USER MOD reduce.3.24.130724 H: found=0, std=0, add=853, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 850 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 10 SER OG : rot 180:sc= -0.408 USER MOD Set 1.2: A 16 THR OG1 : rot 180:sc= 0.0658 USER MOD Set 1.3: A 84 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 11 SER OG : rot -170:sc= -0.0814 USER MOD Set 2.2: A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl 156:sc= -0.0301 (180deg=-0.305) USER MOD Single : A 1 MET N :NH3+ 151:sc= 0.0651 (180deg=-0.0118) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 HIS : no HD1:sc= -3.06 K(o=-3.1,f=-0.62) USER MOD Single : A 7 TYR OH : rot -89:sc= 1.05 USER MOD Single : A 14 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 15 SER OG : rot 175:sc= -5.68! USER MOD Single : A 17 SER OG : rot 180:sc= 0.00396 USER MOD Single : A 21 SER OG : rot 180:sc= -0.014 USER MOD Single : A 22 LYS NZ :NH3+ -148:sc= -0.112 (180deg=-0.692) USER MOD Single : A 23 MET CE :methyl -166:sc= -11! (180deg=-11.8!) USER MOD Single : A 26 GLN : amide:sc= -6.98! C(o=-7!,f=-8!) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= -0.296 X(o=-0.3,f=0) USER MOD Single : A 50 ASN : amide:sc= 0.318 X(o=0.32,f=0) USER MOD Single : A 59 GLN : amide:sc= -1.52 K(o=-1.5,f=-5!) USER MOD Single : A 63 MET CE :methyl -165:sc= -0.583 (180deg=-0.876) USER MOD Single : A 68 GLN : amide:sc= -1.86! K(o=-1.9!,f=-0.22) USER MOD Single : A 73 ASN : amide:sc= -0.0451 X(o=-0.045,f=-0.045) USER MOD Single : A 74 LYS NZ :NH3+ 166:sc= 0.785 (180deg=0.661) USER MOD Single : A 81 SER OG : rot 180:sc= 0 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 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 9.446 17.506 6.050 1.00 0.00 N ATOM 2 CA MET A 1 8.349 17.903 7.000 1.00 0.00 C ATOM 3 C MET A 1 8.470 17.107 8.303 1.00 0.00 C ATOM 4 O MET A 1 8.950 17.607 9.344 1.00 0.00 O ATOM 5 CB MET A 1 7.007 17.697 6.329 1.00 0.00 C ATOM 6 CG MET A 1 6.672 18.872 5.349 1.00 0.00 C ATOM 7 SD MET A 1 7.057 18.471 3.602 1.00 0.00 S ATOM 8 CE MET A 1 8.322 19.737 3.279 1.00 0.00 C ATOM 0 H1 MET A 1 9.120 17.632 5.071 1.00 0.00 H new ATOM 0 H2 MET A 1 10.282 18.102 6.216 1.00 0.00 H new ATOM 0 H3 MET A 1 9.696 16.509 6.206 1.00 0.00 H new ATOM 0 HA MET A 1 8.438 18.959 7.257 1.00 0.00 H new ATOM 0 HB2 MET A 1 7.013 16.755 5.781 1.00 0.00 H new ATOM 0 HB3 MET A 1 6.227 17.620 7.087 1.00 0.00 H new ATOM 0 HG2 MET A 1 5.614 19.121 5.435 1.00 0.00 H new ATOM 0 HG3 MET A 1 7.233 19.758 5.646 1.00 0.00 H new ATOM 0 HE1 MET A 1 8.964 19.409 2.462 1.00 0.00 H new ATOM 0 HE2 MET A 1 7.837 20.674 3.006 1.00 0.00 H new ATOM 0 HE3 MET A 1 8.924 19.887 4.175 1.00 0.00 H new ATOM 18 N GLU A 2 7.973 15.853 8.275 1.00 0.00 N ATOM 19 CA GLU A 2 8.165 14.847 9.347 1.00 0.00 C ATOM 20 C GLU A 2 8.390 13.454 8.744 1.00 0.00 C ATOM 21 O GLU A 2 9.422 12.805 9.012 1.00 0.00 O ATOM 22 CB GLU A 2 7.008 14.856 10.326 1.00 0.00 C ATOM 23 CG GLU A 2 5.641 15.109 9.682 1.00 0.00 C ATOM 24 CD GLU A 2 4.529 14.210 10.258 1.00 0.00 C ATOM 25 OE1 GLU A 2 4.563 12.959 9.996 1.00 0.00 O ATOM 26 OE2 GLU A 2 3.667 14.794 10.956 1.00 0.00 O ATOM 0 H GLU A 2 7.417 15.503 7.495 1.00 0.00 H new ATOM 0 HA GLU A 2 9.059 15.115 9.910 1.00 0.00 H new ATOM 0 HB2 GLU A 2 6.980 13.899 10.847 1.00 0.00 H new ATOM 0 HB3 GLU A 2 7.190 15.623 11.079 1.00 0.00 H new ATOM 0 HG2 GLU A 2 5.366 16.154 9.824 1.00 0.00 H new ATOM 0 HG3 GLU A 2 5.715 14.943 8.607 1.00 0.00 H new ATOM 33 N LYS A 3 7.349 12.914 8.047 1.00 0.00 N ATOM 34 CA LYS A 3 7.302 11.510 7.591 1.00 0.00 C ATOM 35 C LYS A 3 5.913 11.120 7.093 1.00 0.00 C ATOM 36 O LYS A 3 4.888 11.537 7.606 1.00 0.00 O ATOM 37 CB LYS A 3 7.800 10.524 8.642 1.00 0.00 C ATOM 38 CG LYS A 3 7.595 11.159 10.063 1.00 0.00 C ATOM 39 CD LYS A 3 7.022 10.207 11.093 1.00 0.00 C ATOM 40 CE LYS A 3 8.037 8.979 11.154 1.00 0.00 C ATOM 41 NZ LYS A 3 7.564 8.057 12.206 1.00 0.00 N ATOM 0 H LYS A 3 6.520 13.450 7.789 1.00 0.00 H new ATOM 0 HA LYS A 3 7.993 11.449 6.750 1.00 0.00 H new ATOM 0 HB2 LYS A 3 7.255 9.583 8.566 1.00 0.00 H new ATOM 0 HB3 LYS A 3 8.853 10.296 8.478 1.00 0.00 H new ATOM 0 HG2 LYS A 3 8.554 11.532 10.423 1.00 0.00 H new ATOM 0 HG3 LYS A 3 6.932 12.019 9.972 1.00 0.00 H new ATOM 0 HD2 LYS A 3 6.932 10.690 12.066 1.00 0.00 H new ATOM 0 HD3 LYS A 3 6.023 9.876 10.808 1.00 0.00 H new ATOM 0 HE2 LYS A 3 8.080 8.470 10.191 1.00 0.00 H new ATOM 0 HE3 LYS A 3 9.046 9.327 11.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 8.208 7.243 12.270 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 7.543 8.554 13.119 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 6.607 7.724 11.971 1.00 0.00 H new ATOM 55 N LYS A 4 5.915 10.303 5.978 1.00 0.00 N ATOM 56 CA LYS A 4 4.657 9.830 5.364 1.00 0.00 C ATOM 57 C LYS A 4 4.266 8.426 5.844 1.00 0.00 C ATOM 58 O LYS A 4 4.942 7.797 6.661 1.00 0.00 O ATOM 59 CB LYS A 4 4.756 9.874 3.819 1.00 0.00 C ATOM 60 CG LYS A 4 5.257 11.227 3.350 1.00 0.00 C ATOM 61 CD LYS A 4 4.506 11.891 2.203 1.00 0.00 C ATOM 62 CE LYS A 4 3.532 12.968 2.775 1.00 0.00 C ATOM 63 NZ LYS A 4 4.118 14.308 2.561 1.00 0.00 N ATOM 0 H LYS A 4 6.761 9.977 5.512 1.00 0.00 H new ATOM 0 HA LYS A 4 3.867 10.508 5.686 1.00 0.00 H new ATOM 0 HB2 LYS A 4 5.430 9.091 3.471 1.00 0.00 H new ATOM 0 HB3 LYS A 4 3.778 9.671 3.381 1.00 0.00 H new ATOM 0 HG2 LYS A 4 5.241 11.907 4.202 1.00 0.00 H new ATOM 0 HG3 LYS A 4 6.299 11.116 3.051 1.00 0.00 H new ATOM 0 HD2 LYS A 4 5.211 12.353 1.512 1.00 0.00 H new ATOM 0 HD3 LYS A 4 3.948 11.144 1.638 1.00 0.00 H new ATOM 0 HE2 LYS A 4 2.562 12.898 2.283 1.00 0.00 H new ATOM 0 HE3 LYS A 4 3.363 12.796 3.838 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 3.475 15.033 2.939 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 5.034 14.368 3.050 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 4.258 14.467 1.543 1.00 0.00 H new ATOM 77 N HIS A 5 3.065 7.987 5.383 1.00 0.00 N ATOM 78 CA HIS A 5 2.470 6.672 5.664 1.00 0.00 C ATOM 79 C HIS A 5 1.994 5.964 4.395 1.00 0.00 C ATOM 80 O HIS A 5 0.866 6.136 3.905 1.00 0.00 O ATOM 81 CB HIS A 5 1.386 6.775 6.743 1.00 0.00 C ATOM 82 CG HIS A 5 1.764 7.761 7.863 1.00 0.00 C ATOM 83 ND1 HIS A 5 1.087 8.826 8.313 1.00 0.00 N ATOM 84 CD2 HIS A 5 2.938 7.715 8.557 1.00 0.00 C ATOM 85 CE1 HIS A 5 1.689 9.314 9.405 1.00 0.00 C ATOM 86 NE2 HIS A 5 2.792 8.554 9.604 1.00 0.00 N ATOM 0 H HIS A 5 2.472 8.565 4.787 1.00 0.00 H new ATOM 0 HA HIS A 5 3.255 6.034 6.070 1.00 0.00 H new ATOM 0 HB2 HIS A 5 0.450 7.092 6.284 1.00 0.00 H new ATOM 0 HB3 HIS A 5 1.212 5.789 7.174 1.00 0.00 H new ATOM 0 HD2 HIS A 5 3.810 7.125 8.316 1.00 0.00 H new ATOM 0 HE1 HIS A 5 1.360 10.148 10.007 1.00 0.00 H new ATOM 0 HE2 HIS A 5 3.411 8.607 10.413 1.00 0.00 H new ATOM 94 N ILE A 6 2.865 5.092 3.871 1.00 0.00 N ATOM 95 CA ILE A 6 2.598 4.134 2.744 1.00 0.00 C ATOM 96 C ILE A 6 1.855 2.915 3.322 1.00 0.00 C ATOM 97 O ILE A 6 2.456 1.937 3.759 1.00 0.00 O ATOM 98 CB ILE A 6 3.784 3.859 1.864 1.00 0.00 C ATOM 99 CG1 ILE A 6 4.117 5.017 0.876 1.00 0.00 C ATOM 100 CG2 ILE A 6 3.848 2.471 1.222 1.00 0.00 C ATOM 101 CD1 ILE A 6 5.600 5.096 0.442 1.00 0.00 C ATOM 0 H ILE A 6 3.820 5.017 4.222 1.00 0.00 H new ATOM 0 HA ILE A 6 1.937 4.594 2.009 1.00 0.00 H new ATOM 0 HB ILE A 6 4.604 3.829 2.582 1.00 0.00 H new ATOM 0 HG12 ILE A 6 3.498 4.905 -0.014 1.00 0.00 H new ATOM 0 HG13 ILE A 6 3.838 5.963 1.340 1.00 0.00 H new ATOM 0 HG21 ILE A 6 4.748 2.394 0.611 1.00 0.00 H new ATOM 0 HG22 ILE A 6 3.872 1.710 2.002 1.00 0.00 H new ATOM 0 HG23 ILE A 6 2.970 2.319 0.595 1.00 0.00 H new ATOM 0 HD11 ILE A 6 5.734 5.932 -0.245 1.00 0.00 H new ATOM 0 HD12 ILE A 6 6.229 5.243 1.320 1.00 0.00 H new ATOM 0 HD13 ILE A 6 5.883 4.169 -0.056 1.00 0.00 H new ATOM 113 N TYR A 7 0.488 3.016 3.295 1.00 0.00 N ATOM 114 CA TYR A 7 -0.461 2.002 3.717 1.00 0.00 C ATOM 115 C TYR A 7 -0.858 1.029 2.603 1.00 0.00 C ATOM 116 O TYR A 7 -1.049 1.396 1.424 1.00 0.00 O ATOM 117 CB TYR A 7 -1.680 2.591 4.448 1.00 0.00 C ATOM 118 CG TYR A 7 -1.414 3.097 5.878 1.00 0.00 C ATOM 119 CD1 TYR A 7 -0.122 3.028 6.413 1.00 0.00 C ATOM 120 CD2 TYR A 7 -2.500 3.573 6.608 1.00 0.00 C ATOM 121 CE1 TYR A 7 0.140 3.768 7.602 1.00 0.00 C ATOM 122 CE2 TYR A 7 -2.256 4.172 7.873 1.00 0.00 C ATOM 123 CZ TYR A 7 -0.962 4.138 8.391 1.00 0.00 C ATOM 124 OH TYR A 7 -0.742 4.513 9.682 1.00 0.00 O ATOM 0 H TYR A 7 0.024 3.859 2.957 1.00 0.00 H new ATOM 0 HA TYR A 7 0.076 1.400 4.450 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -2.072 3.418 3.856 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -2.460 1.830 4.489 1.00 0.00 H new ATOM 0 HD1 TYR A 7 0.648 2.435 5.942 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -3.505 3.489 6.221 1.00 0.00 H new ATOM 0 HE1 TYR A 7 1.147 4.034 7.886 1.00 0.00 H new ATOM 0 HE2 TYR A 7 -3.057 4.644 8.422 1.00 0.00 H new ATOM 0 HH TYR A 7 -0.778 3.724 10.262 1.00 0.00 H new ATOM 134 N LEU A 8 -0.995 -0.249 3.005 1.00 0.00 N ATOM 135 CA LEU A 8 -1.398 -1.405 2.187 1.00 0.00 C ATOM 136 C LEU A 8 -2.575 -2.111 2.900 1.00 0.00 C ATOM 137 O LEU A 8 -2.664 -2.005 4.137 1.00 0.00 O ATOM 138 CB LEU A 8 -0.168 -2.358 2.164 1.00 0.00 C ATOM 139 CG LEU A 8 0.838 -2.176 1.015 1.00 0.00 C ATOM 140 CD1 LEU A 8 2.074 -1.299 1.384 1.00 0.00 C ATOM 141 CD2 LEU A 8 1.266 -3.527 0.408 1.00 0.00 C ATOM 0 H LEU A 8 -0.815 -0.517 3.973 1.00 0.00 H new ATOM 0 HA LEU A 8 -1.703 -1.120 1.180 1.00 0.00 H new ATOM 0 HB2 LEU A 8 0.369 -2.240 3.105 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -0.535 -3.384 2.133 1.00 0.00 H new ATOM 0 HG LEU A 8 0.299 -1.616 0.251 1.00 0.00 H new ATOM 0 HD11 LEU A 8 2.735 -1.220 0.521 1.00 0.00 H new ATOM 0 HD12 LEU A 8 1.739 -0.304 1.678 1.00 0.00 H new ATOM 0 HD13 LEU A 8 2.613 -1.760 2.212 1.00 0.00 H new ATOM 0 HD21 LEU A 8 1.977 -3.354 -0.400 1.00 0.00 H new ATOM 0 HD22 LEU A 8 1.734 -4.140 1.178 1.00 0.00 H new ATOM 0 HD23 LEU A 8 0.390 -4.044 0.016 1.00 0.00 H new ATOM 153 N PHE A 9 -3.468 -2.745 2.120 1.00 0.00 N ATOM 154 CA PHE A 9 -4.768 -3.333 2.580 1.00 0.00 C ATOM 155 C PHE A 9 -5.027 -4.668 1.922 1.00 0.00 C ATOM 156 O PHE A 9 -5.265 -4.774 0.715 1.00 0.00 O ATOM 157 CB PHE A 9 -5.822 -2.245 2.451 1.00 0.00 C ATOM 158 CG PHE A 9 -5.514 -0.976 3.336 1.00 0.00 C ATOM 159 CD1 PHE A 9 -5.522 -1.169 4.726 1.00 0.00 C ATOM 160 CD2 PHE A 9 -5.245 0.251 2.763 1.00 0.00 C ATOM 161 CE1 PHE A 9 -5.174 -0.084 5.557 1.00 0.00 C ATOM 162 CE2 PHE A 9 -4.978 1.360 3.601 1.00 0.00 C ATOM 163 CZ PHE A 9 -4.864 1.160 4.982 1.00 0.00 C ATOM 0 H PHE A 9 -3.314 -2.874 1.120 1.00 0.00 H new ATOM 0 HA PHE A 9 -4.771 -3.618 3.632 1.00 0.00 H new ATOM 0 HB2 PHE A 9 -5.897 -1.942 1.407 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -6.792 -2.652 2.736 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -5.788 -2.126 5.149 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -5.238 0.363 1.689 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -5.146 -0.209 6.629 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -4.864 2.348 3.180 1.00 0.00 H new ATOM 0 HZ PHE A 9 -4.534 1.972 5.613 1.00 0.00 H new ATOM 173 N SER A 10 -4.818 -5.833 2.631 1.00 0.00 N ATOM 174 CA SER A 10 -4.468 -7.134 2.134 1.00 0.00 C ATOM 175 C SER A 10 -5.646 -8.065 1.834 1.00 0.00 C ATOM 176 O SER A 10 -6.826 -7.709 1.929 1.00 0.00 O ATOM 177 CB SER A 10 -3.449 -7.786 3.086 1.00 0.00 C ATOM 178 OG SER A 10 -3.696 -9.152 3.342 1.00 0.00 O ATOM 0 H SER A 10 -4.908 -5.841 3.647 1.00 0.00 H new ATOM 0 HA SER A 10 -4.020 -6.974 1.153 1.00 0.00 H new ATOM 0 HB2 SER A 10 -2.451 -7.681 2.661 1.00 0.00 H new ATOM 0 HB3 SER A 10 -3.451 -7.243 4.031 1.00 0.00 H new ATOM 0 HG SER A 10 -3.011 -9.500 3.951 1.00 0.00 H new ATOM 184 N SER A 11 -5.282 -9.319 1.405 1.00 0.00 N ATOM 185 CA SER A 11 -6.190 -10.297 0.797 1.00 0.00 C ATOM 186 C SER A 11 -5.686 -11.758 0.994 1.00 0.00 C ATOM 187 O SER A 11 -6.357 -12.580 1.652 1.00 0.00 O ATOM 188 CB SER A 11 -6.423 -9.985 -0.653 1.00 0.00 C ATOM 189 OG SER A 11 -7.734 -9.508 -0.975 1.00 0.00 O ATOM 0 H SER A 11 -4.325 -9.664 1.484 1.00 0.00 H new ATOM 0 HA SER A 11 -7.147 -10.220 1.313 1.00 0.00 H new ATOM 0 HB2 SER A 11 -5.695 -9.237 -0.968 1.00 0.00 H new ATOM 0 HB3 SER A 11 -6.229 -10.885 -1.237 1.00 0.00 H new ATOM 0 HG SER A 11 -7.843 -9.483 -1.949 1.00 0.00 H new ATOM 195 N ALA A 12 -4.480 -11.996 0.452 1.00 0.00 N ATOM 196 CA ALA A 12 -3.815 -13.328 0.477 1.00 0.00 C ATOM 197 C ALA A 12 -2.565 -13.276 1.391 1.00 0.00 C ATOM 198 O ALA A 12 -1.452 -13.041 0.917 1.00 0.00 O ATOM 199 CB ALA A 12 -3.343 -13.713 -0.953 1.00 0.00 C ATOM 0 H ALA A 12 -3.931 -11.276 -0.018 1.00 0.00 H new ATOM 0 HA ALA A 12 -4.530 -14.061 0.851 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -2.858 -14.689 -0.926 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -4.203 -13.754 -1.621 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -2.637 -12.967 -1.316 1.00 0.00 H new ATOM 205 N GLY A 13 -2.790 -13.549 2.685 1.00 0.00 N ATOM 206 CA GLY A 13 -1.694 -13.903 3.663 1.00 0.00 C ATOM 207 C GLY A 13 -0.418 -13.137 3.305 1.00 0.00 C ATOM 208 O GLY A 13 -0.426 -11.893 3.205 1.00 0.00 O ATOM 0 H GLY A 13 -3.721 -13.537 3.102 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -2.005 -13.657 4.678 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -1.505 -14.976 3.639 1.00 0.00 H new ATOM 212 N MET A 14 0.727 -13.872 3.152 1.00 0.00 N ATOM 213 CA MET A 14 2.065 -13.365 3.264 1.00 0.00 C ATOM 214 C MET A 14 2.668 -13.042 1.843 1.00 0.00 C ATOM 215 O MET A 14 3.601 -13.615 1.371 1.00 0.00 O ATOM 216 CB MET A 14 3.011 -14.431 3.906 1.00 0.00 C ATOM 217 CG MET A 14 3.235 -14.162 5.391 1.00 0.00 C ATOM 218 SD MET A 14 2.035 -15.062 6.496 1.00 0.00 S ATOM 219 CE MET A 14 2.535 -14.362 8.072 1.00 0.00 C ATOM 0 H MET A 14 0.703 -14.869 2.940 1.00 0.00 H new ATOM 0 HA MET A 14 2.005 -12.467 3.879 1.00 0.00 H new ATOM 0 HB2 MET A 14 2.582 -15.424 3.776 1.00 0.00 H new ATOM 0 HB3 MET A 14 3.969 -14.428 3.387 1.00 0.00 H new ATOM 0 HG2 MET A 14 4.251 -14.454 5.656 1.00 0.00 H new ATOM 0 HG3 MET A 14 3.153 -13.091 5.575 1.00 0.00 H new ATOM 0 HE1 MET A 14 1.922 -14.784 8.868 1.00 0.00 H new ATOM 0 HE2 MET A 14 3.583 -14.596 8.258 1.00 0.00 H new ATOM 0 HE3 MET A 14 2.403 -13.280 8.048 1.00 0.00 H new ATOM 229 N SER A 15 1.988 -12.020 1.252 1.00 0.00 N ATOM 230 CA SER A 15 2.701 -11.058 0.329 1.00 0.00 C ATOM 231 C SER A 15 3.013 -9.771 1.138 1.00 0.00 C ATOM 232 O SER A 15 4.149 -9.349 1.319 1.00 0.00 O ATOM 233 CB SER A 15 1.755 -10.705 -0.822 1.00 0.00 C ATOM 234 OG SER A 15 1.831 -11.655 -1.906 1.00 0.00 O ATOM 0 H SER A 15 0.993 -11.835 1.382 1.00 0.00 H new ATOM 0 HA SER A 15 3.619 -11.496 -0.064 1.00 0.00 H new ATOM 0 HB2 SER A 15 0.732 -10.665 -0.449 1.00 0.00 H new ATOM 0 HB3 SER A 15 1.997 -9.710 -1.196 1.00 0.00 H new ATOM 0 HG SER A 15 1.156 -11.435 -2.582 1.00 0.00 H new ATOM 240 N THR A 16 1.905 -9.184 1.704 1.00 0.00 N ATOM 241 CA THR A 16 1.870 -7.877 2.407 1.00 0.00 C ATOM 242 C THR A 16 3.050 -7.709 3.379 1.00 0.00 C ATOM 243 O THR A 16 3.957 -6.890 3.170 1.00 0.00 O ATOM 244 CB THR A 16 0.580 -7.678 3.211 1.00 0.00 C ATOM 245 OG1 THR A 16 -0.129 -8.917 3.419 1.00 0.00 O ATOM 246 CG2 THR A 16 -0.324 -6.543 2.704 1.00 0.00 C ATOM 0 H THR A 16 0.989 -9.632 1.676 1.00 0.00 H new ATOM 0 HA THR A 16 1.929 -7.132 1.614 1.00 0.00 H new ATOM 0 HB THR A 16 0.909 -7.333 4.191 1.00 0.00 H new ATOM 0 HG1 THR A 16 -0.943 -8.745 3.936 1.00 0.00 H new ATOM 0 HG21 THR A 16 -1.212 -6.476 3.333 1.00 0.00 H new ATOM 0 HG22 THR A 16 0.220 -5.599 2.743 1.00 0.00 H new ATOM 0 HG23 THR A 16 -0.622 -6.747 1.676 1.00 0.00 H new ATOM 254 N SER A 17 2.957 -8.437 4.507 1.00 0.00 N ATOM 255 CA SER A 17 3.729 -8.205 5.749 1.00 0.00 C ATOM 256 C SER A 17 5.211 -7.930 5.499 1.00 0.00 C ATOM 257 O SER A 17 5.751 -6.861 5.876 1.00 0.00 O ATOM 258 CB SER A 17 3.516 -9.374 6.722 1.00 0.00 C ATOM 259 OG SER A 17 2.136 -9.670 6.904 1.00 0.00 O ATOM 0 H SER A 17 2.321 -9.231 4.585 1.00 0.00 H new ATOM 0 HA SER A 17 3.346 -7.292 6.205 1.00 0.00 H new ATOM 0 HB2 SER A 17 4.030 -10.258 6.345 1.00 0.00 H new ATOM 0 HB3 SER A 17 3.965 -9.131 7.685 1.00 0.00 H new ATOM 0 HG SER A 17 2.042 -10.420 7.528 1.00 0.00 H new ATOM 265 N LEU A 18 5.878 -8.867 4.791 1.00 0.00 N ATOM 266 CA LEU A 18 7.307 -8.905 4.444 1.00 0.00 C ATOM 267 C LEU A 18 7.547 -7.795 3.370 1.00 0.00 C ATOM 268 O LEU A 18 8.644 -7.267 3.261 1.00 0.00 O ATOM 269 CB LEU A 18 7.569 -10.302 3.833 1.00 0.00 C ATOM 270 CG LEU A 18 7.916 -11.487 4.742 1.00 0.00 C ATOM 271 CD1 LEU A 18 7.406 -12.856 4.212 1.00 0.00 C ATOM 272 CD2 LEU A 18 9.465 -11.540 4.975 1.00 0.00 C ATOM 0 H LEU A 18 5.387 -9.680 4.419 1.00 0.00 H new ATOM 0 HA LEU A 18 7.962 -8.736 5.299 1.00 0.00 H new ATOM 0 HB2 LEU A 18 6.680 -10.579 3.266 1.00 0.00 H new ATOM 0 HB3 LEU A 18 8.384 -10.194 3.117 1.00 0.00 H new ATOM 0 HG LEU A 18 7.395 -11.317 5.684 1.00 0.00 H new ATOM 0 HD11 LEU A 18 7.690 -13.645 4.909 1.00 0.00 H new ATOM 0 HD12 LEU A 18 6.320 -12.828 4.118 1.00 0.00 H new ATOM 0 HD13 LEU A 18 7.849 -13.057 3.237 1.00 0.00 H new ATOM 0 HD21 LEU A 18 9.707 -12.384 5.621 1.00 0.00 H new ATOM 0 HD22 LEU A 18 9.973 -11.659 4.018 1.00 0.00 H new ATOM 0 HD23 LEU A 18 9.794 -10.615 5.448 1.00 0.00 H new ATOM 284 N LEU A 19 6.492 -7.526 2.545 1.00 0.00 N ATOM 285 CA LEU A 19 6.533 -6.552 1.442 1.00 0.00 C ATOM 286 C LEU A 19 6.391 -5.137 1.965 1.00 0.00 C ATOM 287 O LEU A 19 6.801 -4.177 1.227 1.00 0.00 O ATOM 288 CB LEU A 19 5.451 -6.985 0.464 1.00 0.00 C ATOM 289 CG LEU A 19 4.385 -6.112 -0.086 1.00 0.00 C ATOM 290 CD1 LEU A 19 4.524 -4.601 -0.075 1.00 0.00 C ATOM 291 CD2 LEU A 19 3.995 -6.616 -1.538 1.00 0.00 C ATOM 0 H LEU A 19 5.588 -7.990 2.638 1.00 0.00 H new ATOM 0 HA LEU A 19 7.491 -6.538 0.922 1.00 0.00 H new ATOM 0 HB2 LEU A 19 5.977 -7.390 -0.400 1.00 0.00 H new ATOM 0 HB3 LEU A 19 4.935 -7.818 0.942 1.00 0.00 H new ATOM 0 HG LEU A 19 3.601 -6.236 0.661 1.00 0.00 H new ATOM 0 HD11 LEU A 19 3.638 -4.151 -0.522 1.00 0.00 H new ATOM 0 HD12 LEU A 19 4.629 -4.253 0.953 1.00 0.00 H new ATOM 0 HD13 LEU A 19 5.405 -4.313 -0.648 1.00 0.00 H new ATOM 0 HD21 LEU A 19 3.212 -5.978 -1.947 1.00 0.00 H new ATOM 0 HD22 LEU A 19 4.871 -6.575 -2.185 1.00 0.00 H new ATOM 0 HD23 LEU A 19 3.634 -7.643 -1.482 1.00 0.00 H new ATOM 303 N VAL A 20 5.825 -4.890 3.147 1.00 0.00 N ATOM 304 CA VAL A 20 5.922 -3.685 3.956 1.00 0.00 C ATOM 305 C VAL A 20 7.327 -3.602 4.612 1.00 0.00 C ATOM 306 O VAL A 20 7.981 -2.571 4.575 1.00 0.00 O ATOM 307 CB VAL A 20 4.745 -3.654 4.973 1.00 0.00 C ATOM 308 CG1 VAL A 20 4.772 -2.480 5.948 1.00 0.00 C ATOM 309 CG2 VAL A 20 3.388 -3.754 4.249 1.00 0.00 C ATOM 0 H VAL A 20 5.237 -5.592 3.597 1.00 0.00 H new ATOM 0 HA VAL A 20 5.825 -2.791 3.340 1.00 0.00 H new ATOM 0 HB VAL A 20 4.882 -4.537 5.598 1.00 0.00 H new ATOM 0 HG11 VAL A 20 3.914 -2.543 6.617 1.00 0.00 H new ATOM 0 HG12 VAL A 20 5.691 -2.514 6.533 1.00 0.00 H new ATOM 0 HG13 VAL A 20 4.730 -1.544 5.391 1.00 0.00 H new ATOM 0 HG21 VAL A 20 2.582 -3.730 4.982 1.00 0.00 H new ATOM 0 HG22 VAL A 20 3.279 -2.914 3.563 1.00 0.00 H new ATOM 0 HG23 VAL A 20 3.342 -4.688 3.690 1.00 0.00 H new ATOM 319 N SER A 21 7.699 -4.738 5.238 1.00 0.00 N ATOM 320 CA SER A 21 8.987 -4.819 6.019 1.00 0.00 C ATOM 321 C SER A 21 10.168 -5.032 5.050 1.00 0.00 C ATOM 322 O SER A 21 11.342 -5.025 5.442 1.00 0.00 O ATOM 323 CB SER A 21 8.852 -5.991 6.981 1.00 0.00 C ATOM 324 OG SER A 21 10.038 -6.837 6.960 1.00 0.00 O ATOM 0 H SER A 21 7.154 -5.600 5.230 1.00 0.00 H new ATOM 0 HA SER A 21 9.177 -3.899 6.572 1.00 0.00 H new ATOM 0 HB2 SER A 21 8.688 -5.617 7.992 1.00 0.00 H new ATOM 0 HB3 SER A 21 7.976 -6.583 6.715 1.00 0.00 H new ATOM 0 HG SER A 21 9.921 -7.579 7.589 1.00 0.00 H new ATOM 330 N LYS A 22 9.845 -5.154 3.769 1.00 0.00 N ATOM 331 CA LYS A 22 10.786 -4.836 2.633 1.00 0.00 C ATOM 332 C LYS A 22 10.817 -3.288 2.439 1.00 0.00 C ATOM 333 O LYS A 22 11.823 -2.660 2.413 1.00 0.00 O ATOM 334 CB LYS A 22 10.150 -5.475 1.330 1.00 0.00 C ATOM 335 CG LYS A 22 11.234 -6.511 0.840 1.00 0.00 C ATOM 336 CD LYS A 22 10.701 -7.550 -0.104 1.00 0.00 C ATOM 337 CE LYS A 22 11.032 -8.995 0.412 1.00 0.00 C ATOM 338 NZ LYS A 22 12.479 -9.125 0.598 1.00 0.00 N ATOM 0 H LYS A 22 8.928 -5.475 3.458 1.00 0.00 H new ATOM 0 HA LYS A 22 11.790 -5.214 2.827 1.00 0.00 H new ATOM 0 HB2 LYS A 22 9.201 -5.965 1.549 1.00 0.00 H new ATOM 0 HB3 LYS A 22 9.951 -4.718 0.571 1.00 0.00 H new ATOM 0 HG2 LYS A 22 12.044 -5.970 0.350 1.00 0.00 H new ATOM 0 HG3 LYS A 22 11.664 -7.010 1.708 1.00 0.00 H new ATOM 0 HD2 LYS A 22 9.622 -7.434 -0.208 1.00 0.00 H new ATOM 0 HD3 LYS A 22 11.134 -7.405 -1.094 1.00 0.00 H new ATOM 0 HE2 LYS A 22 10.515 -9.185 1.353 1.00 0.00 H new ATOM 0 HE3 LYS A 22 10.678 -9.738 -0.302 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 12.767 -10.105 0.404 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 12.972 -8.483 -0.055 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 12.727 -8.879 1.578 1.00 0.00 H new ATOM 352 N MET A 23 9.571 -2.779 2.190 1.00 0.00 N ATOM 353 CA MET A 23 9.319 -1.372 1.804 1.00 0.00 C ATOM 354 C MET A 23 9.768 -0.385 2.865 1.00 0.00 C ATOM 355 O MET A 23 10.050 0.790 2.613 1.00 0.00 O ATOM 356 CB MET A 23 7.831 -1.192 1.460 1.00 0.00 C ATOM 357 CG MET A 23 7.562 -1.749 0.046 1.00 0.00 C ATOM 358 SD MET A 23 6.367 -0.796 -0.952 1.00 0.00 S ATOM 359 CE MET A 23 5.677 0.321 0.253 1.00 0.00 C ATOM 0 H MET A 23 8.721 -3.340 2.254 1.00 0.00 H new ATOM 0 HA MET A 23 9.920 -1.153 0.921 1.00 0.00 H new ATOM 0 HB2 MET A 23 7.212 -1.711 2.191 1.00 0.00 H new ATOM 0 HB3 MET A 23 7.561 -0.137 1.505 1.00 0.00 H new ATOM 0 HG2 MET A 23 8.507 -1.795 -0.495 1.00 0.00 H new ATOM 0 HG3 MET A 23 7.198 -2.772 0.139 1.00 0.00 H new ATOM 0 HE1 MET A 23 4.775 0.780 -0.151 1.00 0.00 H new ATOM 0 HE2 MET A 23 5.429 -0.230 1.160 1.00 0.00 H new ATOM 0 HE3 MET A 23 6.405 1.097 0.488 1.00 0.00 H new ATOM 369 N ARG A 24 9.801 -0.873 4.136 1.00 0.00 N ATOM 370 CA ARG A 24 10.586 -0.302 5.244 1.00 0.00 C ATOM 371 C ARG A 24 12.099 -0.570 5.000 1.00 0.00 C ATOM 372 O ARG A 24 12.915 0.315 5.012 1.00 0.00 O ATOM 373 CB ARG A 24 10.169 -0.941 6.579 1.00 0.00 C ATOM 374 CG ARG A 24 8.708 -0.576 6.953 1.00 0.00 C ATOM 375 CD ARG A 24 8.199 -1.420 8.130 1.00 0.00 C ATOM 376 NE ARG A 24 6.747 -1.282 8.279 1.00 0.00 N ATOM 377 CZ ARG A 24 5.958 -1.874 9.194 1.00 0.00 C ATOM 378 NH1 ARG A 24 6.495 -2.634 10.181 1.00 0.00 N ATOM 379 NH2 ARG A 24 4.626 -1.667 9.211 1.00 0.00 N ATOM 0 H ARG A 24 9.266 -1.695 4.415 1.00 0.00 H new ATOM 0 HA ARG A 24 10.401 0.771 5.289 1.00 0.00 H new ATOM 0 HB2 ARG A 24 10.269 -2.024 6.512 1.00 0.00 H new ATOM 0 HB3 ARG A 24 10.842 -0.608 7.369 1.00 0.00 H new ATOM 0 HG2 ARG A 24 8.651 0.481 7.211 1.00 0.00 H new ATOM 0 HG3 ARG A 24 8.062 -0.728 6.089 1.00 0.00 H new ATOM 0 HD2 ARG A 24 8.455 -2.467 7.970 1.00 0.00 H new ATOM 0 HD3 ARG A 24 8.695 -1.107 9.049 1.00 0.00 H new ATOM 0 HE ARG A 24 6.281 -0.666 7.612 1.00 0.00 H new ATOM 0 HH11 ARG A 24 7.506 -2.761 10.234 1.00 0.00 H new ATOM 0 HH12 ARG A 24 5.888 -3.079 10.870 1.00 0.00 H new ATOM 0 HH21 ARG A 24 4.197 -1.051 8.521 1.00 0.00 H new ATOM 0 HH22 ARG A 24 4.047 -2.127 9.914 1.00 0.00 H new ATOM 393 N ALA A 25 12.393 -1.882 4.862 1.00 0.00 N ATOM 394 CA ALA A 25 13.766 -2.355 4.540 1.00 0.00 C ATOM 395 C ALA A 25 14.526 -1.388 3.642 1.00 0.00 C ATOM 396 O ALA A 25 15.617 -0.927 3.961 1.00 0.00 O ATOM 397 CB ALA A 25 13.765 -3.751 3.955 1.00 0.00 C ATOM 0 H ALA A 25 11.707 -2.630 4.967 1.00 0.00 H new ATOM 0 HA ALA A 25 14.298 -2.393 5.491 1.00 0.00 H new ATOM 0 HB1 ALA A 25 14.789 -4.054 3.736 1.00 0.00 H new ATOM 0 HB2 ALA A 25 13.326 -4.445 4.672 1.00 0.00 H new ATOM 0 HB3 ALA A 25 13.179 -3.760 3.036 1.00 0.00 H new ATOM 403 N GLN A 26 13.952 -1.145 2.432 1.00 0.00 N ATOM 404 CA GLN A 26 14.366 -0.102 1.478 1.00 0.00 C ATOM 405 C GLN A 26 14.413 1.283 2.225 1.00 0.00 C ATOM 406 O GLN A 26 15.436 1.922 2.309 1.00 0.00 O ATOM 407 CB GLN A 26 13.500 -0.035 0.313 1.00 0.00 C ATOM 408 CG GLN A 26 12.284 -0.865 0.083 1.00 0.00 C ATOM 409 CD GLN A 26 12.500 -1.979 -0.997 1.00 0.00 C ATOM 410 OE1 GLN A 26 13.158 -1.777 -2.029 1.00 0.00 O ATOM 411 NE2 GLN A 26 11.971 -3.180 -0.741 1.00 0.00 N ATOM 0 H GLN A 26 13.162 -1.694 2.091 1.00 0.00 H new ATOM 0 HA GLN A 26 15.357 -0.357 1.103 1.00 0.00 H new ATOM 0 HB2 GLN A 26 13.167 1.001 0.252 1.00 0.00 H new ATOM 0 HB3 GLN A 26 14.146 -0.213 -0.546 1.00 0.00 H new ATOM 0 HG2 GLN A 26 11.985 -1.330 1.022 1.00 0.00 H new ATOM 0 HG3 GLN A 26 11.463 -0.219 -0.228 1.00 0.00 H new ATOM 0 HE21 GLN A 26 11.433 -3.329 0.113 1.00 0.00 H new ATOM 0 HE22 GLN A 26 12.106 -3.947 -1.399 1.00 0.00 H new ATOM 420 N ALA A 27 13.200 1.724 2.645 1.00 0.00 N ATOM 421 CA ALA A 27 12.917 3.102 3.061 1.00 0.00 C ATOM 422 C ALA A 27 13.662 3.467 4.360 1.00 0.00 C ATOM 423 O ALA A 27 13.772 4.664 4.672 1.00 0.00 O ATOM 424 CB ALA A 27 11.391 3.317 3.238 1.00 0.00 C ATOM 0 H ALA A 27 12.384 1.114 2.701 1.00 0.00 H new ATOM 0 HA ALA A 27 13.277 3.763 2.272 1.00 0.00 H new ATOM 0 HB1 ALA A 27 11.202 4.345 3.547 1.00 0.00 H new ATOM 0 HB2 ALA A 27 10.884 3.123 2.293 1.00 0.00 H new ATOM 0 HB3 ALA A 27 11.013 2.634 3.999 1.00 0.00 H new ATOM 430 N GLU A 28 14.120 2.491 5.083 1.00 0.00 N ATOM 431 CA GLU A 28 15.000 2.584 6.283 1.00 0.00 C ATOM 432 C GLU A 28 16.480 2.445 5.834 1.00 0.00 C ATOM 433 O GLU A 28 17.378 2.990 6.495 1.00 0.00 O ATOM 434 CB GLU A 28 14.588 1.426 7.256 1.00 0.00 C ATOM 435 CG GLU A 28 15.778 0.743 7.883 1.00 0.00 C ATOM 436 CD GLU A 28 15.593 0.086 9.227 1.00 0.00 C ATOM 437 OE1 GLU A 28 14.428 -0.335 9.522 1.00 0.00 O ATOM 438 OE2 GLU A 28 16.602 -0.045 10.001 1.00 0.00 O ATOM 0 H GLU A 28 13.890 1.522 4.861 1.00 0.00 H new ATOM 0 HA GLU A 28 14.892 3.542 6.792 1.00 0.00 H new ATOM 0 HB2 GLU A 28 13.949 1.827 8.042 1.00 0.00 H new ATOM 0 HB3 GLU A 28 13.998 0.690 6.710 1.00 0.00 H new ATOM 0 HG2 GLU A 28 16.132 -0.017 7.186 1.00 0.00 H new ATOM 0 HG3 GLU A 28 16.574 1.482 7.980 1.00 0.00 H new ATOM 445 N LYS A 29 16.678 1.649 4.789 1.00 0.00 N ATOM 446 CA LYS A 29 17.961 1.677 4.005 1.00 0.00 C ATOM 447 C LYS A 29 18.313 3.114 3.596 1.00 0.00 C ATOM 448 O LYS A 29 19.454 3.574 3.798 1.00 0.00 O ATOM 449 CB LYS A 29 17.791 0.773 2.765 1.00 0.00 C ATOM 450 CG LYS A 29 19.186 0.377 2.212 1.00 0.00 C ATOM 451 CD LYS A 29 19.285 -1.152 1.948 1.00 0.00 C ATOM 452 CE LYS A 29 18.045 -1.576 1.133 1.00 0.00 C ATOM 453 NZ LYS A 29 18.188 -3.005 0.739 1.00 0.00 N ATOM 0 H LYS A 29 15.991 0.976 4.449 1.00 0.00 H new ATOM 0 HA LYS A 29 18.782 1.306 4.618 1.00 0.00 H new ATOM 0 HB2 LYS A 29 17.227 -0.121 3.029 1.00 0.00 H new ATOM 0 HB3 LYS A 29 17.220 1.295 1.998 1.00 0.00 H new ATOM 0 HG2 LYS A 29 19.378 0.920 1.286 1.00 0.00 H new ATOM 0 HG3 LYS A 29 19.957 0.675 2.922 1.00 0.00 H new ATOM 0 HD2 LYS A 29 20.199 -1.386 1.401 1.00 0.00 H new ATOM 0 HD3 LYS A 29 19.328 -1.699 2.890 1.00 0.00 H new ATOM 0 HE2 LYS A 29 17.140 -1.438 1.725 1.00 0.00 H new ATOM 0 HE3 LYS A 29 17.945 -0.949 0.247 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 17.356 -3.298 0.189 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 19.044 -3.122 0.160 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 18.264 -3.594 1.592 1.00 0.00 H new ATOM 467 N TYR A 30 17.311 3.801 2.997 1.00 0.00 N ATOM 468 CA TYR A 30 17.525 5.135 2.338 1.00 0.00 C ATOM 469 C TYR A 30 17.700 6.169 3.482 1.00 0.00 C ATOM 470 O TYR A 30 18.656 6.953 3.531 1.00 0.00 O ATOM 471 CB TYR A 30 16.302 5.483 1.450 1.00 0.00 C ATOM 472 CG TYR A 30 16.192 4.671 0.150 1.00 0.00 C ATOM 473 CD1 TYR A 30 16.326 3.284 0.265 1.00 0.00 C ATOM 474 CD2 TYR A 30 15.960 5.295 -1.072 1.00 0.00 C ATOM 475 CE1 TYR A 30 15.930 2.489 -0.836 1.00 0.00 C ATOM 476 CE2 TYR A 30 15.933 4.499 -2.244 1.00 0.00 C ATOM 477 CZ TYR A 30 15.838 3.111 -2.089 1.00 0.00 C ATOM 478 OH TYR A 30 15.702 2.302 -3.177 1.00 0.00 O ATOM 0 H TYR A 30 16.349 3.466 2.951 1.00 0.00 H new ATOM 0 HA TYR A 30 18.402 5.132 1.691 1.00 0.00 H new ATOM 0 HB2 TYR A 30 15.394 5.332 2.033 1.00 0.00 H new ATOM 0 HB3 TYR A 30 16.345 6.542 1.197 1.00 0.00 H new ATOM 0 HD1 TYR A 30 16.719 2.834 1.165 1.00 0.00 H new ATOM 0 HD2 TYR A 30 15.804 6.362 -1.126 1.00 0.00 H new ATOM 0 HE1 TYR A 30 15.706 1.439 -0.715 1.00 0.00 H new ATOM 0 HE2 TYR A 30 15.984 4.948 -3.225 1.00 0.00 H new ATOM 0 HH TYR A 30 15.647 2.850 -3.987 1.00 0.00 H new ATOM 488 N GLU A 31 16.739 6.167 4.390 1.00 0.00 N ATOM 489 CA GLU A 31 16.314 7.254 5.265 1.00 0.00 C ATOM 490 C GLU A 31 15.054 7.937 4.814 1.00 0.00 C ATOM 491 O GLU A 31 14.635 8.997 5.337 1.00 0.00 O ATOM 492 CB GLU A 31 17.497 8.222 5.535 1.00 0.00 C ATOM 493 CG GLU A 31 18.431 7.558 6.597 1.00 0.00 C ATOM 494 CD GLU A 31 19.840 8.048 6.673 1.00 0.00 C ATOM 495 OE1 GLU A 31 20.092 9.256 6.614 1.00 0.00 O ATOM 496 OE2 GLU A 31 20.795 7.137 6.867 1.00 0.00 O ATOM 0 H GLU A 31 16.183 5.327 4.551 1.00 0.00 H new ATOM 0 HA GLU A 31 16.031 6.815 6.222 1.00 0.00 H new ATOM 0 HB2 GLU A 31 18.046 8.419 4.614 1.00 0.00 H new ATOM 0 HB3 GLU A 31 17.129 9.182 5.898 1.00 0.00 H new ATOM 0 HG2 GLU A 31 17.974 7.691 7.578 1.00 0.00 H new ATOM 0 HG3 GLU A 31 18.457 6.486 6.400 1.00 0.00 H new ATOM 503 N VAL A 32 14.370 7.359 3.784 1.00 0.00 N ATOM 504 CA VAL A 32 13.136 7.821 3.165 1.00 0.00 C ATOM 505 C VAL A 32 11.993 7.868 4.226 1.00 0.00 C ATOM 506 O VAL A 32 11.415 6.857 4.576 1.00 0.00 O ATOM 507 CB VAL A 32 12.779 6.825 2.007 1.00 0.00 C ATOM 508 CG1 VAL A 32 11.226 6.836 1.715 1.00 0.00 C ATOM 509 CG2 VAL A 32 13.567 7.060 0.752 1.00 0.00 C ATOM 0 H VAL A 32 14.707 6.500 3.350 1.00 0.00 H new ATOM 0 HA VAL A 32 13.259 8.827 2.765 1.00 0.00 H new ATOM 0 HB VAL A 32 13.065 5.833 2.358 1.00 0.00 H new ATOM 0 HG11 VAL A 32 11.002 6.138 0.908 1.00 0.00 H new ATOM 0 HG12 VAL A 32 10.685 6.538 2.613 1.00 0.00 H new ATOM 0 HG13 VAL A 32 10.918 7.840 1.422 1.00 0.00 H new ATOM 0 HG21 VAL A 32 13.269 6.336 -0.006 1.00 0.00 H new ATOM 0 HG22 VAL A 32 13.375 8.069 0.386 1.00 0.00 H new ATOM 0 HG23 VAL A 32 14.630 6.947 0.963 1.00 0.00 H new ATOM 519 N PRO A 33 11.740 9.100 4.706 1.00 0.00 N ATOM 520 CA PRO A 33 10.770 9.423 5.768 1.00 0.00 C ATOM 521 C PRO A 33 9.259 9.133 5.501 1.00 0.00 C ATOM 522 O PRO A 33 8.484 9.997 5.118 1.00 0.00 O ATOM 523 CB PRO A 33 11.041 10.833 6.204 1.00 0.00 C ATOM 524 CG PRO A 33 12.357 11.226 5.634 1.00 0.00 C ATOM 525 CD PRO A 33 12.523 10.304 4.381 1.00 0.00 C ATOM 0 HA PRO A 33 10.943 8.707 6.572 1.00 0.00 H new ATOM 0 HB2 PRO A 33 10.255 11.502 5.853 1.00 0.00 H new ATOM 0 HB3 PRO A 33 11.057 10.903 7.292 1.00 0.00 H new ATOM 0 HG2 PRO A 33 12.372 12.280 5.358 1.00 0.00 H new ATOM 0 HG3 PRO A 33 13.163 11.073 6.351 1.00 0.00 H new ATOM 0 HD2 PRO A 33 12.150 10.789 3.479 1.00 0.00 H new ATOM 0 HD3 PRO A 33 13.570 10.061 4.203 1.00 0.00 H new ATOM 533 N VAL A 34 8.890 7.909 5.972 1.00 0.00 N ATOM 534 CA VAL A 34 7.564 7.311 5.740 1.00 0.00 C ATOM 535 C VAL A 34 7.452 5.958 6.449 1.00 0.00 C ATOM 536 O VAL A 34 8.429 5.181 6.568 1.00 0.00 O ATOM 537 CB VAL A 34 7.265 7.273 4.235 1.00 0.00 C ATOM 538 CG1 VAL A 34 8.488 6.940 3.341 1.00 0.00 C ATOM 539 CG2 VAL A 34 6.081 6.309 3.909 1.00 0.00 C ATOM 0 H VAL A 34 9.512 7.317 6.523 1.00 0.00 H new ATOM 0 HA VAL A 34 6.784 7.930 6.184 1.00 0.00 H new ATOM 0 HB VAL A 34 6.980 8.296 3.988 1.00 0.00 H new ATOM 0 HG11 VAL A 34 8.183 6.935 2.295 1.00 0.00 H new ATOM 0 HG12 VAL A 34 9.263 7.692 3.490 1.00 0.00 H new ATOM 0 HG13 VAL A 34 8.879 5.959 3.610 1.00 0.00 H new ATOM 0 HG21 VAL A 34 5.898 6.308 2.834 1.00 0.00 H new ATOM 0 HG22 VAL A 34 6.333 5.300 4.235 1.00 0.00 H new ATOM 0 HG23 VAL A 34 5.184 6.645 4.429 1.00 0.00 H new ATOM 549 N ILE A 35 6.265 5.694 7.013 1.00 0.00 N ATOM 550 CA ILE A 35 5.791 4.393 7.522 1.00 0.00 C ATOM 551 C ILE A 35 4.916 3.690 6.477 1.00 0.00 C ATOM 552 O ILE A 35 3.813 4.120 6.128 1.00 0.00 O ATOM 553 CB ILE A 35 5.076 4.612 8.897 1.00 0.00 C ATOM 554 CG1 ILE A 35 6.051 5.156 9.950 1.00 0.00 C ATOM 555 CG2 ILE A 35 4.231 3.431 9.349 1.00 0.00 C ATOM 556 CD1 ILE A 35 6.663 4.154 10.916 1.00 0.00 C ATOM 0 H ILE A 35 5.565 6.426 7.135 1.00 0.00 H new ATOM 0 HA ILE A 35 6.632 3.722 7.698 1.00 0.00 H new ATOM 0 HB ILE A 35 4.330 5.393 8.751 1.00 0.00 H new ATOM 0 HG12 ILE A 35 6.864 5.661 9.428 1.00 0.00 H new ATOM 0 HG13 ILE A 35 5.528 5.913 10.535 1.00 0.00 H new ATOM 0 HG21 ILE A 35 3.769 3.660 10.309 1.00 0.00 H new ATOM 0 HG22 ILE A 35 3.454 3.236 8.610 1.00 0.00 H new ATOM 0 HG23 ILE A 35 4.864 2.549 9.452 1.00 0.00 H new ATOM 0 HD11 ILE A 35 7.331 4.673 11.604 1.00 0.00 H new ATOM 0 HD12 ILE A 35 5.871 3.662 11.481 1.00 0.00 H new ATOM 0 HD13 ILE A 35 7.227 3.407 10.357 1.00 0.00 H new ATOM 568 N ILE A 36 5.441 2.553 5.973 1.00 0.00 N ATOM 569 CA ILE A 36 4.696 1.419 5.375 1.00 0.00 C ATOM 570 C ILE A 36 4.012 0.590 6.459 1.00 0.00 C ATOM 571 O ILE A 36 4.667 0.051 7.351 1.00 0.00 O ATOM 572 CB ILE A 36 5.577 0.627 4.372 1.00 0.00 C ATOM 573 CG1 ILE A 36 6.469 1.591 3.560 1.00 0.00 C ATOM 574 CG2 ILE A 36 4.792 -0.365 3.507 1.00 0.00 C ATOM 575 CD1 ILE A 36 7.852 1.880 4.143 1.00 0.00 C ATOM 0 H ILE A 36 6.448 2.390 5.971 1.00 0.00 H new ATOM 0 HA ILE A 36 3.879 1.798 4.761 1.00 0.00 H new ATOM 0 HB ILE A 36 6.237 -0.014 4.956 1.00 0.00 H new ATOM 0 HG12 ILE A 36 6.598 1.178 2.559 1.00 0.00 H new ATOM 0 HG13 ILE A 36 5.939 2.537 3.449 1.00 0.00 H new ATOM 0 HG21 ILE A 36 5.476 -0.880 2.832 1.00 0.00 H new ATOM 0 HG22 ILE A 36 4.297 -1.095 4.148 1.00 0.00 H new ATOM 0 HG23 ILE A 36 4.044 0.173 2.925 1.00 0.00 H new ATOM 0 HD11 ILE A 36 8.387 2.568 3.488 1.00 0.00 H new ATOM 0 HD12 ILE A 36 7.744 2.329 5.130 1.00 0.00 H new ATOM 0 HD13 ILE A 36 8.413 0.949 4.227 1.00 0.00 H new ATOM 587 N GLU A 37 2.683 0.491 6.341 1.00 0.00 N ATOM 588 CA GLU A 37 1.830 -0.492 7.045 1.00 0.00 C ATOM 589 C GLU A 37 0.871 -1.159 6.064 1.00 0.00 C ATOM 590 O GLU A 37 0.688 -0.607 4.938 1.00 0.00 O ATOM 591 CB GLU A 37 1.050 0.215 8.182 1.00 0.00 C ATOM 592 CG GLU A 37 1.922 1.166 8.985 1.00 0.00 C ATOM 593 CD GLU A 37 1.137 2.176 9.882 1.00 0.00 C ATOM 594 OE1 GLU A 37 -0.119 2.114 9.862 1.00 0.00 O ATOM 595 OE2 GLU A 37 1.836 2.997 10.487 1.00 0.00 O ATOM 0 H GLU A 37 2.147 1.111 5.734 1.00 0.00 H new ATOM 0 HA GLU A 37 2.460 -1.267 7.482 1.00 0.00 H new ATOM 0 HB2 GLU A 37 0.214 0.768 7.755 1.00 0.00 H new ATOM 0 HB3 GLU A 37 0.628 -0.536 8.849 1.00 0.00 H new ATOM 0 HG2 GLU A 37 2.587 0.579 9.619 1.00 0.00 H new ATOM 0 HG3 GLU A 37 2.553 1.728 8.296 1.00 0.00 H new ATOM 602 N ALA A 38 0.331 -2.322 6.385 1.00 0.00 N ATOM 603 CA ALA A 38 -0.686 -3.074 5.629 1.00 0.00 C ATOM 604 C ALA A 38 -1.680 -3.756 6.626 1.00 0.00 C ATOM 605 O ALA A 38 -1.273 -4.160 7.708 1.00 0.00 O ATOM 606 CB ALA A 38 -0.049 -4.129 4.726 1.00 0.00 C ATOM 0 H ALA A 38 0.603 -2.810 7.239 1.00 0.00 H new ATOM 0 HA ALA A 38 -1.223 -2.372 4.992 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -0.829 -4.663 4.184 1.00 0.00 H new ATOM 0 HB2 ALA A 38 0.619 -3.644 4.015 1.00 0.00 H new ATOM 0 HB3 ALA A 38 0.518 -4.834 5.334 1.00 0.00 H new ATOM 612 N PHE A 39 -2.959 -3.773 6.232 1.00 0.00 N ATOM 613 CA PHE A 39 -4.123 -4.171 7.104 1.00 0.00 C ATOM 614 C PHE A 39 -5.149 -4.882 6.238 1.00 0.00 C ATOM 615 O PHE A 39 -4.955 -4.946 4.992 1.00 0.00 O ATOM 616 CB PHE A 39 -4.674 -2.876 7.764 1.00 0.00 C ATOM 617 CG PHE A 39 -3.601 -1.926 8.353 1.00 0.00 C ATOM 618 CD1 PHE A 39 -2.983 -0.955 7.525 1.00 0.00 C ATOM 619 CD2 PHE A 39 -3.280 -2.015 9.710 1.00 0.00 C ATOM 620 CE1 PHE A 39 -2.148 -0.003 8.116 1.00 0.00 C ATOM 621 CE2 PHE A 39 -2.254 -1.201 10.241 1.00 0.00 C ATOM 622 CZ PHE A 39 -1.745 -0.157 9.449 1.00 0.00 C ATOM 0 H PHE A 39 -3.242 -3.510 5.288 1.00 0.00 H new ATOM 0 HA PHE A 39 -3.840 -4.862 7.898 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -5.253 -2.327 7.021 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -5.363 -3.158 8.560 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -3.154 -0.951 6.459 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -3.813 -2.702 10.350 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -1.814 0.851 7.546 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -1.869 -1.377 11.235 1.00 0.00 H new ATOM 0 HZ PHE A 39 -1.034 0.536 9.874 1.00 0.00 H new ATOM 632 N PRO A 40 -6.149 -5.599 6.814 1.00 0.00 N ATOM 633 CA PRO A 40 -7.111 -6.452 6.157 1.00 0.00 C ATOM 634 C PRO A 40 -8.410 -5.889 5.520 1.00 0.00 C ATOM 635 O PRO A 40 -9.517 -6.404 5.703 1.00 0.00 O ATOM 636 CB PRO A 40 -7.382 -7.619 7.092 1.00 0.00 C ATOM 637 CG PRO A 40 -7.150 -7.048 8.473 1.00 0.00 C ATOM 638 CD PRO A 40 -6.209 -5.836 8.298 1.00 0.00 C ATOM 0 HA PRO A 40 -6.617 -6.715 5.222 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -8.401 -7.991 6.980 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -6.713 -8.456 6.889 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -8.092 -6.744 8.930 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -6.703 -7.794 9.130 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -6.592 -4.960 8.822 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -5.219 -6.043 8.705 1.00 0.00 H new ATOM 646 N GLU A 41 -8.175 -4.952 4.587 1.00 0.00 N ATOM 647 CA GLU A 41 -9.121 -3.980 4.080 1.00 0.00 C ATOM 648 C GLU A 41 -9.938 -3.240 5.179 1.00 0.00 C ATOM 649 O GLU A 41 -10.073 -1.992 5.105 1.00 0.00 O ATOM 650 CB GLU A 41 -10.059 -4.572 3.010 1.00 0.00 C ATOM 651 CG GLU A 41 -10.955 -5.709 3.566 1.00 0.00 C ATOM 652 CD GLU A 41 -12.268 -5.252 4.144 1.00 0.00 C ATOM 653 OE1 GLU A 41 -12.616 -4.051 4.047 1.00 0.00 O ATOM 654 OE2 GLU A 41 -12.984 -6.154 4.715 1.00 0.00 O ATOM 0 H GLU A 41 -7.259 -4.858 4.148 1.00 0.00 H new ATOM 0 HA GLU A 41 -8.494 -3.223 3.608 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -10.691 -3.780 2.608 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -9.463 -4.956 2.182 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -11.155 -6.420 2.764 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -10.401 -6.245 4.337 1.00 0.00 H new ATOM 661 N THR A 42 -10.547 -3.971 6.101 1.00 0.00 N ATOM 662 CA THR A 42 -11.246 -3.508 7.331 1.00 0.00 C ATOM 663 C THR A 42 -10.796 -2.171 7.827 1.00 0.00 C ATOM 664 O THR A 42 -11.594 -1.343 8.368 1.00 0.00 O ATOM 665 CB THR A 42 -11.235 -4.525 8.481 1.00 0.00 C ATOM 666 OG1 THR A 42 -10.965 -3.896 9.758 1.00 0.00 O ATOM 667 CG2 THR A 42 -10.203 -5.687 8.168 1.00 0.00 C ATOM 0 H THR A 42 -10.578 -4.987 6.019 1.00 0.00 H new ATOM 0 HA THR A 42 -12.277 -3.403 6.994 1.00 0.00 H new ATOM 0 HB THR A 42 -12.231 -4.961 8.559 1.00 0.00 H new ATOM 0 HG1 THR A 42 -10.968 -4.575 10.464 1.00 0.00 H new ATOM 0 HG21 THR A 42 -10.202 -6.404 8.989 1.00 0.00 H new ATOM 0 HG22 THR A 42 -10.492 -6.192 7.246 1.00 0.00 H new ATOM 0 HG23 THR A 42 -9.204 -5.266 8.053 1.00 0.00 H new ATOM 675 N LEU A 43 -9.473 -1.866 7.726 1.00 0.00 N ATOM 676 CA LEU A 43 -8.758 -0.738 8.327 1.00 0.00 C ATOM 677 C LEU A 43 -8.268 0.242 7.260 1.00 0.00 C ATOM 678 O LEU A 43 -7.765 1.300 7.561 1.00 0.00 O ATOM 679 CB LEU A 43 -7.493 -1.396 9.013 1.00 0.00 C ATOM 680 CG LEU A 43 -7.681 -1.936 10.456 1.00 0.00 C ATOM 681 CD1 LEU A 43 -6.415 -2.533 11.065 1.00 0.00 C ATOM 682 CD2 LEU A 43 -8.326 -0.845 11.349 1.00 0.00 C ATOM 0 H LEU A 43 -8.845 -2.454 7.179 1.00 0.00 H new ATOM 0 HA LEU A 43 -9.400 -0.184 9.012 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -7.155 -2.219 8.384 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -6.692 -0.657 9.029 1.00 0.00 H new ATOM 0 HG LEU A 43 -8.366 -2.782 10.398 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -6.629 -2.888 12.073 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -6.074 -3.367 10.451 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -5.637 -1.771 11.106 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -8.455 -1.232 12.360 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -7.680 0.032 11.375 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -9.298 -0.568 10.940 1.00 0.00 H new ATOM 694 N ALA A 44 -8.377 -0.149 5.943 1.00 0.00 N ATOM 695 CA ALA A 44 -8.228 0.796 4.812 1.00 0.00 C ATOM 696 C ALA A 44 -9.022 2.091 5.049 1.00 0.00 C ATOM 697 O ALA A 44 -8.496 3.205 4.959 1.00 0.00 O ATOM 698 CB ALA A 44 -8.707 0.130 3.506 1.00 0.00 C ATOM 0 H ALA A 44 -8.567 -1.109 5.657 1.00 0.00 H new ATOM 0 HA ALA A 44 -7.172 1.055 4.731 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -8.595 0.830 2.678 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -8.110 -0.761 3.311 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -9.756 -0.151 3.604 1.00 0.00 H new ATOM 704 N GLY A 45 -10.351 1.913 5.309 1.00 0.00 N ATOM 705 CA GLY A 45 -11.220 3.010 5.813 1.00 0.00 C ATOM 706 C GLY A 45 -10.420 3.980 6.737 1.00 0.00 C ATOM 707 O GLY A 45 -10.204 5.140 6.362 1.00 0.00 O ATOM 0 H GLY A 45 -10.837 1.026 5.178 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -11.636 3.564 4.972 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -12.061 2.588 6.364 1.00 0.00 H new ATOM 711 N GLU A 46 -10.036 3.454 7.905 1.00 0.00 N ATOM 712 CA GLU A 46 -9.513 4.274 9.033 1.00 0.00 C ATOM 713 C GLU A 46 -8.018 4.580 8.815 1.00 0.00 C ATOM 714 O GLU A 46 -7.614 5.747 8.723 1.00 0.00 O ATOM 715 CB GLU A 46 -9.707 3.538 10.361 1.00 0.00 C ATOM 716 CG GLU A 46 -10.878 4.070 11.190 1.00 0.00 C ATOM 717 CD GLU A 46 -10.624 3.930 12.722 1.00 0.00 C ATOM 718 OE1 GLU A 46 -10.071 2.878 13.130 1.00 0.00 O ATOM 719 OE2 GLU A 46 -10.977 4.892 13.436 1.00 0.00 O ATOM 0 H GLU A 46 -10.074 2.455 8.107 1.00 0.00 H new ATOM 0 HA GLU A 46 -10.067 5.212 9.068 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -9.867 2.479 10.160 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -8.792 3.617 10.948 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -11.048 5.119 10.946 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -11.786 3.529 10.923 1.00 0.00 H new ATOM 726 N LYS A 47 -7.187 3.516 8.804 1.00 0.00 N ATOM 727 CA LYS A 47 -5.743 3.609 8.458 1.00 0.00 C ATOM 728 C LYS A 47 -5.520 4.398 7.145 1.00 0.00 C ATOM 729 O LYS A 47 -4.785 5.376 7.109 1.00 0.00 O ATOM 730 CB LYS A 47 -5.120 2.209 8.321 1.00 0.00 C ATOM 731 CG LYS A 47 -4.724 1.674 9.714 1.00 0.00 C ATOM 732 CD LYS A 47 -3.628 2.517 10.439 1.00 0.00 C ATOM 733 CE LYS A 47 -3.338 1.874 11.802 1.00 0.00 C ATOM 734 NZ LYS A 47 -3.337 2.952 12.858 1.00 0.00 N ATOM 0 H LYS A 47 -7.492 2.570 9.033 1.00 0.00 H new ATOM 0 HA LYS A 47 -5.256 4.144 9.273 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -5.830 1.530 7.849 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -4.243 2.253 7.675 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -5.614 1.639 10.343 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -4.367 0.649 9.609 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -2.720 2.554 9.837 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -3.966 3.545 10.570 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -4.092 1.121 12.032 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -2.375 1.365 11.782 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -3.141 2.528 13.787 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -2.603 3.654 12.636 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -4.266 3.418 12.879 1.00 0.00 H new ATOM 748 N GLY A 48 -6.131 3.858 6.056 1.00 0.00 N ATOM 749 CA GLY A 48 -6.264 4.541 4.756 1.00 0.00 C ATOM 750 C GLY A 48 -6.337 6.057 4.895 1.00 0.00 C ATOM 751 O GLY A 48 -5.403 6.788 4.555 1.00 0.00 O ATOM 0 H GLY A 48 -6.547 2.927 6.064 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -5.416 4.278 4.123 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -7.161 4.182 4.252 1.00 0.00 H new ATOM 755 N GLN A 49 -7.512 6.542 5.377 1.00 0.00 N ATOM 756 CA GLN A 49 -7.800 7.954 5.653 1.00 0.00 C ATOM 757 C GLN A 49 -6.613 8.596 6.438 1.00 0.00 C ATOM 758 O GLN A 49 -6.458 9.825 6.462 1.00 0.00 O ATOM 759 CB GLN A 49 -9.088 8.046 6.443 1.00 0.00 C ATOM 760 CG GLN A 49 -9.526 9.485 6.836 1.00 0.00 C ATOM 761 CD GLN A 49 -10.878 9.504 7.552 1.00 0.00 C ATOM 762 OE1 GLN A 49 -11.781 10.350 7.314 1.00 0.00 O ATOM 763 NE2 GLN A 49 -11.118 8.523 8.456 1.00 0.00 N ATOM 0 H GLN A 49 -8.302 5.933 5.587 1.00 0.00 H new ATOM 0 HA GLN A 49 -7.918 8.502 4.718 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -9.886 7.588 5.859 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -8.980 7.456 7.353 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -8.769 9.929 7.482 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -9.583 10.103 5.940 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -10.398 7.830 8.660 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -12.019 8.477 8.932 1.00 0.00 H new ATOM 772 N ASN A 50 -5.870 7.773 7.197 1.00 0.00 N ATOM 773 CA ASN A 50 -4.727 8.177 8.036 1.00 0.00 C ATOM 774 C ASN A 50 -3.374 7.893 7.359 1.00 0.00 C ATOM 775 O ASN A 50 -2.302 7.953 7.946 1.00 0.00 O ATOM 776 CB ASN A 50 -4.821 7.470 9.419 1.00 0.00 C ATOM 777 CG ASN A 50 -5.613 8.313 10.455 1.00 0.00 C ATOM 778 OD1 ASN A 50 -5.103 9.039 11.288 1.00 0.00 O ATOM 779 ND2 ASN A 50 -6.954 8.190 10.395 1.00 0.00 N ATOM 0 H ASN A 50 -6.055 6.771 7.245 1.00 0.00 H new ATOM 0 HA ASN A 50 -4.778 9.256 8.178 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -5.303 6.500 9.297 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -3.817 7.281 9.798 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -7.543 8.706 11.048 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -7.380 7.581 9.696 1.00 0.00 H new ATOM 786 N ALA A 51 -3.472 7.488 6.067 1.00 0.00 N ATOM 787 CA ALA A 51 -2.360 7.343 5.143 1.00 0.00 C ATOM 788 C ALA A 51 -2.126 8.595 4.307 1.00 0.00 C ATOM 789 O ALA A 51 -2.974 9.501 4.241 1.00 0.00 O ATOM 790 CB ALA A 51 -2.578 6.127 4.218 1.00 0.00 C ATOM 0 H ALA A 51 -4.368 7.249 5.642 1.00 0.00 H new ATOM 0 HA ALA A 51 -1.468 7.185 5.750 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -1.735 6.035 3.533 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -2.657 5.222 4.820 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -3.496 6.264 3.647 1.00 0.00 H new ATOM 796 N ASP A 52 -0.931 8.689 3.680 1.00 0.00 N ATOM 797 CA ASP A 52 -0.515 9.565 2.580 1.00 0.00 C ATOM 798 C ASP A 52 -0.901 8.969 1.207 1.00 0.00 C ATOM 799 O ASP A 52 -1.260 9.700 0.269 1.00 0.00 O ATOM 800 CB ASP A 52 0.985 9.823 2.659 1.00 0.00 C ATOM 801 CG ASP A 52 1.379 11.073 3.513 1.00 0.00 C ATOM 802 OD1 ASP A 52 0.932 12.172 3.134 1.00 0.00 O ATOM 803 OD2 ASP A 52 2.066 10.856 4.555 1.00 0.00 O ATOM 0 H ASP A 52 -0.160 8.087 3.968 1.00 0.00 H new ATOM 0 HA ASP A 52 -1.041 10.514 2.681 1.00 0.00 H new ATOM 0 HB2 ASP A 52 1.472 8.943 3.079 1.00 0.00 H new ATOM 0 HB3 ASP A 52 1.374 9.951 1.649 1.00 0.00 H new ATOM 808 N VAL A 53 -0.653 7.631 1.071 1.00 0.00 N ATOM 809 CA VAL A 53 -0.868 6.851 -0.157 1.00 0.00 C ATOM 810 C VAL A 53 -1.177 5.374 0.276 1.00 0.00 C ATOM 811 O VAL A 53 -0.658 4.855 1.232 1.00 0.00 O ATOM 812 CB VAL A 53 0.347 6.977 -1.079 1.00 0.00 C ATOM 813 CG1 VAL A 53 0.371 6.102 -2.332 1.00 0.00 C ATOM 814 CG2 VAL A 53 0.725 8.452 -1.375 1.00 0.00 C ATOM 0 H VAL A 53 -0.290 7.066 1.839 1.00 0.00 H new ATOM 0 HA VAL A 53 -1.713 7.224 -0.735 1.00 0.00 H new ATOM 0 HB VAL A 53 1.140 6.538 -0.474 1.00 0.00 H new ATOM 0 HG11 VAL A 53 1.287 6.293 -2.892 1.00 0.00 H new ATOM 0 HG12 VAL A 53 0.335 5.052 -2.043 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -0.491 6.337 -2.956 1.00 0.00 H new ATOM 0 HG21 VAL A 53 1.593 8.480 -2.033 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -0.114 8.952 -1.859 1.00 0.00 H new ATOM 0 HG23 VAL A 53 0.961 8.961 -0.441 1.00 0.00 H new ATOM 824 N VAL A 54 -2.122 4.765 -0.503 1.00 0.00 N ATOM 825 CA VAL A 54 -2.836 3.529 -0.150 1.00 0.00 C ATOM 826 C VAL A 54 -2.740 2.513 -1.327 1.00 0.00 C ATOM 827 O VAL A 54 -2.805 2.901 -2.498 1.00 0.00 O ATOM 828 CB VAL A 54 -4.261 3.838 0.313 1.00 0.00 C ATOM 829 CG1 VAL A 54 -5.364 2.852 -0.112 1.00 0.00 C ATOM 830 CG2 VAL A 54 -4.346 4.235 1.806 1.00 0.00 C ATOM 0 H VAL A 54 -2.403 5.139 -1.409 1.00 0.00 H new ATOM 0 HA VAL A 54 -2.362 3.047 0.705 1.00 0.00 H new ATOM 0 HB VAL A 54 -4.503 4.725 -0.272 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -6.323 3.188 0.281 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -5.413 2.808 -1.200 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -5.137 1.861 0.281 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -5.383 4.441 2.069 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -3.971 3.418 2.422 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -3.744 5.127 1.980 1.00 0.00 H new ATOM 840 N LEU A 55 -2.476 1.220 -0.990 1.00 0.00 N ATOM 841 CA LEU A 55 -2.458 0.062 -1.860 1.00 0.00 C ATOM 842 C LEU A 55 -3.145 -1.144 -1.191 1.00 0.00 C ATOM 843 O LEU A 55 -2.737 -1.537 -0.092 1.00 0.00 O ATOM 844 CB LEU A 55 -0.953 -0.271 -2.128 1.00 0.00 C ATOM 845 CG LEU A 55 -0.021 0.929 -2.466 1.00 0.00 C ATOM 846 CD1 LEU A 55 1.124 1.131 -1.476 1.00 0.00 C ATOM 847 CD2 LEU A 55 0.297 1.065 -3.927 1.00 0.00 C ATOM 0 H LEU A 55 -2.257 0.966 -0.027 1.00 0.00 H new ATOM 0 HA LEU A 55 -2.997 0.272 -2.784 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -0.554 -0.774 -1.247 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -0.903 -0.983 -2.952 1.00 0.00 H new ATOM 0 HG LEU A 55 -0.615 1.826 -2.290 1.00 0.00 H new ATOM 0 HD11 LEU A 55 1.725 1.987 -1.784 1.00 0.00 H new ATOM 0 HD12 LEU A 55 0.717 1.313 -0.481 1.00 0.00 H new ATOM 0 HD13 LEU A 55 1.748 0.238 -1.455 1.00 0.00 H new ATOM 0 HD21 LEU A 55 0.951 1.924 -4.079 1.00 0.00 H new ATOM 0 HD22 LEU A 55 0.798 0.162 -4.276 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -0.626 1.208 -4.489 1.00 0.00 H new ATOM 859 N LEU A 56 -4.216 -1.674 -1.807 1.00 0.00 N ATOM 860 CA LEU A 56 -5.070 -2.793 -1.318 1.00 0.00 C ATOM 861 C LEU A 56 -4.851 -3.977 -2.289 1.00 0.00 C ATOM 862 O LEU A 56 -4.675 -3.777 -3.489 1.00 0.00 O ATOM 863 CB LEU A 56 -6.509 -2.292 -1.327 1.00 0.00 C ATOM 864 CG LEU A 56 -6.807 -0.918 -2.017 1.00 0.00 C ATOM 865 CD1 LEU A 56 -8.342 -0.677 -2.228 1.00 0.00 C ATOM 866 CD2 LEU A 56 -6.190 0.233 -1.157 1.00 0.00 C ATOM 0 H LEU A 56 -4.534 -1.320 -2.709 1.00 0.00 H new ATOM 0 HA LEU A 56 -4.829 -3.123 -0.308 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -7.123 -3.050 -1.814 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -6.846 -2.226 -0.292 1.00 0.00 H new ATOM 0 HG LEU A 56 -6.351 -0.932 -3.007 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -8.496 0.289 -2.710 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -8.751 -1.466 -2.859 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -8.848 -0.686 -1.262 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -6.394 1.192 -1.633 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -6.633 0.220 -0.161 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -5.112 0.090 -1.077 1.00 0.00 H new ATOM 878 N GLY A 57 -4.765 -5.208 -1.728 1.00 0.00 N ATOM 879 CA GLY A 57 -4.359 -6.416 -2.522 1.00 0.00 C ATOM 880 C GLY A 57 -4.883 -6.318 -3.965 1.00 0.00 C ATOM 881 O GLY A 57 -5.984 -5.757 -4.201 1.00 0.00 O ATOM 0 H GLY A 57 -4.966 -5.399 -0.746 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -3.273 -6.505 -2.529 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -4.749 -7.317 -2.048 1.00 0.00 H new ATOM 885 N PRO A 58 -4.089 -6.809 -4.918 1.00 0.00 N ATOM 886 CA PRO A 58 -4.410 -6.838 -6.376 1.00 0.00 C ATOM 887 C PRO A 58 -5.357 -7.975 -6.872 1.00 0.00 C ATOM 888 O PRO A 58 -5.720 -8.051 -8.027 1.00 0.00 O ATOM 889 CB PRO A 58 -3.097 -6.710 -7.079 1.00 0.00 C ATOM 890 CG PRO A 58 -2.172 -7.558 -6.167 1.00 0.00 C ATOM 891 CD PRO A 58 -2.662 -7.214 -4.736 1.00 0.00 C ATOM 0 HA PRO A 58 -5.062 -6.002 -6.628 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -3.137 -7.099 -8.097 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -2.767 -5.673 -7.146 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -2.266 -8.623 -6.379 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -1.123 -7.297 -6.306 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -2.575 -8.072 -4.069 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -2.073 -6.408 -4.298 1.00 0.00 H new ATOM 899 N GLN A 59 -5.866 -8.683 -5.835 1.00 0.00 N ATOM 900 CA GLN A 59 -7.091 -9.533 -5.889 1.00 0.00 C ATOM 901 C GLN A 59 -8.249 -8.793 -5.172 1.00 0.00 C ATOM 902 O GLN A 59 -9.390 -9.284 -5.112 1.00 0.00 O ATOM 903 CB GLN A 59 -6.703 -10.813 -5.070 1.00 0.00 C ATOM 904 CG GLN A 59 -5.243 -11.218 -5.170 1.00 0.00 C ATOM 905 CD GLN A 59 -4.789 -12.139 -4.019 1.00 0.00 C ATOM 906 OE1 GLN A 59 -5.508 -12.631 -3.162 1.00 0.00 O ATOM 907 NE2 GLN A 59 -3.411 -12.364 -3.972 1.00 0.00 N ATOM 0 H GLN A 59 -5.429 -8.682 -4.913 1.00 0.00 H new ATOM 0 HA GLN A 59 -7.411 -9.763 -6.905 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -6.947 -10.643 -4.021 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -7.320 -11.645 -5.410 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -5.078 -11.726 -6.120 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -4.623 -10.321 -5.176 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -2.803 -11.957 -4.683 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -3.013 -12.935 -3.227 1.00 0.00 H new ATOM 916 N ILE A 60 -7.883 -7.663 -4.541 1.00 0.00 N ATOM 917 CA ILE A 60 -8.795 -6.783 -3.768 1.00 0.00 C ATOM 918 C ILE A 60 -9.112 -5.484 -4.511 1.00 0.00 C ATOM 919 O ILE A 60 -9.408 -4.456 -3.935 1.00 0.00 O ATOM 920 CB ILE A 60 -8.258 -6.556 -2.327 1.00 0.00 C ATOM 921 CG1 ILE A 60 -9.420 -6.701 -1.286 1.00 0.00 C ATOM 922 CG2 ILE A 60 -7.557 -5.182 -2.201 1.00 0.00 C ATOM 923 CD1 ILE A 60 -9.154 -6.128 0.098 1.00 0.00 C ATOM 0 H ILE A 60 -6.921 -7.323 -4.551 1.00 0.00 H new ATOM 0 HA ILE A 60 -9.752 -7.295 -3.667 1.00 0.00 H new ATOM 0 HB ILE A 60 -7.511 -7.321 -2.114 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -10.308 -6.217 -1.693 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -9.655 -7.760 -1.180 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -7.192 -5.052 -1.182 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -6.718 -5.136 -2.896 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -8.266 -4.389 -2.436 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -10.027 -6.286 0.731 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -8.291 -6.627 0.539 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -8.954 -5.060 0.017 1.00 0.00 H new ATOM 935 N ALA A 61 -9.067 -5.580 -5.866 1.00 0.00 N ATOM 936 CA ALA A 61 -9.712 -4.639 -6.803 1.00 0.00 C ATOM 937 C ALA A 61 -11.185 -4.362 -6.367 1.00 0.00 C ATOM 938 O ALA A 61 -11.723 -3.297 -6.508 1.00 0.00 O ATOM 939 CB ALA A 61 -9.737 -5.226 -8.220 1.00 0.00 C ATOM 0 H ALA A 61 -8.569 -6.332 -6.342 1.00 0.00 H new ATOM 0 HA ALA A 61 -9.137 -3.713 -6.792 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -10.216 -4.520 -8.898 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -8.717 -5.415 -8.554 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -10.296 -6.162 -8.216 1.00 0.00 H new ATOM 945 N TYR A 62 -11.808 -5.468 -5.863 1.00 0.00 N ATOM 946 CA TYR A 62 -13.249 -5.651 -5.709 1.00 0.00 C ATOM 947 C TYR A 62 -13.733 -5.015 -4.367 1.00 0.00 C ATOM 948 O TYR A 62 -14.865 -5.058 -3.974 1.00 0.00 O ATOM 949 CB TYR A 62 -13.586 -7.181 -5.719 1.00 0.00 C ATOM 950 CG TYR A 62 -12.799 -7.993 -4.693 1.00 0.00 C ATOM 951 CD1 TYR A 62 -12.134 -7.338 -3.634 1.00 0.00 C ATOM 952 CD2 TYR A 62 -12.724 -9.380 -4.874 1.00 0.00 C ATOM 953 CE1 TYR A 62 -11.782 -8.136 -2.509 1.00 0.00 C ATOM 954 CE2 TYR A 62 -12.100 -10.149 -3.880 1.00 0.00 C ATOM 955 CZ TYR A 62 -11.697 -9.527 -2.685 1.00 0.00 C ATOM 956 OH TYR A 62 -11.231 -10.279 -1.656 1.00 0.00 O ATOM 0 H TYR A 62 -11.280 -6.280 -5.545 1.00 0.00 H new ATOM 0 HA TYR A 62 -13.760 -5.159 -6.537 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -14.652 -7.310 -5.530 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -13.388 -7.580 -6.714 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -11.904 -6.284 -3.675 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -13.136 -9.846 -5.757 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -11.586 -7.685 -1.548 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -11.931 -11.205 -4.031 1.00 0.00 H new ATOM 0 HH TYR A 62 -11.227 -11.224 -1.917 1.00 0.00 H new ATOM 966 N MET A 63 -12.707 -4.405 -3.670 1.00 0.00 N ATOM 967 CA MET A 63 -12.881 -3.599 -2.445 1.00 0.00 C ATOM 968 C MET A 63 -12.754 -2.098 -2.753 1.00 0.00 C ATOM 969 O MET A 63 -13.039 -1.232 -1.954 1.00 0.00 O ATOM 970 CB MET A 63 -11.863 -4.027 -1.374 1.00 0.00 C ATOM 971 CG MET A 63 -12.400 -5.213 -0.518 1.00 0.00 C ATOM 972 SD MET A 63 -12.890 -4.759 1.189 1.00 0.00 S ATOM 973 CE MET A 63 -13.935 -6.143 1.609 1.00 0.00 C ATOM 0 H MET A 63 -11.733 -4.473 -3.964 1.00 0.00 H new ATOM 0 HA MET A 63 -13.884 -3.776 -2.057 1.00 0.00 H new ATOM 0 HB2 MET A 63 -10.928 -4.317 -1.854 1.00 0.00 H new ATOM 0 HB3 MET A 63 -11.639 -3.181 -0.725 1.00 0.00 H new ATOM 0 HG2 MET A 63 -13.260 -5.650 -1.025 1.00 0.00 H new ATOM 0 HG3 MET A 63 -11.633 -5.985 -0.469 1.00 0.00 H new ATOM 0 HE1 MET A 63 -14.521 -5.901 2.496 1.00 0.00 H new ATOM 0 HE2 MET A 63 -14.607 -6.357 0.778 1.00 0.00 H new ATOM 0 HE3 MET A 63 -13.317 -7.018 1.810 1.00 0.00 H new ATOM 983 N LEU A 64 -12.219 -1.829 -3.986 1.00 0.00 N ATOM 984 CA LEU A 64 -11.735 -0.549 -4.469 1.00 0.00 C ATOM 985 C LEU A 64 -12.847 0.523 -4.322 1.00 0.00 C ATOM 986 O LEU A 64 -12.514 1.659 -4.035 1.00 0.00 O ATOM 987 CB LEU A 64 -11.317 -0.721 -5.931 1.00 0.00 C ATOM 988 CG LEU A 64 -10.403 0.369 -6.580 1.00 0.00 C ATOM 989 CD1 LEU A 64 -10.950 0.907 -7.921 1.00 0.00 C ATOM 990 CD2 LEU A 64 -10.128 1.510 -5.575 1.00 0.00 C ATOM 0 H LEU A 64 -12.121 -2.561 -4.689 1.00 0.00 H new ATOM 0 HA LEU A 64 -10.877 -0.214 -3.886 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -10.804 -1.679 -6.018 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -12.225 -0.791 -6.529 1.00 0.00 H new ATOM 0 HG LEU A 64 -9.458 -0.115 -6.825 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -10.268 1.659 -8.317 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -11.038 0.087 -8.633 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -11.931 1.355 -7.760 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -9.490 2.261 -6.042 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -11.071 1.969 -5.278 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -9.628 1.107 -4.694 1.00 0.00 H new ATOM 1002 N PRO A 65 -14.116 0.154 -4.542 1.00 0.00 N ATOM 1003 CA PRO A 65 -15.316 1.016 -4.412 1.00 0.00 C ATOM 1004 C PRO A 65 -15.962 1.215 -3.031 1.00 0.00 C ATOM 1005 O PRO A 65 -16.478 2.272 -2.667 1.00 0.00 O ATOM 1006 CB PRO A 65 -16.299 0.477 -5.479 1.00 0.00 C ATOM 1007 CG PRO A 65 -16.053 -1.032 -5.366 1.00 0.00 C ATOM 1008 CD PRO A 65 -14.519 -1.146 -5.187 1.00 0.00 C ATOM 0 HA PRO A 65 -14.999 2.047 -4.568 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -17.333 0.744 -5.260 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -16.076 0.858 -6.476 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -16.587 -1.462 -4.519 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -16.392 -1.560 -6.257 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -14.255 -1.998 -4.561 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -14.017 -1.286 -6.144 1.00 0.00 H new ATOM 1016 N GLU A 66 -15.715 0.179 -2.196 1.00 0.00 N ATOM 1017 CA GLU A 66 -15.947 0.207 -0.743 1.00 0.00 C ATOM 1018 C GLU A 66 -14.800 1.007 -0.034 1.00 0.00 C ATOM 1019 O GLU A 66 -15.078 1.895 0.734 1.00 0.00 O ATOM 1020 CB GLU A 66 -16.061 -1.206 -0.162 1.00 0.00 C ATOM 1021 CG GLU A 66 -15.894 -1.258 1.329 1.00 0.00 C ATOM 1022 CD GLU A 66 -16.721 -2.327 2.067 1.00 0.00 C ATOM 1023 OE1 GLU A 66 -17.884 -2.585 1.618 1.00 0.00 O ATOM 1024 OE2 GLU A 66 -16.180 -2.851 3.072 1.00 0.00 O ATOM 0 H GLU A 66 -15.343 -0.712 -2.524 1.00 0.00 H new ATOM 0 HA GLU A 66 -16.897 0.710 -0.561 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -17.034 -1.620 -0.425 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -15.308 -1.843 -0.626 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -14.840 -1.426 1.550 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -16.153 -0.281 1.737 1.00 0.00 H new ATOM 1031 N ILE A 67 -13.566 0.536 -0.269 1.00 0.00 N ATOM 1032 CA ILE A 67 -12.297 1.204 0.114 1.00 0.00 C ATOM 1033 C ILE A 67 -12.397 2.724 -0.141 1.00 0.00 C ATOM 1034 O ILE A 67 -12.222 3.552 0.754 1.00 0.00 O ATOM 1035 CB ILE A 67 -11.097 0.555 -0.631 1.00 0.00 C ATOM 1036 CG1 ILE A 67 -10.890 -0.914 -0.297 1.00 0.00 C ATOM 1037 CG2 ILE A 67 -9.844 1.434 -0.584 1.00 0.00 C ATOM 1038 CD1 ILE A 67 -9.926 -1.363 0.774 1.00 0.00 C ATOM 0 H ILE A 67 -13.411 -0.351 -0.747 1.00 0.00 H new ATOM 0 HA ILE A 67 -12.122 1.066 1.181 1.00 0.00 H new ATOM 0 HB ILE A 67 -11.361 0.518 -1.688 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -11.867 -1.316 -0.029 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -10.585 -1.406 -1.221 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -9.032 0.939 -1.117 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -10.055 2.394 -1.055 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -9.551 1.595 0.454 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -9.939 -2.451 0.842 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -8.920 -1.027 0.522 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -10.222 -0.936 1.732 1.00 0.00 H new ATOM 1050 N GLN A 68 -12.697 3.044 -1.427 1.00 0.00 N ATOM 1051 CA GLN A 68 -12.593 4.391 -2.027 1.00 0.00 C ATOM 1052 C GLN A 68 -13.934 5.146 -1.931 1.00 0.00 C ATOM 1053 O GLN A 68 -14.090 6.255 -2.405 1.00 0.00 O ATOM 1054 CB GLN A 68 -12.128 4.233 -3.456 1.00 0.00 C ATOM 1055 CG GLN A 68 -12.876 4.982 -4.529 1.00 0.00 C ATOM 1056 CD GLN A 68 -12.288 6.368 -4.864 1.00 0.00 C ATOM 1057 OE1 GLN A 68 -12.762 7.132 -5.749 1.00 0.00 O ATOM 1058 NE2 GLN A 68 -11.203 6.768 -4.169 1.00 0.00 N ATOM 0 H GLN A 68 -13.028 2.345 -2.092 1.00 0.00 H new ATOM 0 HA GLN A 68 -11.868 4.994 -1.480 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -11.082 4.538 -3.503 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -12.162 3.172 -3.703 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -12.889 4.377 -5.436 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -13.912 5.106 -4.214 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -10.806 6.163 -3.450 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -10.779 7.675 -4.363 1.00 0.00 H new ATOM 1067 N ARG A 69 -14.943 4.437 -1.334 1.00 0.00 N ATOM 1068 CA ARG A 69 -16.100 5.078 -0.662 1.00 0.00 C ATOM 1069 C ARG A 69 -15.680 5.840 0.593 1.00 0.00 C ATOM 1070 O ARG A 69 -16.117 6.942 0.909 1.00 0.00 O ATOM 1071 CB ARG A 69 -17.161 4.016 -0.316 1.00 0.00 C ATOM 1072 CG ARG A 69 -18.387 4.107 -1.278 1.00 0.00 C ATOM 1073 CD ARG A 69 -18.963 2.677 -1.496 1.00 0.00 C ATOM 1074 NE ARG A 69 -19.170 2.448 -2.943 1.00 0.00 N ATOM 1075 CZ ARG A 69 -20.125 2.976 -3.723 1.00 0.00 C ATOM 1076 NH1 ARG A 69 -21.063 3.819 -3.240 1.00 0.00 N ATOM 1077 NH2 ARG A 69 -20.160 2.702 -5.047 1.00 0.00 N ATOM 0 H ARG A 69 -14.969 3.418 -1.310 1.00 0.00 H new ATOM 0 HA ARG A 69 -16.527 5.804 -1.354 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -16.718 3.022 -0.380 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -17.493 4.152 0.713 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -19.150 4.761 -0.855 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -18.087 4.542 -2.231 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -18.278 1.931 -1.093 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -19.906 2.567 -0.960 1.00 0.00 H new ATOM 0 HE ARG A 69 -18.512 1.817 -3.399 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -21.060 4.073 -2.252 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -21.774 4.201 -3.863 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -19.457 2.089 -5.460 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -20.890 3.108 -5.633 1.00 0.00 H new ATOM 1091 N LEU A 70 -14.812 5.144 1.399 1.00 0.00 N ATOM 1092 CA LEU A 70 -14.337 5.486 2.730 1.00 0.00 C ATOM 1093 C LEU A 70 -13.109 6.408 2.636 1.00 0.00 C ATOM 1094 O LEU A 70 -12.962 7.327 3.428 1.00 0.00 O ATOM 1095 CB LEU A 70 -13.859 4.109 3.341 1.00 0.00 C ATOM 1096 CG LEU A 70 -14.844 3.365 4.241 1.00 0.00 C ATOM 1097 CD1 LEU A 70 -15.130 1.909 3.891 1.00 0.00 C ATOM 1098 CD2 LEU A 70 -14.688 3.674 5.727 1.00 0.00 C ATOM 0 H LEU A 70 -14.410 4.262 1.082 1.00 0.00 H new ATOM 0 HA LEU A 70 -15.106 5.990 3.316 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -13.590 3.449 2.516 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -12.949 4.291 3.913 1.00 0.00 H new ATOM 0 HG LEU A 70 -15.799 3.818 3.976 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -15.843 1.497 4.605 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -15.548 1.852 2.886 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -14.203 1.336 3.932 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -15.424 3.106 6.296 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -13.685 3.397 6.053 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -14.843 4.740 5.895 1.00 0.00 H new ATOM 1110 N LEU A 71 -12.204 6.132 1.651 1.00 0.00 N ATOM 1111 CA LEU A 71 -11.164 7.035 1.148 1.00 0.00 C ATOM 1112 C LEU A 71 -11.557 7.574 -0.239 1.00 0.00 C ATOM 1113 O LEU A 71 -11.145 7.067 -1.271 1.00 0.00 O ATOM 1114 CB LEU A 71 -9.870 6.171 1.027 1.00 0.00 C ATOM 1115 CG LEU A 71 -9.517 5.216 2.209 1.00 0.00 C ATOM 1116 CD1 LEU A 71 -8.252 4.377 2.007 1.00 0.00 C ATOM 1117 CD2 LEU A 71 -9.542 5.974 3.545 1.00 0.00 C ATOM 0 H LEU A 71 -12.193 5.230 1.175 1.00 0.00 H new ATOM 0 HA LEU A 71 -11.023 7.889 1.811 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -9.954 5.568 0.123 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -9.028 6.848 0.881 1.00 0.00 H new ATOM 0 HG LEU A 71 -10.305 4.463 2.236 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -8.090 3.746 2.881 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -8.369 3.750 1.123 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -7.395 5.037 1.873 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -9.293 5.290 4.356 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -8.813 6.784 3.517 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -10.537 6.386 3.711 1.00 0.00 H new ATOM 1129 N PRO A 72 -12.422 8.625 -0.243 1.00 0.00 N ATOM 1130 CA PRO A 72 -12.769 9.483 -1.393 1.00 0.00 C ATOM 1131 C PRO A 72 -11.655 9.890 -2.421 1.00 0.00 C ATOM 1132 O PRO A 72 -11.646 9.479 -3.557 1.00 0.00 O ATOM 1133 CB PRO A 72 -13.423 10.726 -0.742 1.00 0.00 C ATOM 1134 CG PRO A 72 -14.197 10.105 0.417 1.00 0.00 C ATOM 1135 CD PRO A 72 -13.377 8.909 0.873 1.00 0.00 C ATOM 0 HA PRO A 72 -13.405 8.897 -2.056 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -12.680 11.445 -0.398 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -14.079 11.253 -1.435 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -14.327 10.821 1.228 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -15.194 9.797 0.101 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -12.844 9.129 1.798 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -14.016 8.048 1.070 1.00 0.00 H new ATOM 1143 N ASN A 73 -10.686 10.620 -1.816 1.00 0.00 N ATOM 1144 CA ASN A 73 -9.515 11.187 -2.505 1.00 0.00 C ATOM 1145 C ASN A 73 -8.309 11.245 -1.591 1.00 0.00 C ATOM 1146 O ASN A 73 -7.972 12.320 -1.003 1.00 0.00 O ATOM 1147 CB ASN A 73 -9.842 12.529 -3.192 1.00 0.00 C ATOM 1148 CG ASN A 73 -8.605 13.262 -3.754 1.00 0.00 C ATOM 1149 OD1 ASN A 73 -7.878 12.799 -4.634 1.00 0.00 O ATOM 1150 ND2 ASN A 73 -8.343 14.481 -3.233 1.00 0.00 N ATOM 0 H ASN A 73 -10.703 10.831 -0.818 1.00 0.00 H new ATOM 0 HA ASN A 73 -9.242 10.510 -3.315 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -10.545 12.348 -4.005 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -10.343 13.180 -2.476 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -7.543 15.018 -3.568 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -8.945 14.864 -2.504 1.00 0.00 H new ATOM 1157 N LYS A 74 -7.660 10.102 -1.372 1.00 0.00 N ATOM 1158 CA LYS A 74 -6.338 9.989 -0.691 1.00 0.00 C ATOM 1159 C LYS A 74 -5.563 8.760 -1.202 1.00 0.00 C ATOM 1160 O LYS A 74 -5.970 7.592 -1.054 1.00 0.00 O ATOM 1161 CB LYS A 74 -6.518 9.890 0.832 1.00 0.00 C ATOM 1162 CG LYS A 74 -6.648 11.285 1.459 1.00 0.00 C ATOM 1163 CD LYS A 74 -5.437 11.700 2.329 1.00 0.00 C ATOM 1164 CE LYS A 74 -5.538 11.058 3.712 1.00 0.00 C ATOM 1165 NZ LYS A 74 -5.988 12.020 4.724 1.00 0.00 N ATOM 0 H LYS A 74 -8.034 9.199 -1.664 1.00 0.00 H new ATOM 0 HA LYS A 74 -5.766 10.888 -0.923 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -7.406 9.300 1.060 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -5.667 9.368 1.270 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -6.779 12.019 0.664 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -7.549 11.314 2.071 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -4.510 11.394 1.845 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -5.403 12.785 2.425 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -6.232 10.218 3.674 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -4.566 10.656 3.999 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -6.272 11.511 5.585 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -5.213 12.675 4.949 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -6.799 12.557 4.356 1.00 0.00 H new ATOM 1179 N PRO A 75 -4.428 9.026 -1.871 1.00 0.00 N ATOM 1180 CA PRO A 75 -3.846 8.193 -2.942 1.00 0.00 C ATOM 1181 C PRO A 75 -3.990 6.649 -2.854 1.00 0.00 C ATOM 1182 O PRO A 75 -3.027 5.911 -2.747 1.00 0.00 O ATOM 1183 CB PRO A 75 -2.417 8.622 -3.042 1.00 0.00 C ATOM 1184 CG PRO A 75 -2.309 9.957 -2.415 1.00 0.00 C ATOM 1185 CD PRO A 75 -3.684 10.309 -1.794 1.00 0.00 C ATOM 0 HA PRO A 75 -4.435 8.373 -3.841 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -1.766 7.908 -2.538 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -2.100 8.661 -4.084 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -1.534 9.956 -1.648 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -2.023 10.704 -3.156 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -3.585 10.656 -0.766 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -4.187 11.100 -2.350 1.00 0.00 H new ATOM 1193 N VAL A 76 -5.266 6.234 -3.049 1.00 0.00 N ATOM 1194 CA VAL A 76 -5.683 4.832 -3.083 1.00 0.00 C ATOM 1195 C VAL A 76 -5.322 4.194 -4.449 1.00 0.00 C ATOM 1196 O VAL A 76 -5.308 4.828 -5.485 1.00 0.00 O ATOM 1197 CB VAL A 76 -7.149 4.692 -2.689 1.00 0.00 C ATOM 1198 CG1 VAL A 76 -7.688 3.260 -2.654 1.00 0.00 C ATOM 1199 CG2 VAL A 76 -7.500 5.456 -1.374 1.00 0.00 C ATOM 0 H VAL A 76 -6.039 6.885 -3.188 1.00 0.00 H new ATOM 0 HA VAL A 76 -5.129 4.264 -2.335 1.00 0.00 H new ATOM 0 HB VAL A 76 -7.672 5.174 -3.515 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -8.738 3.274 -2.363 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -7.591 2.811 -3.642 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -7.119 2.675 -1.932 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -8.557 5.319 -1.145 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -6.897 5.065 -0.554 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -7.291 6.518 -1.503 1.00 0.00 H new ATOM 1209 N GLU A 77 -4.960 2.892 -4.382 1.00 0.00 N ATOM 1210 CA GLU A 77 -4.783 2.023 -5.543 1.00 0.00 C ATOM 1211 C GLU A 77 -4.369 0.601 -5.164 1.00 0.00 C ATOM 1212 O GLU A 77 -3.555 0.381 -4.236 1.00 0.00 O ATOM 1213 CB GLU A 77 -3.752 2.646 -6.553 1.00 0.00 C ATOM 1214 CG GLU A 77 -4.129 2.329 -7.997 1.00 0.00 C ATOM 1215 CD GLU A 77 -5.262 3.184 -8.566 1.00 0.00 C ATOM 1216 OE1 GLU A 77 -6.445 2.870 -8.267 1.00 0.00 O ATOM 1217 OE2 GLU A 77 -4.946 4.112 -9.353 1.00 0.00 O ATOM 0 H GLU A 77 -4.782 2.418 -3.497 1.00 0.00 H new ATOM 0 HA GLU A 77 -5.757 1.949 -6.027 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -3.711 3.726 -6.414 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -2.755 2.260 -6.342 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -3.247 2.456 -8.624 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -4.417 1.280 -8.061 1.00 0.00 H new ATOM 1224 N VAL A 78 -5.017 -0.398 -5.791 1.00 0.00 N ATOM 1225 CA VAL A 78 -4.572 -1.798 -5.856 1.00 0.00 C ATOM 1226 C VAL A 78 -3.014 -1.828 -5.978 1.00 0.00 C ATOM 1227 O VAL A 78 -2.433 -1.033 -6.684 1.00 0.00 O ATOM 1228 CB VAL A 78 -5.287 -2.520 -7.014 1.00 0.00 C ATOM 1229 CG1 VAL A 78 -4.602 -3.821 -7.511 1.00 0.00 C ATOM 1230 CG2 VAL A 78 -6.766 -2.828 -6.655 1.00 0.00 C ATOM 0 H VAL A 78 -5.897 -0.244 -6.284 1.00 0.00 H new ATOM 0 HA VAL A 78 -4.838 -2.336 -4.946 1.00 0.00 H new ATOM 0 HB VAL A 78 -5.228 -1.812 -7.840 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -5.184 -4.250 -8.326 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -3.597 -3.591 -7.865 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -4.543 -4.537 -6.691 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -7.245 -3.338 -7.491 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -6.801 -3.467 -5.773 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -7.292 -1.896 -6.449 1.00 0.00 H new ATOM 1240 N ILE A 79 -2.401 -2.708 -5.178 1.00 0.00 N ATOM 1241 CA ILE A 79 -0.988 -3.200 -5.412 1.00 0.00 C ATOM 1242 C ILE A 79 -0.974 -3.968 -6.724 1.00 0.00 C ATOM 1243 O ILE A 79 -2.012 -4.210 -7.356 1.00 0.00 O ATOM 1244 CB ILE A 79 -0.509 -4.021 -4.180 1.00 0.00 C ATOM 1245 CG1 ILE A 79 -0.768 -3.278 -2.836 1.00 0.00 C ATOM 1246 CG2 ILE A 79 0.945 -4.501 -4.334 1.00 0.00 C ATOM 1247 CD1 ILE A 79 -0.888 -4.250 -1.623 1.00 0.00 C ATOM 0 H ILE A 79 -2.843 -3.111 -4.352 1.00 0.00 H new ATOM 0 HA ILE A 79 -0.275 -2.381 -5.508 1.00 0.00 H new ATOM 0 HB ILE A 79 -1.121 -4.922 -4.142 1.00 0.00 H new ATOM 0 HG12 ILE A 79 0.044 -2.574 -2.653 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -1.684 -2.694 -2.920 1.00 0.00 H new ATOM 0 HG21 ILE A 79 1.236 -5.069 -3.451 1.00 0.00 H new ATOM 0 HG22 ILE A 79 1.027 -5.135 -5.217 1.00 0.00 H new ATOM 0 HG23 ILE A 79 1.603 -3.639 -4.444 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -1.068 -3.677 -0.714 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -1.717 -4.938 -1.789 1.00 0.00 H new ATOM 0 HD13 ILE A 79 0.037 -4.816 -1.518 1.00 0.00 H new ATOM 1259 N ASP A 80 0.236 -4.378 -7.184 1.00 0.00 N ATOM 1260 CA ASP A 80 0.503 -5.242 -8.345 1.00 0.00 C ATOM 1261 C ASP A 80 0.649 -6.727 -7.795 1.00 0.00 C ATOM 1262 O ASP A 80 0.975 -6.908 -6.637 1.00 0.00 O ATOM 1263 CB ASP A 80 1.837 -4.864 -8.997 1.00 0.00 C ATOM 1264 CG ASP A 80 1.693 -3.985 -10.270 1.00 0.00 C ATOM 1265 OD1 ASP A 80 1.405 -2.755 -10.034 1.00 0.00 O ATOM 1266 OD2 ASP A 80 1.898 -4.532 -11.376 1.00 0.00 O ATOM 0 H ASP A 80 1.099 -4.092 -6.720 1.00 0.00 H new ATOM 0 HA ASP A 80 -0.300 -5.139 -9.074 1.00 0.00 H new ATOM 0 HB2 ASP A 80 2.448 -4.332 -8.268 1.00 0.00 H new ATOM 0 HB3 ASP A 80 2.374 -5.776 -9.257 1.00 0.00 H new ATOM 1271 N SER A 81 0.173 -7.645 -8.620 1.00 0.00 N ATOM 1272 CA SER A 81 -0.259 -9.031 -8.203 1.00 0.00 C ATOM 1273 C SER A 81 0.985 -9.953 -8.253 1.00 0.00 C ATOM 1274 O SER A 81 1.064 -10.961 -7.507 1.00 0.00 O ATOM 1275 CB SER A 81 -1.282 -9.436 -9.272 1.00 0.00 C ATOM 1276 OG SER A 81 -1.557 -10.786 -9.332 1.00 0.00 O ATOM 0 H SER A 81 0.062 -7.477 -9.620 1.00 0.00 H new ATOM 0 HA SER A 81 -0.680 -9.089 -7.199 1.00 0.00 H new ATOM 0 HB2 SER A 81 -2.212 -8.899 -9.086 1.00 0.00 H new ATOM 0 HB3 SER A 81 -0.916 -9.111 -10.246 1.00 0.00 H new ATOM 0 HG SER A 81 -2.217 -10.954 -10.036 1.00 0.00 H new ATOM 1282 N LEU A 82 1.965 -9.543 -9.045 1.00 0.00 N ATOM 1283 CA LEU A 82 3.306 -10.171 -9.249 1.00 0.00 C ATOM 1284 C LEU A 82 4.298 -9.546 -8.248 1.00 0.00 C ATOM 1285 O LEU A 82 5.059 -10.277 -7.579 1.00 0.00 O ATOM 1286 CB LEU A 82 3.688 -9.710 -10.674 1.00 0.00 C ATOM 1287 CG LEU A 82 5.140 -9.736 -11.150 1.00 0.00 C ATOM 1288 CD1 LEU A 82 6.223 -10.179 -10.173 1.00 0.00 C ATOM 1289 CD2 LEU A 82 5.263 -10.526 -12.517 1.00 0.00 C ATOM 0 H LEU A 82 1.858 -8.703 -9.613 1.00 0.00 H new ATOM 0 HA LEU A 82 3.312 -11.253 -9.118 1.00 0.00 H new ATOM 0 HB2 LEU A 82 3.113 -10.320 -11.371 1.00 0.00 H new ATOM 0 HB3 LEU A 82 3.335 -8.684 -10.782 1.00 0.00 H new ATOM 0 HG LEU A 82 5.362 -8.676 -11.272 1.00 0.00 H new ATOM 0 HD11 LEU A 82 7.195 -10.141 -10.665 1.00 0.00 H new ATOM 0 HD12 LEU A 82 6.228 -9.514 -9.309 1.00 0.00 H new ATOM 0 HD13 LEU A 82 6.022 -11.199 -9.845 1.00 0.00 H new ATOM 0 HD21 LEU A 82 6.304 -10.534 -12.840 1.00 0.00 H new ATOM 0 HD22 LEU A 82 4.919 -11.551 -12.377 1.00 0.00 H new ATOM 0 HD23 LEU A 82 4.651 -10.038 -13.276 1.00 0.00 H new ATOM 1301 N LEU A 83 4.339 -8.189 -8.157 1.00 0.00 N ATOM 1302 CA LEU A 83 5.154 -7.392 -7.230 1.00 0.00 C ATOM 1303 C LEU A 83 4.653 -7.671 -5.791 1.00 0.00 C ATOM 1304 O LEU A 83 5.409 -7.554 -4.849 1.00 0.00 O ATOM 1305 CB LEU A 83 4.891 -5.914 -7.597 1.00 0.00 C ATOM 1306 CG LEU A 83 5.600 -5.278 -8.786 1.00 0.00 C ATOM 1307 CD1 LEU A 83 5.796 -3.744 -8.713 1.00 0.00 C ATOM 1308 CD2 LEU A 83 6.950 -6.015 -9.096 1.00 0.00 C ATOM 0 H LEU A 83 3.770 -7.601 -8.766 1.00 0.00 H new ATOM 0 HA LEU A 83 6.216 -7.629 -7.291 1.00 0.00 H new ATOM 0 HB2 LEU A 83 3.819 -5.810 -7.767 1.00 0.00 H new ATOM 0 HB3 LEU A 83 5.134 -5.316 -6.719 1.00 0.00 H new ATOM 0 HG LEU A 83 4.910 -5.415 -9.619 1.00 0.00 H new ATOM 0 HD11 LEU A 83 6.310 -3.400 -9.610 1.00 0.00 H new ATOM 0 HD12 LEU A 83 4.824 -3.256 -8.642 1.00 0.00 H new ATOM 0 HD13 LEU A 83 6.392 -3.495 -7.835 1.00 0.00 H new ATOM 0 HD21 LEU A 83 7.436 -5.541 -9.949 1.00 0.00 H new ATOM 0 HD22 LEU A 83 7.605 -5.956 -8.227 1.00 0.00 H new ATOM 0 HD23 LEU A 83 6.749 -7.061 -9.328 1.00 0.00 H new ATOM 1320 N TYR A 84 3.333 -7.999 -5.672 1.00 0.00 N ATOM 1321 CA TYR A 84 2.648 -8.354 -4.426 1.00 0.00 C ATOM 1322 C TYR A 84 3.261 -9.649 -3.819 1.00 0.00 C ATOM 1323 O TYR A 84 3.937 -9.663 -2.821 1.00 0.00 O ATOM 1324 CB TYR A 84 1.136 -8.482 -4.589 1.00 0.00 C ATOM 1325 CG TYR A 84 0.300 -8.624 -3.331 1.00 0.00 C ATOM 1326 CD1 TYR A 84 0.506 -7.755 -2.228 1.00 0.00 C ATOM 1327 CD2 TYR A 84 -0.638 -9.662 -3.283 1.00 0.00 C ATOM 1328 CE1 TYR A 84 -0.039 -8.145 -0.974 1.00 0.00 C ATOM 1329 CE2 TYR A 84 -1.383 -9.860 -2.099 1.00 0.00 C ATOM 1330 CZ TYR A 84 -1.004 -9.136 -0.946 1.00 0.00 C ATOM 1331 OH TYR A 84 -1.582 -9.451 0.242 1.00 0.00 O ATOM 0 H TYR A 84 2.709 -8.019 -6.479 1.00 0.00 H new ATOM 0 HA TYR A 84 2.806 -7.529 -3.732 1.00 0.00 H new ATOM 0 HB2 TYR A 84 0.782 -7.604 -5.130 1.00 0.00 H new ATOM 0 HB3 TYR A 84 0.939 -9.347 -5.222 1.00 0.00 H new ATOM 0 HD1 TYR A 84 1.056 -6.832 -2.337 1.00 0.00 H new ATOM 0 HD2 TYR A 84 -0.790 -10.303 -4.139 1.00 0.00 H new ATOM 0 HE1 TYR A 84 0.294 -7.676 -0.060 1.00 0.00 H new ATOM 0 HE2 TYR A 84 -2.218 -10.545 -2.076 1.00 0.00 H new ATOM 0 HH TYR A 84 -2.241 -10.163 0.106 1.00 0.00 H new ATOM 1341 N GLY A 85 2.926 -10.772 -4.516 1.00 0.00 N ATOM 1342 CA GLY A 85 3.244 -12.139 -4.052 1.00 0.00 C ATOM 1343 C GLY A 85 4.711 -12.490 -4.281 1.00 0.00 C ATOM 1344 O GLY A 85 5.190 -13.543 -3.825 1.00 0.00 O ATOM 0 H GLY A 85 2.432 -10.747 -5.408 1.00 0.00 H new ATOM 0 HA2 GLY A 85 3.011 -12.226 -2.991 1.00 0.00 H new ATOM 0 HA3 GLY A 85 2.613 -12.857 -4.576 1.00 0.00 H new ATOM 1348 N LYS A 86 5.421 -11.630 -5.048 1.00 0.00 N ATOM 1349 CA LYS A 86 6.892 -11.645 -5.131 1.00 0.00 C ATOM 1350 C LYS A 86 7.508 -10.633 -4.106 1.00 0.00 C ATOM 1351 O LYS A 86 8.707 -10.526 -3.986 1.00 0.00 O ATOM 1352 CB LYS A 86 7.399 -11.314 -6.544 1.00 0.00 C ATOM 1353 CG LYS A 86 7.093 -12.451 -7.541 1.00 0.00 C ATOM 1354 CD LYS A 86 8.076 -13.606 -7.561 1.00 0.00 C ATOM 1355 CE LYS A 86 7.375 -14.898 -7.163 1.00 0.00 C ATOM 1356 NZ LYS A 86 8.172 -16.079 -7.588 1.00 0.00 N ATOM 0 H LYS A 86 4.987 -10.909 -5.624 1.00 0.00 H new ATOM 0 HA LYS A 86 7.212 -12.658 -4.889 1.00 0.00 H new ATOM 0 HB2 LYS A 86 6.934 -10.391 -6.891 1.00 0.00 H new ATOM 0 HB3 LYS A 86 8.474 -11.137 -6.513 1.00 0.00 H new ATOM 0 HG2 LYS A 86 6.103 -12.847 -7.315 1.00 0.00 H new ATOM 0 HG3 LYS A 86 7.045 -12.025 -8.543 1.00 0.00 H new ATOM 0 HD2 LYS A 86 8.507 -13.709 -8.557 1.00 0.00 H new ATOM 0 HD3 LYS A 86 8.900 -13.404 -6.876 1.00 0.00 H new ATOM 0 HE2 LYS A 86 7.229 -14.921 -6.083 1.00 0.00 H new ATOM 0 HE3 LYS A 86 6.386 -14.937 -7.619 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 7.678 -16.950 -7.308 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 8.290 -16.065 -8.621 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 9.106 -16.049 -7.133 1.00 0.00 H new ATOM 1370 N VAL A 87 6.562 -9.847 -3.488 1.00 0.00 N ATOM 1371 CA VAL A 87 6.914 -9.081 -2.230 1.00 0.00 C ATOM 1372 C VAL A 87 8.279 -8.419 -2.526 1.00 0.00 C ATOM 1373 O VAL A 87 9.313 -8.758 -1.933 1.00 0.00 O ATOM 1374 CB VAL A 87 6.885 -10.063 -1.062 1.00 0.00 C ATOM 1375 CG1 VAL A 87 7.933 -9.810 0.035 1.00 0.00 C ATOM 1376 CG2 VAL A 87 5.517 -10.450 -0.570 1.00 0.00 C ATOM 0 H VAL A 87 5.603 -9.728 -3.814 1.00 0.00 H new ATOM 0 HA VAL A 87 6.220 -8.289 -1.948 1.00 0.00 H new ATOM 0 HB VAL A 87 7.235 -10.986 -1.523 1.00 0.00 H new ATOM 0 HG11 VAL A 87 7.829 -10.561 0.818 1.00 0.00 H new ATOM 0 HG12 VAL A 87 8.932 -9.871 -0.396 1.00 0.00 H new ATOM 0 HG13 VAL A 87 7.782 -8.818 0.461 1.00 0.00 H new ATOM 0 HG21 VAL A 87 5.613 -11.150 0.260 1.00 0.00 H new ATOM 0 HG22 VAL A 87 4.986 -9.560 -0.234 1.00 0.00 H new ATOM 0 HG23 VAL A 87 4.959 -10.921 -1.379 1.00 0.00 H new ATOM 1386 N ASP A 88 8.261 -7.517 -3.527 1.00 0.00 N ATOM 1387 CA ASP A 88 9.355 -6.590 -3.908 1.00 0.00 C ATOM 1388 C ASP A 88 8.948 -5.128 -3.665 1.00 0.00 C ATOM 1389 O ASP A 88 8.137 -4.558 -4.390 1.00 0.00 O ATOM 1390 CB ASP A 88 9.678 -6.831 -5.405 1.00 0.00 C ATOM 1391 CG ASP A 88 10.255 -8.241 -5.677 1.00 0.00 C ATOM 1392 OD1 ASP A 88 11.303 -8.524 -5.042 1.00 0.00 O ATOM 1393 OD2 ASP A 88 9.612 -8.951 -6.500 1.00 0.00 O ATOM 0 H ASP A 88 7.442 -7.406 -4.125 1.00 0.00 H new ATOM 0 HA ASP A 88 10.237 -6.780 -3.296 1.00 0.00 H new ATOM 0 HB2 ASP A 88 8.771 -6.695 -5.994 1.00 0.00 H new ATOM 0 HB3 ASP A 88 10.392 -6.080 -5.743 1.00 0.00 H new ATOM 1398 N GLY A 89 9.420 -4.609 -2.497 1.00 0.00 N ATOM 1399 CA GLY A 89 9.281 -3.183 -2.141 1.00 0.00 C ATOM 1400 C GLY A 89 9.492 -2.218 -3.292 1.00 0.00 C ATOM 1401 O GLY A 89 8.532 -1.632 -3.836 1.00 0.00 O ATOM 0 H GLY A 89 9.900 -5.166 -1.790 1.00 0.00 H new ATOM 0 HA2 GLY A 89 8.286 -3.021 -1.727 1.00 0.00 H new ATOM 0 HA3 GLY A 89 9.996 -2.948 -1.352 1.00 0.00 H new ATOM 1405 N LEU A 90 10.789 -2.022 -3.689 1.00 0.00 N ATOM 1406 CA LEU A 90 11.306 -0.954 -4.558 1.00 0.00 C ATOM 1407 C LEU A 90 10.484 -0.847 -5.830 1.00 0.00 C ATOM 1408 O LEU A 90 10.638 0.154 -6.588 1.00 0.00 O ATOM 1409 CB LEU A 90 12.765 -1.321 -4.884 1.00 0.00 C ATOM 1410 CG LEU A 90 13.086 -2.686 -5.515 1.00 0.00 C ATOM 1411 CD1 LEU A 90 12.403 -2.958 -6.860 1.00 0.00 C ATOM 1412 CD2 LEU A 90 14.658 -2.860 -5.622 1.00 0.00 C ATOM 0 H LEU A 90 11.532 -2.651 -3.384 1.00 0.00 H new ATOM 0 HA LEU A 90 11.247 0.014 -4.061 1.00 0.00 H new ATOM 0 HB2 LEU A 90 13.151 -0.554 -5.555 1.00 0.00 H new ATOM 0 HB3 LEU A 90 13.333 -1.249 -3.957 1.00 0.00 H new ATOM 0 HG LEU A 90 12.664 -3.437 -4.847 1.00 0.00 H new ATOM 0 HD11 LEU A 90 12.693 -3.944 -7.222 1.00 0.00 H new ATOM 0 HD12 LEU A 90 11.321 -2.921 -6.733 1.00 0.00 H new ATOM 0 HD13 LEU A 90 12.709 -2.202 -7.583 1.00 0.00 H new ATOM 0 HD21 LEU A 90 14.887 -3.827 -6.069 1.00 0.00 H new ATOM 0 HD22 LEU A 90 15.070 -2.066 -6.244 1.00 0.00 H new ATOM 0 HD23 LEU A 90 15.099 -2.807 -4.626 1.00 0.00 H new ATOM 1424 N GLY A 91 9.664 -1.860 -6.159 1.00 0.00 N ATOM 1425 CA GLY A 91 8.723 -1.869 -7.299 1.00 0.00 C ATOM 1426 C GLY A 91 7.309 -1.486 -6.931 1.00 0.00 C ATOM 1427 O GLY A 91 6.601 -0.794 -7.717 1.00 0.00 O ATOM 0 H GLY A 91 9.635 -2.726 -5.622 1.00 0.00 H new ATOM 0 HA2 GLY A 91 9.087 -1.182 -8.063 1.00 0.00 H new ATOM 0 HA3 GLY A 91 8.715 -2.865 -7.743 1.00 0.00 H new ATOM 1431 N VAL A 92 6.840 -1.869 -5.727 1.00 0.00 N ATOM 1432 CA VAL A 92 5.721 -1.269 -5.000 1.00 0.00 C ATOM 1433 C VAL A 92 6.018 0.164 -4.529 1.00 0.00 C ATOM 1434 O VAL A 92 5.292 1.119 -4.898 1.00 0.00 O ATOM 1435 CB VAL A 92 5.306 -2.197 -3.817 1.00 0.00 C ATOM 1436 CG1 VAL A 92 4.043 -1.690 -3.064 1.00 0.00 C ATOM 1437 CG2 VAL A 92 5.076 -3.645 -4.314 1.00 0.00 C ATOM 0 H VAL A 92 7.258 -2.646 -5.215 1.00 0.00 H new ATOM 0 HA VAL A 92 4.881 -1.180 -5.689 1.00 0.00 H new ATOM 0 HB VAL A 92 6.133 -2.180 -3.108 1.00 0.00 H new ATOM 0 HG11 VAL A 92 3.803 -2.377 -2.252 1.00 0.00 H new ATOM 0 HG12 VAL A 92 4.237 -0.698 -2.655 1.00 0.00 H new ATOM 0 HG13 VAL A 92 3.203 -1.639 -3.756 1.00 0.00 H new ATOM 0 HG21 VAL A 92 4.787 -4.277 -3.474 1.00 0.00 H new ATOM 0 HG22 VAL A 92 4.283 -3.651 -5.062 1.00 0.00 H new ATOM 0 HG23 VAL A 92 5.995 -4.028 -4.757 1.00 0.00 H new ATOM 1447 N LEU A 93 6.971 0.322 -3.583 1.00 0.00 N ATOM 1448 CA LEU A 93 7.534 1.605 -3.135 1.00 0.00 C ATOM 1449 C LEU A 93 7.656 2.579 -4.320 1.00 0.00 C ATOM 1450 O LEU A 93 7.133 3.685 -4.275 1.00 0.00 O ATOM 1451 CB LEU A 93 8.902 1.306 -2.506 1.00 0.00 C ATOM 1452 CG LEU A 93 9.499 2.215 -1.460 1.00 0.00 C ATOM 1453 CD1 LEU A 93 9.427 1.716 -0.006 1.00 0.00 C ATOM 1454 CD2 LEU A 93 10.902 2.765 -1.808 1.00 0.00 C ATOM 0 H LEU A 93 7.381 -0.474 -3.095 1.00 0.00 H new ATOM 0 HA LEU A 93 6.886 2.084 -2.401 1.00 0.00 H new ATOM 0 HB2 LEU A 93 8.838 0.312 -2.064 1.00 0.00 H new ATOM 0 HB3 LEU A 93 9.621 1.246 -3.323 1.00 0.00 H new ATOM 0 HG LEU A 93 8.811 3.060 -1.499 1.00 0.00 H new ATOM 0 HD11 LEU A 93 9.887 2.451 0.654 1.00 0.00 H new ATOM 0 HD12 LEU A 93 8.384 1.574 0.279 1.00 0.00 H new ATOM 0 HD13 LEU A 93 9.959 0.769 0.080 1.00 0.00 H new ATOM 0 HD21 LEU A 93 11.252 3.408 -1.000 1.00 0.00 H new ATOM 0 HD22 LEU A 93 11.596 1.935 -1.938 1.00 0.00 H new ATOM 0 HD23 LEU A 93 10.848 3.341 -2.732 1.00 0.00 H new ATOM 1466 N LYS A 94 8.393 2.181 -5.380 1.00 0.00 N ATOM 1467 CA LYS A 94 8.352 2.860 -6.701 1.00 0.00 C ATOM 1468 C LYS A 94 6.936 3.105 -7.215 1.00 0.00 C ATOM 1469 O LYS A 94 6.559 4.228 -7.539 1.00 0.00 O ATOM 1470 CB LYS A 94 9.208 2.097 -7.740 1.00 0.00 C ATOM 1471 CG LYS A 94 9.741 3.050 -8.818 1.00 0.00 C ATOM 1472 CD LYS A 94 10.151 2.325 -10.125 1.00 0.00 C ATOM 1473 CE LYS A 94 8.904 2.226 -11.037 1.00 0.00 C ATOM 1474 NZ LYS A 94 9.220 1.372 -12.213 1.00 0.00 N ATOM 0 H LYS A 94 9.030 1.385 -5.348 1.00 0.00 H new ATOM 0 HA LYS A 94 8.786 3.848 -6.552 1.00 0.00 H new ATOM 0 HB2 LYS A 94 10.042 1.606 -7.239 1.00 0.00 H new ATOM 0 HB3 LYS A 94 8.609 1.314 -8.205 1.00 0.00 H new ATOM 0 HG2 LYS A 94 8.977 3.793 -9.047 1.00 0.00 H new ATOM 0 HG3 LYS A 94 10.602 3.589 -8.424 1.00 0.00 H new ATOM 0 HD2 LYS A 94 10.948 2.872 -10.629 1.00 0.00 H new ATOM 0 HD3 LYS A 94 10.539 1.331 -9.902 1.00 0.00 H new ATOM 0 HE2 LYS A 94 8.066 1.804 -10.482 1.00 0.00 H new ATOM 0 HE3 LYS A 94 8.600 3.220 -11.366 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 8.384 1.304 -12.827 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 10.008 1.793 -12.746 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 9.490 0.421 -11.889 1.00 0.00 H new ATOM 1488 N ALA A 95 6.146 2.008 -7.337 1.00 0.00 N ATOM 1489 CA ALA A 95 4.830 1.985 -7.984 1.00 0.00 C ATOM 1490 C ALA A 95 3.792 2.834 -7.243 1.00 0.00 C ATOM 1491 O ALA A 95 2.773 3.237 -7.809 1.00 0.00 O ATOM 1492 CB ALA A 95 4.327 0.554 -8.182 1.00 0.00 C ATOM 0 H ALA A 95 6.424 1.096 -6.975 1.00 0.00 H new ATOM 0 HA ALA A 95 4.965 2.437 -8.967 1.00 0.00 H new ATOM 0 HB1 ALA A 95 3.350 0.575 -8.664 1.00 0.00 H new ATOM 0 HB2 ALA A 95 5.029 0.005 -8.810 1.00 0.00 H new ATOM 0 HB3 ALA A 95 4.243 0.060 -7.214 1.00 0.00 H new ATOM 1498 N ALA A 96 4.059 3.101 -5.955 1.00 0.00 N ATOM 1499 CA ALA A 96 3.267 3.983 -5.074 1.00 0.00 C ATOM 1500 C ALA A 96 3.693 5.443 -5.204 1.00 0.00 C ATOM 1501 O ALA A 96 2.872 6.368 -5.107 1.00 0.00 O ATOM 1502 CB ALA A 96 3.399 3.535 -3.591 1.00 0.00 C ATOM 0 H ALA A 96 4.863 2.694 -5.477 1.00 0.00 H new ATOM 0 HA ALA A 96 2.227 3.901 -5.389 1.00 0.00 H new ATOM 0 HB1 ALA A 96 2.809 4.197 -2.957 1.00 0.00 H new ATOM 0 HB2 ALA A 96 3.036 2.513 -3.486 1.00 0.00 H new ATOM 0 HB3 ALA A 96 4.445 3.581 -3.289 1.00 0.00 H new ATOM 1508 N VAL A 97 5.027 5.665 -5.365 1.00 0.00 N ATOM 1509 CA VAL A 97 5.659 6.950 -5.624 1.00 0.00 C ATOM 1510 C VAL A 97 5.317 7.400 -7.082 1.00 0.00 C ATOM 1511 O VAL A 97 5.061 8.586 -7.348 1.00 0.00 O ATOM 1512 CB VAL A 97 7.180 6.885 -5.353 1.00 0.00 C ATOM 1513 CG1 VAL A 97 7.978 8.118 -5.833 1.00 0.00 C ATOM 1514 CG2 VAL A 97 7.494 6.581 -3.870 1.00 0.00 C ATOM 0 H VAL A 97 5.705 4.905 -5.312 1.00 0.00 H new ATOM 0 HA VAL A 97 5.268 7.703 -4.940 1.00 0.00 H new ATOM 0 HB VAL A 97 7.522 6.051 -5.966 1.00 0.00 H new ATOM 0 HG11 VAL A 97 9.034 7.981 -5.600 1.00 0.00 H new ATOM 0 HG12 VAL A 97 7.856 8.234 -6.910 1.00 0.00 H new ATOM 0 HG13 VAL A 97 7.608 9.010 -5.328 1.00 0.00 H new ATOM 0 HG21 VAL A 97 8.574 6.545 -3.727 1.00 0.00 H new ATOM 0 HG22 VAL A 97 7.070 7.364 -3.241 1.00 0.00 H new ATOM 0 HG23 VAL A 97 7.059 5.620 -3.596 1.00 0.00 H new ATOM 1524 N ALA A 98 5.367 6.440 -8.008 1.00 0.00 N ATOM 1525 CA ALA A 98 5.031 6.625 -9.437 1.00 0.00 C ATOM 1526 C ALA A 98 3.496 6.667 -9.639 1.00 0.00 C ATOM 1527 O ALA A 98 3.023 7.213 -10.644 1.00 0.00 O ATOM 1528 CB ALA A 98 5.588 5.459 -10.272 1.00 0.00 C ATOM 0 H ALA A 98 5.649 5.485 -7.788 1.00 0.00 H new ATOM 0 HA ALA A 98 5.474 7.567 -9.759 1.00 0.00 H new ATOM 0 HB1 ALA A 98 5.333 5.609 -11.321 1.00 0.00 H new ATOM 0 HB2 ALA A 98 6.672 5.419 -10.164 1.00 0.00 H new ATOM 0 HB3 ALA A 98 5.154 4.522 -9.923 1.00 0.00 H new ATOM 1534 N ALA A 99 2.760 6.024 -8.724 1.00 0.00 N ATOM 1535 CA ALA A 99 1.326 6.176 -8.524 1.00 0.00 C ATOM 1536 C ALA A 99 0.962 7.537 -7.919 1.00 0.00 C ATOM 1537 O ALA A 99 -0.128 8.078 -8.167 1.00 0.00 O ATOM 1538 CB ALA A 99 0.787 5.067 -7.570 1.00 0.00 C ATOM 0 H ALA A 99 3.174 5.354 -8.076 1.00 0.00 H new ATOM 0 HA ALA A 99 0.870 6.094 -9.511 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -0.286 5.196 -7.432 1.00 0.00 H new ATOM 0 HB2 ALA A 99 0.982 4.087 -8.005 1.00 0.00 H new ATOM 0 HB3 ALA A 99 1.289 5.142 -6.605 1.00 0.00 H new ATOM 1544 N ILE A 100 1.883 8.102 -7.137 1.00 0.00 N ATOM 1545 CA ILE A 100 1.819 9.432 -6.503 1.00 0.00 C ATOM 1546 C ILE A 100 1.687 10.534 -7.603 1.00 0.00 C ATOM 1547 O ILE A 100 0.753 11.264 -7.671 1.00 0.00 O ATOM 1548 CB ILE A 100 2.986 9.667 -5.526 1.00 0.00 C ATOM 1549 CG1 ILE A 100 2.582 9.496 -4.055 1.00 0.00 C ATOM 1550 CG2 ILE A 100 3.736 11.012 -5.779 1.00 0.00 C ATOM 1551 CD1 ILE A 100 3.655 9.809 -3.007 1.00 0.00 C ATOM 0 H ILE A 100 2.751 7.617 -6.911 1.00 0.00 H new ATOM 0 HA ILE A 100 0.926 9.487 -5.881 1.00 0.00 H new ATOM 0 HB ILE A 100 3.703 8.874 -5.741 1.00 0.00 H new ATOM 0 HG12 ILE A 100 1.721 10.136 -3.862 1.00 0.00 H new ATOM 0 HG13 ILE A 100 2.254 8.467 -3.909 1.00 0.00 H new ATOM 0 HG21 ILE A 100 4.547 11.118 -5.058 1.00 0.00 H new ATOM 0 HG22 ILE A 100 4.146 11.016 -6.789 1.00 0.00 H new ATOM 0 HG23 ILE A 100 3.040 11.843 -5.667 1.00 0.00 H new ATOM 0 HD11 ILE A 100 3.246 9.650 -2.009 1.00 0.00 H new ATOM 0 HD12 ILE A 100 4.512 9.153 -3.157 1.00 0.00 H new ATOM 0 HD13 ILE A 100 3.971 10.847 -3.109 1.00 0.00 H new ATOM 1563 N LYS A 101 2.794 10.595 -8.415 1.00 0.00 N ATOM 1564 CA LYS A 101 2.804 11.377 -9.664 1.00 0.00 C ATOM 1565 C LYS A 101 1.637 10.984 -10.598 1.00 0.00 C ATOM 1566 O LYS A 101 0.934 11.855 -11.118 1.00 0.00 O ATOM 1567 CB LYS A 101 4.143 11.245 -10.397 1.00 0.00 C ATOM 1568 CG LYS A 101 4.022 11.705 -11.868 1.00 0.00 C ATOM 1569 CD LYS A 101 5.359 12.148 -12.488 1.00 0.00 C ATOM 1570 CE LYS A 101 5.055 12.986 -13.748 1.00 0.00 C ATOM 1571 NZ LYS A 101 5.298 12.200 -14.981 1.00 0.00 N ATOM 0 H LYS A 101 3.671 10.113 -8.216 1.00 0.00 H new ATOM 0 HA LYS A 101 2.670 12.421 -9.382 1.00 0.00 H new ATOM 0 HB2 LYS A 101 4.900 11.841 -9.888 1.00 0.00 H new ATOM 0 HB3 LYS A 101 4.478 10.208 -10.364 1.00 0.00 H new ATOM 0 HG2 LYS A 101 3.608 10.890 -12.462 1.00 0.00 H new ATOM 0 HG3 LYS A 101 3.314 12.532 -11.924 1.00 0.00 H new ATOM 0 HD2 LYS A 101 5.934 12.735 -11.771 1.00 0.00 H new ATOM 0 HD3 LYS A 101 5.964 11.279 -12.747 1.00 0.00 H new ATOM 0 HE2 LYS A 101 4.018 13.321 -13.725 1.00 0.00 H new ATOM 0 HE3 LYS A 101 5.679 13.880 -13.754 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 5.086 12.786 -15.814 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 6.294 11.902 -15.012 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 4.685 11.360 -14.984 1.00 0.00 H new ATOM 1585 N LYS A 102 1.501 9.657 -10.846 1.00 0.00 N ATOM 1586 CA LYS A 102 0.579 9.104 -11.856 1.00 0.00 C ATOM 1587 C LYS A 102 -0.900 9.307 -11.526 1.00 0.00 C ATOM 1588 O LYS A 102 -1.771 9.251 -12.418 1.00 0.00 O ATOM 1589 CB LYS A 102 0.907 7.659 -12.219 1.00 0.00 C ATOM 1590 CG LYS A 102 1.375 7.533 -13.677 1.00 0.00 C ATOM 1591 CD LYS A 102 0.342 8.042 -14.723 1.00 0.00 C ATOM 1592 CE LYS A 102 0.267 6.951 -15.849 1.00 0.00 C ATOM 1593 NZ LYS A 102 -1.081 6.957 -16.445 1.00 0.00 N ATOM 0 H LYS A 102 2.032 8.943 -10.347 1.00 0.00 H new ATOM 0 HA LYS A 102 0.751 9.699 -12.753 1.00 0.00 H new ATOM 0 HB2 LYS A 102 1.684 7.284 -11.553 1.00 0.00 H new ATOM 0 HB3 LYS A 102 0.026 7.036 -12.064 1.00 0.00 H new ATOM 0 HG2 LYS A 102 2.304 8.091 -13.799 1.00 0.00 H new ATOM 0 HG3 LYS A 102 1.602 6.487 -13.885 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -0.635 8.191 -14.262 1.00 0.00 H new ATOM 0 HD3 LYS A 102 0.650 9.003 -15.135 1.00 0.00 H new ATOM 0 HE2 LYS A 102 1.016 7.150 -16.615 1.00 0.00 H new ATOM 0 HE3 LYS A 102 0.489 5.968 -15.434 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -1.134 6.235 -17.192 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -1.786 6.747 -15.710 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -1.275 7.893 -16.854 1.00 0.00 H new ATOM 1607 N ALA A 103 -1.201 9.494 -10.229 1.00 0.00 N ATOM 1608 CA ALA A 103 -2.535 9.770 -9.681 1.00 0.00 C ATOM 1609 C ALA A 103 -2.850 11.276 -9.621 1.00 0.00 C ATOM 1610 O ALA A 103 -3.987 11.665 -9.351 1.00 0.00 O ATOM 1611 CB ALA A 103 -2.709 9.117 -8.306 1.00 0.00 C ATOM 0 H ALA A 103 -0.486 9.454 -9.503 1.00 0.00 H new ATOM 0 HA ALA A 103 -3.255 9.326 -10.368 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -3.705 9.337 -7.922 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -2.585 8.038 -8.397 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -1.960 9.511 -7.619 1.00 0.00 H new ATOM 1617 N ALA A 104 -1.812 12.110 -9.834 1.00 0.00 N ATOM 1618 CA ALA A 104 -1.917 13.563 -10.056 1.00 0.00 C ATOM 1619 C ALA A 104 -0.526 14.214 -10.169 1.00 0.00 C ATOM 1620 O ALA A 104 0.338 14.038 -9.331 1.00 0.00 O ATOM 1621 CB ALA A 104 -2.730 14.215 -8.916 1.00 0.00 C ATOM 0 H ALA A 104 -0.848 11.778 -9.857 1.00 0.00 H new ATOM 0 HA ALA A 104 -2.436 13.726 -11.000 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -2.802 15.289 -9.089 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -3.731 13.784 -8.890 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -2.232 14.033 -7.964 1.00 0.00 H new ATOM 1627 N ALA A 105 -0.312 14.921 -11.318 1.00 0.00 N ATOM 1628 CA ALA A 105 0.896 15.711 -11.586 1.00 0.00 C ATOM 1629 C ALA A 105 0.669 17.209 -11.287 1.00 0.00 C ATOM 1630 O ALA A 105 -0.402 17.748 -11.477 1.00 0.00 O ATOM 1631 CB ALA A 105 1.323 15.562 -13.069 1.00 0.00 C ATOM 0 H ALA A 105 -0.988 14.949 -12.081 1.00 0.00 H new ATOM 0 HA ALA A 105 1.680 15.332 -10.931 1.00 0.00 H new ATOM 0 HB1 ALA A 105 2.220 16.154 -13.251 1.00 0.00 H new ATOM 0 HB2 ALA A 105 1.530 14.514 -13.284 1.00 0.00 H new ATOM 0 HB3 ALA A 105 0.519 15.913 -13.716 1.00 0.00 H new ATOM 1637 N ASN A 106 1.753 17.855 -10.759 1.00 0.00 N ATOM 1638 CA ASN A 106 1.915 19.328 -10.757 1.00 0.00 C ATOM 1639 C ASN A 106 2.846 19.732 -9.570 1.00 0.00 C ATOM 1640 O ASN A 106 3.082 18.872 -8.678 1.00 0.00 O ATOM 1641 CB ASN A 106 0.556 20.024 -10.646 1.00 0.00 C ATOM 1642 CG ASN A 106 0.617 21.412 -9.965 1.00 0.00 C ATOM 1643 OD1 ASN A 106 1.231 22.382 -10.466 1.00 0.00 O ATOM 1644 ND2 ASN A 106 0.022 21.550 -8.770 1.00 0.00 N ATOM 0 H ASN A 106 2.533 17.362 -10.325 1.00 0.00 H new ATOM 0 HA ASN A 106 2.368 19.645 -11.696 1.00 0.00 H new ATOM 0 HB2 ASN A 106 0.135 20.138 -11.645 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -0.124 19.384 -10.084 1.00 0.00 H new ATOM 0 HD21 ASN A 106 0.071 22.441 -8.276 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -0.480 20.764 -8.356 1.00 0.00 H new TER 1651 ASN A 106