU A 11 13.398 10.122 15.106 1.00 0.00 H new ATOM 0 HB3 GLU A 11 13.956 9.265 16.529 1.00 0.00 H new ATOM 0 HG2 GLU A 11 15.907 8.429 15.331 1.00 0.00 H new ATOM 0 HG3 GLU A 11 15.320 9.097 13.822 1.00 0.00 H new ATOM 219 N THR A 12 10.805 7.313 15.196 1.00 0.00 N ATOM 220 CA THR A 12 9.508 7.170 15.844 1.00 0.00 C ATOM 221 C THR A 12 9.654 6.584 17.244 1.00 0.00 C ATOM 222 O THR A 12 10.540 5.772 17.514 1.00 0.00 O ATOM 223 CB THR A 12 8.564 6.273 15.021 1.00 0.00 C ATOM 224 OG1 THR A 12 7.482 5.818 15.840 1.00 0.00 O ATOM 225 CG2 THR A 12 9.314 5.078 14.451 1.00 0.00 C ATOM 0 H THR A 12 10.852 6.921 14.256 1.00 0.00 H new ATOM 0 HA THR A 12 9.079 8.169 15.914 1.00 0.00 H new ATOM 0 HB THR A 12 8.169 6.862 14.193 1.00 0.00 H new ATOM 0 HG1 THR A 12 6.886 5.250 15.309 1.00 0.00 H new ATOM 0 HG21 THR A 12 8.627 4.459 13.874 1.00 0.00 H new ATOM 0 HG22 THR A 12 10.118 5.428 13.804 1.00 0.00 H new ATOM 0 HG23 THR A 12 9.735 4.490 15.267 1.00 0.00 H new ATOM 233 N PRO A 13 8.766 7.002 18.157 1.00 0.00 N ATOM 234 CA PRO A 13 8.775 6.529 19.545 1.00 0.00 C ATOM 235 C PRO A 13 8.356 5.068 19.663 1.00 0.00 C ATOM 236 O PRO A 13 8.035 4.422 18.666 1.00 0.00 O ATOM 237 CB PRO A 13 7.753 7.436 20.235 1.00 0.00 C ATOM 238 CG PRO A 13 6.837 7.873 19.145 1.00 0.00 C ATOM 239 CD PRO A 13 7.683 7.968 17.906 1.00 0.00 C ATOM 0 HA PRO A 13 9.771 6.574 19.984 1.00 0.00 H new ATOM 0 HB2 PRO A 13 7.212 6.901 21.016 1.00 0.00 H new ATOM 0 HB3 PRO A 13 8.238 8.289 20.710 1.00 0.00 H new ATOM 0 HG2 PRO A 13 6.024 7.159 19.009 1.00 0.00 H new ATOM 0 HG3 PRO A 13 6.381 8.834 19.381 1.00 0.00 H new ATOM 0 HD2 PRO A 13 7.115 7.712 17.011 1.00 0.00 H new ATOM 0 HD3 PRO A 13 8.070 8.976 17.760 1.00 0.00 H new ATOM 247 N GLY A 14 8.361 4.553 20.889 1.00 0.00 N ATOM 248 CA GLY A 14 7.979 3.171 21.114 1.00 0.00 C ATOM 249 C GLY A 14 6.777 3.043 22.029 1.00 0.00 C ATOM 250 O GLY A 14 6.875 2.547 23.151 1.00 0.00 O ATOM 0 H GLY A 14 8.623 5.068 21.730 1.00 0.00 H new ATOM 0 HA2 GLY A 14 7.755 2.699 20.157 1.00 0.00 H new ATOM 0 HA3 GLY A 14 8.821 2.631 21.547 1.00 0.00 H new ATOM 254 N PRO A 15 5.611 3.500 21.548 1.00 0.00 N ATOM 255 CA PRO A 15 4.363 3.446 22.315 1.00 0.00 C ATOM 256 C PRO A 15 3.848 2.021 22.484 1.00 0.00 C ATOM 257 O PRO A 15 4.308 1.100 21.810 1.00 0.00 O ATOM 258 CB PRO A 15 3.390 4.270 21.468 1.00 0.00 C ATOM 259 CG PRO A 15 3.926 4.180 20.081 1.00 0.00 C ATOM 260 CD PRO A 15 5.421 4.103 20.218 1.00 0.00 C ATOM 0 HA PRO A 15 4.491 3.824 23.329 1.00 0.00 H new ATOM 0 HB2 PRO A 15 2.377 3.871 21.528 1.00 0.00 H new ATOM 0 HB3 PRO A 15 3.346 5.304 21.809 1.00 0.00 H new ATOM 0 HG2 PRO A 15 3.536 3.301 19.568 1.00 0.00 H new ATOM 0 HG3 PRO A 15 3.632 5.049 19.492 1.00 0.00 H new ATOM 0 HD2 PRO A 15 5.866 3.492 19.432 1.00 0.00 H new ATOM 0 HD3 PRO A 15 5.882 5.089 20.154 1.00 0.00 H new ATOM 268 N ASP A 16 2.890 1.847 23.388 1.00 0.00 N ATOM 269 CA ASP A 16 2.310 0.534 23.645 1.00 0.00 C ATOM 270 C ASP A 16 0.791 0.622 23.750 1.00 0.00 C ATOM 271 O ASP A 16 0.140 -0.292 24.258 1.00 0.00 O ATOM 272 CB ASP A 16 2.889 -0.060 24.930 1.00 0.00 C ATOM 273 CG ASP A 16 3.699 -1.316 24.673 1.00 0.00 C ATOM 274 OD1 ASP A 16 4.289 -1.428 23.579 1.00 0.00 O ATOM 275 OD2 ASP A 16 3.742 -2.188 25.567 1.00 0.00 O ATOM 0 H ASP A 16 2.499 2.599 23.955 1.00 0.00 H new ATOM 0 HA ASP A 16 2.561 -0.117 22.808 1.00 0.00 H new ATOM 0 HB2 ASP A 16 3.520 0.683 25.418 1.00 0.00 H new ATOM 0 HB3 ASP A 16 2.076 -0.290 25.619 1.00 0.00 H new ATOM 280 N ARG A 17 0.232 1.726 23.267 1.00 0.00 N ATOM 281 CA ARG A 17 -1.210 1.934 23.308 1.00 0.00 C ATOM 282 C ARG A 17 -1.781 2.065 21.899 1.00 0.00 C ATOM 283 O ARG A 17 -2.939 1.727 21.655 1.00 0.00 O ATOM 284 CB ARG A 17 -1.543 3.185 24.123 1.00 0.00 C ATOM 285 CG ARG A 17 -0.660 4.378 23.796 1.00 0.00 C ATOM 286 CD ARG A 17 -1.409 5.690 23.972 1.00 0.00 C ATOM 287 NE ARG A 17 -0.836 6.760 23.159 1.00 0.00 N ATOM 288 CZ ARG A 17 -1.406 7.950 23.002 1.00 0.00 C ATOM 289 NH1 ARG A 17 -2.559 8.220 23.599 1.00 0.00 N ATOM 290 NH2 ARG A 17 -0.823 8.872 22.247 1.00 0.00 N ATOM 0 H ARG A 17 0.756 2.491 22.842 1.00 0.00 H new ATOM 0 HA ARG A 17 -1.664 1.066 23.786 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -2.584 3.456 23.948 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -1.448 2.953 25.184 1.00 0.00 H new ATOM 0 HG2 ARG A 17 0.218 4.370 24.441 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -0.302 4.297 22.770 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -2.455 5.549 23.701 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -1.388 5.982 25.022 1.00 0.00 H new ATOM 0 HE ARG A 17 0.050 6.584 22.686 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -3.010 7.513 24.180 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -2.995 9.134 23.477 1.00 0.00 H new ATOM 0 HH21 ARG A 17 0.064 8.668 21.786 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -1.262 9.785 22.127 1.00 0.00 H new ATOM 304 N GLU A 18 -0.961 2.559 20.977 1.00 0.00 N ATOM 305 CA GLU A 18 -1.386 2.735 19.593 1.00 0.00 C ATOM 306 C GLU A 18 -1.054 1.500 18.760 1.00 0.00 C ATOM 307 O GLU A 18 0.098 1.076 18.666 1.00 0.00 O ATOM 308 CB GLU A 18 -0.717 3.969 18.985 1.00 0.00 C ATOM 309 CG GLU A 18 -1.506 4.588 17.843 1.00 0.00 C ATOM 310 CD GLU A 18 -1.685 6.085 18.001 1.00 0.00 C ATOM 311 OE1 GLU A 18 -0.758 6.741 18.523 1.00 0.00 O ATOM 312 OE2 GLU A 18 -2.749 6.602 17.603 1.00 0.00 O ATOM 0 H GLU A 18 0.000 2.844 21.163 1.00 0.00 H new ATOM 0 HA GLU A 18 -2.467 2.876 19.586 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -0.576 4.717 19.765 1.00 0.00 H new ATOM 0 HB3 GLU A 18 0.274 3.694 18.624 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -0.996 4.384 16.902 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -2.485 4.113 17.784 1.00 0.00 H new ATOM 319 N PRO A 19 -2.087 0.909 18.142 1.00 0.00 N ATOM 320 CA PRO A 19 -1.931 -0.285 17.306 1.00 0.00 C ATOM 321 C PRO A 19 -1.194 0.011 16.004 1.00 0.00 C ATOM 322 O PRO A 19 -1.336 1.091 15.430 1.00 0.00 O ATOM 323 CB PRO A 19 -3.373 -0.709 17.020 1.00 0.00 C ATOM 324 CG PRO A 19 -4.169 0.544 17.148 1.00 0.00 C ATOM 325 CD PRO A 19 -3.487 1.361 18.211 1.00 0.00 C ATOM 0 HA PRO A 19 -1.337 -1.054 17.800 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -3.469 -1.139 16.023 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -3.711 -1.466 17.727 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -4.202 1.084 16.202 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -5.200 0.325 17.426 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -3.575 2.430 18.015 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -3.919 1.181 19.195 1.00 0.00 H new ATOM 333 N THR A 20 -0.406 -0.956 15.542 1.00 0.00 N ATOM 334 CA THR A 20 0.353 -0.798 14.309 1.00 0.00 C ATOM 335 C THR A 20 -0.136 -1.763 13.235 1.00 0.00 C ATOM 336 O THR A 20 -0.418 -2.927 13.515 1.00 0.00 O ATOM 337 CB THR A 20 1.858 -1.028 14.542 1.00 0.00 C ATOM 338 OG1 THR A 20 2.155 -0.946 15.941 1.00 0.00 O ATOM 339 CG2 THR A 20 2.687 -0.004 13.781 1.00 0.00 C ATOM 0 H THR A 20 -0.278 -1.856 16.004 1.00 0.00 H new ATOM 0 HA THR A 20 0.197 0.227 13.972 1.00 0.00 H new ATOM 0 HB THR A 20 2.112 -2.022 14.174 1.00 0.00 H new ATOM 0 HG1 THR A 20 3.113 -1.095 16.081 1.00 0.00 H new ATOM 0 HG21 THR A 20 3.746 -0.187 13.961 1.00 0.00 H new ATOM 0 HG22 THR A 20 2.481 -0.089 12.714 1.00 0.00 H new ATOM 0 HG23 THR A 20 2.429 0.999 14.122 1.00 0.00 H new ATOM 347 N ASN A 21 -0.235 -1.271 12.004 1.00 0.00 N ATOM 348 CA ASN A 21 -0.690 -2.091 10.887 1.00 0.00 C ATOM 349 C ASN A 21 0.090 -3.401 10.820 1.00 0.00 C ATOM 350 O ASN A 21 -0.486 -4.468 10.614 1.00 0.00 O ATOM 351 CB ASN A 21 -0.540 -1.326 9.571 1.00 0.00 C ATOM 352 CG ASN A 21 -1.451 -0.116 9.499 1.00 0.00 C ATOM 353 OD1 ASN A 21 -1.476 0.711 10.410 1.00 0.00 O ATOM 354 ND2 ASN A 21 -2.204 -0.007 8.411 1.00 0.00 N ATOM 0 H ASN A 21 -0.006 -0.309 11.755 1.00 0.00 H new ATOM 0 HA ASN A 21 -1.743 -2.324 11.045 1.00 0.00 H new ATOM 0 HB2 ASN A 21 0.495 -1.005 9.456 1.00 0.00 H new ATOM 0 HB3 ASN A 21 -0.761 -1.994 8.738 1.00 0.00 H new ATOM 0 HD21 ASN A 21 -2.836 0.787 8.306 1.00 0.00 H new ATOM 0 HD22 ASN A 21 -2.151 -0.717 7.681 1.00 0.00 H new ATOM 361 N GLU A 22 1.405 -3.309 10.995 1.00 0.00 N ATOM 362 CA GLU A 22 2.264 -4.487 10.954 1.00 0.00 C ATOM 363 C GLU A 22 1.982 -5.408 12.137 1.00 0.00 C ATOM 364 O GLU A 22 2.086 -6.630 12.025 1.00 0.00 O ATOM 365 CB GLU A 22 3.737 -4.071 10.957 1.00 0.00 C ATOM 366 CG GLU A 22 4.202 -3.490 12.282 1.00 0.00 C ATOM 367 CD GLU A 22 5.589 -2.882 12.197 1.00 0.00 C ATOM 368 OE1 GLU A 22 6.372 -3.311 11.323 1.00 0.00 O ATOM 369 OE2 GLU A 22 5.891 -1.978 13.003 1.00 0.00 O ATOM 0 H GLU A 22 1.898 -2.433 11.166 1.00 0.00 H new ATOM 0 HA GLU A 22 2.049 -5.030 10.034 1.00 0.00 H new ATOM 0 HB2 GLU A 22 4.351 -4.938 10.714 1.00 0.00 H new ATOM 0 HB3 GLU A 22 3.900 -3.335 10.170 1.00 0.00 H new ATOM 0 HG2 GLU A 22 3.495 -2.728 12.609 1.00 0.00 H new ATOM 0 HG3 GLU A 22 4.199 -4.274 13.039 1.00 0.00 H new ATOM 376 N LEU A 23 1.624 -4.814 13.270 1.00 0.00 N ATOM 377 CA LEU A 23 1.326 -5.580 14.475 1.00 0.00 C ATOM 378 C LEU A 23 0.104 -6.468 14.268 1.00 0.00 C ATOM 379 O LEU A 23 0.156 -7.677 14.496 1.00 0.00 O ATOM 380 CB LEU A 23 1.093 -4.638 15.657 1.00 0.00 C ATOM 381 CG LEU A 23 1.346 -5.227 17.045 1.00 0.00 C ATOM 382 CD1 LEU A 23 2.766 -4.928 17.501 1.00 0.00 C ATOM 383 CD2 LEU A 23 0.336 -4.686 18.047 1.00 0.00 C ATOM 0 H LEU A 23 1.533 -3.804 13.379 1.00 0.00 H new ATOM 0 HA LEU A 23 2.183 -6.219 14.691 1.00 0.00 H new ATOM 0 HB2 LEU A 23 1.734 -3.765 15.532 1.00 0.00 H new ATOM 0 HB3 LEU A 23 0.063 -4.285 15.617 1.00 0.00 H new ATOM 0 HG LEU A 23 1.225 -6.309 16.987 1.00 0.00 H new ATOM 0 HD11 LEU A 23 2.928 -5.355 18.491 1.00 0.00 H new ATOM 0 HD12 LEU A 23 3.474 -5.365 16.797 1.00 0.00 H new ATOM 0 HD13 LEU A 23 2.915 -3.849 17.542 1.00 0.00 H new ATOM 0 HD21 LEU A 23 0.532 -5.116 19.029 1.00 0.00 H new ATOM 0 HD22 LEU A 23 0.424 -3.601 18.102 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -0.672 -4.953 17.728 1.00 0.00 H new ATOM 395 N ARG A 24 -0.995 -5.861 13.832 1.00 0.00 N ATOM 396 CA ARG A 24 -2.231 -6.596 13.593 1.00 0.00 C ATOM 397 C ARG A 24 -2.095 -7.507 12.377 1.00 0.00 C ATOM 398 O ARG A 24 -2.718 -8.566 12.309 1.00 0.00 O ATOM 399 CB ARG A 24 -3.396 -5.626 13.389 1.00 0.00 C ATOM 400 CG ARG A 24 -3.129 -4.567 12.332 1.00 0.00 C ATOM 401 CD ARG A 24 -4.366 -3.726 12.060 1.00 0.00 C ATOM 402 NE ARG A 24 -4.043 -2.310 11.911 1.00 0.00 N ATOM 403 CZ ARG A 24 -4.832 -1.437 11.293 1.00 0.00 C ATOM 404 NH1 ARG A 24 -5.983 -1.834 10.769 1.00 0.00 N ATOM 405 NH2 ARG A 24 -4.469 -0.164 11.198 1.00 0.00 N ATOM 0 H ARG A 24 -1.054 -4.862 13.637 1.00 0.00 H new ATOM 0 HA ARG A 24 -2.431 -7.214 14.468 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -4.284 -6.192 13.108 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -3.618 -5.134 14.336 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -2.314 -3.922 12.660 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -2.804 -5.047 11.409 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -4.855 -4.083 11.154 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -5.077 -3.852 12.877 1.00 0.00 H new ATOM 0 HE ARG A 24 -3.164 -1.972 12.303 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -6.265 -2.812 10.840 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -6.587 -1.162 10.295 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -3.584 0.145 11.599 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -5.075 0.505 10.724 1.00 0.00 H new ATOM 419 N ASN A 25 -1.276 -7.087 11.418 1.00 0.00 N ATOM 420 CA ASN A 25 -1.059 -7.864 10.203 1.00 0.00 C ATOM 421 C ASN A 25 -0.243 -9.118 10.499 1.00 0.00 C ATOM 422 O ASN A 25 -0.606 -10.219 10.084 1.00 0.00 O ATOM 423 CB ASN A 25 -0.345 -7.014 9.150 1.00 0.00 C ATOM 424 CG ASN A 25 0.444 -7.856 8.166 1.00 0.00 C ATOM 425 OD1 ASN A 25 -0.055 -8.219 7.101 1.00 0.00 O ATOM 426 ND2 ASN A 25 1.685 -8.170 8.520 1.00 0.00 N ATOM 0 H ASN A 25 -0.752 -6.213 11.459 1.00 0.00 H new ATOM 0 HA ASN A 25 -2.032 -8.167 9.816 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -1.080 -6.419 8.608 1.00 0.00 H new ATOM 0 HB3 ASN A 25 0.327 -6.314 9.647 1.00 0.00 H new ATOM 0 HD21 ASN A 25 2.265 -8.734 7.899 1.00 0.00 H new ATOM 0 HD22 ASN A 25 2.058 -7.847 9.413 1.00 0.00 H new ATOM 433 N GLU A 26 0.861 -8.944 11.219 1.00 0.00 N ATOM 434 CA GLU A 26 1.729 -10.062 11.569 1.00 0.00 C ATOM 435 C GLU A 26 1.022 -11.021 12.523 1.00 0.00 C ATOM 436 O GLU A 26 1.146 -12.240 12.401 1.00 0.00 O ATOM 437 CB GLU A 26 3.023 -9.552 12.207 1.00 0.00 C ATOM 438 CG GLU A 26 4.055 -9.080 11.197 1.00 0.00 C ATOM 439 CD GLU A 26 5.180 -10.078 11.003 1.00 0.00 C ATOM 440 OE1 GLU A 26 4.894 -11.226 10.604 1.00 0.00 O ATOM 441 OE2 GLU A 26 6.347 -9.709 11.251 1.00 0.00 O ATOM 0 H GLU A 26 1.175 -8.040 11.571 1.00 0.00 H new ATOM 0 HA GLU A 26 1.972 -10.601 10.653 1.00 0.00 H new ATOM 0 HB2 GLU A 26 2.786 -8.730 12.882 1.00 0.00 H new ATOM 0 HB3 GLU A 26 3.457 -10.347 12.813 1.00 0.00 H new ATOM 0 HG2 GLU A 26 3.565 -8.900 10.240 1.00 0.00 H new ATOM 0 HG3 GLU A 26 4.471 -8.128 11.526 1.00 0.00 H new ATOM 448 N VAL A 27 0.279 -10.461 13.473 1.00 0.00 N ATOM 449 CA VAL A 27 -0.448 -11.265 14.448 1.00 0.00 C ATOM 450 C VAL A 27 -1.580 -12.042 13.785 1.00 0.00 C ATOM 451 O VAL A 27 -1.787 -13.220 14.070 1.00 0.00 O ATOM 452 CB VAL A 27 -1.031 -10.390 15.573 1.00 0.00 C ATOM 453 CG1 VAL A 27 -2.015 -11.188 16.415 1.00 0.00 C ATOM 454 CG2 VAL A 27 0.084 -9.821 16.438 1.00 0.00 C ATOM 0 H VAL A 27 0.165 -9.454 13.588 1.00 0.00 H new ATOM 0 HA VAL A 27 0.268 -11.966 14.877 1.00 0.00 H new ATOM 0 HB VAL A 27 -1.569 -9.557 15.120 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -2.417 -10.553 17.205 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -2.830 -11.542 15.784 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -1.504 -12.042 16.860 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -0.346 -9.205 17.228 1.00 0.00 H new ATOM 0 HG22 VAL A 27 0.652 -10.638 16.883 1.00 0.00 H new ATOM 0 HG23 VAL A 27 0.746 -9.212 15.823 1.00 0.00 H new ATOM 464 N GLU A 28 -2.309 -11.372 12.897 1.00 0.00 N ATOM 465 CA GLU A 28 -3.421 -12.000 12.193 1.00 0.00 C ATOM 466 C GLU A 28 -2.933 -13.165 11.336 1.00 0.00 C ATOM 467 O GLU A 28 -3.484 -14.264 11.394 1.00 0.00 O ATOM 468 CB GLU A 28 -4.143 -10.975 11.316 1.00 0.00 C ATOM 469 CG GLU A 28 -5.147 -10.124 12.076 1.00 0.00 C ATOM 470 CD GLU A 28 -6.538 -10.727 12.080 1.00 0.00 C ATOM 471 OE1 GLU A 28 -6.672 -11.911 11.707 1.00 0.00 O ATOM 472 OE2 GLU A 28 -7.493 -10.016 12.456 1.00 0.00 O ATOM 0 H GLU A 28 -2.149 -10.396 12.649 1.00 0.00 H new ATOM 0 HA GLU A 28 -4.118 -12.385 12.937 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -3.404 -10.322 10.851 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -4.658 -11.498 10.510 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -4.807 -9.998 13.104 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -5.187 -9.130 11.630 1.00 0.00 H new ATOM 479 N GLU A 29 -1.897 -12.915 10.542 1.00 0.00 N ATOM 480 CA GLU A 29 -1.337 -13.942 9.672 1.00 0.00 C ATOM 481 C GLU A 29 -0.780 -15.104 10.491 1.00 0.00 C ATOM 482 O GLU A 29 -1.035 -16.270 10.188 1.00 0.00 O ATOM 483 CB GLU A 29 -0.234 -13.350 8.792 1.00 0.00 C ATOM 484 CG GLU A 29 0.588 -14.398 8.059 1.00 0.00 C ATOM 485 CD GLU A 29 1.064 -13.920 6.701 1.00 0.00 C ATOM 486 OE1 GLU A 29 1.444 -12.737 6.587 1.00 0.00 O ATOM 487 OE2 GLU A 29 1.056 -14.732 5.752 1.00 0.00 O ATOM 0 H GLU A 29 -1.429 -12.011 10.483 1.00 0.00 H new ATOM 0 HA GLU A 29 -2.137 -14.319 9.035 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -0.685 -12.678 8.062 1.00 0.00 H new ATOM 0 HB3 GLU A 29 0.430 -12.748 9.412 1.00 0.00 H new ATOM 0 HG2 GLU A 29 1.451 -14.669 8.668 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -0.010 -15.301 7.933 1.00 0.00 H new ATOM 494 N THR A 30 -0.017 -14.777 11.529 1.00 0.00 N ATOM 495 CA THR A 30 0.577 -15.791 12.391 1.00 0.00 C ATOM 496 C THR A 30 -0.493 -16.690 13.000 1.00 0.00 C ATOM 497 O THR A 30 -0.349 -17.913 13.025 1.00 0.00 O ATOM 498 CB THR A 30 1.402 -15.153 13.524 1.00 0.00 C ATOM 499 OG1 THR A 30 0.653 -14.101 14.142 1.00 0.00 O ATOM 500 CG2 THR A 30 2.716 -14.601 12.992 1.00 0.00 C ATOM 0 H THR A 30 0.204 -13.817 11.793 1.00 0.00 H new ATOM 0 HA THR A 30 1.238 -16.390 11.765 1.00 0.00 H new ATOM 0 HB THR A 30 1.622 -15.924 14.262 1.00 0.00 H new ATOM 0 HG1 THR A 30 0.829 -13.257 13.676 1.00 0.00 H new ATOM 0 HG21 THR A 30 3.281 -14.155 13.810 1.00 0.00 H new ATOM 0 HG22 THR A 30 3.297 -15.409 12.548 1.00 0.00 H new ATOM 0 HG23 THR A 30 2.513 -13.842 12.236 1.00 0.00 H new ATOM 508 N ILE A 31 -1.565 -16.077 13.490 1.00 0.00 N ATOM 509 CA ILE A 31 -2.660 -16.823 14.098 1.00 0.00 C ATOM 510 C ILE A 31 -3.382 -17.680 13.064 1.00 0.00 C ATOM 511 O ILE A 31 -3.806 -18.799 13.355 1.00 0.00 O ATOM 512 CB ILE A 31 -3.677 -15.882 14.770 1.00 0.00 C ATOM 513 CG1 ILE A 31 -3.056 -15.219 16.001 1.00 0.00 C ATOM 514 CG2 ILE A 31 -4.935 -16.649 15.152 1.00 0.00 C ATOM 515 CD1 ILE A 31 -2.764 -16.187 17.126 1.00 0.00 C ATOM 0 H ILE A 31 -1.699 -15.066 13.478 1.00 0.00 H new ATOM 0 HA ILE A 31 -2.219 -17.469 14.857 1.00 0.00 H new ATOM 0 HB ILE A 31 -3.952 -15.101 14.061 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -2.130 -14.724 15.709 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -3.730 -14.444 16.365 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -5.645 -15.971 15.626 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -5.385 -17.078 14.257 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -4.677 -17.448 15.847 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -2.325 -15.648 17.965 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -3.691 -16.664 17.446 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -2.065 -16.948 16.779 1.00 0.00 H new ATOM 527 N THR A 32 -3.518 -17.148 11.854 1.00 0.00 N ATOM 528 CA THR A 32 -4.188 -17.864 10.775 1.00 0.00 C ATOM 529 C THR A 32 -3.388 -19.089 10.348 1.00 0.00 C ATOM 530 O THR A 32 -3.947 -20.165 10.134 1.00 0.00 O ATOM 531 CB THR A 32 -4.408 -16.956 9.550 1.00 0.00 C ATOM 532 OG1 THR A 32 -5.233 -15.841 9.909 1.00 0.00 O ATOM 533 CG2 THR A 32 -5.059 -17.730 8.413 1.00 0.00 C ATOM 0 H THR A 32 -3.173 -16.223 11.596 1.00 0.00 H new ATOM 0 HA THR A 32 -5.156 -18.182 11.161 1.00 0.00 H new ATOM 0 HB THR A 32 -3.436 -16.595 9.213 1.00 0.00 H new ATOM 0 HG1 THR A 32 -4.712 -15.208 10.446 1.00 0.00 H new ATOM 0 HG21 THR A 32 -5.205 -17.068 7.559 1.00 0.00 H new ATOM 0 HG22 THR A 32 -4.416 -18.561 8.123 1.00 0.00 H new ATOM 0 HG23 THR A 32 -6.024 -18.116 8.741 1.00 0.00 H new ATOM 541 N LEU A 33 -2.076 -18.920 10.226 1.00 0.00 N ATOM 542 CA LEU A 33 -1.197 -20.013 9.825 1.00 0.00 C ATOM 543 C LEU A 33 -0.999 -21.001 10.970 1.00 0.00 C ATOM 544 O LEU A 33 -0.986 -22.214 10.762 1.00 0.00 O ATOM 545 CB LEU A 33 0.156 -19.465 9.368 1.00 0.00 C ATOM 546 CG LEU A 33 0.158 -18.698 8.046 1.00 0.00 C ATOM 547 CD1 LEU A 33 1.567 -18.246 7.694 1.00 0.00 C ATOM 548 CD2 LEU A 33 -0.424 -19.554 6.931 1.00 0.00 C ATOM 0 H LEU A 33 -1.597 -18.036 10.399 1.00 0.00 H new ATOM 0 HA LEU A 33 -1.668 -20.539 8.994 1.00 0.00 H new ATOM 0 HB2 LEU A 33 0.541 -18.807 10.147 1.00 0.00 H new ATOM 0 HB3 LEU A 33 0.853 -20.299 9.282 1.00 0.00 H new ATOM 0 HG LEU A 33 -0.468 -17.813 8.161 1.00 0.00 H new ATOM 0 HD11 LEU A 33 1.549 -17.702 6.750 1.00 0.00 H new ATOM 0 HD12 LEU A 33 1.948 -17.595 8.481 1.00 0.00 H new ATOM 0 HD13 LEU A 33 2.215 -19.117 7.598 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -0.414 -18.991 5.998 1.00 0.00 H new ATOM 0 HD22 LEU A 33 0.174 -20.458 6.816 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -1.450 -19.827 7.179 1.00 0.00 H new ATOM 560 N MET A 34 -0.848 -20.473 12.180 1.00 0.00 N ATOM 561 CA MET A 34 -0.654 -21.309 13.359 1.00 0.00 C ATOM 562 C MET A 34 -1.951 -22.012 13.746 1.00 0.00 C ATOM 563 O MET A 34 -1.931 -23.046 14.414 1.00 0.00 O ATOM 564 CB MET A 34 -0.149 -20.465 14.531 1.00 0.00 C ATOM 565 CG MET A 34 -1.259 -19.769 15.302 1.00 0.00 C ATOM 566 SD MET A 34 -1.783 -20.699 16.756 1.00 0.00 S ATOM 567 CE MET A 34 -3.451 -20.081 16.969 1.00 0.00 C ATOM 0 H MET A 34 -0.856 -19.471 12.370 1.00 0.00 H new ATOM 0 HA MET A 34 0.092 -22.067 13.118 1.00 0.00 H new ATOM 0 HB2 MET A 34 0.411 -21.104 15.214 1.00 0.00 H new ATOM 0 HB3 MET A 34 0.546 -19.715 14.155 1.00 0.00 H new ATOM 0 HG2 MET A 34 -0.917 -18.781 15.611 1.00 0.00 H new ATOM 0 HG3 MET A 34 -2.115 -19.619 14.644 1.00 0.00 H new ATOM 0 HE1 MET A 34 -3.958 -20.661 17.740 1.00 0.00 H new ATOM 0 HE2 MET A 34 -3.415 -19.033 17.268 1.00 0.00 H new ATOM 0 HE3 MET A 34 -3.995 -20.172 16.029 1.00 0.00 H new ATOM 577 N GLU A 35 -3.076 -21.445 13.322 1.00 0.00 N ATOM 578 CA GLU A 35 -4.381 -22.019 13.626 1.00 0.00 C ATOM 579 C GLU A 35 -4.463 -23.467 13.151 1.00 0.00 C ATOM 580 O GLU A 35 -5.270 -24.252 13.651 1.00 0.00 O ATOM 581 CB GLU A 35 -5.491 -21.193 12.973 1.00 0.00 C ATOM 582 CG GLU A 35 -6.850 -21.872 12.997 1.00 0.00 C ATOM 583 CD GLU A 35 -7.993 -20.885 13.139 1.00 0.00 C ATOM 584 OE1 GLU A 35 -8.346 -20.237 12.132 1.00 0.00 O ATOM 585 OE2 GLU A 35 -8.533 -20.762 14.258 1.00 0.00 O ATOM 0 H GLU A 35 -3.110 -20.590 12.768 1.00 0.00 H new ATOM 0 HA GLU A 35 -4.514 -22.002 14.708 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -5.565 -20.232 13.483 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -5.217 -20.985 11.939 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -6.982 -22.445 12.079 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -6.883 -22.582 13.824 1.00 0.00 H new ATOM 592 N LEU A 36 -3.623 -23.814 12.182 1.00 0.00 N ATOM 593 CA LEU A 36 -3.599 -25.167 11.638 1.00 0.00 C ATOM 594 C LEU A 36 -2.548 -26.019 12.342 1.00 0.00 C ATOM 595 O LEU A 36 -2.046 -26.994 11.781 1.00 0.00 O ATOM 596 CB LEU A 36 -3.317 -25.128 10.135 1.00 0.00 C ATOM 597 CG LEU A 36 -4.503 -24.773 9.238 1.00 0.00 C ATOM 598 CD1 LEU A 36 -4.077 -24.739 7.778 1.00 0.00 C ATOM 599 CD2 LEU A 36 -5.640 -25.763 9.441 1.00 0.00 C ATOM 0 H LEU A 36 -2.949 -23.177 11.757 1.00 0.00 H new ATOM 0 HA LEU A 36 -4.577 -25.617 11.807 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -2.521 -24.406 9.954 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -2.937 -26.104 9.832 1.00 0.00 H new ATOM 0 HG LEU A 36 -4.859 -23.780 9.514 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -4.934 -24.485 7.155 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -3.296 -23.990 7.644 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -3.695 -25.718 7.488 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -6.476 -25.495 8.795 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -5.297 -26.767 9.193 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -5.963 -25.737 10.482 1.00 0.00 H new ATOM 611 N LEU A 37 -2.222 -25.647 13.575 1.00 0.00 N ATOM 612 CA LEU A 37 -1.233 -26.379 14.359 1.00 0.00 C ATOM 613 C LEU A 37 -1.598 -27.857 14.453 1.00 0.00 C ATOM 614 O LEU A 37 -2.770 -28.225 14.370 1.00 0.00 O ATOM 615 CB LEU A 37 -1.119 -25.779 15.761 1.00 0.00 C ATOM 616 CG LEU A 37 0.200 -25.076 16.086 1.00 0.00 C ATOM 617 CD1 LEU A 37 -0.054 -23.646 16.535 1.00 0.00 C ATOM 618 CD2 LEU A 37 0.965 -25.844 17.153 1.00 0.00 C ATOM 0 H LEU A 37 -2.628 -24.843 14.053 1.00 0.00 H new ATOM 0 HA LEU A 37 -0.270 -26.293 13.855 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -1.931 -25.064 15.896 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -1.272 -26.576 16.489 1.00 0.00 H new ATOM 0 HG LEU A 37 0.807 -25.048 15.181 1.00 0.00 H new ATOM 0 HD11 LEU A 37 0.896 -23.162 16.762 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -0.559 -23.099 15.739 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -0.681 -23.651 17.427 1.00 0.00 H new ATOM 0 HD21 LEU A 37 1.901 -25.329 17.371 1.00 0.00 H new ATOM 0 HD22 LEU A 37 0.363 -25.904 18.060 1.00 0.00 H new ATOM 0 HD23 LEU A 37 1.180 -26.850 16.793 1.00 0.00 H new ATOM 630 N LYS A 38 -0.586 -28.700 14.630 1.00 0.00 N ATOM 631 CA LYS A 38 -0.799 -30.139 14.740 1.00 0.00 C ATOM 632 C LYS A 38 -0.181 -30.684 16.023 1.00 0.00 C ATOM 633 O LYS A 38 0.560 -29.983 16.713 1.00 0.00 O ATOM 634 CB LYS A 38 -0.202 -30.858 13.528 1.00 0.00 C ATOM 635 CG LYS A 38 1.183 -30.363 13.149 1.00 0.00 C ATOM 636 CD LYS A 38 1.658 -30.982 11.845 1.00 0.00 C ATOM 637 CE LYS A 38 1.990 -29.916 10.811 1.00 0.00 C ATOM 638 NZ LYS A 38 3.259 -29.207 11.133 1.00 0.00 N ATOM 0 H LYS A 38 0.390 -28.412 14.700 1.00 0.00 H new ATOM 0 HA LYS A 38 -1.873 -30.321 14.770 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -0.152 -31.926 13.738 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -0.870 -30.732 12.676 1.00 0.00 H new ATOM 0 HG2 LYS A 38 1.169 -29.277 13.054 1.00 0.00 H new ATOM 0 HG3 LYS A 38 1.887 -30.604 13.945 1.00 0.00 H new ATOM 0 HD2 LYS A 38 2.539 -31.596 12.032 1.00 0.00 H new ATOM 0 HD3 LYS A 38 0.886 -31.644 11.452 1.00 0.00 H new ATOM 0 HE2 LYS A 38 2.072 -30.378 9.827 1.00 0.00 H new ATOM 0 HE3 LYS A 38 1.174 -29.195 10.758 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 3.049 -28.226 11.407 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 3.737 -29.691 11.920 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 3.879 -29.208 10.298 1.00 0.00 H new ATOM 652 N VAL A 39 -0.489 -31.938 16.337 1.00 0.00 N ATOM 653 CA VAL A 39 0.039 -32.578 17.537 1.00 0.00 C ATOM 654 C VAL A 39 1.552 -32.415 17.626 1.00 0.00 C ATOM 655 O VAL A 39 2.100 -32.190 18.705 1.00 0.00 O ATOM 656 CB VAL A 39 -0.308 -34.078 17.571 1.00 0.00 C ATOM 657 CG1 VAL A 39 -1.790 -34.278 17.846 1.00 0.00 C ATOM 658 CG2 VAL A 39 0.096 -34.748 16.266 1.00 0.00 C ATOM 0 H VAL A 39 -1.101 -32.531 15.777 1.00 0.00 H new ATOM 0 HA VAL A 39 -0.427 -32.085 18.390 1.00 0.00 H new ATOM 0 HB VAL A 39 0.253 -34.544 18.381 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -2.016 -35.344 17.866 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -2.044 -33.835 18.809 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -2.374 -33.798 17.060 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -0.157 -35.808 16.308 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -0.436 -34.281 15.437 1.00 0.00 H new ATOM 0 HG23 VAL A 39 1.170 -34.637 16.117 1.00 0.00 H new ATOM 668 N SER A 40 2.222 -32.528 16.484 1.00 0.00 N ATOM 669 CA SER A 40 3.674 -32.397 16.433 1.00 0.00 C ATOM 670 C SER A 40 4.107 -30.994 16.848 1.00 0.00 C ATOM 671 O SER A 40 4.978 -30.830 17.702 1.00 0.00 O ATOM 672 CB SER A 40 4.186 -32.704 15.024 1.00 0.00 C ATOM 673 OG SER A 40 3.191 -33.352 14.250 1.00 0.00 O ATOM 0 H SER A 40 1.783 -32.710 15.581 1.00 0.00 H new ATOM 0 HA SER A 40 4.104 -33.114 17.133 1.00 0.00 H new ATOM 0 HB2 SER A 40 4.487 -31.778 14.533 1.00 0.00 H new ATOM 0 HB3 SER A 40 5.072 -33.336 15.085 1.00 0.00 H new ATOM 0 HG SER A 40 3.542 -33.536 13.354 1.00 0.00 H new ATOM 679 N GLU A 41 3.491 -29.986 16.238 1.00 0.00 N ATOM 680 CA GLU A 41 3.814 -28.597 16.544 1.00 0.00 C ATOM 681 C GLU A 41 3.457 -28.262 17.990 1.00 0.00 C ATOM 682 O GLU A 41 4.297 -27.780 18.752 1.00 0.00 O ATOM 683 CB GLU A 41 3.072 -27.657 15.593 1.00 0.00 C ATOM 684 CG GLU A 41 3.533 -27.762 14.149 1.00 0.00 C ATOM 685 CD GLU A 41 3.917 -26.418 13.560 1.00 0.00 C ATOM 686 OE1 GLU A 41 4.461 -25.577 14.304 1.00 0.00 O ATOM 687 OE2 GLU A 41 3.673 -26.209 12.353 1.00 0.00 O ATOM 0 H GLU A 41 2.766 -30.105 15.530 1.00 0.00 H new ATOM 0 HA GLU A 41 4.888 -28.462 16.412 1.00 0.00 H new ATOM 0 HB2 GLU A 41 2.005 -27.874 15.641 1.00 0.00 H new ATOM 0 HB3 GLU A 41 3.205 -26.630 15.934 1.00 0.00 H new ATOM 0 HG2 GLU A 41 4.387 -28.437 14.092 1.00 0.00 H new ATOM 0 HG3 GLU A 41 2.738 -28.204 13.549 1.00 0.00 H new ATOM 694 N LEU A 42 2.208 -28.519 18.359 1.00 0.00 N ATOM 695 CA LEU A 42 1.739 -28.244 19.713 1.00 0.00 C ATOM 696 C LEU A 42 2.684 -28.843 20.749 1.00 0.00 C ATOM 697 O LEU A 42 3.071 -28.178 21.711 1.00 0.00 O ATOM 698 CB LEU A 42 0.329 -28.804 19.909 1.00 0.00 C ATOM 699 CG LEU A 42 -0.723 -28.344 18.899 1.00 0.00 C ATOM 700 CD1 LEU A 42 -1.819 -29.388 18.756 1.00 0.00 C ATOM 701 CD2 LEU A 42 -1.311 -27.003 19.315 1.00 0.00 C ATOM 0 H LEU A 42 1.501 -28.917 17.740 1.00 0.00 H new ATOM 0 HA LEU A 42 1.717 -27.163 19.850 1.00 0.00 H new ATOM 0 HB2 LEU A 42 0.384 -29.892 19.876 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -0.012 -28.533 20.908 1.00 0.00 H new ATOM 0 HG LEU A 42 -0.239 -28.221 17.930 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -2.558 -29.043 18.033 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -1.385 -30.326 18.411 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -2.301 -29.544 19.721 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -2.058 -26.691 18.585 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -1.779 -27.099 20.295 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -0.518 -26.257 19.364 1.00 0.00 H new ATOM 713 N LYS A 43 3.055 -30.103 20.546 1.00 0.00 N ATOM 714 CA LYS A 43 3.959 -30.792 21.459 1.00 0.00 C ATOM 715 C LYS A 43 5.321 -30.107 21.497 1.00 0.00 C ATOM 716 O LYS A 43 5.883 -29.881 22.569 1.00 0.00 O ATOM 717 CB LYS A 43 4.123 -32.254 21.041 1.00 0.00 C ATOM 718 CG LYS A 43 2.941 -33.131 21.416 1.00 0.00 C ATOM 719 CD LYS A 43 3.146 -34.567 20.964 1.00 0.00 C ATOM 720 CE LYS A 43 1.835 -35.338 20.945 1.00 0.00 C ATOM 721 NZ LYS A 43 1.351 -35.642 22.320 1.00 0.00 N ATOM 0 H LYS A 43 2.743 -30.668 19.756 1.00 0.00 H new ATOM 0 HA LYS A 43 3.525 -30.753 22.458 1.00 0.00 H new ATOM 0 HB2 LYS A 43 4.271 -32.300 19.962 1.00 0.00 H new ATOM 0 HB3 LYS A 43 5.024 -32.656 21.504 1.00 0.00 H new ATOM 0 HG2 LYS A 43 2.796 -33.106 22.496 1.00 0.00 H new ATOM 0 HG3 LYS A 43 2.033 -32.732 20.963 1.00 0.00 H new ATOM 0 HD2 LYS A 43 3.589 -34.576 19.968 1.00 0.00 H new ATOM 0 HD3 LYS A 43 3.851 -35.062 21.631 1.00 0.00 H new ATOM 0 HE2 LYS A 43 1.080 -34.758 20.414 1.00 0.00 H new ATOM 0 HE3 LYS A 43 1.969 -36.268 20.393 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 0.456 -36.168 22.264 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 2.060 -36.217 22.818 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 1.199 -34.754 22.839 1.00 0.00 H new ATOM 735 N ASP A 44 5.845 -29.777 20.322 1.00 0.00 N ATOM 736 CA ASP A 44 7.141 -29.115 20.221 1.00 0.00 C ATOM 737 C ASP A 44 7.171 -27.848 21.070 1.00 0.00 C ATOM 738 O ASP A 44 8.092 -27.641 21.861 1.00 0.00 O ATOM 739 CB ASP A 44 7.451 -28.774 18.763 1.00 0.00 C ATOM 740 CG ASP A 44 8.573 -29.621 18.196 1.00 0.00 C ATOM 741 OD1 ASP A 44 9.512 -29.944 18.952 1.00 0.00 O ATOM 742 OD2 ASP A 44 8.512 -29.961 16.995 1.00 0.00 O ATOM 0 H ASP A 44 5.393 -29.957 19.426 1.00 0.00 H new ATOM 0 HA ASP A 44 7.902 -29.800 20.595 1.00 0.00 H new ATOM 0 HB2 ASP A 44 6.553 -28.915 18.161 1.00 0.00 H new ATOM 0 HB3 ASP A 44 7.722 -27.721 18.689 1.00 0.00 H new ATOM 747 N ILE A 45 6.159 -27.004 20.901 1.00 0.00 N ATOM 748 CA ILE A 45 6.070 -25.758 21.652 1.00 0.00 C ATOM 749 C ILE A 45 5.951 -26.025 23.148 1.00 0.00 C ATOM 750 O ILE A 45 6.721 -25.491 23.948 1.00 0.00 O ATOM 751 CB ILE A 45 4.868 -24.910 21.195 1.00 0.00 C ATOM 752 CG1 ILE A 45 5.016 -24.526 19.722 1.00 0.00 C ATOM 753 CG2 ILE A 45 4.738 -23.666 22.062 1.00 0.00 C ATOM 754 CD1 ILE A 45 3.831 -24.926 18.871 1.00 0.00 C ATOM 0 H ILE A 45 5.389 -27.160 20.251 1.00 0.00 H new ATOM 0 HA ILE A 45 6.989 -25.205 21.457 1.00 0.00 H new ATOM 0 HB ILE A 45 3.961 -25.504 21.306 1.00 0.00 H new ATOM 0 HG12 ILE A 45 5.158 -23.448 19.649 1.00 0.00 H new ATOM 0 HG13 ILE A 45 5.915 -24.994 19.321 1.00 0.00 H new ATOM 0 HG21 ILE A 45 3.884 -23.077 21.727 1.00 0.00 H new ATOM 0 HG22 ILE A 45 4.590 -23.960 23.101 1.00 0.00 H new ATOM 0 HG23 ILE A 45 5.646 -23.069 21.980 1.00 0.00 H new ATOM 0 HD11 ILE A 45 4.005 -24.622 17.839 1.00 0.00 H new ATOM 0 HD12 ILE A 45 3.701 -26.007 18.914 1.00 0.00 H new ATOM 0 HD13 ILE A 45 2.932 -24.437 19.246 1.00 0.00 H new ATOM 766 N CYS A 46 4.984 -26.855 23.520 1.00 0.00 N ATOM 767 CA CYS A 46 4.764 -27.195 24.921 1.00 0.00 C ATOM 768 C CYS A 46 6.055 -27.683 25.571 1.00 0.00 C ATOM 769 O CYS A 46 6.290 -27.452 26.757 1.00 0.00 O ATOM 770 CB CYS A 46 3.680 -28.267 25.044 1.00 0.00 C ATOM 771 SG CYS A 46 2.379 -27.867 26.235 1.00 0.00 S ATOM 0 H CYS A 46 4.339 -27.305 22.871 1.00 0.00 H new ATOM 0 HA CYS A 46 4.434 -26.295 25.440 1.00 0.00 H new ATOM 0 HB2 CYS A 46 3.226 -28.424 24.065 1.00 0.00 H new ATOM 0 HB3 CYS A 46 4.146 -29.209 25.334 1.00 0.00 H new ATOM 0 HG CYS A 46 1.654 -26.891 25.774 1.00 0.00 H new ATOM 777 N ARG A 47 6.886 -28.361 24.787 1.00 0.00 N ATOM 778 CA ARG A 47 8.151 -28.885 25.286 1.00 0.00 C ATOM 779 C ARG A 47 9.172 -27.765 25.462 1.00 0.00 C ATOM 780 O ARG A 47 9.794 -27.638 26.516 1.00 0.00 O ATOM 781 CB ARG A 47 8.702 -29.946 24.331 1.00 0.00 C ATOM 782 CG ARG A 47 10.217 -29.930 24.210 1.00 0.00 C ATOM 783 CD ARG A 47 10.719 -31.073 23.343 1.00 0.00 C ATOM 784 NE ARG A 47 10.125 -32.352 23.725 1.00 0.00 N ATOM 785 CZ ARG A 47 10.560 -33.090 24.740 1.00 0.00 C ATOM 786 NH1 ARG A 47 11.587 -32.678 25.471 1.00 0.00 N ATOM 787 NH2 ARG A 47 9.968 -34.242 25.026 1.00 0.00 N ATOM 0 H ARG A 47 6.706 -28.560 23.803 1.00 0.00 H new ATOM 0 HA ARG A 47 7.967 -29.342 26.258 1.00 0.00 H new ATOM 0 HB2 ARG A 47 8.384 -30.931 24.673 1.00 0.00 H new ATOM 0 HB3 ARG A 47 8.266 -29.795 23.344 1.00 0.00 H new ATOM 0 HG2 ARG A 47 10.539 -28.980 23.783 1.00 0.00 H new ATOM 0 HG3 ARG A 47 10.663 -30.001 25.202 1.00 0.00 H new ATOM 0 HD2 ARG A 47 10.488 -30.864 22.298 1.00 0.00 H new ATOM 0 HD3 ARG A 47 11.804 -31.139 23.423 1.00 0.00 H new ATOM 0 HE ARG A 47 9.333 -32.697 23.183 1.00 0.00 H new ATOM 0 HH11 ARG A 47 12.045 -31.793 25.254 1.00 0.00 H new ATOM 0 HH12 ARG A 47 11.919 -33.247 26.250 1.00 0.00 H new ATOM 0 HH21 ARG A 47 9.178 -34.562 24.466 1.00 0.00 H new ATOM 0 HH22 ARG A 47 10.303 -34.808 25.806 1.00 0.00 H new ATOM 801 N SER A 48 9.340 -26.955 24.421 1.00 0.00 N ATOM 802 CA SER A 48 10.288 -25.848 24.458 1.00 0.00 C ATOM 803 C SER A 48 9.969 -24.898 25.609 1.00 0.00 C ATOM 804 O SER A 48 10.842 -24.553 26.405 1.00 0.00 O ATOM 805 CB SER A 48 10.267 -25.086 23.132 1.00 0.00 C ATOM 806 OG SER A 48 11.463 -24.348 22.949 1.00 0.00 O ATOM 0 H SER A 48 8.831 -27.045 23.541 1.00 0.00 H new ATOM 0 HA SER A 48 11.285 -26.261 24.616 1.00 0.00 H new ATOM 0 HB2 SER A 48 10.139 -25.788 22.308 1.00 0.00 H new ATOM 0 HB3 SER A 48 9.412 -24.410 23.111 1.00 0.00 H new ATOM 0 HG SER A 48 11.489 -23.989 22.038 1.00 0.00 H new ATOM 812 N VAL A 49 8.710 -24.478 25.689 1.00 0.00 N ATOM 813 CA VAL A 49 8.274 -23.569 26.742 1.00 0.00 C ATOM 814 C VAL A 49 8.117 -24.300 28.070 1.00 0.00 C ATOM 815 O VAL A 49 7.866 -23.683 29.105 1.00 0.00 O ATOM 816 CB VAL A 49 6.938 -22.892 26.381 1.00 0.00 C ATOM 817 CG1 VAL A 49 6.645 -21.744 27.336 1.00 0.00 C ATOM 818 CG2 VAL A 49 6.961 -22.404 24.940 1.00 0.00 C ATOM 0 H VAL A 49 7.975 -24.753 25.037 1.00 0.00 H new ATOM 0 HA VAL A 49 9.046 -22.806 26.840 1.00 0.00 H new ATOM 0 HB VAL A 49 6.140 -23.628 26.480 1.00 0.00 H new ATOM 0 HG11 VAL A 49 5.698 -21.278 27.065 1.00 0.00 H new ATOM 0 HG12 VAL A 49 6.584 -22.125 28.355 1.00 0.00 H new ATOM 0 HG13 VAL A 49 7.444 -21.005 27.273 1.00 0.00 H new ATOM 0 HG21 VAL A 49 6.010 -21.928 24.702 1.00 0.00 H new ATOM 0 HG22 VAL A 49 7.769 -21.683 24.813 1.00 0.00 H new ATOM 0 HG23 VAL A 49 7.121 -23.250 24.272 1.00 0.00 H new ATOM 828 N SER A 50 8.267 -25.621 28.034 1.00 0.00 N ATOM 829 CA SER A 50 8.139 -26.438 29.234 1.00 0.00 C ATOM 830 C SER A 50 6.718 -26.374 29.786 1.00 0.00 C ATOM 831 O SER A 50 6.468 -26.744 30.933 1.00 0.00 O ATOM 832 CB SER A 50 9.133 -25.975 30.300 1.00 0.00 C ATOM 833 OG SER A 50 10.417 -25.757 29.740 1.00 0.00 O ATOM 0 H SER A 50 8.477 -26.147 27.186 1.00 0.00 H new ATOM 0 HA SER A 50 8.360 -27.471 28.965 1.00 0.00 H new ATOM 0 HB2 SER A 50 8.773 -25.056 30.762 1.00 0.00 H new ATOM 0 HB3 SER A 50 9.199 -26.724 31.089 1.00 0.00 H new ATOM 0 HG SER A 50 11.034 -25.460 30.441 1.00 0.00 H new ATOM 839 N PHE A 51 5.790 -25.900 28.961 1.00 0.00 N ATOM 840 CA PHE A 51 4.394 -25.785 29.365 1.00 0.00 C ATOM 841 C PHE A 51 3.769 -27.164 29.561 1.00 0.00 C ATOM 842 O PHE A 51 4.261 -28.173 29.057 1.00 0.00 O ATOM 843 CB PHE A 51 3.601 -24.998 28.320 1.00 0.00 C ATOM 844 CG PHE A 51 3.226 -23.615 28.769 1.00 0.00 C ATOM 845 CD1 PHE A 51 4.142 -22.815 29.433 1.00 0.00 C ATOM 846 CD2 PHE A 51 1.957 -23.114 28.526 1.00 0.00 C ATOM 847 CE1 PHE A 51 3.798 -21.542 29.848 1.00 0.00 C ATOM 848 CE2 PHE A 51 1.608 -21.841 28.938 1.00 0.00 C ATOM 849 CZ PHE A 51 2.530 -21.054 29.599 1.00 0.00 C ATOM 0 H PHE A 51 5.980 -25.589 28.008 1.00 0.00 H new ATOM 0 HA PHE A 51 4.360 -25.251 30.315 1.00 0.00 H new ATOM 0 HB2 PHE A 51 4.190 -24.927 27.406 1.00 0.00 H new ATOM 0 HB3 PHE A 51 2.694 -25.550 28.073 1.00 0.00 H new ATOM 0 HD1 PHE A 51 5.136 -23.190 29.628 1.00 0.00 H new ATOM 0 HD2 PHE A 51 1.232 -23.725 28.009 1.00 0.00 H new ATOM 0 HE1 PHE A 51 4.520 -20.929 30.367 1.00 0.00 H new ATOM 0 HE2 PHE A 51 0.615 -21.463 28.743 1.00 0.00 H new ATOM 0 HZ PHE A 51 2.260 -20.059 29.921 1.00 0.00 H new ATOM 859 N PRO A 52 2.659 -27.208 30.313 1.00 0.00 N ATOM 860 CA PRO A 52 1.943 -28.456 30.594 1.00 0.00 C ATOM 861 C PRO A 52 1.247 -29.016 29.358 1.00 0.00 C ATOM 862 O PRO A 52 0.238 -28.476 28.904 1.00 0.00 O ATOM 863 CB PRO A 52 0.912 -28.044 31.648 1.00 0.00 C ATOM 864 CG PRO A 52 0.698 -26.588 31.419 1.00 0.00 C ATOM 865 CD PRO A 52 2.017 -26.044 30.946 1.00 0.00 C ATOM 0 HA PRO A 52 2.617 -29.247 30.923 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -0.016 -28.603 31.534 1.00 0.00 H new ATOM 0 HB3 PRO A 52 1.278 -28.237 32.656 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -0.082 -26.420 30.676 1.00 0.00 H new ATOM 0 HG3 PRO A 52 0.377 -26.092 32.335 1.00 0.00 H new ATOM 0 HD2 PRO A 52 1.884 -25.225 30.239 1.00 0.00 H new ATOM 0 HD3 PRO A 52 2.612 -25.657 31.773 1.00 0.00 H new ATOM 873 N VAL A 53 1.791 -30.102 28.819 1.00 0.00 N ATOM 874 CA VAL A 53 1.221 -30.736 27.636 1.00 0.00 C ATOM 875 C VAL A 53 0.283 -31.874 28.021 1.00 0.00 C ATOM 876 O VAL A 53 0.049 -32.792 27.235 1.00 0.00 O ATOM 877 CB VAL A 53 2.321 -31.284 26.707 1.00 0.00 C ATOM 878 CG1 VAL A 53 2.935 -32.546 27.293 1.00 0.00 C ATOM 879 CG2 VAL A 53 1.761 -31.548 25.318 1.00 0.00 C ATOM 0 H VAL A 53 2.626 -30.561 29.183 1.00 0.00 H new ATOM 0 HA VAL A 53 0.658 -29.968 27.106 1.00 0.00 H new ATOM 0 HB VAL A 53 3.107 -30.534 26.620 1.00 0.00 H new ATOM 0 HG11 VAL A 53 3.710 -32.919 26.623 1.00 0.00 H new ATOM 0 HG12 VAL A 53 3.374 -32.320 28.265 1.00 0.00 H new ATOM 0 HG13 VAL A 53 2.162 -33.305 27.412 1.00 0.00 H new ATOM 0 HG21 VAL A 53 2.551 -31.935 24.675 1.00 0.00 H new ATOM 0 HG22 VAL A 53 0.956 -32.280 25.383 1.00 0.00 H new ATOM 0 HG23 VAL A 53 1.374 -30.619 24.899 1.00 0.00 H new ATOM 889 N SER A 54 -0.254 -31.806 29.235 1.00 0.00 N ATOM 890 CA SER A 54 -1.165 -32.833 29.726 1.00 0.00 C ATOM 891 C SER A 54 -2.568 -32.629 29.163 1.00 0.00 C ATOM 892 O SER A 54 -3.416 -33.518 29.241 1.00 0.00 O ATOM 893 CB SER A 54 -1.209 -32.816 31.256 1.00 0.00 C ATOM 894 OG SER A 54 -0.198 -33.643 31.805 1.00 0.00 O ATOM 0 H SER A 54 -0.074 -31.051 29.896 1.00 0.00 H new ATOM 0 HA SER A 54 -0.796 -33.802 29.391 1.00 0.00 H new ATOM 0 HB2 SER A 54 -1.082 -31.795 31.615 1.00 0.00 H new ATOM 0 HB3 SER A 54 -2.187 -33.155 31.599 1.00 0.00 H new ATOM 0 HG SER A 54 -0.247 -33.613 32.783 1.00 0.00 H new ATOM 900 N GLY A 55 -2.806 -31.451 28.596 1.00 0.00 N ATOM 901 CA GLY A 55 -4.107 -31.149 28.027 1.00 0.00 C ATOM 902 C GLY A 55 -4.313 -31.802 26.675 1.00 0.00 C ATOM 903 O GLY A 55 -4.058 -32.994 26.507 1.00 0.00 O ATOM 0 H GLY A 55 -2.121 -30.699 28.520 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -4.886 -31.484 28.712 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -4.214 -30.069 27.926 1.00 0.00 H new ATOM 907 N ARG A 56 -4.779 -31.019 25.707 1.00 0.00 N ATOM 908 CA ARG A 56 -5.023 -31.528 24.363 1.00 0.00 C ATOM 909 C ARG A 56 -4.649 -30.488 23.311 1.00 0.00 C ATOM 910 O ARG A 56 -4.314 -29.350 23.639 1.00 0.00 O ATOM 911 CB ARG A 56 -6.493 -31.924 24.204 1.00 0.00 C ATOM 912 CG ARG A 56 -7.450 -30.745 24.253 1.00 0.00 C ATOM 913 CD ARG A 56 -8.710 -31.083 25.034 1.00 0.00 C ATOM 914 NE ARG A 56 -8.452 -31.201 26.467 1.00 0.00 N ATOM 915 CZ ARG A 56 -9.410 -31.285 27.382 1.00 0.00 C ATOM 916 NH1 ARG A 56 -10.685 -31.265 27.017 1.00 0.00 N ATOM 917 NH2 ARG A 56 -9.095 -31.391 28.667 1.00 0.00 N ATOM 0 H ARG A 56 -4.995 -30.030 25.829 1.00 0.00 H new ATOM 0 HA ARG A 56 -4.398 -32.409 24.216 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -6.620 -32.445 23.255 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -6.758 -32.629 24.992 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -6.953 -29.891 24.713 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -7.718 -30.450 23.238 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -9.460 -30.311 24.863 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -9.126 -32.019 24.663 1.00 0.00 H new ATOM 0 HE ARG A 56 -7.482 -31.220 26.782 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -10.932 -31.185 26.031 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -11.419 -31.330 27.723 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -8.116 -31.408 28.952 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -9.832 -31.455 29.369 1.00 0.00 H new ATOM 931 N LYS A 57 -4.708 -30.887 22.045 1.00 0.00 N ATOM 932 CA LYS A 57 -4.376 -29.991 20.944 1.00 0.00 C ATOM 933 C LYS A 57 -5.200 -28.710 21.018 1.00 0.00 C ATOM 934 O LYS A 57 -4.718 -27.630 20.678 1.00 0.00 O ATOM 935 CB LYS A 57 -4.615 -30.688 19.603 1.00 0.00 C ATOM 936 CG LYS A 57 -6.005 -31.285 19.467 1.00 0.00 C ATOM 937 CD LYS A 57 -6.220 -31.890 18.090 1.00 0.00 C ATOM 938 CE LYS A 57 -7.466 -31.330 17.423 1.00 0.00 C ATOM 939 NZ LYS A 57 -7.490 -31.616 15.961 1.00 0.00 N ATOM 0 H LYS A 57 -4.983 -31.826 21.756 1.00 0.00 H new ATOM 0 HA LYS A 57 -3.321 -29.728 21.027 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -4.456 -29.971 18.797 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -3.875 -31.479 19.477 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -6.149 -32.051 20.229 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -6.753 -30.513 19.647 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -5.350 -31.690 17.464 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -6.308 -32.973 18.177 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -8.352 -31.758 17.891 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -7.510 -30.253 17.583 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -8.355 -31.218 15.544 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -6.658 -31.186 15.509 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -7.474 -32.645 15.808 1.00 0.00 H new ATOM 953 N ALA A 58 -6.445 -28.838 21.464 1.00 0.00 N ATOM 954 CA ALA A 58 -7.335 -27.690 21.586 1.00 0.00 C ATOM 955 C ALA A 58 -6.847 -26.728 22.664 1.00 0.00 C ATOM 956 O ALA A 58 -6.871 -25.511 22.481 1.00 0.00 O ATOM 957 CB ALA A 58 -8.753 -28.151 21.890 1.00 0.00 C ATOM 0 H ALA A 58 -6.860 -29.726 21.747 1.00 0.00 H new ATOM 0 HA ALA A 58 -7.334 -27.158 20.634 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -9.407 -27.283 21.978 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -9.108 -28.792 21.083 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -8.761 -28.708 22.827 1.00 0.00 H new ATOM 963 N VAL A 59 -6.405 -27.282 23.788 1.00 0.00 N ATOM 964 CA VAL A 59 -5.910 -26.474 24.896 1.00 0.00 C ATOM 965 C VAL A 59 -4.647 -25.716 24.503 1.00 0.00 C ATOM 966 O VAL A 59 -4.516 -24.522 24.774 1.00 0.00 O ATOM 967 CB VAL A 59 -5.612 -27.340 26.134 1.00 0.00 C ATOM 968 CG1 VAL A 59 -5.067 -26.484 27.267 1.00 0.00 C ATOM 969 CG2 VAL A 59 -6.861 -28.089 26.573 1.00 0.00 C ATOM 0 H VAL A 59 -6.380 -28.288 23.956 1.00 0.00 H new ATOM 0 HA VAL A 59 -6.696 -25.760 25.142 1.00 0.00 H new ATOM 0 HB VAL A 59 -4.851 -28.074 25.868 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -4.863 -27.114 28.133 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -4.145 -25.999 26.946 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -5.802 -25.725 27.536 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -6.632 -28.696 27.449 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -7.645 -27.374 26.822 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -7.202 -28.734 25.763 1.00 0.00 H new ATOM 979 N LEU A 60 -3.719 -26.418 23.862 1.00 0.00 N ATOM 980 CA LEU A 60 -2.464 -25.812 23.429 1.00 0.00 C ATOM 981 C LEU A 60 -2.717 -24.707 22.409 1.00 0.00 C ATOM 982 O LEU A 60 -2.284 -23.569 22.593 1.00 0.00 O ATOM 983 CB LEU A 60 -1.542 -26.875 22.829 1.00 0.00 C ATOM 984 CG LEU A 60 -0.297 -27.222 23.646 1.00 0.00 C ATOM 985 CD1 LEU A 60 -0.178 -28.727 23.825 1.00 0.00 C ATOM 986 CD2 LEU A 60 0.951 -26.662 22.980 1.00 0.00 C ATOM 0 H LEU A 60 -3.812 -27.407 23.630 1.00 0.00 H new ATOM 0 HA LEU A 60 -1.981 -25.372 24.301 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -2.120 -27.787 22.680 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -1.223 -26.536 21.844 1.00 0.00 H new ATOM 0 HG LEU A 60 -0.394 -26.766 24.631 1.00 0.00 H new ATOM 0 HD11 LEU A 60 0.714 -28.955 24.409 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -1.059 -29.102 24.347 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -0.104 -29.205 22.848 1.00 0.00 H new ATOM 0 HD21 LEU A 60 1.827 -26.919 23.575 1.00 0.00 H new ATOM 0 HD22 LEU A 60 1.053 -27.088 21.982 1.00 0.00 H new ATOM 0 HD23 LEU A 60 0.868 -25.578 22.905 1.00 0.00 H new ATOM 998 N GLN A 61 -3.420 -25.050 21.335 1.00 0.00 N ATOM 999 CA GLN A 61 -3.731 -24.085 20.286 1.00 0.00 C ATOM 1000 C GLN A 61 -4.518 -22.906 20.847 1.00 0.00 C ATOM 1001 O GLN A 61 -4.375 -21.774 20.383 1.00 0.00 O ATOM 1002 CB GLN A 61 -4.527 -24.757 19.166 1.00 0.00 C ATOM 1003 CG GLN A 61 -5.981 -25.017 19.524 1.00 0.00 C ATOM 1004 CD GLN A 61 -6.789 -25.529 18.347 1.00 0.00 C ATOM 1005 OE1 GLN A 61 -7.489 -26.537 18.452 1.00 0.00 O ATOM 1006 NE2 GLN A 61 -6.697 -24.836 17.219 1.00 0.00 N ATOM 0 H GLN A 61 -3.785 -25.988 21.168 1.00 0.00 H new ATOM 0 HA GLN A 61 -2.791 -23.711 19.881 1.00 0.00 H new ATOM 0 HB2 GLN A 61 -4.487 -24.129 18.276 1.00 0.00 H new ATOM 0 HB3 GLN A 61 -4.050 -25.703 18.910 1.00 0.00 H new ATOM 0 HG2 GLN A 61 -6.027 -25.744 20.335 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -6.430 -24.096 19.895 1.00 0.00 H new ATOM 0 HE21 GLN A 61 -6.105 -24.007 17.177 1.00 0.00 H new ATOM 0 HE22 GLN A 61 -7.219 -25.133 16.394 1.00 0.00 H new ATOM 1015 N ASP A 62 -5.348 -23.177 21.848 1.00 0.00 N ATOM 1016 CA ASP A 62 -6.158 -22.138 22.474 1.00 0.00 C ATOM 1017 C ASP A 62 -5.284 -21.174 23.271 1.00 0.00 C ATOM 1018 O ASP A 62 -5.492 -19.961 23.240 1.00 0.00 O ATOM 1019 CB ASP A 62 -7.213 -22.764 23.387 1.00 0.00 C ATOM 1020 CG ASP A 62 -8.463 -23.172 22.634 1.00 0.00 C ATOM 1021 OD1 ASP A 62 -8.798 -22.504 21.633 1.00 0.00 O ATOM 1022 OD2 ASP A 62 -9.107 -24.160 23.044 1.00 0.00 O ATOM 0 H ASP A 62 -5.478 -24.108 22.244 1.00 0.00 H new ATOM 0 HA ASP A 62 -6.659 -21.578 21.685 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -6.789 -23.638 23.881 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -7.480 -22.053 24.169 1.00 0.00 H new ATOM 1027 N LEU A 63 -4.307 -21.722 23.984 1.00 0.00 N ATOM 1028 CA LEU A 63 -3.401 -20.912 24.791 1.00 0.00 C ATOM 1029 C LEU A 63 -2.557 -19.997 23.909 1.00 0.00 C ATOM 1030 O LEU A 63 -2.453 -18.797 24.163 1.00 0.00 O ATOM 1031 CB LEU A 63 -2.492 -21.810 25.631 1.00 0.00 C ATOM 1032 CG LEU A 63 -3.103 -22.370 26.916 1.00 0.00 C ATOM 1033 CD1 LEU A 63 -2.112 -23.279 27.626 1.00 0.00 C ATOM 1034 CD2 LEU A 63 -3.546 -21.239 27.833 1.00 0.00 C ATOM 0 H LEU A 63 -4.121 -22.724 24.020 1.00 0.00 H new ATOM 0 HA LEU A 63 -4.003 -20.292 25.456 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -2.169 -22.647 25.012 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -1.598 -21.244 25.894 1.00 0.00 H new ATOM 0 HG LEU A 63 -3.980 -22.960 26.652 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -2.564 -23.668 28.538 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -1.845 -24.108 26.971 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -1.215 -22.713 27.878 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -3.978 -21.656 28.742 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -2.686 -20.621 28.090 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -4.292 -20.629 27.324 1.00 0.00 H new ATOM 1046 N ILE A 64 -1.958 -20.572 22.871 1.00 0.00 N ATOM 1047 CA ILE A 64 -1.127 -19.808 21.950 1.00 0.00 C ATOM 1048 C ILE A 64 -1.945 -18.748 21.221 1.00 0.00 C ATOM 1049 O ILE A 64 -1.566 -17.578 21.177 1.00 0.00 O ATOM 1050 CB ILE A 64 -0.450 -20.722 20.912 1.00 0.00 C ATOM 1051 CG1 ILE A 64 0.408 -21.778 21.612 1.00 0.00 C ATOM 1052 CG2 ILE A 64 0.394 -19.898 19.950 1.00 0.00 C ATOM 1053 CD1 ILE A 64 1.468 -21.191 22.517 1.00 0.00 C ATOM 0 H ILE A 64 -2.033 -21.564 22.647 1.00 0.00 H new ATOM 0 HA ILE A 64 -0.358 -19.321 22.549 1.00 0.00 H new ATOM 0 HB ILE A 64 -1.225 -21.232 20.339 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -0.239 -22.430 22.199 1.00 0.00 H new ATOM 0 HG13 ILE A 64 0.889 -22.401 20.858 1.00 0.00 H new ATOM 0 HG21 ILE A 64 0.866 -20.559 19.223 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -0.242 -19.181 19.430 1.00 0.00 H new ATOM 0 HG23 ILE A 64 1.163 -19.363 20.507 1.00 0.00 H new ATOM 0 HD11 ILE A 64 2.038 -21.997 22.980 1.00 0.00 H new ATOM 0 HD12 ILE A 64 2.139 -20.562 21.932 1.00 0.00 H new ATOM 0 HD13 ILE A 64 0.992 -20.591 23.293 1.00 0.00 H new ATOM 1065 N ARG A 65 -3.071 -19.166 20.650 1.00 0.00 N ATOM 1066 CA ARG A 65 -3.944 -18.252 19.923 1.00 0.00 C ATOM 1067 C ARG A 65 -4.334 -17.063 20.796 1.00 0.00 C ATOM 1068 O ARG A 65 -4.240 -15.912 20.371 1.00 0.00 O ATOM 1069 CB ARG A 65 -5.201 -18.984 19.448 1.00 0.00 C ATOM 1070 CG ARG A 65 -5.933 -18.269 18.325 1.00 0.00 C ATOM 1071 CD ARG A 65 -6.965 -19.173 17.669 1.00 0.00 C ATOM 1072 NE ARG A 65 -7.890 -19.746 18.644 1.00 0.00 N ATOM 1073 CZ ARG A 65 -8.880 -19.063 19.207 1.00 0.00 C ATOM 1074 NH1 ARG A 65 -9.074 -17.789 18.893 1.00 0.00 N ATOM 1075 NH2 ARG A 65 -9.680 -19.654 20.086 1.00 0.00 N ATOM 0 H ARG A 65 -3.400 -20.131 20.677 1.00 0.00 H new ATOM 0 HA ARG A 65 -3.398 -17.880 19.056 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -4.924 -19.983 19.112 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -5.880 -19.108 20.292 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -6.425 -17.379 18.718 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -5.215 -17.932 17.577 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -7.526 -18.604 16.928 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -6.457 -19.976 17.136 1.00 0.00 H new ATOM 0 HE ARG A 65 -7.769 -20.724 18.907 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -8.462 -17.331 18.217 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -9.835 -17.267 19.327 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -9.535 -20.634 20.330 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -10.440 -19.128 20.518 1.00 0.00 H new ATOM 1089 N ASN A 66 -4.771 -17.350 22.018 1.00 0.00 N ATOM 1090 CA ASN A 66 -5.177 -16.304 22.950 1.00 0.00 C ATOM 1091 C ASN A 66 -3.992 -15.417 23.320 1.00 0.00 C ATOM 1092 O ASN A 66 -4.143 -14.211 23.515 1.00 0.00 O ATOM 1093 CB ASN A 66 -5.779 -16.923 24.212 1.00 0.00 C ATOM 1094 CG ASN A 66 -7.167 -17.486 23.975 1.00 0.00 C ATOM 1095 OD1 ASN A 66 -7.449 -18.636 24.312 1.00 0.00 O ATOM 1096 ND2 ASN A 66 -8.042 -16.676 23.390 1.00 0.00 N ATOM 0 H ASN A 66 -4.853 -18.298 22.386 1.00 0.00 H new ATOM 0 HA ASN A 66 -5.931 -15.688 22.461 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -5.124 -17.717 24.572 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -5.825 -16.168 24.997 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -8.991 -17.000 23.203 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -7.765 -15.730 23.127 1.00 0.00 H new ATOM 1103 N PHE A 67 -2.813 -16.023 23.416 1.00 0.00 N ATOM 1104 CA PHE A 67 -1.602 -15.288 23.763 1.00 0.00 C ATOM 1105 C PHE A 67 -1.308 -14.205 22.730 1.00 0.00 C ATOM 1106 O PHE A 67 -1.132 -13.035 23.073 1.00 0.00 O ATOM 1107 CB PHE A 67 -0.413 -16.245 23.868 1.00 0.00 C ATOM 1108 CG PHE A 67 -0.113 -16.677 25.275 1.00 0.00 C ATOM 1109 CD1 PHE A 67 0.114 -15.738 26.269 1.00 0.00 C ATOM 1110 CD2 PHE A 67 -0.060 -18.022 25.605 1.00 0.00 C ATOM 1111 CE1 PHE A 67 0.390 -16.133 27.564 1.00 0.00 C ATOM 1112 CE2 PHE A 67 0.216 -18.423 26.898 1.00 0.00 C ATOM 1113 CZ PHE A 67 0.440 -17.477 27.880 1.00 0.00 C ATOM 0 H PHE A 67 -2.670 -17.021 23.258 1.00 0.00 H new ATOM 0 HA PHE A 67 -1.761 -14.809 24.729 1.00 0.00 H new ATOM 0 HB2 PHE A 67 -0.613 -17.128 23.260 1.00 0.00 H new ATOM 0 HB3 PHE A 67 0.470 -15.762 23.449 1.00 0.00 H new ATOM 0 HD1 PHE A 67 0.075 -14.686 26.029 1.00 0.00 H new ATOM 0 HD2 PHE A 67 -0.237 -18.766 24.842 1.00 0.00 H new ATOM 0 HE1 PHE A 67 0.567 -15.391 28.329 1.00 0.00 H new ATOM 0 HE2 PHE A 67 0.257 -19.475 27.141 1.00 0.00 H new ATOM 0 HZ PHE A 67 0.654 -17.788 28.892 1.00 0.00 H new ATOM 1123 N LEU A 68 -1.254 -14.602 21.463 1.00 0.00 N ATOM 1124 CA LEU A 68 -0.981 -13.666 20.379 1.00 0.00 C ATOM 1125 C LEU A 68 -2.140 -12.692 20.195 1.00 0.00 C ATOM 1126 O LEU A 68 -1.932 -11.512 19.914 1.00 0.00 O ATOM 1127 CB LEU A 68 -0.727 -14.425 19.075 1.00 0.00 C ATOM 1128 CG LEU A 68 0.615 -14.156 18.392 1.00 0.00 C ATOM 1129 CD1 LEU A 68 0.750 -14.995 17.131 1.00 0.00 C ATOM 1130 CD2 LEU A 68 0.760 -12.676 18.068 1.00 0.00 C ATOM 0 H LEU A 68 -1.396 -15.566 21.162 1.00 0.00 H new ATOM 0 HA LEU A 68 -0.089 -13.096 20.641 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -0.800 -15.493 19.280 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -1.525 -14.179 18.374 1.00 0.00 H new ATOM 0 HG LEU A 68 1.414 -14.438 19.078 1.00 0.00 H new ATOM 0 HD11 LEU A 68 1.711 -14.790 16.659 1.00 0.00 H new ATOM 0 HD12 LEU A 68 0.691 -16.052 17.389 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -0.055 -14.745 16.440 1.00 0.00 H new ATOM 0 HD21 LEU A 68 1.720 -12.502 17.583 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -0.045 -12.369 17.400 1.00 0.00 H new ATOM 0 HD23 LEU A 68 0.709 -12.095 18.989 1.00 0.00 H new ATOM 1142 N GLN A 69 -3.360 -13.193 20.358 1.00 0.00 N ATOM 1143 CA GLN A 69 -4.551 -12.366 20.212 1.00 0.00 C ATOM 1144 C GLN A 69 -4.613 -11.302 21.303 1.00 0.00 C ATOM 1145 O GLN A 69 -5.001 -10.163 21.050 1.00 0.00 O ATOM 1146 CB GLN A 69 -5.810 -13.235 20.258 1.00 0.00 C ATOM 1147 CG GLN A 69 -6.296 -13.674 18.886 1.00 0.00 C ATOM 1148 CD GLN A 69 -6.652 -12.504 17.990 1.00 0.00 C ATOM 1149 OE1 GLN A 69 -7.281 -11.540 18.429 1.00 0.00 O ATOM 1150 NE2 GLN A 69 -6.251 -12.582 16.727 1.00 0.00 N ATOM 0 H GLN A 69 -3.549 -14.168 20.591 1.00 0.00 H new ATOM 0 HA GLN A 69 -4.498 -11.866 19.245 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -5.609 -14.119 20.863 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -6.606 -12.681 20.756 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -5.522 -14.272 18.405 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -7.169 -14.316 19.003 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -5.732 -13.400 16.406 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -6.462 -11.824 16.077 1.00 0.00 H new ATOM 1159 N ASN A 70 -4.229 -11.684 22.516 1.00 0.00 N ATOM 1160 CA ASN A 70 -4.241 -10.762 23.647 1.00 0.00 C ATOM 1161 C ASN A 70 -2.944 -9.963 23.712 1.00 0.00 C ATOM 1162 O ASN A 70 -2.862 -8.949 24.404 1.00 0.00 O ATOM 1163 CB ASN A 70 -4.446 -11.530 24.955 1.00 0.00 C ATOM 1164 CG ASN A 70 -5.894 -11.924 25.173 1.00 0.00 C ATOM 1165 OD1 ASN A 70 -6.742 -11.079 25.464 1.00 0.00 O ATOM 1166 ND2 ASN A 70 -6.184 -13.212 25.034 1.00 0.00 N ATOM 0 H ASN A 70 -3.906 -12.625 22.742 1.00 0.00 H new ATOM 0 HA ASN A 70 -5.068 -10.066 23.508 1.00 0.00 H new ATOM 0 HB2 ASN A 70 -3.826 -12.426 24.948 1.00 0.00 H new ATOM 0 HB3 ASN A 70 -4.110 -10.916 25.790 1.00 0.00 H new ATOM 0 HD21 ASN A 70 -7.141 -13.537 25.169 1.00 0.00 H new ATOM 0 HD22 ASN A 70 -5.449 -13.877 24.792 1.00 0.00 H new ATOM 1173 N ALA A 71 -1.933 -10.426 22.984 1.00 0.00 N ATOM 1174 CA ALA A 71 -0.640 -9.753 22.956 1.00 0.00 C ATOM 1175 C ALA A 71 -0.785 -8.306 22.500 1.00 0.00 C ATOM 1176 O ALA A 71 0.088 -7.474 22.753 1.00 0.00 O ATOM 1177 CB ALA A 71 0.325 -10.501 22.049 1.00 0.00 C ATOM 0 H ALA A 71 -1.984 -11.265 22.406 1.00 0.00 H new ATOM 0 HA ALA A 71 -0.238 -9.748 23.969 1.00 0.00 H new ATOM 0 HB1 ALA A 71 1.286 -9.987 22.038 1.00 0.00 H new ATOM 0 HB2 ALA A 71 0.461 -11.517 22.421 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -0.079 -10.536 21.037 1.00 0.00 H new ATOM 1183 N LEU A 72 -1.890 -8.010 21.826 1.00 0.00 N ATOM 1184 CA LEU A 72 -2.149 -6.662 21.333 1.00 0.00 C ATOM 1185 C LEU A 72 -3.447 -6.109 21.914 1.00 0.00 C ATOM 1186 O LEU A 72 -4.399 -5.836 21.183 1.00 0.00 O ATOM 1187 CB LEU A 72 -2.220 -6.661 19.805 1.00 0.00 C ATOM 1188 CG LEU A 72 -3.069 -7.764 19.172 1.00 0.00 C ATOM 1189 CD1 LEU A 72 -4.376 -7.194 18.643 1.00 0.00 C ATOM 1190 CD2 LEU A 72 -2.299 -8.458 18.058 1.00 0.00 C ATOM 0 H LEU A 72 -2.622 -8.686 21.608 1.00 0.00 H new ATOM 0 HA LEU A 72 -1.327 -6.021 21.653 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -2.612 -5.697 19.480 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -1.206 -6.741 19.414 1.00 0.00 H new ATOM 0 HG LEU A 72 -3.302 -8.502 19.940 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -4.967 -7.993 18.196 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -4.935 -6.744 19.463 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -4.164 -6.435 17.890 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -2.919 -9.240 17.619 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -2.035 -7.731 17.290 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -1.390 -8.901 18.465 1.00 0.00 H new ATOM 1202 N VAL A 73 -3.476 -5.945 23.233 1.00 0.00 N ATOM 1203 CA VAL A 73 -4.656 -5.422 23.912 1.00 0.00 C ATOM 1204 C VAL A 73 -4.418 -4.000 24.408 1.00 0.00 C ATOM 1205 O VAL A 73 -3.347 -3.682 24.925 1.00 0.00 O ATOM 1206 CB VAL A 73 -5.057 -6.310 25.104 1.00 0.00 C ATOM 1207 CG1 VAL A 73 -6.179 -5.661 25.900 1.00 0.00 C ATOM 1208 CG2 VAL A 73 -5.464 -7.695 24.624 1.00 0.00 C ATOM 0 H VAL A 73 -2.696 -6.167 23.852 1.00 0.00 H new ATOM 0 HA VAL A 73 -5.466 -5.419 23.183 1.00 0.00 H new ATOM 0 HB VAL A 73 -4.194 -6.418 25.761 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -6.449 -6.303 26.738 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -5.846 -4.694 26.276 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -7.047 -5.520 25.256 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -5.744 -8.309 25.480 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -6.313 -7.610 23.945 1.00 0.00 H new ATOM 0 HG23 VAL A 73 -4.627 -8.160 24.103 1.00 0.00 H new ATOM 1218 N VAL A 74 -5.425 -3.148 24.248 1.00 0.00 N ATOM 1219 CA VAL A 74 -5.328 -1.759 24.681 1.00 0.00 C ATOM 1220 C VAL A 74 -4.869 -1.667 26.132 1.00 0.00 C ATOM 1221 O VAL A 74 -5.595 -2.051 27.049 1.00 0.00 O ATOM 1222 CB VAL A 74 -6.675 -1.028 24.532 1.00 0.00 C ATOM 1223 CG1 VAL A 74 -6.539 0.432 24.935 1.00 0.00 C ATOM 1224 CG2 VAL A 74 -7.193 -1.151 23.107 1.00 0.00 C ATOM 0 H VAL A 74 -6.318 -3.395 23.821 1.00 0.00 H new ATOM 0 HA VAL A 74 -4.591 -1.278 24.038 1.00 0.00 H new ATOM 0 HB VAL A 74 -7.398 -1.497 25.199 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -7.501 0.932 24.823 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -6.217 0.494 25.974 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -5.801 0.918 24.297 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -8.146 -0.629 23.020 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -6.473 -0.709 22.419 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -7.332 -2.203 22.860 1.00 0.00 H new ATOM 1234 N GLY A 75 -3.659 -1.154 26.334 1.00 0.00 N ATOM 1235 CA GLY A 75 -3.125 -1.020 27.676 1.00 0.00 C ATOM 1236 C GLY A 75 -2.735 -2.354 28.281 1.00 0.00 C ATOM 1237 O GLY A 75 -2.986 -2.607 29.459 1.00 0.00 O ATOM 0 H GLY A 75 -3.039 -0.829 25.592 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -2.253 -0.366 27.653 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -3.867 -0.539 28.313 1.00 0.00 H new ATOM 1241 N LYS A 76 -2.122 -3.212 27.472 1.00 0.00 N ATOM 1242 CA LYS A 76 -1.697 -4.528 27.933 1.00 0.00 C ATOM 1243 C LYS A 76 -0.851 -5.228 26.875 1.00 0.00 C ATOM 1244 O LYS A 76 -0.888 -6.452 26.747 1.00 0.00 O ATOM 1245 CB LYS A 76 -2.915 -5.388 28.279 1.00 0.00 C ATOM 1246 CG LYS A 76 -2.827 -6.044 29.646 1.00 0.00 C ATOM 1247 CD LYS A 76 -3.337 -7.475 29.612 1.00 0.00 C ATOM 1248 CE LYS A 76 -3.864 -7.912 30.970 1.00 0.00 C ATOM 1249 NZ LYS A 76 -5.264 -8.413 30.886 1.00 0.00 N ATOM 0 H LYS A 76 -1.909 -3.019 26.493 1.00 0.00 H new ATOM 0 HA LYS A 76 -1.089 -4.393 28.828 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -3.810 -4.768 28.240 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -3.030 -6.162 27.520 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -1.793 -6.034 29.990 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -3.408 -5.467 30.366 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -4.129 -7.562 28.868 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -2.533 -8.142 29.301 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -3.222 -8.694 31.374 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -3.819 -7.073 31.664 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -5.587 -8.701 31.832 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -5.882 -7.659 30.524 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -5.302 -9.230 30.243 1.00 0.00 H new ATOM 1263 N SER A 77 -0.089 -4.444 26.118 1.00 0.00 N ATOM 1264 CA SER A 77 0.764 -4.990 25.069 1.00 0.00 C ATOM 1265 C SER A 77 1.622 -6.132 25.605 1.00 0.00 C ATOM 1266 O SER A 77 1.980 -6.154 26.783 1.00 0.00 O ATOM 1267 CB SER A 77 1.660 -3.893 24.489 1.00 0.00 C ATOM 1268 OG SER A 77 1.226 -3.511 23.195 1.00 0.00 O ATOM 0 H SER A 77 -0.045 -3.429 26.212 1.00 0.00 H new ATOM 0 HA SER A 77 0.122 -5.381 24.280 1.00 0.00 H new ATOM 0 HB2 SER A 77 1.652 -3.026 25.149 1.00 0.00 H new ATOM 0 HB3 SER A 77 2.690 -4.248 24.441 1.00 0.00 H new ATOM 0 HG SER A 77 1.814 -2.808 22.847 1.00 0.00 H new ATOM 1274 N ASP A 78 1.947 -7.079 24.732 1.00 0.00 N ATOM 1275 CA ASP A 78 2.764 -8.224 25.116 1.00 0.00 C ATOM 1276 C ASP A 78 3.373 -8.893 23.887 1.00 0.00 C ATOM 1277 O ASP A 78 2.937 -9.957 23.449 1.00 0.00 O ATOM 1278 CB ASP A 78 1.926 -9.236 25.899 1.00 0.00 C ATOM 1279 CG ASP A 78 2.091 -9.087 27.399 1.00 0.00 C ATOM 1280 OD1 ASP A 78 3.158 -9.472 27.920 1.00 0.00 O ATOM 1281 OD2 ASP A 78 1.152 -8.584 28.051 1.00 0.00 O ATOM 0 H ASP A 78 1.657 -7.076 23.754 1.00 0.00 H new ATOM 0 HA ASP A 78 3.573 -7.865 25.752 1.00 0.00 H new ATOM 0 HB2 ASP A 78 0.875 -9.112 25.638 1.00 0.00 H new ATOM 0 HB3 ASP A 78 2.211 -10.246 25.604 1.00 0.00 H new ATOM 1286 N PRO A 79 4.406 -8.255 23.317 1.00 0.00 N ATOM 1287 CA PRO A 79 5.097 -8.769 22.131 1.00 0.00 C ATOM 1288 C PRO A 79 5.912 -10.022 22.433 1.00 0.00 C ATOM 1289 O PRO A 79 6.278 -10.770 21.526 1.00 0.00 O ATOM 1290 CB PRO A 79 6.020 -7.615 21.730 1.00 0.00 C ATOM 1291 CG PRO A 79 6.249 -6.858 22.992 1.00 0.00 C ATOM 1292 CD PRO A 79 4.979 -6.982 23.786 1.00 0.00 C ATOM 0 HA PRO A 79 4.398 -9.066 21.349 1.00 0.00 H new ATOM 0 HB2 PRO A 79 6.957 -7.984 21.314 1.00 0.00 H new ATOM 0 HB3 PRO A 79 5.559 -6.986 20.969 1.00 0.00 H new ATOM 0 HG2 PRO A 79 7.096 -7.267 23.544 1.00 0.00 H new ATOM 0 HG3 PRO A 79 6.479 -5.813 22.784 1.00 0.00 H new ATOM 0 HD2 PRO A 79 5.176 -7.001 24.858 1.00 0.00 H new ATOM 0 HD3 PRO A 79 4.305 -6.145 23.600 1.00 0.00 H new ATOM 1300 N TYR A 80 6.192 -10.247 23.712 1.00 0.00 N ATOM 1301 CA TYR A 80 6.965 -11.409 24.133 1.00 0.00 C ATOM 1302 C TYR A 80 6.384 -12.691 23.545 1.00 0.00 C ATOM 1303 O TYR A 80 7.090 -13.469 22.903 1.00 0.00 O ATOM 1304 CB TYR A 80 6.995 -11.502 25.659 1.00 0.00 C ATOM 1305 CG TYR A 80 7.410 -10.215 26.336 1.00 0.00 C ATOM 1306 CD1 TYR A 80 8.472 -9.463 25.851 1.00 0.00 C ATOM 1307 CD2 TYR A 80 6.740 -9.752 27.462 1.00 0.00 C ATOM 1308 CE1 TYR A 80 8.855 -8.287 26.466 1.00 0.00 C ATOM 1309 CE2 TYR A 80 7.114 -8.576 28.083 1.00 0.00 C ATOM 1310 CZ TYR A 80 8.173 -7.847 27.581 1.00 0.00 C ATOM 1311 OH TYR A 80 8.550 -6.677 28.198 1.00 0.00 O ATOM 0 H TYR A 80 5.895 -9.639 24.475 1.00 0.00 H new ATOM 0 HA TYR A 80 7.983 -11.290 23.763 1.00 0.00 H new ATOM 0 HB2 TYR A 80 6.006 -11.788 26.017 1.00 0.00 H new ATOM 0 HB3 TYR A 80 7.682 -12.295 25.953 1.00 0.00 H new ATOM 0 HD1 TYR A 80 9.008 -9.804 24.977 1.00 0.00 H new ATOM 0 HD2 TYR A 80 5.912 -10.321 27.859 1.00 0.00 H new ATOM 0 HE1 TYR A 80 9.684 -7.715 26.076 1.00 0.00 H new ATOM 0 HE2 TYR A 80 6.581 -8.229 28.956 1.00 0.00 H new ATOM 0 HH TYR A 80 7.966 -6.510 28.967 1.00 0.00 H new ATOM 1321 N ARG A 81 5.091 -12.905 23.769 1.00 0.00 N ATOM 1322 CA ARG A 81 4.414 -14.092 23.264 1.00 0.00 C ATOM 1323 C ARG A 81 4.437 -14.123 21.738 1.00 0.00 C ATOM 1324 O ARG A 81 4.488 -15.192 21.129 1.00 0.00 O ATOM 1325 CB ARG A 81 2.968 -14.133 23.763 1.00 0.00 C ATOM 1326 CG ARG A 81 2.842 -14.005 25.272 1.00 0.00 C ATOM 1327 CD ARG A 81 3.303 -15.269 25.979 1.00 0.00 C ATOM 1328 NE ARG A 81 3.291 -15.119 27.432 1.00 0.00 N ATOM 1329 CZ ARG A 81 3.839 -15.997 28.266 1.00 0.00 C ATOM 1330 NH1 ARG A 81 4.438 -17.081 27.793 1.00 0.00 N ATOM 1331 NH2 ARG A 81 3.788 -15.790 29.576 1.00 0.00 N ATOM 0 H ARG A 81 4.492 -12.271 24.297 1.00 0.00 H new ATOM 0 HA ARG A 81 4.945 -14.968 23.637 1.00 0.00 H new ATOM 0 HB2 ARG A 81 2.406 -13.327 23.290 1.00 0.00 H new ATOM 0 HB3 ARG A 81 2.510 -15.070 23.447 1.00 0.00 H new ATOM 0 HG2 ARG A 81 3.434 -13.157 25.617 1.00 0.00 H new ATOM 0 HG3 ARG A 81 1.805 -13.797 25.535 1.00 0.00 H new ATOM 0 HD2 ARG A 81 2.657 -16.099 25.695 1.00 0.00 H new ATOM 0 HD3 ARG A 81 4.311 -15.522 25.649 1.00 0.00 H new ATOM 0 HE ARG A 81 2.837 -14.296 27.828 1.00 0.00 H new ATOM 0 HH11 ARG A 81 4.479 -17.243 26.787 1.00 0.00 H new ATOM 0 HH12 ARG A 81 4.858 -17.753 28.435 1.00 0.00 H new ATOM 0 HH21 ARG A 81 3.328 -14.957 29.943 1.00 0.00 H new ATOM 0 HH22 ARG A 81 4.209 -16.464 30.216 1.00 0.00 H new ATOM 1345 N VAL A 82 4.400 -12.944 21.127 1.00 0.00 N ATOM 1346 CA VAL A 82 4.417 -12.835 19.673 1.00 0.00 C ATOM 1347 C VAL A 82 5.699 -13.424 19.093 1.00 0.00 C ATOM 1348 O VAL A 82 5.655 -14.293 18.223 1.00 0.00 O ATOM 1349 CB VAL A 82 4.286 -11.370 19.218 1.00 0.00 C ATOM 1350 CG1 VAL A 82 4.158 -11.290 17.704 1.00 0.00 C ATOM 1351 CG2 VAL A 82 3.099 -10.705 19.898 1.00 0.00 C ATOM 0 H VAL A 82 4.358 -12.050 21.616 1.00 0.00 H new ATOM 0 HA VAL A 82 3.561 -13.400 19.303 1.00 0.00 H new ATOM 0 HB VAL A 82 5.189 -10.835 19.511 1.00 0.00 H new ATOM 0 HG11 VAL A 82 4.066 -10.247 17.401 1.00 0.00 H new ATOM 0 HG12 VAL A 82 5.043 -11.726 17.240 1.00 0.00 H new ATOM 0 HG13 VAL A 82 3.273 -11.840 17.384 1.00 0.00 H new ATOM 0 HG21 VAL A 82 3.022 -9.670 19.565 1.00 0.00 H new ATOM 0 HG22 VAL A 82 2.185 -11.239 19.639 1.00 0.00 H new ATOM 0 HG23 VAL A 82 3.239 -10.729 20.979 1.00 0.00 H new ATOM 1361 N GLN A 83 6.837 -12.944 19.583 1.00 0.00 N ATOM 1362 CA GLN A 83 8.132 -13.423 19.112 1.00 0.00 C ATOM 1363 C GLN A 83 8.339 -14.888 19.486 1.00 0.00 C ATOM 1364 O GLN A 83 8.893 -15.664 18.708 1.00 0.00 O ATOM 1365 CB GLN A 83 9.259 -12.571 19.699 1.00 0.00 C ATOM 1366 CG GLN A 83 9.180 -12.415 21.209 1.00 0.00 C ATOM 1367 CD GLN A 83 10.398 -11.722 21.788 1.00 0.00 C ATOM 1368 OE1 GLN A 83 11.243 -11.210 21.053 1.00 0.00 O ATOM 1369 NE2 GLN A 83 10.495 -11.703 23.112 1.00 0.00 N ATOM 0 H GLN A 83 6.889 -12.225 20.305 1.00 0.00 H new ATOM 0 HA GLN A 83 8.150 -13.338 18.025 1.00 0.00 H new ATOM 0 HB2 GLN A 83 10.217 -13.021 19.438 1.00 0.00 H new ATOM 0 HB3 GLN A 83 9.235 -11.583 19.238 1.00 0.00 H new ATOM 0 HG2 GLN A 83 8.287 -11.846 21.466 1.00 0.00 H new ATOM 0 HG3 GLN A 83 9.074 -13.398 21.667 1.00 0.00 H new ATOM 0 HE21 GLN A 83 9.771 -12.140 23.683 1.00 0.00 H new ATOM 0 HE22 GLN A 83 11.293 -11.252 23.558 1.00 0.00 H new ATOM 1378 N ALA A 84 7.890 -15.257 20.681 1.00 0.00 N ATOM 1379 CA ALA A 84 8.025 -16.629 21.157 1.00 0.00 C ATOM 1380 C ALA A 84 7.254 -17.597 20.266 1.00 0.00 C ATOM 1381 O ALA A 84 7.793 -18.610 19.820 1.00 0.00 O ATOM 1382 CB ALA A 84 7.545 -16.737 22.597 1.00 0.00 C ATOM 0 H ALA A 84 7.430 -14.626 21.337 1.00 0.00 H new ATOM 0 HA ALA A 84 9.080 -16.900 21.116 1.00 0.00 H new ATOM 0 HB1 ALA A 84 7.651 -17.766 22.940 1.00 0.00 H new ATOM 0 HB2 ALA A 84 8.142 -16.080 23.230 1.00 0.00 H new ATOM 0 HB3 ALA A 84 6.497 -16.442 22.654 1.00 0.00 H new ATOM 1388 N VAL A 85 5.989 -17.279 20.010 1.00 0.00 N ATOM 1389 CA VAL A 85 5.143 -18.121 19.172 1.00 0.00 C ATOM 1390 C VAL A 85 5.682 -18.196 17.748 1.00 0.00 C ATOM 1391 O VAL A 85 5.803 -19.278 17.174 1.00 0.00 O ATOM 1392 CB VAL A 85 3.694 -17.601 19.135 1.00 0.00 C ATOM 1393 CG1 VAL A 85 2.863 -18.405 18.147 1.00 0.00 C ATOM 1394 CG2 VAL A 85 3.076 -17.645 20.524 1.00 0.00 C ATOM 0 H VAL A 85 5.527 -16.444 20.371 1.00 0.00 H new ATOM 0 HA VAL A 85 5.151 -19.118 19.613 1.00 0.00 H new ATOM 0 HB VAL A 85 3.708 -16.563 18.802 1.00 0.00 H new ATOM 0 HG11 VAL A 85 1.842 -18.023 18.135 1.00 0.00 H new ATOM 0 HG12 VAL A 85 3.296 -18.316 17.151 1.00 0.00 H new ATOM 0 HG13 VAL A 85 2.855 -19.453 18.447 1.00 0.00 H new ATOM 0 HG21 VAL A 85 2.052 -17.274 20.479 1.00 0.00 H new ATOM 0 HG22 VAL A 85 3.074 -18.672 20.889 1.00 0.00 H new ATOM 0 HG23 VAL A 85 3.659 -17.021 21.201 1.00 0.00 H new ATOM 1404 N LYS A 86 6.004 -17.038 17.182 1.00 0.00 N ATOM 1405 CA LYS A 86 6.532 -16.970 15.824 1.00 0.00 C ATOM 1406 C LYS A 86 7.761 -17.860 15.674 1.00 0.00 C ATOM 1407 O LYS A 86 7.876 -18.620 14.712 1.00 0.00 O ATOM 1408 CB LYS A 86 6.888 -15.525 15.465 1.00 0.00 C ATOM 1409 CG LYS A 86 7.653 -15.394 14.159 1.00 0.00 C ATOM 1410 CD LYS A 86 9.155 -15.414 14.389 1.00 0.00 C ATOM 1411 CE LYS A 86 9.798 -14.097 13.981 1.00 0.00 C ATOM 1412 NZ LYS A 86 11.251 -14.065 14.307 1.00 0.00 N ATOM 0 H LYS A 86 5.909 -16.133 17.643 1.00 0.00 H new ATOM 0 HA LYS A 86 5.761 -17.328 15.142 1.00 0.00 H new ATOM 0 HB2 LYS A 86 5.971 -14.939 15.400 1.00 0.00 H new ATOM 0 HB3 LYS A 86 7.484 -15.096 16.270 1.00 0.00 H new ATOM 0 HG2 LYS A 86 7.375 -16.209 13.490 1.00 0.00 H new ATOM 0 HG3 LYS A 86 7.372 -14.465 13.663 1.00 0.00 H new ATOM 0 HD2 LYS A 86 9.361 -15.610 15.441 1.00 0.00 H new ATOM 0 HD3 LYS A 86 9.601 -16.230 13.820 1.00 0.00 H new ATOM 0 HE2 LYS A 86 9.662 -13.943 12.910 1.00 0.00 H new ATOM 0 HE3 LYS A 86 9.294 -13.274 14.488 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 11.653 -13.152 14.014 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 11.380 -14.187 15.332 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 11.737 -14.834 13.803 1.00 0.00 H new ATOM 1426 N PHE A 87 8.679 -17.761 16.630 1.00 0.00 N ATOM 1427 CA PHE A 87 9.899 -18.559 16.604 1.00 0.00 C ATOM 1428 C PHE A 87 9.578 -20.048 16.682 1.00 0.00 C ATOM 1429 O PHE A 87 10.127 -20.854 15.929 1.00 0.00 O ATOM 1430 CB PHE A 87 10.818 -18.162 17.761 1.00 0.00 C ATOM 1431 CG PHE A 87 12.261 -18.033 17.365 1.00 0.00 C ATOM 1432 CD1 PHE A 87 12.639 -17.176 16.344 1.00 0.00 C ATOM 1433 CD2 PHE A 87 13.239 -18.771 18.012 1.00 0.00 C ATOM 1434 CE1 PHE A 87 13.966 -17.055 15.977 1.00 0.00 C ATOM 1435 CE2 PHE A 87 14.568 -18.654 17.650 1.00 0.00 C ATOM 1436 CZ PHE A 87 14.932 -17.796 16.630 1.00 0.00 C ATOM 0 H PHE A 87 8.601 -17.136 17.432 1.00 0.00 H new ATOM 0 HA PHE A 87 10.409 -18.365 15.661 1.00 0.00 H new ATOM 0 HB2 PHE A 87 10.477 -17.213 18.176 1.00 0.00 H new ATOM 0 HB3 PHE A 87 10.732 -18.905 18.554 1.00 0.00 H new ATOM 0 HD1 PHE A 87 11.888 -16.596 15.829 1.00 0.00 H new ATOM 0 HD2 PHE A 87 12.960 -19.445 18.808 1.00 0.00 H new ATOM 0 HE1 PHE A 87 14.247 -16.382 15.181 1.00 0.00 H new ATOM 0 HE2 PHE A 87 15.321 -19.233 18.164 1.00 0.00 H new ATOM 0 HZ PHE A 87 15.969 -17.705 16.344 1.00 0.00 H new ATOM 1446 N LEU A 88 8.687 -20.407 17.599 1.00 0.00 N ATOM 1447 CA LEU A 88 8.292 -21.800 17.778 1.00 0.00 C ATOM 1448 C LEU A 88 7.712 -22.372 16.488 1.00 0.00 C ATOM 1449 O LEU A 88 8.121 -23.440 16.031 1.00 0.00 O ATOM 1450 CB LEU A 88 7.268 -21.920 18.907 1.00 0.00 C ATOM 1451 CG LEU A 88 7.765 -21.552 20.306 1.00 0.00 C ATOM 1452 CD1 LEU A 88 6.618 -21.041 21.163 1.00 0.00 C ATOM 1453 CD2 LEU A 88 8.435 -22.749 20.966 1.00 0.00 C ATOM 0 H LEU A 88 8.224 -19.753 18.230 1.00 0.00 H new ATOM 0 HA LEU A 88 9.182 -22.373 18.040 1.00 0.00 H new ATOM 0 HB2 LEU A 88 6.416 -21.284 18.667 1.00 0.00 H new ATOM 0 HB3 LEU A 88 6.902 -22.947 18.931 1.00 0.00 H new ATOM 0 HG LEU A 88 8.503 -20.755 20.211 1.00 0.00 H new ATOM 0 HD11 LEU A 88 6.991 -20.784 22.155 1.00 0.00 H new ATOM 0 HD12 LEU A 88 6.183 -20.156 20.699 1.00 0.00 H new ATOM 0 HD13 LEU A 88 5.856 -21.816 21.251 1.00 0.00 H new ATOM 0 HD21 LEU A 88 8.782 -22.469 21.960 1.00 0.00 H new ATOM 0 HD22 LEU A 88 7.719 -23.567 21.049 1.00 0.00 H new ATOM 0 HD23 LEU A 88 9.284 -23.070 20.362 1.00 0.00 H new ATOM 1465 N ILE A 89 6.759 -21.652 15.904 1.00 0.00 N ATOM 1466 CA ILE A 89 6.126 -22.086 14.665 1.00 0.00 C ATOM 1467 C ILE A 89 7.159 -22.292 13.562 1.00 0.00 C ATOM 1468 O ILE A 89 7.210 -23.350 12.937 1.00 0.00 O ATOM 1469 CB ILE A 89 5.074 -21.069 14.184 1.00 0.00 C ATOM 1470 CG1 ILE A 89 3.936 -20.961 15.200 1.00 0.00 C ATOM 1471 CG2 ILE A 89 4.536 -21.469 12.818 1.00 0.00 C ATOM 1472 CD1 ILE A 89 3.122 -22.229 15.333 1.00 0.00 C ATOM 0 H ILE A 89 6.409 -20.766 16.269 1.00 0.00 H new ATOM 0 HA ILE A 89 5.632 -23.034 14.879 1.00 0.00 H new ATOM 0 HB ILE A 89 5.549 -20.092 14.094 1.00 0.00 H new ATOM 0 HG12 ILE A 89 4.352 -20.702 16.174 1.00 0.00 H new ATOM 0 HG13 ILE A 89 3.276 -20.144 14.909 1.00 0.00 H new ATOM 0 HG21 ILE A 89 3.794 -20.741 12.492 1.00 0.00 H new ATOM 0 HG22 ILE A 89 5.355 -21.500 12.099 1.00 0.00 H new ATOM 0 HG23 ILE A 89 4.074 -22.454 12.883 1.00 0.00 H new ATOM 0 HD11 ILE A 89 2.333 -22.079 16.070 1.00 0.00 H new ATOM 0 HD12 ILE A 89 2.676 -22.478 14.370 1.00 0.00 H new ATOM 0 HD13 ILE A 89 3.769 -23.045 15.655 1.00 0.00 H new ATOM 1484 N GLU A 90 7.981 -21.273 13.331 1.00 0.00 N ATOM 1485 CA GLU A 90 9.014 -21.344 12.304 1.00 0.00 C ATOM 1486 C GLU A 90 9.977 -22.495 12.580 1.00 0.00 C ATOM 1487 O GLU A 90 10.300 -23.276 11.684 1.00 0.00 O ATOM 1488 CB GLU A 90 9.786 -20.024 12.234 1.00 0.00 C ATOM 1489 CG GLU A 90 11.012 -20.083 11.338 1.00 0.00 C ATOM 1490 CD GLU A 90 11.595 -18.711 11.057 1.00 0.00 C ATOM 1491 OE1 GLU A 90 10.837 -17.721 11.122 1.00 0.00 O ATOM 1492 OE2 GLU A 90 12.808 -18.629 10.772 1.00 0.00 O ATOM 0 H GLU A 90 7.952 -20.390 13.840 1.00 0.00 H new ATOM 0 HA GLU A 90 8.526 -21.523 11.346 1.00 0.00 H new ATOM 0 HB2 GLU A 90 9.119 -19.241 11.872 1.00 0.00 H new ATOM 0 HB3 GLU A 90 10.095 -19.740 13.240 1.00 0.00 H new ATOM 0 HG2 GLU A 90 11.772 -20.707 11.808 1.00 0.00 H new ATOM 0 HG3 GLU A 90 10.746 -20.561 10.395 1.00 0.00 H new ATOM 1499 N ARG A 91 10.433 -22.592 13.824 1.00 0.00 N ATOM 1500 CA ARG A 91 11.361 -23.646 14.218 1.00 0.00 C ATOM 1501 C ARG A 91 10.829 -25.017 13.812 1.00 0.00 C ATOM 1502 O ARG A 91 11.540 -25.812 13.196 1.00 0.00 O ATOM 1503 CB ARG A 91 11.600 -23.606 15.728 1.00 0.00 C ATOM 1504 CG ARG A 91 12.933 -22.987 16.118 1.00 0.00 C ATOM 1505 CD ARG A 91 13.021 -21.534 15.680 1.00 0.00 C ATOM 1506 NE ARG A 91 14.268 -21.251 14.973 1.00 0.00 N ATOM 1507 CZ ARG A 91 15.461 -21.251 15.557 1.00 0.00 C ATOM 1508 NH1 ARG A 91 15.569 -21.520 16.851 1.00 0.00 N ATOM 1509 NH2 ARG A 91 16.549 -20.984 14.847 1.00 0.00 N ATOM 0 H ARG A 91 10.175 -21.954 14.577 1.00 0.00 H new ATOM 0 HA ARG A 91 12.306 -23.475 13.703 1.00 0.00 H new ATOM 0 HB2 ARG A 91 10.795 -23.042 16.200 1.00 0.00 H new ATOM 0 HB3 ARG A 91 11.551 -24.621 16.122 1.00 0.00 H new ATOM 0 HG2 ARG A 91 13.063 -23.051 17.198 1.00 0.00 H new ATOM 0 HG3 ARG A 91 13.746 -23.555 15.665 1.00 0.00 H new ATOM 0 HD2 ARG A 91 12.176 -21.298 15.033 1.00 0.00 H new ATOM 0 HD3 ARG A 91 12.944 -20.887 16.554 1.00 0.00 H new ATOM 0 HE ARG A 91 14.220 -21.042 13.976 1.00 0.00 H new ATOM 0 HH11 ARG A 91 14.735 -21.728 17.400 1.00 0.00 H new ATOM 0 HH12 ARG A 91 16.486 -21.519 17.297 1.00 0.00 H new ATOM 0 HH21 ARG A 91 16.470 -20.778 13.851 1.00 0.00 H new ATOM 0 HH22 ARG A 91 17.464 -20.984 15.297 1.00 0.00 H new ATOM 1523 N ILE A 92 9.577 -25.288 14.163 1.00 0.00 N ATOM 1524 CA ILE A 92 8.951 -26.563 13.835 1.00 0.00 C ATOM 1525 C ILE A 92 8.726 -26.695 12.333 1.00 0.00 C ATOM 1526 O ILE A 92 8.778 -27.794 11.781 1.00 0.00 O ATOM 1527 CB ILE A 92 7.603 -26.732 14.561 1.00 0.00 C ATOM 1528 CG1 ILE A 92 7.798 -26.630 16.075 1.00 0.00 C ATOM 1529 CG2 ILE A 92 6.965 -28.063 14.192 1.00 0.00 C ATOM 1530 CD1 ILE A 92 6.538 -26.254 16.823 1.00 0.00 C ATOM 0 H ILE A 92 8.976 -24.642 14.674 1.00 0.00 H new ATOM 0 HA ILE A 92 9.634 -27.344 14.168 1.00 0.00 H new ATOM 0 HB ILE A 92 6.934 -25.931 14.245 1.00 0.00 H new ATOM 0 HG12 ILE A 92 8.163 -27.586 16.451 1.00 0.00 H new ATOM 0 HG13 ILE A 92 8.570 -25.889 16.285 1.00 0.00 H new ATOM 0 HG21 ILE A 92 6.013 -28.167 14.713 1.00 0.00 H new ATOM 0 HG22 ILE A 92 6.795 -28.099 13.116 1.00 0.00 H new ATOM 0 HG23 ILE A 92 7.629 -28.877 14.482 1.00 0.00 H new ATOM 0 HD11 ILE A 92 6.751 -26.200 17.891 1.00 0.00 H new ATOM 0 HD12 ILE A 92 6.184 -25.284 16.474 1.00 0.00 H new ATOM 0 HD13 ILE A 92 5.770 -27.007 16.644 1.00 0.00 H new ATOM 1542 N ARG A 93 8.479 -25.566 11.676 1.00 0.00 N ATOM 1543 CA ARG A 93 8.247 -25.555 10.236 1.00 0.00 C ATOM 1544 C ARG A 93 9.558 -25.725 9.474 1.00 0.00 C ATOM 1545 O ARG A 93 9.560 -26.045 8.285 1.00 0.00 O ATOM 1546 CB ARG A 93 7.566 -24.251 9.818 1.00 0.00 C ATOM 1547 CG ARG A 93 6.120 -24.430 9.386 1.00 0.00 C ATOM 1548 CD ARG A 93 5.857 -23.783 8.035 1.00 0.00 C ATOM 1549 NE ARG A 93 6.765 -24.280 7.005 1.00 0.00 N ATOM 1550 CZ ARG A 93 6.516 -24.196 5.703 1.00 0.00 C ATOM 1551 NH1 ARG A 93 5.392 -23.638 5.275 1.00 0.00 N ATOM 1552 NH2 ARG A 93 7.391 -24.671 4.826 1.00 0.00 N ATOM 0 H ARG A 93 8.434 -24.648 12.118 1.00 0.00 H new ATOM 0 HA ARG A 93 7.593 -26.392 9.991 1.00 0.00 H new ATOM 0 HB2 ARG A 93 7.603 -23.549 10.651 1.00 0.00 H new ATOM 0 HB3 ARG A 93 8.128 -23.804 8.998 1.00 0.00 H new ATOM 0 HG2 ARG A 93 5.884 -25.493 9.334 1.00 0.00 H new ATOM 0 HG3 ARG A 93 5.459 -23.993 10.135 1.00 0.00 H new ATOM 0 HD2 ARG A 93 4.827 -23.976 7.735 1.00 0.00 H new ATOM 0 HD3 ARG A 93 5.966 -22.702 8.123 1.00 0.00 H new ATOM 0 HE ARG A 93 7.638 -24.716 7.302 1.00 0.00 H new ATOM 0 HH11 ARG A 93 4.717 -23.272 5.946 1.00 0.00 H new ATOM 0 HH12 ARG A 93 5.203 -23.575 4.275 1.00 0.00 H new ATOM 0 HH21 ARG A 93 8.257 -25.102 5.151 1.00 0.00 H new ATOM 0 HH22 ARG A 93 7.198 -24.606 3.827 1.00 0.00 H new ATOM 1566 N LYS A 94 10.671 -25.507 10.165 1.00 0.00 N ATOM 1567 CA LYS A 94 11.989 -25.636 9.555 1.00 0.00 C ATOM 1568 C LYS A 94 12.755 -26.810 10.156 1.00 0.00 C ATOM 1569 O LYS A 94 13.848 -27.148 9.704 1.00 0.00 O ATOM 1570 CB LYS A 94 12.788 -24.344 9.740 1.00 0.00 C ATOM 1571 CG LYS A 94 12.305 -23.200 8.865 1.00 0.00 C ATOM 1572 CD LYS A 94 13.113 -21.936 9.104 1.00 0.00 C ATOM 1573 CE LYS A 94 14.232 -21.788 8.085 1.00 0.00 C ATOM 1574 NZ LYS A 94 14.024 -20.609 7.199 1.00 0.00 N ATOM 0 H LYS A 94 10.687 -25.240 11.149 1.00 0.00 H new ATOM 0 HA LYS A 94 11.852 -25.822 8.490 1.00 0.00 H new ATOM 0 HB2 LYS A 94 12.733 -24.039 10.785 1.00 0.00 H new ATOM 0 HB3 LYS A 94 13.837 -24.541 9.520 1.00 0.00 H new ATOM 0 HG2 LYS A 94 12.378 -23.487 7.816 1.00 0.00 H new ATOM 0 HG3 LYS A 94 11.252 -23.004 9.069 1.00 0.00 H new ATOM 0 HD2 LYS A 94 12.456 -21.068 9.053 1.00 0.00 H new ATOM 0 HD3 LYS A 94 13.535 -21.957 10.109 1.00 0.00 H new ATOM 0 HE2 LYS A 94 15.185 -21.688 8.604 1.00 0.00 H new ATOM 0 HE3 LYS A 94 14.293 -22.692 7.479 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 14.808 -20.543 6.519 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 13.127 -20.716 6.684 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 13.992 -19.743 7.775 1.00 0.00 H new ATOM 1588 N ASN A 95 12.172 -27.430 11.178 1.00 0.00 N ATOM 1589 CA ASN A 95 12.800 -28.567 11.841 1.00 0.00 C ATOM 1590 C ASN A 95 14.073 -28.140 12.565 1.00 0.00 C ATOM 1591 O ASN A 95 15.059 -28.876 12.594 1.00 0.00 O ATOM 1592 CB ASN A 95 13.122 -29.663 10.823 1.00 0.00 C ATOM 1593 CG ASN A 95 12.728 -31.042 11.315 1.00 0.00 C ATOM 1594 OD1 ASN A 95 13.533 -31.973 11.296 1.00 0.00 O ATOM 1595 ND2 ASN A 95 11.484 -31.179 11.758 1.00 0.00 N ATOM 0 H ASN A 95 11.266 -27.164 11.564 1.00 0.00 H new ATOM 0 HA ASN A 95 12.099 -28.959 12.578 1.00 0.00 H new ATOM 0 HB2 ASN A 95 12.602 -29.451 9.889 1.00 0.00 H new ATOM 0 HB3 ASN A 95 14.190 -29.650 10.604 1.00 0.00 H new ATOM 0 HD21 ASN A 95 11.162 -32.084 12.101 1.00 0.00 H new ATOM 0 HD22 ASN A 95 10.851 -30.379 11.755 1.00 0.00 H new ATOM 1602 N GLU A 96 14.044 -26.945 13.148 1.00 0.00 N ATOM 1603 CA GLU A 96 15.196 -26.421 13.871 1.00 0.00 C ATOM 1604 C GLU A 96 15.141 -26.818 15.344 1.00 0.00 C ATOM 1605 O GLU A 96 14.096 -27.201 15.871 1.00 0.00 O ATOM 1606 CB GLU A 96 15.256 -24.897 13.745 1.00 0.00 C ATOM 1607 CG GLU A 96 16.132 -24.415 12.601 1.00 0.00 C ATOM 1608 CD GLU A 96 16.114 -22.906 12.448 1.00 0.00 C ATOM 1609 OE1 GLU A 96 15.010 -22.332 12.344 1.00 0.00 O ATOM 1610 OE2 GLU A 96 17.206 -22.300 12.434 1.00 0.00 O ATOM 0 H GLU A 96 13.236 -26.323 13.133 1.00 0.00 H new ATOM 0 HA GLU A 96 16.095 -26.851 13.429 1.00 0.00 H new ATOM 0 HB2 GLU A 96 14.246 -24.512 13.605 1.00 0.00 H new ATOM 0 HB3 GLU A 96 15.630 -24.478 14.679 1.00 0.00 H new ATOM 0 HG2 GLU A 96 17.157 -24.747 12.768 1.00 0.00 H new ATOM 0 HG3 GLU A 96 15.795 -24.875 11.672 1.00 0.00 H new ATOM 1617 N PRO A 97 16.293 -26.726 16.024 1.00 0.00 N ATOM 1618 CA PRO A 97 16.403 -27.071 17.445 1.00 0.00 C ATOM 1619 C PRO A 97 15.679 -26.072 18.342 1.00 0.00 C ATOM 1620 O PRO A 97 15.618 -24.880 18.038 1.00 0.00 O ATOM 1621 CB PRO A 97 17.911 -27.028 17.705 1.00 0.00 C ATOM 1622 CG PRO A 97 18.447 -26.096 16.674 1.00 0.00 C ATOM 1623 CD PRO A 97 17.577 -26.277 15.460 1.00 0.00 C ATOM 0 HA PRO A 97 15.946 -28.035 17.667 1.00 0.00 H new ATOM 0 HB2 PRO A 97 18.129 -26.672 18.712 1.00 0.00 H new ATOM 0 HB3 PRO A 97 18.357 -28.018 17.613 1.00 0.00 H new ATOM 0 HG2 PRO A 97 18.416 -25.065 17.026 1.00 0.00 H new ATOM 0 HG3 PRO A 97 19.488 -26.324 16.446 1.00 0.00 H new ATOM 0 HD2 PRO A 97 17.467 -25.347 14.902 1.00 0.00 H new ATOM 0 HD3 PRO A 97 17.994 -27.014 14.773 1.00 0.00 H new ATOM 1631 N LEU A 98 15.133 -26.565 19.448 1.00 0.00 N ATOM 1632 CA LEU A 98 14.413 -25.715 20.390 1.00 0.00 C ATOM 1633 C LEU A 98 15.250 -25.456 21.639 1.00 0.00 C ATOM 1634 O LEU A 98 15.299 -26.269 22.562 1.00 0.00 O ATOM 1635 CB LEU A 98 13.083 -26.363 20.779 1.00 0.00 C ATOM 1636 CG LEU A 98 12.167 -26.762 19.621 1.00 0.00 C ATOM 1637 CD1 LEU A 98 12.112 -28.275 19.482 1.00 0.00 C ATOM 1638 CD2 LEU A 98 10.771 -26.192 19.825 1.00 0.00 C ATOM 0 H LEU A 98 15.175 -27.549 19.715 1.00 0.00 H new ATOM 0 HA LEU A 98 14.216 -24.760 19.902 1.00 0.00 H new ATOM 0 HB2 LEU A 98 13.295 -27.253 21.372 1.00 0.00 H new ATOM 0 HB3 LEU A 98 12.540 -25.672 21.424 1.00 0.00 H new ATOM 0 HG LEU A 98 12.576 -26.348 18.699 1.00 0.00 H new ATOM 0 HD11 LEU A 98 11.456 -28.541 18.653 1.00 0.00 H new ATOM 0 HD12 LEU A 98 13.114 -28.659 19.289 1.00 0.00 H new ATOM 0 HD13 LEU A 98 11.727 -28.711 20.404 1.00 0.00 H new ATOM 0 HD21 LEU A 98 10.133 -26.486 18.992 1.00 0.00 H new ATOM 0 HD22 LEU A 98 10.353 -26.577 20.755 1.00 0.00 H new ATOM 0 HD23 LEU A 98 10.826 -25.104 19.874 1.00 0.00 H new ATOM 1650 N PRO A 99 15.923 -24.296 21.670 1.00 0.00 N ATOM 1651 CA PRO A 99 16.768 -23.902 22.802 1.00 0.00 C ATOM 1652 C PRO A 99 15.953 -23.576 24.048 1.00 0.00 C ATOM 1653 O PRO A 99 14.752 -23.841 24.103 1.00 0.00 O ATOM 1654 CB PRO A 99 17.486 -22.651 22.289 1.00 0.00 C ATOM 1655 CG PRO A 99 16.580 -22.096 21.245 1.00 0.00 C ATOM 1656 CD PRO A 99 15.911 -23.281 20.604 1.00 0.00 C ATOM 0 HA PRO A 99 17.442 -24.703 23.106 1.00 0.00 H new ATOM 0 HB2 PRO A 99 17.652 -21.933 23.092 1.00 0.00 H new ATOM 0 HB3 PRO A 99 18.464 -22.897 21.875 1.00 0.00 H new ATOM 0 HG2 PRO A 99 15.844 -21.423 21.685 1.00 0.00 H new ATOM 0 HG3 PRO A 99 17.140 -21.519 20.509 1.00 0.00 H new ATOM 0 HD2 PRO A 99 14.896 -23.045 20.285 1.00 0.00 H new ATOM 0 HD3 PRO A 99 16.453 -23.619 19.721 1.00 0.00 H new ATOM 1664 N VAL A 100 16.613 -22.999 25.047 1.00 0.00 N ATOM 1665 CA VAL A 100 15.948 -22.634 26.293 1.00 0.00 C ATOM 1666 C VAL A 100 14.949 -21.504 26.072 1.00 0.00 C ATOM 1667 O VAL A 100 15.273 -20.485 25.464 1.00 0.00 O ATOM 1668 CB VAL A 100 16.965 -22.203 27.366 1.00 0.00 C ATOM 1669 CG1 VAL A 100 16.274 -21.999 28.706 1.00 0.00 C ATOM 1670 CG2 VAL A 100 18.083 -23.229 27.483 1.00 0.00 C ATOM 0 H VAL A 100 17.607 -22.774 25.018 1.00 0.00 H new ATOM 0 HA VAL A 100 15.418 -23.521 26.641 1.00 0.00 H new ATOM 0 HB VAL A 100 17.405 -21.253 27.064 1.00 0.00 H new ATOM 0 HG11 VAL A 100 17.009 -21.695 29.452 1.00 0.00 H new ATOM 0 HG12 VAL A 100 15.513 -21.224 28.609 1.00 0.00 H new ATOM 0 HG13 VAL A 100 15.804 -22.932 29.019 1.00 0.00 H new ATOM 0 HG21 VAL A 100 18.793 -22.908 28.246 1.00 0.00 H new ATOM 0 HG22 VAL A 100 17.662 -24.195 27.762 1.00 0.00 H new ATOM 0 HG23 VAL A 100 18.596 -23.319 26.525 1.00 0.00 H new ATOM 1680 N TYR A 101 13.732 -21.693 26.572 1.00 0.00 N ATOM 1681 CA TYR A 101 12.684 -20.690 26.428 1.00 0.00 C ATOM 1682 C TYR A 101 13.066 -19.396 27.139 1.00 0.00 C ATOM 1683 O TYR A 101 12.857 -18.301 26.617 1.00 0.00 O ATOM 1684 CB TYR A 101 11.362 -21.221 26.986 1.00 0.00 C ATOM 1685 CG TYR A 101 10.272 -20.175 27.059 1.00 0.00 C ATOM 1686 CD1 TYR A 101 9.641 -19.719 25.908 1.00 0.00 C ATOM 1687 CD2 TYR A 101 9.875 -19.642 28.279 1.00 0.00 C ATOM 1688 CE1 TYR A 101 8.646 -18.763 25.971 1.00 0.00 C ATOM 1689 CE2 TYR A 101 8.879 -18.687 28.351 1.00 0.00 C ATOM 1690 CZ TYR A 101 8.268 -18.251 27.194 1.00 0.00 C ATOM 1691 OH TYR A 101 7.277 -17.298 27.261 1.00 0.00 O ATOM 0 H TYR A 101 13.448 -22.531 27.080 1.00 0.00 H new ATOM 0 HA TYR A 101 12.564 -20.477 25.366 1.00 0.00 H new ATOM 0 HB2 TYR A 101 11.020 -22.047 26.363 1.00 0.00 H new ATOM 0 HB3 TYR A 101 11.534 -21.624 27.984 1.00 0.00 H new ATOM 0 HD1 TYR A 101 9.933 -20.119 24.948 1.00 0.00 H new ATOM 0 HD2 TYR A 101 10.353 -19.980 29.187 1.00 0.00 H new ATOM 0 HE1 TYR A 101 8.167 -18.418 25.067 1.00 0.00 H new ATOM 0 HE2 TYR A 101 8.581 -18.284 29.308 1.00 0.00 H new ATOM 0 HH TYR A 101 7.130 -17.044 28.196 1.00 0.00 H new ATOM 1701 N LYS A 102 13.628 -19.530 28.336 1.00 0.00 N ATOM 1702 CA LYS A 102 14.043 -18.374 29.121 1.00 0.00 C ATOM 1703 C LYS A 102 15.215 -17.658 28.458 1.00 0.00 C ATOM 1704 O LYS A 102 15.166 -16.450 28.224 1.00 0.00 O ATOM 1705 CB LYS A 102 14.430 -18.805 30.537 1.00 0.00 C ATOM 1706 CG LYS A 102 14.599 -17.644 31.502 1.00 0.00 C ATOM 1707 CD LYS A 102 13.315 -16.844 31.641 1.00 0.00 C ATOM 1708 CE LYS A 102 13.400 -15.848 32.787 1.00 0.00 C ATOM 1709 NZ LYS A 102 12.613 -16.295 33.970 1.00 0.00 N ATOM 0 H LYS A 102 13.806 -20.429 28.784 1.00 0.00 H new ATOM 0 HA LYS A 102 13.202 -17.683 29.175 1.00 0.00 H new ATOM 0 HB2 LYS A 102 13.666 -19.480 30.924 1.00 0.00 H new ATOM 0 HB3 LYS A 102 15.362 -19.369 30.494 1.00 0.00 H new ATOM 0 HG2 LYS A 102 14.901 -18.022 32.479 1.00 0.00 H new ATOM 0 HG3 LYS A 102 15.399 -16.992 31.152 1.00 0.00 H new ATOM 0 HD2 LYS A 102 13.113 -16.313 30.711 1.00 0.00 H new ATOM 0 HD3 LYS A 102 12.479 -17.523 31.809 1.00 0.00 H new ATOM 0 HE2 LYS A 102 14.443 -15.713 33.074 1.00 0.00 H new ATOM 0 HE3 LYS A 102 13.033 -14.877 32.453 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 12.696 -15.589 34.729 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 11.613 -16.399 33.703 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 12.979 -17.209 34.305 1.00 0.00 H new ATOM 1723 N ASP A 103 16.267 -18.410 28.155 1.00 0.00 N ATOM 1724 CA ASP A 103 17.451 -17.848 27.516 1.00 0.00 C ATOM 1725 C ASP A 103 17.098 -17.224 26.170 1.00 0.00 C ATOM 1726 O ASP A 103 17.417 -16.064 25.908 1.00 0.00 O ATOM 1727 CB ASP A 103 18.517 -18.928 27.327 1.00 0.00 C ATOM 1728 CG ASP A 103 19.920 -18.406 27.565 1.00 0.00 C ATOM 1729 OD1 ASP A 103 20.376 -18.437 28.727 1.00 0.00 O ATOM 1730 OD2 ASP A 103 20.562 -17.964 26.589 1.00 0.00 O ATOM 0 H ASP A 103 16.324 -19.411 28.342 1.00 0.00 H new ATOM 0 HA ASP A 103 17.847 -17.067 28.166 1.00 0.00 H new ATOM 0 HB2 ASP A 103 18.319 -19.753 28.011 1.00 0.00 H new ATOM 0 HB3 ASP A 103 18.448 -19.329 26.316 1.00 0.00 H new ATOM 1735 N LEU A 104 16.438 -18.002 25.319 1.00 0.00 N ATOM 1736 CA LEU A 104 16.041 -17.526 23.998 1.00 0.00 C ATOM 1737 C LEU A 104 15.189 -16.266 24.106 1.00 0.00 C ATOM 1738 O LEU A 104 15.452 -15.267 23.435 1.00 0.00 O ATOM 1739 CB LEU A 104 15.268 -18.616 23.253 1.00 0.00 C ATOM 1740 CG LEU A 104 14.786 -18.255 21.847 1.00 0.00 C ATOM 1741 CD1 LEU A 104 15.565 -19.034 20.799 1.00 0.00 C ATOM 1742 CD2 LEU A 104 13.294 -18.519 21.711 1.00 0.00 C ATOM 0 H LEU A 104 16.167 -18.965 25.520 1.00 0.00 H new ATOM 0 HA LEU A 104 16.945 -17.284 23.440 1.00 0.00 H new ATOM 0 HB2 LEU A 104 15.902 -19.500 23.182 1.00 0.00 H new ATOM 0 HB3 LEU A 104 14.401 -18.893 23.853 1.00 0.00 H new ATOM 0 HG LEU A 104 14.963 -17.192 21.685 1.00 0.00 H new ATOM 0 HD11 LEU A 104 15.208 -18.764 19.805 1.00 0.00 H new ATOM 0 HD12 LEU A 104 16.625 -18.795 20.881 1.00 0.00 H new ATOM 0 HD13 LEU A 104 15.421 -20.103 20.958 1.00 0.00 H new ATOM 0 HD21 LEU A 104 12.968 -18.257 20.704 1.00 0.00 H new ATOM 0 HD22 LEU A 104 13.093 -19.575 21.894 1.00 0.00 H new ATOM 0 HD23 LEU A 104 12.750 -17.915 22.437 1.00 0.00 H new ATOM 1754 N TRP A 105 14.169 -16.318 24.956 1.00 0.00 N ATOM 1755 CA TRP A 105 13.280 -15.180 25.154 1.00 0.00 C ATOM 1756 C TRP A 105 14.071 -13.926 25.508 1.00 0.00 C ATOM 1757 O TRP A 105 13.912 -12.881 24.878 1.00 0.00 O ATOM 1758 CB TRP A 105 12.264 -15.485 26.256 1.00 0.00 C ATOM 1759 CG TRP A 105 11.425 -14.302 26.635 1.00 0.00 C ATOM 1760 CD1 TRP A 105 10.779 -13.450 25.786 1.00 0.00 C ATOM 1761 CD2 TRP A 105 11.144 -13.841 27.961 1.00 0.00 C ATOM 1762 NE1 TRP A 105 10.113 -12.486 26.504 1.00 0.00 N ATOM 1763 CE2 TRP A 105 10.321 -12.704 27.840 1.00 0.00 C ATOM 1764 CE3 TRP A 105 11.507 -14.277 29.238 1.00 0.00 C ATOM 1765 CZ2 TRP A 105 9.856 -12.001 28.949 1.00 0.00 C ATOM 1766 CZ3 TRP A 105 11.045 -13.578 30.337 1.00 0.00 C ATOM 1767 CH2 TRP A 105 10.227 -12.451 30.187 1.00 0.00 C ATOM 0 H TRP A 105 13.938 -17.137 25.519 1.00 0.00 H new ATOM 0 HA TRP A 105 12.749 -15.000 24.220 1.00 0.00 H new ATOM 0 HB2 TRP A 105 11.611 -16.293 25.925 1.00 0.00 H new ATOM 0 HB3 TRP A 105 12.793 -15.844 27.139 1.00 0.00 H new ATOM 0 HD1 TRP A 105 10.790 -13.523 24.709 1.00 0.00 H new ATOM 0 HE1 TRP A 105 9.554 -11.731 26.106 1.00 0.00 H new ATOM 0 HE3 TRP A 105 12.137 -15.145 29.364 1.00 0.00 H new ATOM 0 HZ2 TRP A 105 9.225 -11.132 28.836 1.00 0.00 H new ATOM 0 HZ3 TRP A 105 11.319 -13.906 31.329 1.00 0.00 H new ATOM 0 HH2 TRP A 105 9.882 -11.927 31.066 1.00 0.00 H new ATOM 1778 N ASN A 106 14.925 -14.036 26.520 1.00 0.00 N ATOM 1779 CA ASN A 106 15.742 -12.910 26.958 1.00 0.00 C ATOM 1780 C ASN A 106 16.601 -12.383 25.813 1.00 0.00 C ATOM 1781 O ASN A 106 16.768 -11.174 25.654 1.00 0.00 O ATOM 1782 CB ASN A 106 16.634 -13.325 28.130 1.00 0.00 C ATOM 1783 CG ASN A 106 15.894 -13.307 29.454 1.00 0.00 C ATOM 1784 OD1 ASN A 106 15.464 -12.253 29.923 1.00 0.00 O ATOM 1785 ND2 ASN A 106 15.744 -14.477 30.063 1.00 0.00 N ATOM 0 H ASN A 106 15.069 -14.894 27.053 1.00 0.00 H new ATOM 0 HA ASN A 106 15.073 -12.113 27.283 1.00 0.00 H new ATOM 0 HB2 ASN A 106 17.025 -14.326 27.949 1.00 0.00 H new ATOM 0 HB3 ASN A 106 17.491 -12.654 28.187 1.00 0.00 H new ATOM 0 HD21 ASN A 106 15.256 -14.528 30.957 1.00 0.00 H new ATOM 0 HD22 ASN A 106 16.117 -15.325 29.637 1.00 0.00 H new ATOM 1792 N ALA A 107 17.142 -13.299 25.016 1.00 0.00 N ATOM 1793 CA ALA A 107 17.981 -12.927 23.884 1.00 0.00 C ATOM 1794 C ALA A 107 17.212 -12.062 22.891 1.00 0.00 C ATOM 1795 O ALA A 107 17.694 -11.014 22.461 1.00 0.00 O ATOM 1796 CB ALA A 107 18.521 -14.171 23.195 1.00 0.00 C ATOM 0 H ALA A 107 17.014 -14.304 25.134 1.00 0.00 H new ATOM 0 HA ALA A 107 18.819 -12.342 24.262 1.00 0.00 H new ATOM 0 HB1 ALA A 107 19.146 -13.877 22.351 1.00 0.00 H new ATOM 0 HB2 ALA A 107 19.115 -14.750 23.902 1.00 0.00 H new ATOM 0 HB3 ALA A 107 17.690 -14.778 22.837 1.00 0.00 H new ATOM 1802 N LEU A 108 16.013 -12.508 22.531 1.00 0.00 N ATOM 1803 CA LEU A 108 15.176 -11.775 21.587 1.00 0.00 C ATOM 1804 C LEU A 108 14.609 -10.512 22.229 1.00 0.00 C ATOM 1805 O LEU A 108 14.309 -9.536 21.542 1.00 0.00 O ATOM 1806 CB LEU A 108 14.035 -12.664 21.089 1.00 0.00 C ATOM 1807 CG LEU A 108 14.450 -13.924 20.329 1.00 0.00 C ATOM 1808 CD1 LEU A 108 13.229 -14.762 19.979 1.00 0.00 C ATOM 1809 CD2 LEU A 108 15.226 -13.558 19.072 1.00 0.00 C ATOM 0 H LEU A 108 15.599 -13.373 22.878 1.00 0.00 H new ATOM 0 HA LEU A 108 15.797 -11.483 20.740 1.00 0.00 H new ATOM 0 HB2 LEU A 108 13.433 -12.963 21.947 1.00 0.00 H new ATOM 0 HB3 LEU A 108 13.393 -12.068 20.441 1.00 0.00 H new ATOM 0 HG LEU A 108 15.100 -14.516 20.973 1.00 0.00 H new ATOM 0 HD11 LEU A 108 13.543 -15.655 19.438 1.00 0.00 H new ATOM 0 HD12 LEU A 108 12.714 -15.054 20.894 1.00 0.00 H new ATOM 0 HD13 LEU A 108 12.554 -14.178 19.353 1.00 0.00 H new ATOM 0 HD21 LEU A 108 15.513 -14.467 18.544 1.00 0.00 H new ATOM 0 HD22 LEU A 108 14.600 -12.944 18.424 1.00 0.00 H new ATOM 0 HD23 LEU A 108 16.121 -13.000 19.347 1.00 0.00 H new ATOM 1821 N ARG A 109 14.468 -10.539 23.550 1.00 0.00 N ATOM 1822 CA ARG A 109 13.938 -9.396 24.285 1.00 0.00 C ATOM 1823 C ARG A 109 14.899 -8.213 24.217 1.00 0.00 C ATOM 1824 O ARG A 109 14.522 -7.115 23.809 1.00 0.00 O ATOM 1825 CB ARG A 109 13.681 -9.776 25.744 1.00 0.00 C ATOM 1826 CG ARG A 109 12.227 -9.635 26.163 1.00 0.00 C ATOM 1827 CD ARG A 109 12.105 -9.127 27.591 1.00 0.00 C ATOM 1828 NE ARG A 109 12.683 -10.059 28.555 1.00 0.00 N ATOM 1829 CZ ARG A 109 12.629 -9.883 29.871 1.00 0.00 C ATOM 1830 NH1 ARG A 109 12.026 -8.816 30.376 1.00 0.00 N ATOM 1831 NH2 ARG A 109 13.178 -10.776 30.684 1.00 0.00 N ATOM 0 H ARG A 109 14.713 -11.339 24.133 1.00 0.00 H new ATOM 0 HA ARG A 109 12.996 -9.103 23.822 1.00 0.00 H new ATOM 0 HB2 ARG A 109 13.998 -10.807 25.903 1.00 0.00 H new ATOM 0 HB3 ARG A 109 14.298 -9.150 26.388 1.00 0.00 H new ATOM 0 HG2 ARG A 109 11.717 -8.949 25.487 1.00 0.00 H new ATOM 0 HG3 ARG A 109 11.727 -10.599 26.075 1.00 0.00 H new ATOM 0 HD2 ARG A 109 12.604 -8.162 27.676 1.00 0.00 H new ATOM 0 HD3 ARG A 109 11.054 -8.965 27.829 1.00 0.00 H new ATOM 0 HE ARG A 109 13.154 -10.891 28.199 1.00 0.00 H new ATOM 0 HH11 ARG A 109 11.602 -8.128 29.754 1.00 0.00 H new ATOM 0 HH12 ARG A 109 11.986 -8.683 31.387 1.00 0.00 H new ATOM 0 HH21 ARG A 109 13.642 -11.599 30.299 1.00 0.00 H new ATOM 0 HH22 ARG A 109 13.136 -10.640 31.694 1.00 0.00 H new ATOM 1845 N LYS A 110 16.144 -8.445 24.621 1.00 0.00 N ATOM 1846 CA LYS A 110 17.161 -7.401 24.607 1.00 0.00 C ATOM 1847 C LYS A 110 17.725 -7.210 23.202 1.00 0.00 C ATOM 1848 O LYS A 110 18.228 -6.139 22.865 1.00 0.00 O ATOM 1849 CB LYS A 110 18.291 -7.747 25.579 1.00 0.00 C ATOM 1850 CG LYS A 110 18.692 -6.593 26.482 1.00 0.00 C ATOM 1851 CD LYS A 110 18.196 -6.798 27.903 1.00 0.00 C ATOM 1852 CE LYS A 110 18.876 -5.845 28.874 1.00 0.00 C ATOM 1853 NZ LYS A 110 18.249 -5.887 30.224 1.00 0.00 N ATOM 0 H LYS A 110 16.473 -9.348 24.962 1.00 0.00 H new ATOM 0 HA LYS A 110 16.693 -6.468 24.922 1.00 0.00 H new ATOM 0 HB2 LYS A 110 17.982 -8.590 26.197 1.00 0.00 H new ATOM 0 HB3 LYS A 110 19.162 -8.071 25.010 1.00 0.00 H new ATOM 0 HG2 LYS A 110 19.777 -6.493 26.486 1.00 0.00 H new ATOM 0 HG3 LYS A 110 18.287 -5.662 26.085 1.00 0.00 H new ATOM 0 HD2 LYS A 110 17.117 -6.646 27.938 1.00 0.00 H new ATOM 0 HD3 LYS A 110 18.384 -7.827 28.210 1.00 0.00 H new ATOM 0 HE2 LYS A 110 19.932 -6.103 28.956 1.00 0.00 H new ATOM 0 HE3 LYS A 110 18.825 -4.829 28.482 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 18.741 -5.224 30.856 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 17.247 -5.617 30.150 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 18.320 -6.850 30.610 1.00 0.00 H new ATOM 1867 N GLY A 111 17.636 -8.256 22.387 1.00 0.00 N ATOM 1868 CA GLY A 111 18.141 -8.182 21.028 1.00 0.00 C ATOM 1869 C GLY A 111 17.117 -7.625 20.059 1.00 0.00 C ATOM 1870 O GLY A 111 16.689 -8.314 19.134 1.00 0.00 O ATOM 0 H GLY A 111 17.224 -9.153 22.643 1.00 0.00 H new ATOM 0 HA2 GLY A 111 19.033 -7.556 21.009 1.00 0.00 H new ATOM 0 HA3 GLY A 111 18.443 -9.177 20.701 1.00 0.00 H new TER 1874 GLY A 111