USER MOD reduce.3.24.130724 H: found=0, std=0, add=844, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 841 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 Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 170:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 MET CE :methyl -123:sc= -4.45 (180deg=-7.99!) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 THR OG1 : rot 20:sc= 1.37 USER MOD Single : A 38 LYS NZ :NH3+ 177:sc= -0.251 (180deg=-0.269) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 ASN : amide:sc= -1.2 K(o=-1.2,f=-2.6!) USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 43 CYS SG : rot 78:sc= 1.07 USER MOD Single : A 44 GLN : amide:sc= -0.312 K(o=-0.31,f=-2.2!) USER MOD Single : A 45 MET CE :methyl 157:sc= -7.47! (180deg=-8.67!) USER MOD Single : A 46 SER OG : rot -72:sc= -0.501 USER MOD Single : A 48 GLN : amide:sc= -0.162 X(o=-0.16,f=-0.13) USER MOD Single : A 51 GLN : amide:sc= -0.0131 K(o=-0.013,f=-1.1) USER MOD Single : A 52 THR OG1 : rot 139:sc= -0.621! USER MOD Single : A 53 THR OG1 : rot -37:sc= -0.0796 USER MOD Single : A 60 ASN : amide:sc= -0.446 X(o=-0.45,f=-0.082) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 HIS :FLIP no HD1:sc= -2.21! C(o=-4.7!,f=-2.2!) USER MOD Single : A 66 CYS SG : rot 90:sc= -3.76 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 76 LYS NZ :NH3+ 161:sc= 0 (180deg=-0.461) USER MOD Single : A 80 LYS NZ :NH3+ -164:sc= -0.103 (180deg=-0.517) USER MOD Single : A 81 ASN : amide:sc= -1.38 K(o=-1.4,f=-2.6!) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 SER OG : rot 96:sc= 0.0211 USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 THR OG1 : rot 180:sc= -0.0365 USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 36:sc= 0.603 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -2.047 -11.667 -16.321 1.00 0.00 N ATOM 2 CA GLY A 1 -1.718 -12.579 -15.239 1.00 0.00 C ATOM 3 C GLY A 1 -2.877 -13.537 -14.957 1.00 0.00 C ATOM 4 O GLY A 1 -2.858 -14.686 -15.395 1.00 0.00 O ATOM 0 H1 GLY A 1 -1.245 -11.028 -16.492 1.00 0.00 H new ATOM 0 H2 GLY A 1 -2.247 -12.211 -17.185 1.00 0.00 H new ATOM 0 H3 GLY A 1 -2.885 -11.108 -16.062 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -0.825 -13.149 -15.498 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -1.484 -12.011 -14.339 1.00 0.00 H new ATOM 8 N SER A 2 -3.859 -13.028 -14.227 1.00 0.00 N ATOM 9 CA SER A 2 -5.025 -13.824 -13.882 1.00 0.00 C ATOM 10 C SER A 2 -6.299 -13.108 -14.332 1.00 0.00 C ATOM 11 O SER A 2 -6.394 -11.885 -14.241 1.00 0.00 O ATOM 12 CB SER A 2 -5.075 -14.103 -12.379 1.00 0.00 C ATOM 13 OG SER A 2 -5.899 -15.224 -12.071 1.00 0.00 O ATOM 0 H SER A 2 -3.871 -12.074 -13.865 1.00 0.00 H new ATOM 0 HA SER A 2 -4.952 -14.781 -14.400 1.00 0.00 H new ATOM 0 HB2 SER A 2 -4.065 -14.283 -12.010 1.00 0.00 H new ATOM 0 HB3 SER A 2 -5.452 -13.222 -11.859 1.00 0.00 H new ATOM 0 HG SER A 2 -5.779 -15.469 -11.130 1.00 0.00 H new ATOM 19 N SER A 3 -7.249 -13.900 -14.808 1.00 0.00 N ATOM 20 CA SER A 3 -8.514 -13.357 -15.272 1.00 0.00 C ATOM 21 C SER A 3 -9.471 -13.177 -14.092 1.00 0.00 C ATOM 22 O SER A 3 -9.684 -14.106 -13.315 1.00 0.00 O ATOM 23 CB SER A 3 -9.144 -14.260 -16.334 1.00 0.00 C ATOM 24 OG SER A 3 -8.972 -13.738 -17.649 1.00 0.00 O ATOM 0 H SER A 3 -7.168 -14.914 -14.882 1.00 0.00 H new ATOM 0 HA SER A 3 -8.323 -12.385 -15.727 1.00 0.00 H new ATOM 0 HB2 SER A 3 -8.698 -15.253 -16.277 1.00 0.00 H new ATOM 0 HB3 SER A 3 -10.208 -14.376 -16.126 1.00 0.00 H new ATOM 0 HG SER A 3 -9.386 -14.344 -18.298 1.00 0.00 H new ATOM 30 N GLY A 4 -10.022 -11.976 -13.995 1.00 0.00 N ATOM 31 CA GLY A 4 -10.951 -11.663 -12.923 1.00 0.00 C ATOM 32 C GLY A 4 -10.348 -12.002 -11.559 1.00 0.00 C ATOM 33 O GLY A 4 -10.489 -13.124 -11.075 1.00 0.00 O ATOM 0 H GLY A 4 -9.843 -11.208 -14.642 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -11.209 -10.604 -12.958 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -11.876 -12.221 -13.064 1.00 0.00 H new ATOM 37 N SER A 5 -9.689 -11.011 -10.976 1.00 0.00 N ATOM 38 CA SER A 5 -9.063 -11.190 -9.677 1.00 0.00 C ATOM 39 C SER A 5 -8.166 -12.429 -9.694 1.00 0.00 C ATOM 40 O SER A 5 -8.028 -13.086 -10.725 1.00 0.00 O ATOM 41 CB SER A 5 -10.115 -11.312 -8.572 1.00 0.00 C ATOM 42 OG SER A 5 -10.646 -10.044 -8.198 1.00 0.00 O ATOM 0 H SER A 5 -9.575 -10.081 -11.380 1.00 0.00 H new ATOM 0 HA SER A 5 -8.453 -10.311 -9.467 1.00 0.00 H new ATOM 0 HB2 SER A 5 -10.924 -11.958 -8.912 1.00 0.00 H new ATOM 0 HB3 SER A 5 -9.670 -11.790 -7.699 1.00 0.00 H new ATOM 0 HG SER A 5 -11.315 -10.165 -7.492 1.00 0.00 H new ATOM 48 N SER A 6 -7.577 -12.710 -8.541 1.00 0.00 N ATOM 49 CA SER A 6 -6.696 -13.858 -8.411 1.00 0.00 C ATOM 50 C SER A 6 -7.396 -14.969 -7.625 1.00 0.00 C ATOM 51 O SER A 6 -7.727 -16.015 -8.181 1.00 0.00 O ATOM 52 CB SER A 6 -5.384 -13.471 -7.727 1.00 0.00 C ATOM 53 OG SER A 6 -4.312 -13.351 -8.658 1.00 0.00 O ATOM 0 H SER A 6 -7.693 -12.162 -7.688 1.00 0.00 H new ATOM 0 HA SER A 6 -6.460 -14.222 -9.411 1.00 0.00 H new ATOM 0 HB2 SER A 6 -5.515 -12.525 -7.201 1.00 0.00 H new ATOM 0 HB3 SER A 6 -5.131 -14.221 -6.977 1.00 0.00 H new ATOM 0 HG SER A 6 -3.492 -13.101 -8.183 1.00 0.00 H new ATOM 59 N GLY A 7 -7.602 -14.703 -6.343 1.00 0.00 N ATOM 60 CA GLY A 7 -8.257 -15.667 -5.475 1.00 0.00 C ATOM 61 C GLY A 7 -9.485 -15.052 -4.801 1.00 0.00 C ATOM 62 O GLY A 7 -10.552 -14.967 -5.406 1.00 0.00 O ATOM 0 H GLY A 7 -7.327 -13.834 -5.885 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -8.555 -16.540 -6.055 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -7.556 -16.013 -4.716 1.00 0.00 H new ATOM 66 N MET A 8 -9.293 -14.639 -3.557 1.00 0.00 N ATOM 67 CA MET A 8 -10.371 -14.034 -2.794 1.00 0.00 C ATOM 68 C MET A 8 -10.798 -12.700 -3.410 1.00 0.00 C ATOM 69 O MET A 8 -11.953 -12.534 -3.801 1.00 0.00 O ATOM 70 CB MET A 8 -9.913 -13.807 -1.352 1.00 0.00 C ATOM 71 CG MET A 8 -11.104 -13.800 -0.392 1.00 0.00 C ATOM 72 SD MET A 8 -10.573 -14.282 1.242 1.00 0.00 S ATOM 73 CE MET A 8 -10.772 -16.052 1.124 1.00 0.00 C ATOM 0 H MET A 8 -8.406 -14.712 -3.058 1.00 0.00 H new ATOM 0 HA MET A 8 -11.225 -14.711 -2.810 1.00 0.00 H new ATOM 0 HB2 MET A 8 -9.212 -14.590 -1.062 1.00 0.00 H new ATOM 0 HB3 MET A 8 -9.379 -12.859 -1.281 1.00 0.00 H new ATOM 0 HG2 MET A 8 -11.550 -12.806 -0.360 1.00 0.00 H new ATOM 0 HG3 MET A 8 -11.874 -14.484 -0.750 1.00 0.00 H new ATOM 0 HE1 MET A 8 -10.482 -16.514 2.067 1.00 0.00 H new ATOM 0 HE2 MET A 8 -11.815 -16.287 0.910 1.00 0.00 H new ATOM 0 HE3 MET A 8 -10.141 -16.436 0.322 1.00 0.00 H new ATOM 83 N GLY A 9 -9.843 -11.784 -3.479 1.00 0.00 N ATOM 84 CA GLY A 9 -10.106 -10.470 -4.041 1.00 0.00 C ATOM 85 C GLY A 9 -9.211 -9.410 -3.396 1.00 0.00 C ATOM 86 O GLY A 9 -9.587 -8.800 -2.396 1.00 0.00 O ATOM 0 H GLY A 9 -8.886 -11.926 -3.155 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -9.935 -10.490 -5.117 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -11.153 -10.208 -3.889 1.00 0.00 H new ATOM 90 N LEU A 10 -8.045 -9.221 -3.996 1.00 0.00 N ATOM 91 CA LEU A 10 -7.094 -8.245 -3.492 1.00 0.00 C ATOM 92 C LEU A 10 -6.543 -7.426 -4.662 1.00 0.00 C ATOM 93 O LEU A 10 -6.669 -6.202 -4.681 1.00 0.00 O ATOM 94 CB LEU A 10 -6.010 -8.932 -2.659 1.00 0.00 C ATOM 95 CG LEU A 10 -4.998 -8.007 -1.980 1.00 0.00 C ATOM 96 CD1 LEU A 10 -5.295 -7.872 -0.486 1.00 0.00 C ATOM 97 CD2 LEU A 10 -3.565 -8.476 -2.241 1.00 0.00 C ATOM 0 H LEU A 10 -7.737 -9.727 -4.826 1.00 0.00 H new ATOM 0 HA LEU A 10 -7.588 -7.547 -2.816 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -6.497 -9.532 -1.890 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -5.466 -9.621 -3.305 1.00 0.00 H new ATOM 0 HG LEU A 10 -5.096 -7.014 -2.418 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -4.561 -7.209 -0.028 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -6.294 -7.457 -0.350 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -5.242 -8.853 -0.014 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -2.866 -7.801 -1.747 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -3.435 -9.484 -1.848 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -3.372 -8.477 -3.314 1.00 0.00 H new ATOM 109 N GLU A 11 -5.944 -8.134 -5.608 1.00 0.00 N ATOM 110 CA GLU A 11 -5.374 -7.488 -6.778 1.00 0.00 C ATOM 111 C GLU A 11 -6.275 -6.343 -7.245 1.00 0.00 C ATOM 112 O GLU A 11 -5.794 -5.351 -7.789 1.00 0.00 O ATOM 113 CB GLU A 11 -5.143 -8.497 -7.904 1.00 0.00 C ATOM 114 CG GLU A 11 -4.528 -7.820 -9.130 1.00 0.00 C ATOM 115 CD GLU A 11 -3.551 -8.758 -9.843 1.00 0.00 C ATOM 116 OE1 GLU A 11 -3.917 -9.943 -10.003 1.00 0.00 O ATOM 117 OE2 GLU A 11 -2.461 -8.270 -10.210 1.00 0.00 O ATOM 0 H GLU A 11 -5.841 -9.149 -5.588 1.00 0.00 H new ATOM 0 HA GLU A 11 -4.405 -7.072 -6.502 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -4.484 -9.292 -7.555 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -6.089 -8.964 -8.178 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -5.318 -7.520 -9.819 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -4.009 -6.911 -8.826 1.00 0.00 H new ATOM 124 N GLU A 12 -7.568 -6.519 -7.014 1.00 0.00 N ATOM 125 CA GLU A 12 -8.542 -5.513 -7.404 1.00 0.00 C ATOM 126 C GLU A 12 -8.521 -4.344 -6.418 1.00 0.00 C ATOM 127 O GLU A 12 -8.152 -3.228 -6.780 1.00 0.00 O ATOM 128 CB GLU A 12 -9.943 -6.118 -7.509 1.00 0.00 C ATOM 129 CG GLU A 12 -10.279 -6.477 -8.958 1.00 0.00 C ATOM 130 CD GLU A 12 -10.976 -5.312 -9.664 1.00 0.00 C ATOM 131 OE1 GLU A 12 -10.443 -4.186 -9.562 1.00 0.00 O ATOM 132 OE2 GLU A 12 -12.026 -5.575 -10.290 1.00 0.00 O ATOM 0 H GLU A 12 -7.964 -7.343 -6.562 1.00 0.00 H new ATOM 0 HA GLU A 12 -8.271 -5.135 -8.390 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -10.005 -7.010 -6.886 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -10.678 -5.410 -7.126 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -9.366 -6.737 -9.493 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -10.922 -7.357 -8.979 1.00 0.00 H new ATOM 139 N GLU A 13 -8.922 -4.640 -5.190 1.00 0.00 N ATOM 140 CA GLU A 13 -8.955 -3.627 -4.149 1.00 0.00 C ATOM 141 C GLU A 13 -7.673 -2.793 -4.180 1.00 0.00 C ATOM 142 O GLU A 13 -7.713 -1.579 -3.987 1.00 0.00 O ATOM 143 CB GLU A 13 -9.162 -4.263 -2.772 1.00 0.00 C ATOM 144 CG GLU A 13 -7.821 -4.607 -2.120 1.00 0.00 C ATOM 145 CD GLU A 13 -8.030 -5.342 -0.794 1.00 0.00 C ATOM 146 OE1 GLU A 13 -8.696 -4.753 0.083 1.00 0.00 O ATOM 147 OE2 GLU A 13 -7.517 -6.478 -0.689 1.00 0.00 O ATOM 0 H GLU A 13 -9.227 -5.567 -4.893 1.00 0.00 H new ATOM 0 HA GLU A 13 -9.800 -2.966 -4.339 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -9.717 -3.578 -2.131 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -9.764 -5.166 -2.871 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -7.233 -5.228 -2.796 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -7.251 -3.694 -1.948 1.00 0.00 H new ATOM 154 N LEU A 14 -6.565 -3.477 -4.425 1.00 0.00 N ATOM 155 CA LEU A 14 -5.273 -2.814 -4.484 1.00 0.00 C ATOM 156 C LEU A 14 -5.289 -1.776 -5.607 1.00 0.00 C ATOM 157 O LEU A 14 -4.999 -0.603 -5.377 1.00 0.00 O ATOM 158 CB LEU A 14 -4.148 -3.843 -4.613 1.00 0.00 C ATOM 159 CG LEU A 14 -3.780 -4.598 -3.334 1.00 0.00 C ATOM 160 CD1 LEU A 14 -2.681 -5.628 -3.603 1.00 0.00 C ATOM 161 CD2 LEU A 14 -3.395 -3.628 -2.215 1.00 0.00 C ATOM 0 H LEU A 14 -6.535 -4.484 -4.585 1.00 0.00 H new ATOM 0 HA LEU A 14 -5.077 -2.277 -3.556 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -4.434 -4.571 -5.372 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -3.257 -3.334 -4.980 1.00 0.00 H new ATOM 0 HG LEU A 14 -4.660 -5.146 -2.996 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -2.438 -6.151 -2.678 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -3.029 -6.346 -4.345 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -1.792 -5.122 -3.978 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -3.138 -4.191 -1.318 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -2.537 -3.033 -2.528 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -4.235 -2.968 -2.001 1.00 0.00 H new ATOM 173 N LEU A 15 -5.630 -2.245 -6.799 1.00 0.00 N ATOM 174 CA LEU A 15 -5.687 -1.371 -7.958 1.00 0.00 C ATOM 175 C LEU A 15 -6.661 -0.225 -7.681 1.00 0.00 C ATOM 176 O LEU A 15 -6.356 0.934 -7.958 1.00 0.00 O ATOM 177 CB LEU A 15 -6.024 -2.173 -9.217 1.00 0.00 C ATOM 178 CG LEU A 15 -4.908 -3.066 -9.763 1.00 0.00 C ATOM 179 CD1 LEU A 15 -5.468 -4.396 -10.272 1.00 0.00 C ATOM 180 CD2 LEU A 15 -4.098 -2.337 -10.836 1.00 0.00 C ATOM 0 H LEU A 15 -5.869 -3.219 -6.987 1.00 0.00 H new ATOM 0 HA LEU A 15 -4.711 -0.922 -8.144 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -6.891 -2.798 -9.004 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -6.319 -1.475 -10.000 1.00 0.00 H new ATOM 0 HG LEU A 15 -4.225 -3.297 -8.945 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -4.654 -5.011 -10.654 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -5.964 -4.919 -9.454 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -6.186 -4.207 -11.070 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -3.311 -2.994 -11.207 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -4.755 -2.056 -11.659 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -3.650 -1.441 -10.407 1.00 0.00 H new ATOM 192 N ARG A 16 -7.813 -0.588 -7.137 1.00 0.00 N ATOM 193 CA ARG A 16 -8.833 0.396 -6.818 1.00 0.00 C ATOM 194 C ARG A 16 -8.252 1.494 -5.925 1.00 0.00 C ATOM 195 O ARG A 16 -8.588 2.667 -6.079 1.00 0.00 O ATOM 196 CB ARG A 16 -10.022 -0.254 -6.108 1.00 0.00 C ATOM 197 CG ARG A 16 -11.066 -0.738 -7.116 1.00 0.00 C ATOM 198 CD ARG A 16 -12.480 -0.610 -6.546 1.00 0.00 C ATOM 199 NE ARG A 16 -13.143 -1.933 -6.536 1.00 0.00 N ATOM 200 CZ ARG A 16 -14.463 -2.112 -6.385 1.00 0.00 C ATOM 201 NH1 ARG A 16 -15.268 -1.052 -6.231 1.00 0.00 N ATOM 202 NH2 ARG A 16 -14.976 -3.349 -6.389 1.00 0.00 N ATOM 0 H ARG A 16 -8.063 -1.550 -6.909 1.00 0.00 H new ATOM 0 HA ARG A 16 -9.178 0.831 -7.756 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -9.676 -1.094 -5.506 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -10.477 0.462 -5.424 1.00 0.00 H new ATOM 0 HG2 ARG A 16 -10.986 -0.157 -8.035 1.00 0.00 H new ATOM 0 HG3 ARG A 16 -10.869 -1.777 -7.378 1.00 0.00 H new ATOM 0 HD2 ARG A 16 -12.438 -0.207 -5.534 1.00 0.00 H new ATOM 0 HD3 ARG A 16 -13.060 0.092 -7.145 1.00 0.00 H new ATOM 0 HE ARG A 16 -12.559 -2.761 -6.651 1.00 0.00 H new ATOM 0 HH11 ARG A 16 -14.876 -0.110 -6.229 1.00 0.00 H new ATOM 0 HH12 ARG A 16 -16.272 -1.187 -6.116 1.00 0.00 H new ATOM 0 HH21 ARG A 16 -14.362 -4.155 -6.507 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -15.980 -3.485 -6.274 1.00 0.00 H new ATOM 216 N ILE A 17 -7.390 1.074 -5.011 1.00 0.00 N ATOM 217 CA ILE A 17 -6.759 2.006 -4.093 1.00 0.00 C ATOM 218 C ILE A 17 -5.829 2.936 -4.876 1.00 0.00 C ATOM 219 O ILE A 17 -6.001 4.153 -4.854 1.00 0.00 O ATOM 220 CB ILE A 17 -6.062 1.253 -2.958 1.00 0.00 C ATOM 221 CG1 ILE A 17 -7.076 0.754 -1.927 1.00 0.00 C ATOM 222 CG2 ILE A 17 -4.969 2.112 -2.319 1.00 0.00 C ATOM 223 CD1 ILE A 17 -6.690 -0.630 -1.403 1.00 0.00 C ATOM 0 H ILE A 17 -7.114 0.100 -4.887 1.00 0.00 H new ATOM 0 HA ILE A 17 -7.510 2.634 -3.613 1.00 0.00 H new ATOM 0 HB ILE A 17 -5.574 0.375 -3.380 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -7.132 1.458 -1.097 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -8.068 0.712 -2.378 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -4.490 1.553 -1.515 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -4.226 2.374 -3.072 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -5.412 3.022 -1.914 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -7.427 -0.961 -0.672 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -6.658 -1.337 -2.232 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -5.709 -0.580 -0.931 1.00 0.00 H new ATOM 235 N ALA A 18 -4.864 2.325 -5.548 1.00 0.00 N ATOM 236 CA ALA A 18 -3.907 3.083 -6.337 1.00 0.00 C ATOM 237 C ALA A 18 -4.656 4.093 -7.208 1.00 0.00 C ATOM 238 O ALA A 18 -4.284 5.264 -7.266 1.00 0.00 O ATOM 239 CB ALA A 18 -3.052 2.121 -7.164 1.00 0.00 C ATOM 0 H ALA A 18 -4.724 1.315 -5.562 1.00 0.00 H new ATOM 0 HA ALA A 18 -3.233 3.643 -5.689 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -2.334 2.689 -7.756 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -2.518 1.444 -6.497 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -3.694 1.543 -7.829 1.00 0.00 H new ATOM 245 N LYS A 19 -5.698 3.603 -7.863 1.00 0.00 N ATOM 246 CA LYS A 19 -6.503 4.449 -8.729 1.00 0.00 C ATOM 247 C LYS A 19 -7.214 5.507 -7.883 1.00 0.00 C ATOM 248 O LYS A 19 -7.521 6.594 -8.371 1.00 0.00 O ATOM 249 CB LYS A 19 -7.452 3.599 -9.576 1.00 0.00 C ATOM 250 CG LYS A 19 -8.910 3.853 -9.187 1.00 0.00 C ATOM 251 CD LYS A 19 -9.866 3.217 -10.198 1.00 0.00 C ATOM 252 CE LYS A 19 -10.077 1.732 -9.893 1.00 0.00 C ATOM 253 NZ LYS A 19 -10.788 1.070 -11.010 1.00 0.00 N ATOM 0 H LYS A 19 -6.004 2.631 -7.812 1.00 0.00 H new ATOM 0 HA LYS A 19 -5.869 4.981 -9.439 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -7.308 3.829 -10.632 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -7.215 2.543 -9.445 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -9.101 3.446 -8.194 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -9.094 4.926 -9.132 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -10.824 3.737 -10.175 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -9.465 3.332 -11.205 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -9.114 1.248 -9.729 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -10.650 1.621 -8.973 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -10.923 0.063 -10.787 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -11.715 1.522 -11.148 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -10.226 1.160 -11.881 1.00 0.00 H new ATOM 267 N LYS A 20 -7.455 5.152 -6.629 1.00 0.00 N ATOM 268 CA LYS A 20 -8.123 6.058 -5.710 1.00 0.00 C ATOM 269 C LYS A 20 -7.109 7.063 -5.162 1.00 0.00 C ATOM 270 O LYS A 20 -7.485 8.128 -4.674 1.00 0.00 O ATOM 271 CB LYS A 20 -8.859 5.272 -4.623 1.00 0.00 C ATOM 272 CG LYS A 20 -10.344 5.126 -4.962 1.00 0.00 C ATOM 273 CD LYS A 20 -11.200 5.150 -3.694 1.00 0.00 C ATOM 274 CE LYS A 20 -11.361 6.577 -3.168 1.00 0.00 C ATOM 275 NZ LYS A 20 -12.167 6.585 -1.927 1.00 0.00 N ATOM 0 H LYS A 20 -7.200 4.250 -6.228 1.00 0.00 H new ATOM 0 HA LYS A 20 -8.890 6.631 -6.231 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -8.408 4.285 -4.514 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -8.749 5.780 -3.665 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -10.650 5.933 -5.627 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -10.508 4.191 -5.498 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -12.181 4.724 -3.905 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -10.739 4.526 -2.928 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -10.381 7.012 -2.974 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -11.841 7.198 -3.924 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -12.266 7.562 -1.584 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -13.109 6.189 -2.122 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -11.693 6.010 -1.202 1.00 0.00 H new ATOM 289 N LEU A 21 -5.841 6.690 -5.261 1.00 0.00 N ATOM 290 CA LEU A 21 -4.769 7.545 -4.781 1.00 0.00 C ATOM 291 C LEU A 21 -4.273 8.426 -5.929 1.00 0.00 C ATOM 292 O LEU A 21 -4.288 9.652 -5.827 1.00 0.00 O ATOM 293 CB LEU A 21 -3.667 6.708 -4.128 1.00 0.00 C ATOM 294 CG LEU A 21 -4.086 5.880 -2.911 1.00 0.00 C ATOM 295 CD1 LEU A 21 -3.055 4.792 -2.608 1.00 0.00 C ATOM 296 CD2 LEU A 21 -4.346 6.778 -1.700 1.00 0.00 C ATOM 0 H LEU A 21 -5.532 5.807 -5.667 1.00 0.00 H new ATOM 0 HA LEU A 21 -5.135 8.213 -4.001 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -3.258 6.032 -4.879 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -2.860 7.376 -3.828 1.00 0.00 H new ATOM 0 HG LEU A 21 -5.024 5.378 -3.146 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -3.376 4.218 -1.739 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -2.963 4.128 -3.468 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -2.089 5.253 -2.401 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -4.642 6.165 -0.849 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -3.438 7.327 -1.453 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -5.144 7.483 -1.934 1.00 0.00 H new ATOM 308 N GLU A 22 -3.846 7.768 -6.996 1.00 0.00 N ATOM 309 CA GLU A 22 -3.346 8.476 -8.163 1.00 0.00 C ATOM 310 C GLU A 22 -4.186 9.728 -8.423 1.00 0.00 C ATOM 311 O GLU A 22 -3.645 10.822 -8.574 1.00 0.00 O ATOM 312 CB GLU A 22 -3.327 7.564 -9.391 1.00 0.00 C ATOM 313 CG GLU A 22 -2.515 6.296 -9.119 1.00 0.00 C ATOM 314 CD GLU A 22 -1.226 6.282 -9.944 1.00 0.00 C ATOM 315 OE1 GLU A 22 -0.351 7.122 -9.643 1.00 0.00 O ATOM 316 OE2 GLU A 22 -1.146 5.432 -10.857 1.00 0.00 O ATOM 0 H GLU A 22 -3.836 6.751 -7.078 1.00 0.00 H new ATOM 0 HA GLU A 22 -2.320 8.785 -7.965 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -4.347 7.295 -9.665 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -2.900 8.099 -10.239 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -2.272 6.236 -8.058 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -3.114 5.418 -9.359 1.00 0.00 H new ATOM 323 N LYS A 23 -5.495 9.526 -8.467 1.00 0.00 N ATOM 324 CA LYS A 23 -6.414 10.625 -8.707 1.00 0.00 C ATOM 325 C LYS A 23 -6.076 11.782 -7.764 1.00 0.00 C ATOM 326 O LYS A 23 -5.932 12.922 -8.202 1.00 0.00 O ATOM 327 CB LYS A 23 -7.863 10.145 -8.597 1.00 0.00 C ATOM 328 CG LYS A 23 -8.259 9.928 -7.135 1.00 0.00 C ATOM 329 CD LYS A 23 -9.695 9.412 -7.028 1.00 0.00 C ATOM 330 CE LYS A 23 -10.482 10.196 -5.975 1.00 0.00 C ATOM 331 NZ LYS A 23 -11.920 9.853 -6.041 1.00 0.00 N ATOM 0 H LYS A 23 -5.941 8.617 -8.340 1.00 0.00 H new ATOM 0 HA LYS A 23 -6.303 11.000 -9.725 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -8.528 10.878 -9.053 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -7.985 9.215 -9.152 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -7.577 9.215 -6.672 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -8.163 10.864 -6.585 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -10.189 9.498 -7.996 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -9.687 8.354 -6.768 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -10.094 9.972 -4.981 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -10.350 11.266 -6.135 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -12.439 10.394 -5.320 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -12.290 10.089 -6.984 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -12.043 8.835 -5.865 1.00 0.00 H new ATOM 345 N MET A 24 -5.959 11.447 -6.487 1.00 0.00 N ATOM 346 CA MET A 24 -5.641 12.444 -5.479 1.00 0.00 C ATOM 347 C MET A 24 -4.374 13.217 -5.853 1.00 0.00 C ATOM 348 O MET A 24 -4.375 14.447 -5.866 1.00 0.00 O ATOM 349 CB MET A 24 -5.440 11.757 -4.127 1.00 0.00 C ATOM 350 CG MET A 24 -6.702 11.003 -3.702 1.00 0.00 C ATOM 351 SD MET A 24 -7.083 11.366 -1.996 1.00 0.00 S ATOM 352 CE MET A 24 -7.078 9.715 -1.319 1.00 0.00 C ATOM 0 H MET A 24 -6.079 10.500 -6.128 1.00 0.00 H new ATOM 0 HA MET A 24 -6.470 13.149 -5.418 1.00 0.00 H new ATOM 0 HB2 MET A 24 -4.601 11.064 -4.189 1.00 0.00 H new ATOM 0 HB3 MET A 24 -5.184 12.500 -3.372 1.00 0.00 H new ATOM 0 HG2 MET A 24 -7.539 11.289 -4.339 1.00 0.00 H new ATOM 0 HG3 MET A 24 -6.556 9.931 -3.831 1.00 0.00 H new ATOM 0 HE1 MET A 24 -8.040 9.512 -0.848 1.00 0.00 H new ATOM 0 HE2 MET A 24 -6.906 8.994 -2.119 1.00 0.00 H new ATOM 0 HE3 MET A 24 -6.285 9.629 -0.576 1.00 0.00 H new ATOM 362 N VAL A 25 -3.325 12.463 -6.148 1.00 0.00 N ATOM 363 CA VAL A 25 -2.055 13.062 -6.521 1.00 0.00 C ATOM 364 C VAL A 25 -2.225 13.835 -7.830 1.00 0.00 C ATOM 365 O VAL A 25 -1.852 15.003 -7.919 1.00 0.00 O ATOM 366 CB VAL A 25 -0.971 11.985 -6.598 1.00 0.00 C ATOM 367 CG1 VAL A 25 0.367 12.584 -7.036 1.00 0.00 C ATOM 368 CG2 VAL A 25 -0.832 11.250 -5.263 1.00 0.00 C ATOM 0 H VAL A 25 -3.329 11.443 -6.136 1.00 0.00 H new ATOM 0 HA VAL A 25 -1.732 13.775 -5.763 1.00 0.00 H new ATOM 0 HB VAL A 25 -1.275 11.258 -7.351 1.00 0.00 H new ATOM 0 HG11 VAL A 25 1.120 11.797 -7.083 1.00 0.00 H new ATOM 0 HG12 VAL A 25 0.257 13.040 -8.020 1.00 0.00 H new ATOM 0 HG13 VAL A 25 0.679 13.342 -6.318 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -0.055 10.490 -5.345 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -0.563 11.961 -4.482 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -1.779 10.774 -5.009 1.00 0.00 H new ATOM 378 N SER A 26 -2.789 13.150 -8.815 1.00 0.00 N ATOM 379 CA SER A 26 -3.013 13.757 -10.116 1.00 0.00 C ATOM 380 C SER A 26 -3.824 15.045 -9.960 1.00 0.00 C ATOM 381 O SER A 26 -3.515 16.057 -10.586 1.00 0.00 O ATOM 382 CB SER A 26 -3.730 12.789 -11.059 1.00 0.00 C ATOM 383 OG SER A 26 -2.814 11.977 -11.788 1.00 0.00 O ATOM 0 H SER A 26 -3.097 12.181 -8.738 1.00 0.00 H new ATOM 0 HA SER A 26 -2.044 13.997 -10.553 1.00 0.00 H new ATOM 0 HB2 SER A 26 -4.400 12.151 -10.483 1.00 0.00 H new ATOM 0 HB3 SER A 26 -4.348 13.354 -11.757 1.00 0.00 H new ATOM 0 HG SER A 26 -3.311 11.372 -12.377 1.00 0.00 H new ATOM 389 N ARG A 27 -4.847 14.964 -9.121 1.00 0.00 N ATOM 390 CA ARG A 27 -5.705 16.111 -8.875 1.00 0.00 C ATOM 391 C ARG A 27 -5.067 17.038 -7.838 1.00 0.00 C ATOM 392 O ARG A 27 -5.633 18.075 -7.495 1.00 0.00 O ATOM 393 CB ARG A 27 -7.083 15.671 -8.376 1.00 0.00 C ATOM 394 CG ARG A 27 -7.756 14.735 -9.382 1.00 0.00 C ATOM 395 CD ARG A 27 -8.900 13.958 -8.727 1.00 0.00 C ATOM 396 NE ARG A 27 -10.172 14.697 -8.888 1.00 0.00 N ATOM 397 CZ ARG A 27 -10.596 15.655 -8.052 1.00 0.00 C ATOM 398 NH1 ARG A 27 -9.852 15.994 -6.990 1.00 0.00 N ATOM 399 NH2 ARG A 27 -11.764 16.272 -8.277 1.00 0.00 N ATOM 0 H ARG A 27 -5.101 14.122 -8.603 1.00 0.00 H new ATOM 0 HA ARG A 27 -5.826 16.643 -9.818 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -6.982 15.166 -7.415 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -7.711 16.547 -8.212 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -8.139 15.314 -10.223 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -7.021 14.038 -9.784 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -8.985 12.970 -9.179 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -8.689 13.808 -7.668 1.00 0.00 H new ATOM 0 HE ARG A 27 -10.763 14.463 -9.685 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -8.964 15.523 -6.818 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -10.174 16.723 -6.353 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -12.331 16.013 -9.085 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -12.087 17.001 -7.641 1.00 0.00 H new ATOM 413 N LYS A 28 -3.897 16.631 -7.367 1.00 0.00 N ATOM 414 CA LYS A 28 -3.176 17.413 -6.376 1.00 0.00 C ATOM 415 C LYS A 28 -4.126 17.781 -5.235 1.00 0.00 C ATOM 416 O LYS A 28 -4.534 18.935 -5.110 1.00 0.00 O ATOM 417 CB LYS A 28 -2.504 18.621 -7.032 1.00 0.00 C ATOM 418 CG LYS A 28 -1.040 18.732 -6.604 1.00 0.00 C ATOM 419 CD LYS A 28 -0.706 20.157 -6.156 1.00 0.00 C ATOM 420 CE LYS A 28 -0.238 21.008 -7.338 1.00 0.00 C ATOM 421 NZ LYS A 28 1.204 21.318 -7.213 1.00 0.00 N ATOM 0 H LYS A 28 -3.430 15.770 -7.653 1.00 0.00 H new ATOM 0 HA LYS A 28 -2.367 16.826 -5.941 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -2.564 18.531 -8.117 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -3.037 19.532 -6.758 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -0.842 18.035 -5.790 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -0.392 18.446 -7.433 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -1.584 20.614 -5.700 1.00 0.00 H new ATOM 0 HD3 LYS A 28 0.072 20.129 -5.393 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -0.423 20.477 -8.272 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -0.813 21.933 -7.378 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 1.506 21.896 -8.023 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 1.371 21.843 -6.331 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 1.749 20.433 -7.197 1.00 0.00 H new ATOM 435 N LYS A 29 -4.450 16.780 -4.431 1.00 0.00 N ATOM 436 CA LYS A 29 -5.344 16.985 -3.304 1.00 0.00 C ATOM 437 C LYS A 29 -4.871 16.135 -2.122 1.00 0.00 C ATOM 438 O LYS A 29 -4.387 16.668 -1.125 1.00 0.00 O ATOM 439 CB LYS A 29 -6.794 16.715 -3.713 1.00 0.00 C ATOM 440 CG LYS A 29 -7.559 18.024 -3.916 1.00 0.00 C ATOM 441 CD LYS A 29 -8.298 18.431 -2.640 1.00 0.00 C ATOM 442 CE LYS A 29 -9.797 18.152 -2.762 1.00 0.00 C ATOM 443 NZ LYS A 29 -10.511 19.355 -3.244 1.00 0.00 N ATOM 0 H LYS A 29 -4.110 15.824 -4.537 1.00 0.00 H new ATOM 0 HA LYS A 29 -5.316 18.026 -2.981 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -6.813 16.132 -4.634 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -7.287 16.117 -2.946 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -6.866 18.813 -4.206 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -8.272 17.910 -4.733 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -7.891 17.884 -1.790 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -8.137 19.491 -2.444 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -9.964 17.323 -3.450 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -10.196 17.848 -1.794 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -11.527 19.148 -3.321 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -10.367 20.136 -2.573 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -10.142 19.627 -4.177 1.00 0.00 H new ATOM 457 N THR A 30 -5.028 14.829 -2.273 1.00 0.00 N ATOM 458 CA THR A 30 -4.623 13.901 -1.231 1.00 0.00 C ATOM 459 C THR A 30 -5.121 14.381 0.133 1.00 0.00 C ATOM 460 O THR A 30 -4.424 15.118 0.829 1.00 0.00 O ATOM 461 CB THR A 30 -3.103 13.744 -1.302 1.00 0.00 C ATOM 462 OG1 THR A 30 -2.604 15.030 -0.944 1.00 0.00 O ATOM 463 CG2 THR A 30 -2.602 13.535 -2.733 1.00 0.00 C ATOM 0 H THR A 30 -5.430 14.391 -3.102 1.00 0.00 H new ATOM 0 HA THR A 30 -5.073 12.919 -1.379 1.00 0.00 H new ATOM 0 HB THR A 30 -2.796 12.901 -0.683 1.00 0.00 H new ATOM 0 HG1 THR A 30 -3.300 15.530 -0.469 1.00 0.00 H new ATOM 0 HG21 THR A 30 -1.517 13.429 -2.727 1.00 0.00 H new ATOM 0 HG22 THR A 30 -3.052 12.633 -3.148 1.00 0.00 H new ATOM 0 HG23 THR A 30 -2.879 14.393 -3.345 1.00 0.00 H new ATOM 471 N GLU A 31 -6.324 13.943 0.476 1.00 0.00 N ATOM 472 CA GLU A 31 -6.923 14.319 1.745 1.00 0.00 C ATOM 473 C GLU A 31 -7.301 13.070 2.544 1.00 0.00 C ATOM 474 O GLU A 31 -7.078 13.010 3.752 1.00 0.00 O ATOM 475 CB GLU A 31 -8.139 15.222 1.531 1.00 0.00 C ATOM 476 CG GLU A 31 -7.906 16.608 2.134 1.00 0.00 C ATOM 477 CD GLU A 31 -8.428 16.677 3.570 1.00 0.00 C ATOM 478 OE1 GLU A 31 -7.887 15.923 4.407 1.00 0.00 O ATOM 479 OE2 GLU A 31 -9.357 17.482 3.799 1.00 0.00 O ATOM 0 H GLU A 31 -6.900 13.331 -0.103 1.00 0.00 H new ATOM 0 HA GLU A 31 -6.188 14.885 2.318 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -8.344 15.315 0.464 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -9.019 14.767 1.986 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -6.841 16.840 2.119 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -8.405 17.362 1.525 1.00 0.00 H new ATOM 486 N GLY A 32 -7.867 12.103 1.837 1.00 0.00 N ATOM 487 CA GLY A 32 -8.279 10.859 2.465 1.00 0.00 C ATOM 488 C GLY A 32 -7.481 9.676 1.913 1.00 0.00 C ATOM 489 O GLY A 32 -8.057 8.726 1.385 1.00 0.00 O ATOM 0 H GLY A 32 -8.050 12.156 0.835 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -8.136 10.927 3.543 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -9.343 10.696 2.294 1.00 0.00 H new ATOM 493 N ALA A 33 -6.167 9.772 2.054 1.00 0.00 N ATOM 494 CA ALA A 33 -5.284 8.722 1.576 1.00 0.00 C ATOM 495 C ALA A 33 -5.043 7.713 2.701 1.00 0.00 C ATOM 496 O ALA A 33 -4.853 6.525 2.444 1.00 0.00 O ATOM 497 CB ALA A 33 -3.984 9.343 1.061 1.00 0.00 C ATOM 0 H ALA A 33 -5.693 10.561 2.493 1.00 0.00 H new ATOM 0 HA ALA A 33 -5.741 8.186 0.744 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -3.322 8.555 0.702 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -4.207 10.029 0.244 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -3.496 9.888 1.869 1.00 0.00 H new ATOM 503 N LEU A 34 -5.058 8.223 3.923 1.00 0.00 N ATOM 504 CA LEU A 34 -4.844 7.381 5.088 1.00 0.00 C ATOM 505 C LEU A 34 -5.628 6.078 4.922 1.00 0.00 C ATOM 506 O LEU A 34 -5.041 5.020 4.699 1.00 0.00 O ATOM 507 CB LEU A 34 -5.184 8.144 6.370 1.00 0.00 C ATOM 508 CG LEU A 34 -4.005 8.466 7.292 1.00 0.00 C ATOM 509 CD1 LEU A 34 -4.493 8.881 8.681 1.00 0.00 C ATOM 510 CD2 LEU A 34 -3.023 7.295 7.355 1.00 0.00 C ATOM 0 H LEU A 34 -5.215 9.209 4.132 1.00 0.00 H new ATOM 0 HA LEU A 34 -3.791 7.111 5.174 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -5.670 9.080 6.094 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -5.912 7.561 6.934 1.00 0.00 H new ATOM 0 HG LEU A 34 -3.466 9.316 6.873 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -3.636 9.104 9.316 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -5.122 9.767 8.596 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -5.069 8.068 9.122 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -2.195 7.550 8.016 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -3.534 6.412 7.737 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -2.639 7.088 6.356 1.00 0.00 H new ATOM 522 N ASP A 35 -6.942 6.197 5.036 1.00 0.00 N ATOM 523 CA ASP A 35 -7.813 5.041 4.901 1.00 0.00 C ATOM 524 C ASP A 35 -7.263 4.118 3.812 1.00 0.00 C ATOM 525 O ASP A 35 -7.089 2.921 4.037 1.00 0.00 O ATOM 526 CB ASP A 35 -9.227 5.462 4.494 1.00 0.00 C ATOM 527 CG ASP A 35 -9.739 6.739 5.161 1.00 0.00 C ATOM 528 OD1 ASP A 35 -9.353 7.826 4.678 1.00 0.00 O ATOM 529 OD2 ASP A 35 -10.504 6.601 6.140 1.00 0.00 O ATOM 0 H ASP A 35 -7.425 7.076 5.220 1.00 0.00 H new ATOM 0 HA ASP A 35 -7.851 4.533 5.864 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -9.252 5.600 3.413 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -9.913 4.648 4.727 1.00 0.00 H new ATOM 534 N LEU A 36 -7.003 4.709 2.655 1.00 0.00 N ATOM 535 CA LEU A 36 -6.475 3.955 1.531 1.00 0.00 C ATOM 536 C LEU A 36 -5.155 3.297 1.938 1.00 0.00 C ATOM 537 O LEU A 36 -4.965 2.100 1.731 1.00 0.00 O ATOM 538 CB LEU A 36 -6.362 4.847 0.293 1.00 0.00 C ATOM 539 CG LEU A 36 -7.684 5.295 -0.334 1.00 0.00 C ATOM 540 CD1 LEU A 36 -7.488 6.548 -1.190 1.00 0.00 C ATOM 541 CD2 LEU A 36 -8.329 4.156 -1.126 1.00 0.00 C ATOM 0 H LEU A 36 -7.148 5.702 2.472 1.00 0.00 H new ATOM 0 HA LEU A 36 -7.159 3.153 1.256 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -5.790 5.736 0.561 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -5.786 4.314 -0.463 1.00 0.00 H new ATOM 0 HG LEU A 36 -8.371 5.558 0.470 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -8.443 6.845 -1.624 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -7.104 7.357 -0.568 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -6.777 6.336 -1.988 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -9.267 4.501 -1.561 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -7.655 3.839 -1.922 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -8.525 3.316 -0.460 1.00 0.00 H new ATOM 553 N LEU A 37 -4.278 4.109 2.509 1.00 0.00 N ATOM 554 CA LEU A 37 -2.981 3.621 2.946 1.00 0.00 C ATOM 555 C LEU A 37 -3.181 2.511 3.980 1.00 0.00 C ATOM 556 O LEU A 37 -2.630 1.420 3.839 1.00 0.00 O ATOM 557 CB LEU A 37 -2.114 4.779 3.447 1.00 0.00 C ATOM 558 CG LEU A 37 -1.870 5.914 2.450 1.00 0.00 C ATOM 559 CD1 LEU A 37 -1.643 7.241 3.176 1.00 0.00 C ATOM 560 CD2 LEU A 37 -0.717 5.574 1.504 1.00 0.00 C ATOM 0 H LEU A 37 -4.440 5.102 2.679 1.00 0.00 H new ATOM 0 HA LEU A 37 -2.436 3.184 2.109 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -2.582 5.199 4.337 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -1.148 4.377 3.754 1.00 0.00 H new ATOM 0 HG LEU A 37 -2.765 6.030 1.838 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -1.472 8.031 2.445 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -2.522 7.484 3.774 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -0.773 7.155 3.828 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -0.564 6.397 0.806 1.00 0.00 H new ATOM 0 HD22 LEU A 37 0.193 5.415 2.082 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -0.957 4.667 0.949 1.00 0.00 H new ATOM 572 N LYS A 38 -3.971 2.827 4.996 1.00 0.00 N ATOM 573 CA LYS A 38 -4.250 1.870 6.052 1.00 0.00 C ATOM 574 C LYS A 38 -4.570 0.509 5.430 1.00 0.00 C ATOM 575 O LYS A 38 -4.043 -0.514 5.863 1.00 0.00 O ATOM 576 CB LYS A 38 -5.350 2.398 6.976 1.00 0.00 C ATOM 577 CG LYS A 38 -4.832 3.545 7.846 1.00 0.00 C ATOM 578 CD LYS A 38 -5.894 4.634 8.007 1.00 0.00 C ATOM 579 CE LYS A 38 -5.417 5.728 8.965 1.00 0.00 C ATOM 580 NZ LYS A 38 -6.529 6.181 9.830 1.00 0.00 N ATOM 0 H LYS A 38 -4.426 3.733 5.110 1.00 0.00 H new ATOM 0 HA LYS A 38 -3.373 1.733 6.684 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -6.196 2.742 6.381 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -5.715 1.591 7.611 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -4.547 3.163 8.826 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -3.935 3.971 7.396 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -6.122 5.071 7.035 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -6.817 4.194 8.383 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -4.601 5.350 9.580 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -5.024 6.571 8.397 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -6.176 6.887 10.508 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -7.274 6.607 9.243 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -6.919 5.368 10.348 1.00 0.00 H new ATOM 594 N LYS A 39 -5.433 0.542 4.425 1.00 0.00 N ATOM 595 CA LYS A 39 -5.829 -0.676 3.739 1.00 0.00 C ATOM 596 C LYS A 39 -4.589 -1.352 3.151 1.00 0.00 C ATOM 597 O LYS A 39 -4.431 -2.567 3.255 1.00 0.00 O ATOM 598 CB LYS A 39 -6.917 -0.379 2.705 1.00 0.00 C ATOM 599 CG LYS A 39 -8.308 -0.453 3.336 1.00 0.00 C ATOM 600 CD LYS A 39 -8.836 -1.890 3.331 1.00 0.00 C ATOM 601 CE LYS A 39 -10.365 -1.912 3.395 1.00 0.00 C ATOM 602 NZ LYS A 39 -10.841 -3.201 3.945 1.00 0.00 N ATOM 0 H LYS A 39 -5.869 1.393 4.070 1.00 0.00 H new ATOM 0 HA LYS A 39 -6.273 -1.381 4.441 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -6.759 0.612 2.280 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -6.848 -1.093 1.884 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -8.267 -0.080 4.359 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -8.995 0.193 2.788 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -8.499 -2.402 2.430 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -8.425 -2.435 4.180 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -10.721 -1.091 4.017 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -10.779 -1.760 2.398 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -11.880 -3.200 3.982 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -10.517 -3.979 3.336 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -10.461 -3.331 4.904 1.00 0.00 H new ATOM 616 N LEU A 40 -3.740 -0.534 2.545 1.00 0.00 N ATOM 617 CA LEU A 40 -2.519 -1.038 1.939 1.00 0.00 C ATOM 618 C LEU A 40 -1.629 -1.644 3.026 1.00 0.00 C ATOM 619 O LEU A 40 -0.759 -2.463 2.735 1.00 0.00 O ATOM 620 CB LEU A 40 -1.833 0.061 1.124 1.00 0.00 C ATOM 621 CG LEU A 40 -2.616 0.592 -0.078 1.00 0.00 C ATOM 622 CD1 LEU A 40 -1.807 1.646 -0.837 1.00 0.00 C ATOM 623 CD2 LEU A 40 -3.065 -0.552 -0.989 1.00 0.00 C ATOM 0 H LEU A 40 -3.874 0.474 2.461 1.00 0.00 H new ATOM 0 HA LEU A 40 -2.745 -1.835 1.230 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -1.616 0.897 1.789 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -0.876 -0.321 0.769 1.00 0.00 H new ATOM 0 HG LEU A 40 -3.517 1.082 0.291 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -2.386 2.007 -1.687 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -1.580 2.479 -0.172 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -0.877 1.203 -1.194 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -3.619 -0.147 -1.836 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -2.191 -1.092 -1.353 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -3.705 -1.233 -0.429 1.00 0.00 H new ATOM 635 N ASN A 41 -1.878 -1.218 4.256 1.00 0.00 N ATOM 636 CA ASN A 41 -1.110 -1.709 5.387 1.00 0.00 C ATOM 637 C ASN A 41 -1.799 -2.946 5.968 1.00 0.00 C ATOM 638 O ASN A 41 -1.305 -3.546 6.921 1.00 0.00 O ATOM 639 CB ASN A 41 -1.021 -0.655 6.492 1.00 0.00 C ATOM 640 CG ASN A 41 -0.328 -1.218 7.734 1.00 0.00 C ATOM 641 OD1 ASN A 41 0.512 -2.100 7.662 1.00 0.00 O ATOM 642 ND2 ASN A 41 -0.727 -0.663 8.875 1.00 0.00 N ATOM 0 H ASN A 41 -2.601 -0.538 4.494 1.00 0.00 H new ATOM 0 HA ASN A 41 -0.107 -1.948 5.035 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -0.472 0.213 6.127 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -2.022 -0.312 6.754 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -0.325 -0.972 9.760 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -1.435 0.071 8.865 1.00 0.00 H new ATOM 649 N SER A 42 -2.930 -3.289 5.370 1.00 0.00 N ATOM 650 CA SER A 42 -3.692 -4.443 5.816 1.00 0.00 C ATOM 651 C SER A 42 -4.026 -5.342 4.624 1.00 0.00 C ATOM 652 O SER A 42 -5.043 -6.033 4.629 1.00 0.00 O ATOM 653 CB SER A 42 -4.975 -4.013 6.531 1.00 0.00 C ATOM 654 OG SER A 42 -5.164 -4.716 7.756 1.00 0.00 O ATOM 0 H SER A 42 -3.337 -2.788 4.580 1.00 0.00 H new ATOM 0 HA SER A 42 -3.082 -5.002 6.526 1.00 0.00 H new ATOM 0 HB2 SER A 42 -4.938 -2.942 6.730 1.00 0.00 H new ATOM 0 HB3 SER A 42 -5.830 -4.187 5.878 1.00 0.00 H new ATOM 0 HG SER A 42 -5.992 -4.412 8.183 1.00 0.00 H new ATOM 660 N CYS A 43 -3.149 -5.305 3.632 1.00 0.00 N ATOM 661 CA CYS A 43 -3.337 -6.108 2.436 1.00 0.00 C ATOM 662 C CYS A 43 -2.058 -6.912 2.191 1.00 0.00 C ATOM 663 O CYS A 43 -0.956 -6.376 2.290 1.00 0.00 O ATOM 664 CB CYS A 43 -3.710 -5.246 1.228 1.00 0.00 C ATOM 665 SG CYS A 43 -5.426 -4.635 1.401 1.00 0.00 S ATOM 0 H CYS A 43 -2.306 -4.731 3.632 1.00 0.00 H new ATOM 0 HA CYS A 43 -4.173 -6.792 2.582 1.00 0.00 H new ATOM 0 HB2 CYS A 43 -3.022 -4.404 1.145 1.00 0.00 H new ATOM 0 HB3 CYS A 43 -3.613 -5.828 0.312 1.00 0.00 H new ATOM 0 HG CYS A 43 -5.449 -3.636 2.233 1.00 0.00 H new ATOM 671 N GLN A 44 -2.249 -8.184 1.875 1.00 0.00 N ATOM 672 CA GLN A 44 -1.124 -9.067 1.614 1.00 0.00 C ATOM 673 C GLN A 44 -0.468 -8.711 0.279 1.00 0.00 C ATOM 674 O GLN A 44 -0.657 -9.410 -0.716 1.00 0.00 O ATOM 675 CB GLN A 44 -1.561 -10.533 1.637 1.00 0.00 C ATOM 676 CG GLN A 44 -2.557 -10.826 0.513 1.00 0.00 C ATOM 677 CD GLN A 44 -3.902 -11.287 1.078 1.00 0.00 C ATOM 678 OE1 GLN A 44 -4.204 -11.116 2.248 1.00 0.00 O ATOM 679 NE2 GLN A 44 -4.690 -11.879 0.185 1.00 0.00 N ATOM 0 H GLN A 44 -3.165 -8.625 1.794 1.00 0.00 H new ATOM 0 HA GLN A 44 -0.388 -8.929 2.406 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -0.689 -11.178 1.532 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -2.015 -10.766 2.600 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -2.701 -9.931 -0.093 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -2.152 -11.595 -0.145 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -4.375 -11.990 -0.779 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -5.609 -12.222 0.464 1.00 0.00 H new ATOM 688 N MET A 45 0.289 -7.624 0.299 1.00 0.00 N ATOM 689 CA MET A 45 0.974 -7.167 -0.899 1.00 0.00 C ATOM 690 C MET A 45 2.029 -8.180 -1.347 1.00 0.00 C ATOM 691 O MET A 45 2.578 -8.914 -0.527 1.00 0.00 O ATOM 692 CB MET A 45 1.645 -5.820 -0.620 1.00 0.00 C ATOM 693 CG MET A 45 2.294 -5.259 -1.887 1.00 0.00 C ATOM 694 SD MET A 45 1.041 -4.881 -3.100 1.00 0.00 S ATOM 695 CE MET A 45 0.150 -3.599 -2.236 1.00 0.00 C ATOM 0 H MET A 45 0.443 -7.046 1.125 1.00 0.00 H new ATOM 0 HA MET A 45 0.239 -7.059 -1.697 1.00 0.00 H new ATOM 0 HB2 MET A 45 0.907 -5.113 -0.242 1.00 0.00 H new ATOM 0 HB3 MET A 45 2.400 -5.939 0.157 1.00 0.00 H new ATOM 0 HG2 MET A 45 2.862 -4.360 -1.647 1.00 0.00 H new ATOM 0 HG3 MET A 45 3.000 -5.983 -2.295 1.00 0.00 H new ATOM 0 HE1 MET A 45 -0.382 -2.977 -2.956 1.00 0.00 H new ATOM 0 HE2 MET A 45 -0.565 -4.052 -1.550 1.00 0.00 H new ATOM 0 HE3 MET A 45 0.852 -2.983 -1.674 1.00 0.00 H new ATOM 705 N SER A 46 2.281 -8.187 -2.648 1.00 0.00 N ATOM 706 CA SER A 46 3.260 -9.097 -3.216 1.00 0.00 C ATOM 707 C SER A 46 4.053 -8.393 -4.318 1.00 0.00 C ATOM 708 O SER A 46 3.652 -7.332 -4.795 1.00 0.00 O ATOM 709 CB SER A 46 2.588 -10.356 -3.767 1.00 0.00 C ATOM 710 OG SER A 46 1.202 -10.150 -4.026 1.00 0.00 O ATOM 0 H SER A 46 1.824 -7.576 -3.325 1.00 0.00 H new ATOM 0 HA SER A 46 3.944 -9.400 -2.423 1.00 0.00 H new ATOM 0 HB2 SER A 46 3.087 -10.661 -4.687 1.00 0.00 H new ATOM 0 HB3 SER A 46 2.707 -11.172 -3.054 1.00 0.00 H new ATOM 0 HG SER A 46 0.716 -10.091 -3.177 1.00 0.00 H new ATOM 716 N ILE A 47 5.165 -9.010 -4.691 1.00 0.00 N ATOM 717 CA ILE A 47 6.017 -8.455 -5.728 1.00 0.00 C ATOM 718 C ILE A 47 5.238 -8.394 -7.044 1.00 0.00 C ATOM 719 O ILE A 47 5.163 -7.342 -7.677 1.00 0.00 O ATOM 720 CB ILE A 47 7.326 -9.242 -5.824 1.00 0.00 C ATOM 721 CG1 ILE A 47 8.021 -9.318 -4.463 1.00 0.00 C ATOM 722 CG2 ILE A 47 8.240 -8.656 -6.902 1.00 0.00 C ATOM 723 CD1 ILE A 47 9.006 -10.488 -4.415 1.00 0.00 C ATOM 0 H ILE A 47 5.495 -9.889 -4.293 1.00 0.00 H new ATOM 0 HA ILE A 47 6.304 -7.433 -5.479 1.00 0.00 H new ATOM 0 HB ILE A 47 7.089 -10.263 -6.122 1.00 0.00 H new ATOM 0 HG12 ILE A 47 8.549 -8.385 -4.268 1.00 0.00 H new ATOM 0 HG13 ILE A 47 7.276 -9.433 -3.676 1.00 0.00 H new ATOM 0 HG21 ILE A 47 9.163 -9.234 -6.950 1.00 0.00 H new ATOM 0 HG22 ILE A 47 7.736 -8.697 -7.868 1.00 0.00 H new ATOM 0 HG23 ILE A 47 8.473 -7.620 -6.658 1.00 0.00 H new ATOM 0 HD11 ILE A 47 9.486 -10.519 -3.437 1.00 0.00 H new ATOM 0 HD12 ILE A 47 8.470 -11.422 -4.586 1.00 0.00 H new ATOM 0 HD13 ILE A 47 9.764 -10.357 -5.187 1.00 0.00 H new ATOM 735 N GLN A 48 4.679 -9.536 -7.417 1.00 0.00 N ATOM 736 CA GLN A 48 3.909 -9.626 -8.646 1.00 0.00 C ATOM 737 C GLN A 48 2.832 -8.540 -8.678 1.00 0.00 C ATOM 738 O GLN A 48 2.712 -7.807 -9.659 1.00 0.00 O ATOM 739 CB GLN A 48 3.291 -11.016 -8.805 1.00 0.00 C ATOM 740 CG GLN A 48 3.485 -11.543 -10.229 1.00 0.00 C ATOM 741 CD GLN A 48 4.948 -11.913 -10.481 1.00 0.00 C ATOM 742 OE1 GLN A 48 5.475 -12.871 -9.941 1.00 0.00 O ATOM 743 NE2 GLN A 48 5.573 -11.102 -11.331 1.00 0.00 N ATOM 0 H GLN A 48 4.744 -10.407 -6.890 1.00 0.00 H new ATOM 0 HA GLN A 48 4.584 -9.466 -9.487 1.00 0.00 H new ATOM 0 HB2 GLN A 48 3.747 -11.704 -8.093 1.00 0.00 H new ATOM 0 HB3 GLN A 48 2.227 -10.974 -8.571 1.00 0.00 H new ATOM 0 HG2 GLN A 48 2.853 -12.417 -10.387 1.00 0.00 H new ATOM 0 HG3 GLN A 48 3.168 -10.787 -10.947 1.00 0.00 H new ATOM 0 HE21 GLN A 48 5.073 -10.317 -11.748 1.00 0.00 H new ATOM 0 HE22 GLN A 48 6.552 -11.265 -11.565 1.00 0.00 H new ATOM 752 N LEU A 49 2.075 -8.470 -7.592 1.00 0.00 N ATOM 753 CA LEU A 49 1.011 -7.486 -7.484 1.00 0.00 C ATOM 754 C LEU A 49 1.619 -6.082 -7.490 1.00 0.00 C ATOM 755 O LEU A 49 1.145 -5.199 -8.203 1.00 0.00 O ATOM 756 CB LEU A 49 0.139 -7.773 -6.260 1.00 0.00 C ATOM 757 CG LEU A 49 -0.693 -9.056 -6.316 1.00 0.00 C ATOM 758 CD1 LEU A 49 -1.566 -9.198 -5.068 1.00 0.00 C ATOM 759 CD2 LEU A 49 -1.518 -9.120 -7.603 1.00 0.00 C ATOM 0 H LEU A 49 2.178 -9.078 -6.780 1.00 0.00 H new ATOM 0 HA LEU A 49 0.344 -7.549 -8.344 1.00 0.00 H new ATOM 0 HB2 LEU A 49 0.783 -7.819 -5.382 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -0.537 -6.931 -6.115 1.00 0.00 H new ATOM 0 HG LEU A 49 -0.010 -9.905 -6.330 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -2.147 -10.118 -5.133 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -0.932 -9.231 -4.182 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -2.242 -8.346 -4.998 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -2.100 -10.042 -7.617 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -2.192 -8.265 -7.646 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -0.851 -9.099 -8.464 1.00 0.00 H new ATOM 771 N LEU A 50 2.660 -5.919 -6.686 1.00 0.00 N ATOM 772 CA LEU A 50 3.338 -4.637 -6.590 1.00 0.00 C ATOM 773 C LEU A 50 3.541 -4.066 -7.995 1.00 0.00 C ATOM 774 O LEU A 50 3.590 -2.850 -8.173 1.00 0.00 O ATOM 775 CB LEU A 50 4.634 -4.775 -5.790 1.00 0.00 C ATOM 776 CG LEU A 50 4.587 -4.273 -4.345 1.00 0.00 C ATOM 777 CD1 LEU A 50 5.620 -4.998 -3.479 1.00 0.00 C ATOM 778 CD2 LEU A 50 4.755 -2.754 -4.287 1.00 0.00 C ATOM 0 H LEU A 50 3.050 -6.653 -6.095 1.00 0.00 H new ATOM 0 HA LEU A 50 2.725 -3.923 -6.040 1.00 0.00 H new ATOM 0 HB2 LEU A 50 4.921 -5.827 -5.779 1.00 0.00 H new ATOM 0 HB3 LEU A 50 5.422 -4.235 -6.316 1.00 0.00 H new ATOM 0 HG LEU A 50 3.604 -4.504 -3.935 1.00 0.00 H new ATOM 0 HD11 LEU A 50 5.566 -4.623 -2.457 1.00 0.00 H new ATOM 0 HD12 LEU A 50 5.412 -6.068 -3.484 1.00 0.00 H new ATOM 0 HD13 LEU A 50 6.619 -4.820 -3.878 1.00 0.00 H new ATOM 0 HD21 LEU A 50 4.718 -2.423 -3.249 1.00 0.00 H new ATOM 0 HD22 LEU A 50 5.715 -2.477 -4.722 1.00 0.00 H new ATOM 0 HD23 LEU A 50 3.952 -2.277 -4.849 1.00 0.00 H new ATOM 790 N GLN A 51 3.652 -4.970 -8.957 1.00 0.00 N ATOM 791 CA GLN A 51 3.848 -4.571 -10.340 1.00 0.00 C ATOM 792 C GLN A 51 2.503 -4.262 -10.999 1.00 0.00 C ATOM 793 O GLN A 51 2.298 -3.163 -11.514 1.00 0.00 O ATOM 794 CB GLN A 51 4.606 -5.648 -11.119 1.00 0.00 C ATOM 795 CG GLN A 51 6.027 -5.818 -10.580 1.00 0.00 C ATOM 796 CD GLN A 51 6.854 -6.729 -11.490 1.00 0.00 C ATOM 797 OE1 GLN A 51 6.611 -6.846 -12.680 1.00 0.00 O ATOM 798 NE2 GLN A 51 7.841 -7.365 -10.866 1.00 0.00 N ATOM 0 H GLN A 51 3.610 -5.978 -8.806 1.00 0.00 H new ATOM 0 HA GLN A 51 4.454 -3.665 -10.354 1.00 0.00 H new ATOM 0 HB2 GLN A 51 4.072 -6.595 -11.050 1.00 0.00 H new ATOM 0 HB3 GLN A 51 4.644 -5.379 -12.175 1.00 0.00 H new ATOM 0 HG2 GLN A 51 6.509 -4.843 -10.501 1.00 0.00 H new ATOM 0 HG3 GLN A 51 5.991 -6.238 -9.575 1.00 0.00 H new ATOM 0 HE21 GLN A 51 7.989 -7.221 -9.867 1.00 0.00 H new ATOM 0 HE22 GLN A 51 8.450 -7.996 -11.386 1.00 0.00 H new ATOM 807 N THR A 52 1.620 -5.249 -10.961 1.00 0.00 N ATOM 808 CA THR A 52 0.300 -5.096 -11.548 1.00 0.00 C ATOM 809 C THR A 52 -0.419 -3.891 -10.937 1.00 0.00 C ATOM 810 O THR A 52 -0.810 -2.969 -11.652 1.00 0.00 O ATOM 811 CB THR A 52 -0.456 -6.413 -11.362 1.00 0.00 C ATOM 812 OG1 THR A 52 -0.653 -6.504 -9.954 1.00 0.00 O ATOM 813 CG2 THR A 52 0.403 -7.634 -11.698 1.00 0.00 C ATOM 0 H THR A 52 1.793 -6.158 -10.532 1.00 0.00 H new ATOM 0 HA THR A 52 0.364 -4.889 -12.616 1.00 0.00 H new ATOM 0 HB THR A 52 -1.347 -6.412 -11.990 1.00 0.00 H new ATOM 0 HG1 THR A 52 -1.556 -6.839 -9.771 1.00 0.00 H new ATOM 0 HG21 THR A 52 -0.181 -8.542 -11.549 1.00 0.00 H new ATOM 0 HG22 THR A 52 0.726 -7.577 -12.737 1.00 0.00 H new ATOM 0 HG23 THR A 52 1.277 -7.654 -11.047 1.00 0.00 H new ATOM 821 N THR A 53 -0.571 -3.938 -9.622 1.00 0.00 N ATOM 822 CA THR A 53 -1.236 -2.862 -8.907 1.00 0.00 C ATOM 823 C THR A 53 -0.423 -1.570 -9.011 1.00 0.00 C ATOM 824 O THR A 53 -0.983 -0.475 -8.982 1.00 0.00 O ATOM 825 CB THR A 53 -1.463 -3.322 -7.465 1.00 0.00 C ATOM 826 OG1 THR A 53 -0.154 -3.614 -6.984 1.00 0.00 O ATOM 827 CG2 THR A 53 -2.197 -4.662 -7.387 1.00 0.00 C ATOM 0 H THR A 53 -0.245 -4.704 -9.033 1.00 0.00 H new ATOM 0 HA THR A 53 -2.207 -2.635 -9.348 1.00 0.00 H new ATOM 0 HB THR A 53 -2.033 -2.564 -6.927 1.00 0.00 H new ATOM 0 HG1 THR A 53 0.375 -4.022 -7.701 1.00 0.00 H new ATOM 0 HG21 THR A 53 -2.332 -4.942 -6.342 1.00 0.00 H new ATOM 0 HG22 THR A 53 -3.171 -4.572 -7.868 1.00 0.00 H new ATOM 0 HG23 THR A 53 -1.611 -5.428 -7.895 1.00 0.00 H new ATOM 835 N ARG A 54 0.886 -1.740 -9.131 1.00 0.00 N ATOM 836 CA ARG A 54 1.781 -0.601 -9.240 1.00 0.00 C ATOM 837 C ARG A 54 1.449 0.440 -8.170 1.00 0.00 C ATOM 838 O ARG A 54 1.587 1.640 -8.402 1.00 0.00 O ATOM 839 CB ARG A 54 1.681 0.048 -10.622 1.00 0.00 C ATOM 840 CG ARG A 54 3.070 0.333 -11.196 1.00 0.00 C ATOM 841 CD ARG A 54 3.291 -0.432 -12.503 1.00 0.00 C ATOM 842 NE ARG A 54 4.391 0.190 -13.273 1.00 0.00 N ATOM 843 CZ ARG A 54 4.282 1.350 -13.935 1.00 0.00 C ATOM 844 NH1 ARG A 54 3.122 2.022 -13.924 1.00 0.00 N ATOM 845 NH2 ARG A 54 5.333 1.839 -14.608 1.00 0.00 N ATOM 0 H ARG A 54 1.348 -2.649 -9.155 1.00 0.00 H new ATOM 0 HA ARG A 54 2.798 -0.964 -9.094 1.00 0.00 H new ATOM 0 HB2 ARG A 54 1.132 -0.609 -11.297 1.00 0.00 H new ATOM 0 HB3 ARG A 54 1.115 0.977 -10.551 1.00 0.00 H new ATOM 0 HG2 ARG A 54 3.182 1.403 -11.373 1.00 0.00 H new ATOM 0 HG3 ARG A 54 3.832 0.049 -10.471 1.00 0.00 H new ATOM 0 HD2 ARG A 54 3.530 -1.474 -12.288 1.00 0.00 H new ATOM 0 HD3 ARG A 54 2.375 -0.430 -13.095 1.00 0.00 H new ATOM 0 HE ARG A 54 5.288 -0.294 -13.302 1.00 0.00 H new ATOM 0 HH11 ARG A 54 2.322 1.650 -13.412 1.00 0.00 H new ATOM 0 HH12 ARG A 54 3.039 2.905 -14.428 1.00 0.00 H new ATOM 0 HH21 ARG A 54 6.216 1.328 -14.616 1.00 0.00 H new ATOM 0 HH22 ARG A 54 5.250 2.722 -15.112 1.00 0.00 H new ATOM 859 N ILE A 55 1.017 -0.057 -7.020 1.00 0.00 N ATOM 860 CA ILE A 55 0.664 0.815 -5.913 1.00 0.00 C ATOM 861 C ILE A 55 1.928 1.492 -5.379 1.00 0.00 C ATOM 862 O ILE A 55 1.848 2.502 -4.681 1.00 0.00 O ATOM 863 CB ILE A 55 -0.116 0.041 -4.848 1.00 0.00 C ATOM 864 CG1 ILE A 55 -0.765 0.994 -3.842 1.00 0.00 C ATOM 865 CG2 ILE A 55 0.775 -0.997 -4.162 1.00 0.00 C ATOM 866 CD1 ILE A 55 -2.203 1.323 -4.247 1.00 0.00 C ATOM 0 H ILE A 55 0.904 -1.053 -6.831 1.00 0.00 H new ATOM 0 HA ILE A 55 -0.004 1.607 -6.251 1.00 0.00 H new ATOM 0 HB ILE A 55 -0.921 -0.502 -5.342 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -0.757 0.542 -2.850 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -0.182 1.913 -3.778 1.00 0.00 H new ATOM 0 HG21 ILE A 55 0.196 -1.533 -3.410 1.00 0.00 H new ATOM 0 HG22 ILE A 55 1.148 -1.703 -4.904 1.00 0.00 H new ATOM 0 HG23 ILE A 55 1.616 -0.495 -3.683 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -2.641 2.002 -3.515 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -2.205 1.797 -5.229 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -2.789 0.405 -4.286 1.00 0.00 H new ATOM 878 N GLY A 56 3.065 0.909 -5.727 1.00 0.00 N ATOM 879 CA GLY A 56 4.344 1.443 -5.292 1.00 0.00 C ATOM 880 C GLY A 56 4.520 2.891 -5.753 1.00 0.00 C ATOM 881 O GLY A 56 4.956 3.743 -4.982 1.00 0.00 O ATOM 0 H GLY A 56 3.127 0.071 -6.306 1.00 0.00 H new ATOM 0 HA2 GLY A 56 4.412 1.393 -4.205 1.00 0.00 H new ATOM 0 HA3 GLY A 56 5.152 0.830 -5.691 1.00 0.00 H new ATOM 885 N VAL A 57 4.170 3.124 -7.010 1.00 0.00 N ATOM 886 CA VAL A 57 4.284 4.455 -7.583 1.00 0.00 C ATOM 887 C VAL A 57 3.217 5.363 -6.968 1.00 0.00 C ATOM 888 O VAL A 57 3.443 6.559 -6.789 1.00 0.00 O ATOM 889 CB VAL A 57 4.195 4.376 -9.109 1.00 0.00 C ATOM 890 CG1 VAL A 57 2.961 3.584 -9.546 1.00 0.00 C ATOM 891 CG2 VAL A 57 4.198 5.774 -9.730 1.00 0.00 C ATOM 0 H VAL A 57 3.808 2.414 -7.647 1.00 0.00 H new ATOM 0 HA VAL A 57 5.255 4.891 -7.349 1.00 0.00 H new ATOM 0 HB VAL A 57 5.077 3.847 -9.470 1.00 0.00 H new ATOM 0 HG11 VAL A 57 2.922 3.543 -10.635 1.00 0.00 H new ATOM 0 HG12 VAL A 57 3.018 2.571 -9.147 1.00 0.00 H new ATOM 0 HG13 VAL A 57 2.063 4.073 -9.169 1.00 0.00 H new ATOM 0 HG21 VAL A 57 4.134 5.690 -10.815 1.00 0.00 H new ATOM 0 HG22 VAL A 57 3.343 6.339 -9.359 1.00 0.00 H new ATOM 0 HG23 VAL A 57 5.119 6.290 -9.460 1.00 0.00 H new ATOM 901 N ALA A 58 2.078 4.760 -6.661 1.00 0.00 N ATOM 902 CA ALA A 58 0.976 5.500 -6.070 1.00 0.00 C ATOM 903 C ALA A 58 1.407 6.049 -4.709 1.00 0.00 C ATOM 904 O ALA A 58 1.533 7.260 -4.536 1.00 0.00 O ATOM 905 CB ALA A 58 -0.253 4.593 -5.970 1.00 0.00 C ATOM 0 H ALA A 58 1.894 3.768 -6.810 1.00 0.00 H new ATOM 0 HA ALA A 58 0.705 6.349 -6.697 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -1.080 5.148 -5.527 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -0.537 4.254 -6.966 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -0.019 3.731 -5.346 1.00 0.00 H new ATOM 911 N VAL A 59 1.623 5.131 -3.778 1.00 0.00 N ATOM 912 CA VAL A 59 2.038 5.509 -2.437 1.00 0.00 C ATOM 913 C VAL A 59 3.111 6.595 -2.527 1.00 0.00 C ATOM 914 O VAL A 59 2.909 7.713 -2.054 1.00 0.00 O ATOM 915 CB VAL A 59 2.503 4.272 -1.666 1.00 0.00 C ATOM 916 CG1 VAL A 59 2.983 4.649 -0.263 1.00 0.00 C ATOM 917 CG2 VAL A 59 1.396 3.217 -1.602 1.00 0.00 C ATOM 0 H VAL A 59 1.519 4.127 -3.925 1.00 0.00 H new ATOM 0 HA VAL A 59 1.199 5.927 -1.881 1.00 0.00 H new ATOM 0 HB VAL A 59 3.347 3.840 -2.204 1.00 0.00 H new ATOM 0 HG11 VAL A 59 3.308 3.752 0.264 1.00 0.00 H new ATOM 0 HG12 VAL A 59 3.817 5.347 -0.339 1.00 0.00 H new ATOM 0 HG13 VAL A 59 2.167 5.117 0.287 1.00 0.00 H new ATOM 0 HG21 VAL A 59 1.753 2.348 -1.049 1.00 0.00 H new ATOM 0 HG22 VAL A 59 0.524 3.635 -1.099 1.00 0.00 H new ATOM 0 HG23 VAL A 59 1.122 2.916 -2.613 1.00 0.00 H new ATOM 927 N ASN A 60 4.229 6.230 -3.138 1.00 0.00 N ATOM 928 CA ASN A 60 5.334 7.159 -3.296 1.00 0.00 C ATOM 929 C ASN A 60 4.821 8.450 -3.938 1.00 0.00 C ATOM 930 O ASN A 60 5.153 9.546 -3.489 1.00 0.00 O ATOM 931 CB ASN A 60 6.418 6.577 -4.204 1.00 0.00 C ATOM 932 CG ASN A 60 7.771 6.539 -3.490 1.00 0.00 C ATOM 933 OD1 ASN A 60 8.495 5.558 -3.528 1.00 0.00 O ATOM 934 ND2 ASN A 60 8.069 7.659 -2.837 1.00 0.00 N ATOM 0 H ASN A 60 4.393 5.303 -3.530 1.00 0.00 H new ATOM 0 HA ASN A 60 5.756 7.352 -2.310 1.00 0.00 H new ATOM 0 HB2 ASN A 60 6.137 5.570 -4.512 1.00 0.00 H new ATOM 0 HB3 ASN A 60 6.498 7.177 -5.111 1.00 0.00 H new ATOM 0 HD21 ASN A 60 8.949 7.733 -2.327 1.00 0.00 H new ATOM 0 HD22 ASN A 60 7.417 8.443 -2.846 1.00 0.00 H new ATOM 941 N GLY A 61 4.021 8.277 -4.980 1.00 0.00 N ATOM 942 CA GLY A 61 3.459 9.414 -5.689 1.00 0.00 C ATOM 943 C GLY A 61 2.740 10.360 -4.726 1.00 0.00 C ATOM 944 O GLY A 61 2.698 11.568 -4.953 1.00 0.00 O ATOM 0 H GLY A 61 3.749 7.366 -5.350 1.00 0.00 H new ATOM 0 HA2 GLY A 61 4.252 9.952 -6.208 1.00 0.00 H new ATOM 0 HA3 GLY A 61 2.761 9.064 -6.449 1.00 0.00 H new ATOM 948 N VAL A 62 2.193 9.776 -3.670 1.00 0.00 N ATOM 949 CA VAL A 62 1.478 10.552 -2.671 1.00 0.00 C ATOM 950 C VAL A 62 2.477 11.114 -1.658 1.00 0.00 C ATOM 951 O VAL A 62 2.488 12.315 -1.392 1.00 0.00 O ATOM 952 CB VAL A 62 0.388 9.695 -2.024 1.00 0.00 C ATOM 953 CG1 VAL A 62 -0.727 10.570 -1.449 1.00 0.00 C ATOM 954 CG2 VAL A 62 -0.171 8.676 -3.019 1.00 0.00 C ATOM 0 H VAL A 62 2.231 8.774 -3.484 1.00 0.00 H new ATOM 0 HA VAL A 62 0.973 11.400 -3.135 1.00 0.00 H new ATOM 0 HB VAL A 62 0.840 9.144 -1.199 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -1.489 9.937 -0.995 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -0.313 11.238 -0.693 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -1.175 11.160 -2.248 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -0.944 8.080 -2.534 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -0.600 9.199 -3.874 1.00 0.00 H new ATOM 0 HG23 VAL A 62 0.632 8.022 -3.359 1.00 0.00 H new ATOM 964 N ARG A 63 3.293 10.219 -1.120 1.00 0.00 N ATOM 965 CA ARG A 63 4.293 10.610 -0.141 1.00 0.00 C ATOM 966 C ARG A 63 5.124 11.781 -0.671 1.00 0.00 C ATOM 967 O ARG A 63 5.750 12.503 0.103 1.00 0.00 O ATOM 968 CB ARG A 63 5.224 9.443 0.192 1.00 0.00 C ATOM 969 CG ARG A 63 6.494 9.936 0.889 1.00 0.00 C ATOM 970 CD ARG A 63 7.468 8.782 1.134 1.00 0.00 C ATOM 971 NE ARG A 63 8.739 9.301 1.686 1.00 0.00 N ATOM 972 CZ ARG A 63 9.658 9.960 0.967 1.00 0.00 C ATOM 973 NH1 ARG A 63 9.452 10.184 -0.338 1.00 0.00 N ATOM 974 NH2 ARG A 63 10.782 10.395 1.552 1.00 0.00 N ATOM 0 H ARG A 63 3.282 9.224 -1.344 1.00 0.00 H new ATOM 0 HA ARG A 63 3.769 10.912 0.766 1.00 0.00 H new ATOM 0 HB2 ARG A 63 4.705 8.731 0.834 1.00 0.00 H new ATOM 0 HB3 ARG A 63 5.489 8.913 -0.722 1.00 0.00 H new ATOM 0 HG2 ARG A 63 6.975 10.699 0.278 1.00 0.00 H new ATOM 0 HG3 ARG A 63 6.234 10.405 1.838 1.00 0.00 H new ATOM 0 HD2 ARG A 63 7.028 8.064 1.826 1.00 0.00 H new ATOM 0 HD3 ARG A 63 7.657 8.251 0.201 1.00 0.00 H new ATOM 0 HE ARG A 63 8.928 9.147 2.677 1.00 0.00 H new ATOM 0 HH11 ARG A 63 8.596 9.853 -0.783 1.00 0.00 H new ATOM 0 HH12 ARG A 63 10.151 10.686 -0.886 1.00 0.00 H new ATOM 0 HH21 ARG A 63 10.939 10.225 2.545 1.00 0.00 H new ATOM 0 HH22 ARG A 63 11.481 10.896 1.004 1.00 0.00 H new ATOM 988 N LYS A 64 5.103 11.932 -1.987 1.00 0.00 N ATOM 989 CA LYS A 64 5.847 13.002 -2.630 1.00 0.00 C ATOM 990 C LYS A 64 5.089 14.320 -2.455 1.00 0.00 C ATOM 991 O LYS A 64 5.606 15.263 -1.858 1.00 0.00 O ATOM 992 CB LYS A 64 6.140 12.650 -4.090 1.00 0.00 C ATOM 993 CG LYS A 64 7.634 12.770 -4.393 1.00 0.00 C ATOM 994 CD LYS A 64 7.867 13.473 -5.732 1.00 0.00 C ATOM 995 CE LYS A 64 9.166 14.281 -5.709 1.00 0.00 C ATOM 996 NZ LYS A 64 8.909 15.662 -5.243 1.00 0.00 N ATOM 0 H LYS A 64 4.582 11.331 -2.626 1.00 0.00 H new ATOM 0 HA LYS A 64 6.820 13.127 -2.156 1.00 0.00 H new ATOM 0 HB2 LYS A 64 5.804 11.634 -4.298 1.00 0.00 H new ATOM 0 HB3 LYS A 64 5.577 13.313 -4.748 1.00 0.00 H new ATOM 0 HG2 LYS A 64 8.127 13.326 -3.596 1.00 0.00 H new ATOM 0 HG3 LYS A 64 8.085 11.778 -4.416 1.00 0.00 H new ATOM 0 HD2 LYS A 64 7.908 12.734 -6.532 1.00 0.00 H new ATOM 0 HD3 LYS A 64 7.028 14.133 -5.951 1.00 0.00 H new ATOM 0 HE2 LYS A 64 9.890 13.798 -5.053 1.00 0.00 H new ATOM 0 HE3 LYS A 64 9.605 14.303 -6.706 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 9.801 16.197 -5.233 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 8.235 16.125 -5.885 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 8.511 15.636 -4.283 1.00 0.00 H new ATOM 1010 N HIS A 65 3.876 14.343 -2.986 1.00 0.00 N ATOM 1011 CA HIS A 65 3.042 15.529 -2.897 1.00 0.00 C ATOM 1012 C HIS A 65 2.501 15.670 -1.472 1.00 0.00 C ATOM 1013 O HIS A 65 2.518 16.761 -0.903 1.00 0.00 O ATOM 1014 CB HIS A 65 1.933 15.495 -3.950 1.00 0.00 C ATOM 1015 CG HIS A 65 2.438 15.489 -5.373 1.00 0.00 C ATOM 1016 ND1 HIS A 65 2.604 14.462 -6.256 1.00 0.00 N flip ATOM 1017 CD2 HIS A 65 2.839 16.638 -6.032 1.00 0.00 C flip ATOM 1018 CE1 HIS A 65 3.079 14.957 -7.392 1.00 0.00 C flip ATOM 1019 NE2 HIS A 65 3.226 16.306 -7.255 1.00 0.00 N flip ATOM 0 H HIS A 65 3.450 13.559 -3.480 1.00 0.00 H new ATOM 0 HA HIS A 65 3.640 16.415 -3.112 1.00 0.00 H new ATOM 0 HB2 HIS A 65 1.320 14.608 -3.789 1.00 0.00 H new ATOM 0 HB3 HIS A 65 1.285 16.360 -3.809 1.00 0.00 H new ATOM 0 HD2 HIS A 65 2.837 17.636 -5.619 1.00 0.00 H new ATOM 0 HE1 HIS A 65 3.311 14.386 -8.279 1.00 0.00 H new ATOM 0 HE2 HIS A 65 3.573 16.947 -7.969 1.00 0.00 H new ATOM 1027 N CYS A 66 2.035 14.552 -0.937 1.00 0.00 N ATOM 1028 CA CYS A 66 1.491 14.537 0.410 1.00 0.00 C ATOM 1029 C CYS A 66 2.477 15.254 1.335 1.00 0.00 C ATOM 1030 O CYS A 66 3.647 14.882 1.408 1.00 0.00 O ATOM 1031 CB CYS A 66 1.196 13.113 0.886 1.00 0.00 C ATOM 1032 SG CYS A 66 -0.069 13.144 2.208 1.00 0.00 S ATOM 0 H CYS A 66 2.023 13.649 -1.412 1.00 0.00 H new ATOM 0 HA CYS A 66 0.535 15.060 0.424 1.00 0.00 H new ATOM 0 HB2 CYS A 66 0.846 12.507 0.051 1.00 0.00 H new ATOM 0 HB3 CYS A 66 2.110 12.648 1.256 1.00 0.00 H new ATOM 0 HG CYS A 66 -1.253 13.055 1.678 1.00 0.00 H new ATOM 1038 N SER A 67 1.968 16.269 2.017 1.00 0.00 N ATOM 1039 CA SER A 67 2.789 17.042 2.933 1.00 0.00 C ATOM 1040 C SER A 67 2.435 16.688 4.379 1.00 0.00 C ATOM 1041 O SER A 67 3.158 17.051 5.306 1.00 0.00 O ATOM 1042 CB SER A 67 2.615 18.544 2.697 1.00 0.00 C ATOM 1043 OG SER A 67 3.480 19.026 1.672 1.00 0.00 O ATOM 0 H SER A 67 0.997 16.574 1.954 1.00 0.00 H new ATOM 0 HA SER A 67 3.834 16.792 2.749 1.00 0.00 H new ATOM 0 HB2 SER A 67 1.580 18.751 2.425 1.00 0.00 H new ATOM 0 HB3 SER A 67 2.815 19.082 3.623 1.00 0.00 H new ATOM 0 HG SER A 67 3.338 19.988 1.550 1.00 0.00 H new ATOM 1049 N ASP A 68 1.322 15.984 4.526 1.00 0.00 N ATOM 1050 CA ASP A 68 0.863 15.577 5.843 1.00 0.00 C ATOM 1051 C ASP A 68 1.984 14.819 6.558 1.00 0.00 C ATOM 1052 O ASP A 68 3.108 14.753 6.062 1.00 0.00 O ATOM 1053 CB ASP A 68 -0.346 14.646 5.742 1.00 0.00 C ATOM 1054 CG ASP A 68 -1.557 15.064 6.579 1.00 0.00 C ATOM 1055 OD1 ASP A 68 -1.670 16.280 6.844 1.00 0.00 O ATOM 1056 OD2 ASP A 68 -2.341 14.158 6.935 1.00 0.00 O ATOM 0 H ASP A 68 0.725 15.685 3.755 1.00 0.00 H new ATOM 0 HA ASP A 68 0.582 16.475 6.394 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -0.650 14.582 4.697 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -0.041 13.645 6.047 1.00 0.00 H new ATOM 1061 N LYS A 69 1.640 14.265 7.711 1.00 0.00 N ATOM 1062 CA LYS A 69 2.603 13.515 8.499 1.00 0.00 C ATOM 1063 C LYS A 69 2.119 12.071 8.647 1.00 0.00 C ATOM 1064 O LYS A 69 2.852 11.132 8.337 1.00 0.00 O ATOM 1065 CB LYS A 69 2.866 14.215 9.833 1.00 0.00 C ATOM 1066 CG LYS A 69 3.712 13.336 10.756 1.00 0.00 C ATOM 1067 CD LYS A 69 4.516 14.189 11.740 1.00 0.00 C ATOM 1068 CE LYS A 69 5.991 13.779 11.741 1.00 0.00 C ATOM 1069 NZ LYS A 69 6.827 14.854 11.160 1.00 0.00 N ATOM 0 H LYS A 69 0.707 14.321 8.119 1.00 0.00 H new ATOM 0 HA LYS A 69 3.566 13.479 7.990 1.00 0.00 H new ATOM 0 HB2 LYS A 69 3.378 15.161 9.657 1.00 0.00 H new ATOM 0 HB3 LYS A 69 1.918 14.450 10.317 1.00 0.00 H new ATOM 0 HG2 LYS A 69 3.066 12.652 11.306 1.00 0.00 H new ATOM 0 HG3 LYS A 69 4.390 12.724 10.161 1.00 0.00 H new ATOM 0 HD2 LYS A 69 4.427 15.242 11.471 1.00 0.00 H new ATOM 0 HD3 LYS A 69 4.104 14.080 12.743 1.00 0.00 H new ATOM 0 HE2 LYS A 69 6.315 13.568 12.760 1.00 0.00 H new ATOM 0 HE3 LYS A 69 6.120 12.860 11.169 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 7.825 14.560 11.168 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 6.527 15.036 10.181 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 6.717 15.722 11.723 1.00 0.00 H new ATOM 1083 N GLU A 70 0.889 11.938 9.120 1.00 0.00 N ATOM 1084 CA GLU A 70 0.299 10.625 9.314 1.00 0.00 C ATOM 1085 C GLU A 70 0.073 9.941 7.964 1.00 0.00 C ATOM 1086 O GLU A 70 0.466 8.791 7.772 1.00 0.00 O ATOM 1087 CB GLU A 70 -1.006 10.721 10.106 1.00 0.00 C ATOM 1088 CG GLU A 70 -0.739 10.670 11.611 1.00 0.00 C ATOM 1089 CD GLU A 70 -0.621 12.080 12.195 1.00 0.00 C ATOM 1090 OE1 GLU A 70 -1.411 12.944 11.756 1.00 0.00 O ATOM 1091 OE2 GLU A 70 0.256 12.262 13.066 1.00 0.00 O ATOM 0 H GLU A 70 0.284 12.719 9.375 1.00 0.00 H new ATOM 0 HA GLU A 70 0.993 10.018 9.895 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -1.520 11.649 9.856 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -1.668 9.903 9.823 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -1.546 10.133 12.109 1.00 0.00 H new ATOM 0 HG3 GLU A 70 0.179 10.115 11.802 1.00 0.00 H new ATOM 1098 N VAL A 71 -0.561 10.677 7.062 1.00 0.00 N ATOM 1099 CA VAL A 71 -0.844 10.156 5.736 1.00 0.00 C ATOM 1100 C VAL A 71 0.471 9.790 5.045 1.00 0.00 C ATOM 1101 O VAL A 71 0.525 8.833 4.274 1.00 0.00 O ATOM 1102 CB VAL A 71 -1.675 11.168 4.943 1.00 0.00 C ATOM 1103 CG1 VAL A 71 -1.703 10.809 3.456 1.00 0.00 C ATOM 1104 CG2 VAL A 71 -3.093 11.275 5.508 1.00 0.00 C ATOM 0 H VAL A 71 -0.886 11.630 7.224 1.00 0.00 H new ATOM 0 HA VAL A 71 -1.440 9.246 5.802 1.00 0.00 H new ATOM 0 HB VAL A 71 -1.200 12.144 5.043 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -2.300 11.544 2.916 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -0.686 10.807 3.063 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -2.143 9.820 3.329 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -3.662 12.000 4.927 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -3.581 10.302 5.452 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -3.047 11.599 6.548 1.00 0.00 H new ATOM 1114 N VAL A 72 1.498 10.572 5.345 1.00 0.00 N ATOM 1115 CA VAL A 72 2.808 10.341 4.762 1.00 0.00 C ATOM 1116 C VAL A 72 3.515 9.223 5.531 1.00 0.00 C ATOM 1117 O VAL A 72 4.269 8.445 4.949 1.00 0.00 O ATOM 1118 CB VAL A 72 3.607 11.647 4.737 1.00 0.00 C ATOM 1119 CG1 VAL A 72 5.105 11.376 4.893 1.00 0.00 C ATOM 1120 CG2 VAL A 72 3.322 12.439 3.460 1.00 0.00 C ATOM 0 H VAL A 72 1.449 11.366 5.984 1.00 0.00 H new ATOM 0 HA VAL A 72 2.713 10.013 3.727 1.00 0.00 H new ATOM 0 HB VAL A 72 3.287 12.253 5.585 1.00 0.00 H new ATOM 0 HG11 VAL A 72 5.650 12.320 4.872 1.00 0.00 H new ATOM 0 HG12 VAL A 72 5.287 10.873 5.843 1.00 0.00 H new ATOM 0 HG13 VAL A 72 5.447 10.741 4.075 1.00 0.00 H new ATOM 0 HG21 VAL A 72 3.902 13.362 3.467 1.00 0.00 H new ATOM 0 HG22 VAL A 72 3.601 11.842 2.592 1.00 0.00 H new ATOM 0 HG23 VAL A 72 2.260 12.678 3.410 1.00 0.00 H new ATOM 1130 N SER A 73 3.245 9.178 6.827 1.00 0.00 N ATOM 1131 CA SER A 73 3.845 8.168 7.682 1.00 0.00 C ATOM 1132 C SER A 73 3.620 6.777 7.085 1.00 0.00 C ATOM 1133 O SER A 73 4.575 6.089 6.727 1.00 0.00 O ATOM 1134 CB SER A 73 3.274 8.236 9.099 1.00 0.00 C ATOM 1135 OG SER A 73 3.949 7.351 9.990 1.00 0.00 O ATOM 0 H SER A 73 2.619 9.825 7.306 1.00 0.00 H new ATOM 0 HA SER A 73 4.916 8.362 7.742 1.00 0.00 H new ATOM 0 HB2 SER A 73 3.353 9.257 9.473 1.00 0.00 H new ATOM 0 HB3 SER A 73 2.213 7.987 9.075 1.00 0.00 H new ATOM 0 HG SER A 73 3.556 7.425 10.885 1.00 0.00 H new ATOM 1141 N LEU A 74 2.352 6.404 6.996 1.00 0.00 N ATOM 1142 CA LEU A 74 1.989 5.108 6.449 1.00 0.00 C ATOM 1143 C LEU A 74 2.586 4.965 5.047 1.00 0.00 C ATOM 1144 O LEU A 74 3.248 3.973 4.749 1.00 0.00 O ATOM 1145 CB LEU A 74 0.473 4.912 6.495 1.00 0.00 C ATOM 1146 CG LEU A 74 -0.050 3.973 7.584 1.00 0.00 C ATOM 1147 CD1 LEU A 74 -1.562 3.774 7.457 1.00 0.00 C ATOM 1148 CD2 LEU A 74 0.706 2.643 7.572 1.00 0.00 C ATOM 0 H LEU A 74 1.563 6.977 7.294 1.00 0.00 H new ATOM 0 HA LEU A 74 2.409 4.307 7.058 1.00 0.00 H new ATOM 0 HB2 LEU A 74 0.005 5.887 6.628 1.00 0.00 H new ATOM 0 HB3 LEU A 74 0.146 4.531 5.527 1.00 0.00 H new ATOM 0 HG LEU A 74 0.133 4.438 8.552 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -1.908 3.103 8.243 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -2.065 4.736 7.554 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -1.792 3.341 6.483 1.00 0.00 H new ATOM 0 HD21 LEU A 74 0.314 1.995 8.356 1.00 0.00 H new ATOM 0 HD22 LEU A 74 0.577 2.160 6.603 1.00 0.00 H new ATOM 0 HD23 LEU A 74 1.766 2.825 7.748 1.00 0.00 H new ATOM 1160 N ALA A 75 2.329 5.972 4.225 1.00 0.00 N ATOM 1161 CA ALA A 75 2.832 5.972 2.862 1.00 0.00 C ATOM 1162 C ALA A 75 4.306 5.561 2.867 1.00 0.00 C ATOM 1163 O ALA A 75 4.756 4.837 1.980 1.00 0.00 O ATOM 1164 CB ALA A 75 2.614 7.351 2.237 1.00 0.00 C ATOM 0 H ALA A 75 1.779 6.793 4.477 1.00 0.00 H new ATOM 0 HA ALA A 75 2.290 5.249 2.253 1.00 0.00 H new ATOM 0 HB1 ALA A 75 2.991 7.351 1.214 1.00 0.00 H new ATOM 0 HB2 ALA A 75 1.549 7.583 2.231 1.00 0.00 H new ATOM 0 HB3 ALA A 75 3.146 8.103 2.820 1.00 0.00 H new ATOM 1170 N LYS A 76 5.018 6.041 3.876 1.00 0.00 N ATOM 1171 CA LYS A 76 6.432 5.733 4.009 1.00 0.00 C ATOM 1172 C LYS A 76 6.597 4.246 4.331 1.00 0.00 C ATOM 1173 O LYS A 76 7.294 3.527 3.617 1.00 0.00 O ATOM 1174 CB LYS A 76 7.089 6.661 5.032 1.00 0.00 C ATOM 1175 CG LYS A 76 7.704 7.884 4.349 1.00 0.00 C ATOM 1176 CD LYS A 76 8.319 8.835 5.377 1.00 0.00 C ATOM 1177 CE LYS A 76 8.349 10.270 4.846 1.00 0.00 C ATOM 1178 NZ LYS A 76 9.739 10.776 4.798 1.00 0.00 N ATOM 0 H LYS A 76 4.642 6.641 4.610 1.00 0.00 H new ATOM 0 HA LYS A 76 6.952 5.916 3.069 1.00 0.00 H new ATOM 0 HB2 LYS A 76 6.348 6.983 5.764 1.00 0.00 H new ATOM 0 HB3 LYS A 76 7.861 6.118 5.577 1.00 0.00 H new ATOM 0 HG2 LYS A 76 8.469 7.564 3.642 1.00 0.00 H new ATOM 0 HG3 LYS A 76 6.939 8.408 3.776 1.00 0.00 H new ATOM 0 HD2 LYS A 76 7.744 8.798 6.302 1.00 0.00 H new ATOM 0 HD3 LYS A 76 9.332 8.511 5.618 1.00 0.00 H new ATOM 0 HE2 LYS A 76 7.909 10.305 3.850 1.00 0.00 H new ATOM 0 HE3 LYS A 76 7.743 10.913 5.485 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 9.789 11.593 4.157 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 10.036 11.065 5.752 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 10.370 10.025 4.452 1.00 0.00 H new ATOM 1192 N VAL A 77 5.945 3.831 5.407 1.00 0.00 N ATOM 1193 CA VAL A 77 6.011 2.443 5.832 1.00 0.00 C ATOM 1194 C VAL A 77 5.698 1.534 4.642 1.00 0.00 C ATOM 1195 O VAL A 77 6.417 0.568 4.388 1.00 0.00 O ATOM 1196 CB VAL A 77 5.075 2.215 7.021 1.00 0.00 C ATOM 1197 CG1 VAL A 77 4.846 0.721 7.260 1.00 0.00 C ATOM 1198 CG2 VAL A 77 5.613 2.896 8.281 1.00 0.00 C ATOM 0 H VAL A 77 5.369 4.431 5.997 1.00 0.00 H new ATOM 0 HA VAL A 77 7.016 2.196 6.174 1.00 0.00 H new ATOM 0 HB VAL A 77 4.113 2.667 6.781 1.00 0.00 H new ATOM 0 HG11 VAL A 77 4.177 0.587 8.110 1.00 0.00 H new ATOM 0 HG12 VAL A 77 4.398 0.275 6.372 1.00 0.00 H new ATOM 0 HG13 VAL A 77 5.799 0.235 7.468 1.00 0.00 H new ATOM 0 HG21 VAL A 77 4.929 2.718 9.111 1.00 0.00 H new ATOM 0 HG22 VAL A 77 6.594 2.487 8.525 1.00 0.00 H new ATOM 0 HG23 VAL A 77 5.700 3.968 8.106 1.00 0.00 H new ATOM 1208 N LEU A 78 4.625 1.874 3.944 1.00 0.00 N ATOM 1209 CA LEU A 78 4.208 1.101 2.787 1.00 0.00 C ATOM 1210 C LEU A 78 5.402 0.908 1.850 1.00 0.00 C ATOM 1211 O LEU A 78 5.574 -0.162 1.269 1.00 0.00 O ATOM 1212 CB LEU A 78 2.998 1.752 2.114 1.00 0.00 C ATOM 1213 CG LEU A 78 1.667 1.625 2.860 1.00 0.00 C ATOM 1214 CD1 LEU A 78 0.574 2.446 2.173 1.00 0.00 C ATOM 1215 CD2 LEU A 78 1.267 0.158 3.020 1.00 0.00 C ATOM 0 H LEU A 78 4.031 2.675 4.158 1.00 0.00 H new ATOM 0 HA LEU A 78 3.878 0.108 3.092 1.00 0.00 H new ATOM 0 HB2 LEU A 78 3.212 2.811 1.972 1.00 0.00 H new ATOM 0 HB3 LEU A 78 2.879 1.315 1.123 1.00 0.00 H new ATOM 0 HG LEU A 78 1.796 2.035 3.862 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -0.361 2.339 2.722 1.00 0.00 H new ATOM 0 HD12 LEU A 78 0.865 3.496 2.154 1.00 0.00 H new ATOM 0 HD13 LEU A 78 0.438 2.089 1.152 1.00 0.00 H new ATOM 0 HD21 LEU A 78 0.318 0.096 3.553 1.00 0.00 H new ATOM 0 HD22 LEU A 78 1.161 -0.300 2.036 1.00 0.00 H new ATOM 0 HD23 LEU A 78 2.036 -0.369 3.585 1.00 0.00 H new ATOM 1227 N ILE A 79 6.197 1.962 1.733 1.00 0.00 N ATOM 1228 CA ILE A 79 7.371 1.922 0.877 1.00 0.00 C ATOM 1229 C ILE A 79 8.400 0.961 1.475 1.00 0.00 C ATOM 1230 O ILE A 79 8.840 0.025 0.809 1.00 0.00 O ATOM 1231 CB ILE A 79 7.911 3.335 0.643 1.00 0.00 C ATOM 1232 CG1 ILE A 79 7.333 3.937 -0.639 1.00 0.00 C ATOM 1233 CG2 ILE A 79 9.441 3.343 0.641 1.00 0.00 C ATOM 1234 CD1 ILE A 79 5.838 4.223 -0.484 1.00 0.00 C ATOM 0 H ILE A 79 6.051 2.848 2.216 1.00 0.00 H new ATOM 0 HA ILE A 79 7.111 1.537 -0.109 1.00 0.00 H new ATOM 0 HB ILE A 79 7.587 3.967 1.470 1.00 0.00 H new ATOM 0 HG12 ILE A 79 7.860 4.860 -0.882 1.00 0.00 H new ATOM 0 HG13 ILE A 79 7.491 3.251 -1.471 1.00 0.00 H new ATOM 0 HG21 ILE A 79 9.799 4.359 0.473 1.00 0.00 H new ATOM 0 HG22 ILE A 79 9.808 2.983 1.602 1.00 0.00 H new ATOM 0 HG23 ILE A 79 9.807 2.693 -0.154 1.00 0.00 H new ATOM 0 HD11 ILE A 79 5.451 4.650 -1.409 1.00 0.00 H new ATOM 0 HD12 ILE A 79 5.311 3.294 -0.265 1.00 0.00 H new ATOM 0 HD13 ILE A 79 5.685 4.928 0.333 1.00 0.00 H new ATOM 1246 N LYS A 80 8.755 1.226 2.723 1.00 0.00 N ATOM 1247 CA LYS A 80 9.725 0.396 3.418 1.00 0.00 C ATOM 1248 C LYS A 80 9.231 -1.052 3.435 1.00 0.00 C ATOM 1249 O LYS A 80 9.872 -1.936 2.869 1.00 0.00 O ATOM 1250 CB LYS A 80 10.016 0.963 4.809 1.00 0.00 C ATOM 1251 CG LYS A 80 11.246 0.295 5.427 1.00 0.00 C ATOM 1252 CD LYS A 80 11.176 0.322 6.955 1.00 0.00 C ATOM 1253 CE LYS A 80 11.454 -1.063 7.541 1.00 0.00 C ATOM 1254 NZ LYS A 80 10.258 -1.927 7.419 1.00 0.00 N ATOM 0 H LYS A 80 8.389 2.004 3.272 1.00 0.00 H new ATOM 0 HA LYS A 80 10.679 0.402 2.891 1.00 0.00 H new ATOM 0 HB2 LYS A 80 10.178 2.039 4.741 1.00 0.00 H new ATOM 0 HB3 LYS A 80 9.152 0.811 5.456 1.00 0.00 H new ATOM 0 HG2 LYS A 80 11.316 -0.736 5.081 1.00 0.00 H new ATOM 0 HG3 LYS A 80 12.149 0.806 5.092 1.00 0.00 H new ATOM 0 HD2 LYS A 80 11.901 1.037 7.343 1.00 0.00 H new ATOM 0 HD3 LYS A 80 10.190 0.664 7.271 1.00 0.00 H new ATOM 0 HE2 LYS A 80 12.296 -1.522 7.022 1.00 0.00 H new ATOM 0 HE3 LYS A 80 11.738 -0.971 8.589 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 10.359 -2.750 8.047 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 9.411 -1.387 7.689 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 10.163 -2.251 6.435 1.00 0.00 H new ATOM 1268 N ASN A 81 8.097 -1.249 4.090 1.00 0.00 N ATOM 1269 CA ASN A 81 7.510 -2.575 4.187 1.00 0.00 C ATOM 1270 C ASN A 81 7.683 -3.304 2.853 1.00 0.00 C ATOM 1271 O ASN A 81 8.132 -4.449 2.821 1.00 0.00 O ATOM 1272 CB ASN A 81 6.013 -2.494 4.491 1.00 0.00 C ATOM 1273 CG ASN A 81 5.752 -2.606 5.995 1.00 0.00 C ATOM 1274 OD1 ASN A 81 6.576 -3.077 6.761 1.00 0.00 O ATOM 1275 ND2 ASN A 81 4.562 -2.148 6.372 1.00 0.00 N ATOM 0 H ASN A 81 7.569 -0.513 4.559 1.00 0.00 H new ATOM 0 HA ASN A 81 8.013 -3.108 4.994 1.00 0.00 H new ATOM 0 HB2 ASN A 81 5.613 -1.551 4.118 1.00 0.00 H new ATOM 0 HB3 ASN A 81 5.488 -3.293 3.967 1.00 0.00 H new ATOM 0 HD21 ASN A 81 4.292 -2.178 7.355 1.00 0.00 H new ATOM 0 HD22 ASN A 81 3.919 -1.766 5.678 1.00 0.00 H new ATOM 1282 N TRP A 82 7.317 -2.611 1.785 1.00 0.00 N ATOM 1283 CA TRP A 82 7.426 -3.178 0.452 1.00 0.00 C ATOM 1284 C TRP A 82 8.913 -3.345 0.129 1.00 0.00 C ATOM 1285 O TRP A 82 9.332 -4.394 -0.358 1.00 0.00 O ATOM 1286 CB TRP A 82 6.685 -2.317 -0.573 1.00 0.00 C ATOM 1287 CG TRP A 82 5.163 -2.332 -0.413 1.00 0.00 C ATOM 1288 CD1 TRP A 82 4.406 -3.256 0.194 1.00 0.00 C ATOM 1289 CD2 TRP A 82 4.239 -1.334 -0.895 1.00 0.00 C ATOM 1290 NE1 TRP A 82 3.067 -2.928 0.139 1.00 0.00 N ATOM 1291 CE2 TRP A 82 2.962 -1.722 -0.544 1.00 0.00 C ATOM 1292 CE3 TRP A 82 4.474 -0.142 -1.603 1.00 0.00 C ATOM 1293 CZ2 TRP A 82 1.820 -0.976 -0.860 1.00 0.00 C ATOM 1294 CZ3 TRP A 82 3.322 0.592 -1.911 1.00 0.00 C ATOM 1295 CH2 TRP A 82 2.030 0.215 -1.565 1.00 0.00 C ATOM 0 H TRP A 82 6.945 -1.662 1.816 1.00 0.00 H new ATOM 0 HA TRP A 82 6.948 -4.157 0.409 1.00 0.00 H new ATOM 0 HB2 TRP A 82 7.039 -1.289 -0.493 1.00 0.00 H new ATOM 0 HB3 TRP A 82 6.938 -2.664 -1.575 1.00 0.00 H new ATOM 0 HD1 TRP A 82 4.795 -4.146 0.667 1.00 0.00 H new ATOM 0 HE1 TRP A 82 2.296 -3.471 0.528 1.00 0.00 H new ATOM 0 HE3 TRP A 82 5.465 0.182 -1.887 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 0.831 -1.302 -0.575 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 3.446 1.516 -2.456 1.00 0.00 H new ATOM 0 HH2 TRP A 82 1.192 0.838 -1.839 1.00 0.00 H new ATOM 1306 N LYS A 83 9.669 -2.294 0.413 1.00 0.00 N ATOM 1307 CA LYS A 83 11.099 -2.311 0.159 1.00 0.00 C ATOM 1308 C LYS A 83 11.703 -3.587 0.750 1.00 0.00 C ATOM 1309 O LYS A 83 12.735 -4.064 0.281 1.00 0.00 O ATOM 1310 CB LYS A 83 11.750 -1.026 0.675 1.00 0.00 C ATOM 1311 CG LYS A 83 12.596 -0.365 -0.414 1.00 0.00 C ATOM 1312 CD LYS A 83 14.084 -0.656 -0.206 1.00 0.00 C ATOM 1313 CE LYS A 83 14.767 0.490 0.544 1.00 0.00 C ATOM 1314 NZ LYS A 83 15.947 0.971 -0.209 1.00 0.00 N ATOM 0 H LYS A 83 9.318 -1.426 0.816 1.00 0.00 H new ATOM 0 HA LYS A 83 11.295 -2.332 -0.913 1.00 0.00 H new ATOM 0 HB2 LYS A 83 10.979 -0.333 1.012 1.00 0.00 H new ATOM 0 HB3 LYS A 83 12.375 -1.252 1.539 1.00 0.00 H new ATOM 0 HG2 LYS A 83 12.284 -0.729 -1.393 1.00 0.00 H new ATOM 0 HG3 LYS A 83 12.428 0.712 -0.406 1.00 0.00 H new ATOM 0 HD2 LYS A 83 14.202 -1.583 0.354 1.00 0.00 H new ATOM 0 HD3 LYS A 83 14.568 -0.803 -1.172 1.00 0.00 H new ATOM 0 HE2 LYS A 83 14.062 1.309 0.689 1.00 0.00 H new ATOM 0 HE3 LYS A 83 15.073 0.153 1.535 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 16.399 1.748 0.313 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 16.626 0.192 -0.326 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 15.647 1.311 -1.145 1.00 0.00 H new ATOM 1328 N ARG A 84 11.033 -4.102 1.770 1.00 0.00 N ATOM 1329 CA ARG A 84 11.491 -5.313 2.430 1.00 0.00 C ATOM 1330 C ARG A 84 10.911 -6.548 1.736 1.00 0.00 C ATOM 1331 O ARG A 84 11.513 -7.620 1.763 1.00 0.00 O ATOM 1332 CB ARG A 84 11.081 -5.326 3.904 1.00 0.00 C ATOM 1333 CG ARG A 84 11.944 -4.364 4.722 1.00 0.00 C ATOM 1334 CD ARG A 84 12.045 -4.821 6.178 1.00 0.00 C ATOM 1335 NE ARG A 84 13.453 -4.757 6.632 1.00 0.00 N ATOM 1336 CZ ARG A 84 13.923 -5.393 7.714 1.00 0.00 C ATOM 1337 NH1 ARG A 84 13.101 -6.146 8.458 1.00 0.00 N ATOM 1338 NH2 ARG A 84 15.215 -5.277 8.050 1.00 0.00 N ATOM 0 H ARG A 84 10.177 -3.703 2.156 1.00 0.00 H new ATOM 0 HA ARG A 84 12.579 -5.333 2.367 1.00 0.00 H new ATOM 0 HB2 ARG A 84 10.032 -5.046 3.996 1.00 0.00 H new ATOM 0 HB3 ARG A 84 11.178 -6.336 4.303 1.00 0.00 H new ATOM 0 HG2 ARG A 84 12.941 -4.304 4.286 1.00 0.00 H new ATOM 0 HG3 ARG A 84 11.517 -3.362 4.680 1.00 0.00 H new ATOM 0 HD2 ARG A 84 11.421 -4.189 6.810 1.00 0.00 H new ATOM 0 HD3 ARG A 84 11.669 -5.839 6.275 1.00 0.00 H new ATOM 0 HE ARG A 84 14.106 -4.194 6.087 1.00 0.00 H new ATOM 0 HH11 ARG A 84 12.118 -6.235 8.201 1.00 0.00 H new ATOM 0 HH12 ARG A 84 13.458 -6.630 9.282 1.00 0.00 H new ATOM 0 HH21 ARG A 84 15.840 -4.705 7.482 1.00 0.00 H new ATOM 0 HH22 ARG A 84 15.573 -5.761 8.873 1.00 0.00 H new ATOM 1352 N LEU A 85 9.749 -6.355 1.129 1.00 0.00 N ATOM 1353 CA LEU A 85 9.082 -7.439 0.429 1.00 0.00 C ATOM 1354 C LEU A 85 9.692 -7.592 -0.966 1.00 0.00 C ATOM 1355 O LEU A 85 9.931 -8.708 -1.424 1.00 0.00 O ATOM 1356 CB LEU A 85 7.568 -7.217 0.417 1.00 0.00 C ATOM 1357 CG LEU A 85 6.978 -6.687 -0.891 1.00 0.00 C ATOM 1358 CD1 LEU A 85 7.156 -7.701 -2.024 1.00 0.00 C ATOM 1359 CD2 LEU A 85 5.514 -6.283 -0.709 1.00 0.00 C ATOM 0 H LEU A 85 9.253 -5.464 1.108 1.00 0.00 H new ATOM 0 HA LEU A 85 9.239 -8.383 0.951 1.00 0.00 H new ATOM 0 HB2 LEU A 85 7.080 -8.162 0.656 1.00 0.00 H new ATOM 0 HB3 LEU A 85 7.317 -6.518 1.215 1.00 0.00 H new ATOM 0 HG LEU A 85 7.527 -5.789 -1.173 1.00 0.00 H new ATOM 0 HD11 LEU A 85 6.728 -7.299 -2.942 1.00 0.00 H new ATOM 0 HD12 LEU A 85 8.218 -7.897 -2.174 1.00 0.00 H new ATOM 0 HD13 LEU A 85 6.649 -8.630 -1.764 1.00 0.00 H new ATOM 0 HD21 LEU A 85 5.119 -5.910 -1.654 1.00 0.00 H new ATOM 0 HD22 LEU A 85 4.934 -7.149 -0.391 1.00 0.00 H new ATOM 0 HD23 LEU A 85 5.444 -5.501 0.047 1.00 0.00 H new ATOM 1371 N LEU A 86 9.927 -6.453 -1.602 1.00 0.00 N ATOM 1372 CA LEU A 86 10.505 -6.446 -2.935 1.00 0.00 C ATOM 1373 C LEU A 86 11.900 -7.072 -2.885 1.00 0.00 C ATOM 1374 O LEU A 86 12.186 -8.021 -3.614 1.00 0.00 O ATOM 1375 CB LEU A 86 10.485 -5.033 -3.520 1.00 0.00 C ATOM 1376 CG LEU A 86 9.140 -4.552 -4.068 1.00 0.00 C ATOM 1377 CD1 LEU A 86 9.020 -3.030 -3.969 1.00 0.00 C ATOM 1378 CD2 LEU A 86 8.920 -5.053 -5.497 1.00 0.00 C ATOM 0 H LEU A 86 9.728 -5.529 -1.219 1.00 0.00 H new ATOM 0 HA LEU A 86 9.907 -7.055 -3.613 1.00 0.00 H new ATOM 0 HB2 LEU A 86 10.810 -4.337 -2.747 1.00 0.00 H new ATOM 0 HB3 LEU A 86 11.221 -4.983 -4.323 1.00 0.00 H new ATOM 0 HG LEU A 86 8.348 -4.978 -3.452 1.00 0.00 H new ATOM 0 HD11 LEU A 86 8.055 -2.715 -4.365 1.00 0.00 H new ATOM 0 HD12 LEU A 86 9.101 -2.726 -2.925 1.00 0.00 H new ATOM 0 HD13 LEU A 86 9.819 -2.564 -4.546 1.00 0.00 H new ATOM 0 HD21 LEU A 86 7.957 -4.697 -5.863 1.00 0.00 H new ATOM 0 HD22 LEU A 86 9.715 -4.676 -6.141 1.00 0.00 H new ATOM 0 HD23 LEU A 86 8.931 -6.143 -5.506 1.00 0.00 H new ATOM 1390 N ASP A 87 12.732 -6.516 -2.017 1.00 0.00 N ATOM 1391 CA ASP A 87 14.091 -7.007 -1.862 1.00 0.00 C ATOM 1392 C ASP A 87 14.052 -8.437 -1.319 1.00 0.00 C ATOM 1393 O ASP A 87 14.161 -8.649 -0.112 1.00 0.00 O ATOM 1394 CB ASP A 87 14.878 -6.146 -0.872 1.00 0.00 C ATOM 1395 CG ASP A 87 15.772 -5.081 -1.510 1.00 0.00 C ATOM 1396 OD1 ASP A 87 15.789 -5.028 -2.759 1.00 0.00 O ATOM 1397 OD2 ASP A 87 16.419 -4.344 -0.735 1.00 0.00 O ATOM 0 H ASP A 87 12.491 -5.730 -1.413 1.00 0.00 H new ATOM 0 HA ASP A 87 14.577 -6.970 -2.837 1.00 0.00 H new ATOM 0 HB2 ASP A 87 14.173 -5.654 -0.202 1.00 0.00 H new ATOM 0 HB3 ASP A 87 15.498 -6.799 -0.258 1.00 0.00 H new ATOM 1402 N SER A 88 13.897 -9.380 -2.236 1.00 0.00 N ATOM 1403 CA SER A 88 13.843 -10.784 -1.864 1.00 0.00 C ATOM 1404 C SER A 88 15.088 -11.160 -1.058 1.00 0.00 C ATOM 1405 O SER A 88 16.189 -10.705 -1.361 1.00 0.00 O ATOM 1406 CB SER A 88 13.721 -11.677 -3.100 1.00 0.00 C ATOM 1407 OG SER A 88 14.921 -11.692 -3.868 1.00 0.00 O ATOM 0 H SER A 88 13.807 -9.200 -3.236 1.00 0.00 H new ATOM 0 HA SER A 88 12.958 -10.941 -1.247 1.00 0.00 H new ATOM 0 HB2 SER A 88 13.476 -12.693 -2.790 1.00 0.00 H new ATOM 0 HB3 SER A 88 12.897 -11.326 -3.721 1.00 0.00 H new ATOM 0 HG SER A 88 15.458 -12.473 -3.620 1.00 0.00 H new ATOM 1413 N PRO A 89 14.865 -12.010 -0.019 1.00 0.00 N ATOM 1414 CA PRO A 89 15.956 -12.452 0.832 1.00 0.00 C ATOM 1415 C PRO A 89 16.820 -13.495 0.120 1.00 0.00 C ATOM 1416 O PRO A 89 18.021 -13.296 -0.054 1.00 0.00 O ATOM 1417 CB PRO A 89 15.283 -12.994 2.083 1.00 0.00 C ATOM 1418 CG PRO A 89 13.838 -13.262 1.697 1.00 0.00 C ATOM 1419 CD PRO A 89 13.574 -12.570 0.370 1.00 0.00 C ATOM 0 HA PRO A 89 16.646 -11.647 1.083 1.00 0.00 H new ATOM 0 HB2 PRO A 89 15.771 -13.907 2.425 1.00 0.00 H new ATOM 0 HB3 PRO A 89 15.342 -12.275 2.900 1.00 0.00 H new ATOM 0 HG2 PRO A 89 13.658 -14.334 1.611 1.00 0.00 H new ATOM 0 HG3 PRO A 89 13.162 -12.886 2.465 1.00 0.00 H new ATOM 0 HD2 PRO A 89 13.206 -13.273 -0.377 1.00 0.00 H new ATOM 0 HD3 PRO A 89 12.819 -11.791 0.473 1.00 0.00 H new ATOM 1427 N ARG A 90 16.174 -14.583 -0.274 1.00 0.00 N ATOM 1428 CA ARG A 90 16.869 -15.656 -0.964 1.00 0.00 C ATOM 1429 C ARG A 90 17.324 -15.191 -2.348 1.00 0.00 C ATOM 1430 O ARG A 90 16.702 -14.316 -2.949 1.00 0.00 O ATOM 1431 CB ARG A 90 15.970 -16.885 -1.117 1.00 0.00 C ATOM 1432 CG ARG A 90 14.741 -16.562 -1.970 1.00 0.00 C ATOM 1433 CD ARG A 90 14.700 -17.436 -3.225 1.00 0.00 C ATOM 1434 NE ARG A 90 13.882 -16.782 -4.271 1.00 0.00 N ATOM 1435 CZ ARG A 90 12.546 -16.686 -4.228 1.00 0.00 C ATOM 1436 NH1 ARG A 90 11.870 -17.200 -3.192 1.00 0.00 N ATOM 1437 NH2 ARG A 90 11.886 -16.075 -5.222 1.00 0.00 N ATOM 0 H ARG A 90 15.177 -14.744 -0.128 1.00 0.00 H new ATOM 0 HA ARG A 90 17.738 -15.927 -0.365 1.00 0.00 H new ATOM 0 HB2 ARG A 90 16.533 -17.697 -1.577 1.00 0.00 H new ATOM 0 HB3 ARG A 90 15.654 -17.233 -0.134 1.00 0.00 H new ATOM 0 HG2 ARG A 90 13.836 -16.719 -1.384 1.00 0.00 H new ATOM 0 HG3 ARG A 90 14.758 -15.510 -2.255 1.00 0.00 H new ATOM 0 HD2 ARG A 90 15.712 -17.604 -3.595 1.00 0.00 H new ATOM 0 HD3 ARG A 90 14.283 -18.414 -2.984 1.00 0.00 H new ATOM 0 HE ARG A 90 14.365 -16.380 -5.074 1.00 0.00 H new ATOM 0 HH11 ARG A 90 12.372 -17.665 -2.435 1.00 0.00 H new ATOM 0 HH12 ARG A 90 10.853 -17.127 -3.160 1.00 0.00 H new ATOM 0 HH21 ARG A 90 12.401 -15.683 -6.011 1.00 0.00 H new ATOM 0 HH22 ARG A 90 10.869 -16.002 -5.190 1.00 0.00 H new ATOM 1451 N THR A 91 18.407 -15.796 -2.815 1.00 0.00 N ATOM 1452 CA THR A 91 18.953 -15.454 -4.117 1.00 0.00 C ATOM 1453 C THR A 91 20.071 -16.426 -4.498 1.00 0.00 C ATOM 1454 O THR A 91 20.839 -16.861 -3.642 1.00 0.00 O ATOM 1455 CB THR A 91 19.407 -13.993 -4.071 1.00 0.00 C ATOM 1456 OG1 THR A 91 19.858 -13.728 -5.396 1.00 0.00 O ATOM 1457 CG2 THR A 91 20.654 -13.795 -3.206 1.00 0.00 C ATOM 0 H THR A 91 18.921 -16.521 -2.314 1.00 0.00 H new ATOM 0 HA THR A 91 18.200 -15.551 -4.899 1.00 0.00 H new ATOM 0 HB THR A 91 18.597 -13.373 -3.688 1.00 0.00 H new ATOM 0 HG1 THR A 91 20.169 -12.801 -5.456 1.00 0.00 H new ATOM 0 HG21 THR A 91 20.934 -12.742 -3.207 1.00 0.00 H new ATOM 0 HG22 THR A 91 20.443 -14.113 -2.185 1.00 0.00 H new ATOM 0 HG23 THR A 91 21.474 -14.389 -3.609 1.00 0.00 H new ATOM 1465 N THR A 92 20.127 -16.738 -5.785 1.00 0.00 N ATOM 1466 CA THR A 92 21.138 -17.651 -6.290 1.00 0.00 C ATOM 1467 C THR A 92 22.536 -17.061 -6.091 1.00 0.00 C ATOM 1468 O THR A 92 22.691 -15.846 -5.978 1.00 0.00 O ATOM 1469 CB THR A 92 20.810 -17.957 -7.753 1.00 0.00 C ATOM 1470 OG1 THR A 92 21.773 -18.939 -8.126 1.00 0.00 O ATOM 1471 CG2 THR A 92 21.105 -16.775 -8.679 1.00 0.00 C ATOM 0 H THR A 92 19.489 -16.375 -6.493 1.00 0.00 H new ATOM 0 HA THR A 92 21.134 -18.591 -5.738 1.00 0.00 H new ATOM 0 HB THR A 92 19.759 -18.232 -7.840 1.00 0.00 H new ATOM 0 HG1 THR A 92 21.632 -19.197 -9.061 1.00 0.00 H new ATOM 0 HG21 THR A 92 20.855 -17.045 -9.705 1.00 0.00 H new ATOM 0 HG22 THR A 92 20.508 -15.916 -8.374 1.00 0.00 H new ATOM 0 HG23 THR A 92 22.163 -16.521 -8.619 1.00 0.00 H new ATOM 1479 N LYS A 93 23.518 -17.950 -6.055 1.00 0.00 N ATOM 1480 CA LYS A 93 24.898 -17.533 -5.871 1.00 0.00 C ATOM 1481 C LYS A 93 25.165 -16.283 -6.713 1.00 0.00 C ATOM 1482 O LYS A 93 24.699 -16.183 -7.847 1.00 0.00 O ATOM 1483 CB LYS A 93 25.852 -18.690 -6.171 1.00 0.00 C ATOM 1484 CG LYS A 93 26.209 -19.452 -4.893 1.00 0.00 C ATOM 1485 CD LYS A 93 25.354 -20.712 -4.749 1.00 0.00 C ATOM 1486 CE LYS A 93 25.611 -21.399 -3.406 1.00 0.00 C ATOM 1487 NZ LYS A 93 24.372 -21.439 -2.598 1.00 0.00 N ATOM 0 H LYS A 93 23.386 -18.957 -6.150 1.00 0.00 H new ATOM 0 HA LYS A 93 25.078 -17.263 -4.831 1.00 0.00 H new ATOM 0 HB2 LYS A 93 25.391 -19.370 -6.887 1.00 0.00 H new ATOM 0 HB3 LYS A 93 26.760 -18.306 -6.635 1.00 0.00 H new ATOM 0 HG2 LYS A 93 27.264 -19.724 -4.911 1.00 0.00 H new ATOM 0 HG3 LYS A 93 26.061 -18.807 -4.027 1.00 0.00 H new ATOM 0 HD2 LYS A 93 24.299 -20.451 -4.832 1.00 0.00 H new ATOM 0 HD3 LYS A 93 25.577 -21.402 -5.563 1.00 0.00 H new ATOM 0 HE2 LYS A 93 25.976 -22.412 -3.573 1.00 0.00 H new ATOM 0 HE3 LYS A 93 26.390 -20.866 -2.861 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 24.565 -21.908 -1.690 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 24.040 -20.469 -2.423 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 23.639 -21.968 -3.112 1.00 0.00 H new ATOM 1501 N GLY A 94 25.912 -15.361 -6.124 1.00 0.00 N ATOM 1502 CA GLY A 94 26.246 -14.121 -6.805 1.00 0.00 C ATOM 1503 C GLY A 94 27.584 -14.242 -7.538 1.00 0.00 C ATOM 1504 O GLY A 94 27.644 -14.088 -8.757 1.00 0.00 O ATOM 0 H GLY A 94 26.296 -15.447 -5.183 1.00 0.00 H new ATOM 0 HA2 GLY A 94 25.459 -13.869 -7.516 1.00 0.00 H new ATOM 0 HA3 GLY A 94 26.295 -13.307 -6.082 1.00 0.00 H new ATOM 1508 N GLU A 95 28.624 -14.516 -6.764 1.00 0.00 N ATOM 1509 CA GLU A 95 29.957 -14.659 -7.324 1.00 0.00 C ATOM 1510 C GLU A 95 29.910 -15.507 -8.597 1.00 0.00 C ATOM 1511 O GLU A 95 29.049 -16.374 -8.738 1.00 0.00 O ATOM 1512 CB GLU A 95 30.921 -15.261 -6.300 1.00 0.00 C ATOM 1513 CG GLU A 95 32.362 -15.216 -6.811 1.00 0.00 C ATOM 1514 CD GLU A 95 33.332 -14.850 -5.685 1.00 0.00 C ATOM 1515 OE1 GLU A 95 33.692 -15.773 -4.923 1.00 0.00 O ATOM 1516 OE2 GLU A 95 33.691 -13.655 -5.612 1.00 0.00 O ATOM 0 H GLU A 95 28.570 -14.643 -5.753 1.00 0.00 H new ATOM 0 HA GLU A 95 30.328 -13.668 -7.584 1.00 0.00 H new ATOM 0 HB2 GLU A 95 30.847 -14.714 -5.360 1.00 0.00 H new ATOM 0 HB3 GLU A 95 30.638 -16.293 -6.091 1.00 0.00 H new ATOM 0 HG2 GLU A 95 32.634 -16.185 -7.229 1.00 0.00 H new ATOM 0 HG3 GLU A 95 32.443 -14.487 -7.617 1.00 0.00 H new ATOM 1523 N ARG A 96 30.846 -15.226 -9.491 1.00 0.00 N ATOM 1524 CA ARG A 96 30.922 -15.953 -10.748 1.00 0.00 C ATOM 1525 C ARG A 96 32.383 -16.203 -11.128 1.00 0.00 C ATOM 1526 O ARG A 96 32.766 -17.334 -11.423 1.00 0.00 O ATOM 1527 CB ARG A 96 30.235 -15.178 -11.874 1.00 0.00 C ATOM 1528 CG ARG A 96 28.776 -15.615 -12.028 1.00 0.00 C ATOM 1529 CD ARG A 96 28.672 -16.898 -12.855 1.00 0.00 C ATOM 1530 NE ARG A 96 27.308 -17.030 -13.414 1.00 0.00 N ATOM 1531 CZ ARG A 96 26.811 -16.243 -14.377 1.00 0.00 C ATOM 1532 NH1 ARG A 96 27.562 -15.261 -14.894 1.00 0.00 N ATOM 1533 NH2 ARG A 96 25.562 -16.436 -14.823 1.00 0.00 N ATOM 0 H ARG A 96 31.558 -14.506 -9.371 1.00 0.00 H new ATOM 0 HA ARG A 96 30.410 -16.906 -10.613 1.00 0.00 H new ATOM 0 HB2 ARG A 96 30.278 -14.109 -11.664 1.00 0.00 H new ATOM 0 HB3 ARG A 96 30.768 -15.341 -12.811 1.00 0.00 H new ATOM 0 HG2 ARG A 96 28.335 -15.776 -11.044 1.00 0.00 H new ATOM 0 HG3 ARG A 96 28.204 -14.821 -12.508 1.00 0.00 H new ATOM 0 HD2 ARG A 96 29.405 -16.881 -13.662 1.00 0.00 H new ATOM 0 HD3 ARG A 96 28.904 -17.762 -12.232 1.00 0.00 H new ATOM 0 HE ARG A 96 26.709 -17.767 -13.042 1.00 0.00 H new ATOM 0 HH11 ARG A 96 28.512 -15.113 -14.554 1.00 0.00 H new ATOM 0 HH12 ARG A 96 27.183 -14.662 -15.627 1.00 0.00 H new ATOM 0 HH21 ARG A 96 24.989 -17.183 -14.429 1.00 0.00 H new ATOM 0 HH22 ARG A 96 25.184 -15.836 -15.556 1.00 0.00 H new ATOM 1547 N GLU A 97 33.159 -15.129 -11.109 1.00 0.00 N ATOM 1548 CA GLU A 97 34.569 -15.219 -11.449 1.00 0.00 C ATOM 1549 C GLU A 97 35.179 -16.488 -10.851 1.00 0.00 C ATOM 1550 O GLU A 97 34.743 -16.955 -9.800 1.00 0.00 O ATOM 1551 CB GLU A 97 35.325 -13.974 -10.981 1.00 0.00 C ATOM 1552 CG GLU A 97 35.321 -13.870 -9.455 1.00 0.00 C ATOM 1553 CD GLU A 97 36.736 -13.647 -8.917 1.00 0.00 C ATOM 1554 OE1 GLU A 97 37.612 -14.468 -9.266 1.00 0.00 O ATOM 1555 OE2 GLU A 97 36.910 -12.661 -8.169 1.00 0.00 O ATOM 0 H GLU A 97 32.838 -14.192 -10.864 1.00 0.00 H new ATOM 0 HA GLU A 97 34.659 -15.273 -12.534 1.00 0.00 H new ATOM 0 HB2 GLU A 97 36.352 -14.011 -11.344 1.00 0.00 H new ATOM 0 HB3 GLU A 97 34.867 -13.083 -11.411 1.00 0.00 H new ATOM 0 HG2 GLU A 97 34.676 -13.048 -9.145 1.00 0.00 H new ATOM 0 HG3 GLU A 97 34.904 -14.781 -9.026 1.00 0.00 H new ATOM 1562 N SER A 98 36.179 -17.009 -11.546 1.00 0.00 N ATOM 1563 CA SER A 98 36.854 -18.215 -11.096 1.00 0.00 C ATOM 1564 C SER A 98 38.319 -18.190 -11.538 1.00 0.00 C ATOM 1565 O SER A 98 38.711 -17.357 -12.353 1.00 0.00 O ATOM 1566 CB SER A 98 36.159 -19.468 -11.634 1.00 0.00 C ATOM 1567 OG SER A 98 36.240 -19.556 -13.054 1.00 0.00 O ATOM 0 H SER A 98 36.538 -16.619 -12.417 1.00 0.00 H new ATOM 0 HA SER A 98 36.810 -18.246 -10.007 1.00 0.00 H new ATOM 0 HB2 SER A 98 36.613 -20.354 -11.190 1.00 0.00 H new ATOM 0 HB3 SER A 98 35.112 -19.460 -11.330 1.00 0.00 H new ATOM 0 HG SER A 98 35.786 -20.370 -13.358 1.00 0.00 H new ATOM 1573 N GLY A 99 39.088 -19.113 -10.979 1.00 0.00 N ATOM 1574 CA GLY A 99 40.501 -19.208 -11.305 1.00 0.00 C ATOM 1575 C GLY A 99 40.851 -20.603 -11.826 1.00 0.00 C ATOM 1576 O GLY A 99 41.271 -21.468 -11.059 1.00 0.00 O ATOM 0 H GLY A 99 38.759 -19.802 -10.302 1.00 0.00 H new ATOM 0 HA2 GLY A 99 40.755 -18.461 -12.057 1.00 0.00 H new ATOM 0 HA3 GLY A 99 41.098 -18.986 -10.420 1.00 0.00 H new ATOM 1580 N PRO A 100 40.661 -20.783 -13.160 1.00 0.00 N ATOM 1581 CA PRO A 100 40.953 -22.059 -13.792 1.00 0.00 C ATOM 1582 C PRO A 100 42.461 -22.263 -13.945 1.00 0.00 C ATOM 1583 O PRO A 100 43.210 -21.299 -14.098 1.00 0.00 O ATOM 1584 CB PRO A 100 40.222 -22.014 -15.124 1.00 0.00 C ATOM 1585 CG PRO A 100 39.934 -20.545 -15.393 1.00 0.00 C ATOM 1586 CD PRO A 100 40.165 -19.781 -14.099 1.00 0.00 C ATOM 0 HA PRO A 100 40.619 -22.909 -13.197 1.00 0.00 H new ATOM 0 HB2 PRO A 100 40.832 -22.444 -15.919 1.00 0.00 H new ATOM 0 HB3 PRO A 100 39.299 -22.592 -15.082 1.00 0.00 H new ATOM 0 HG2 PRO A 100 40.585 -20.166 -16.181 1.00 0.00 H new ATOM 0 HG3 PRO A 100 38.908 -20.414 -15.736 1.00 0.00 H new ATOM 0 HD2 PRO A 100 40.887 -18.977 -14.238 1.00 0.00 H new ATOM 0 HD3 PRO A 100 39.243 -19.323 -13.739 1.00 0.00 H new ATOM 1594 N SER A 101 42.863 -23.525 -13.897 1.00 0.00 N ATOM 1595 CA SER A 101 44.269 -23.868 -14.028 1.00 0.00 C ATOM 1596 C SER A 101 44.421 -25.144 -14.859 1.00 0.00 C ATOM 1597 O SER A 101 44.094 -26.234 -14.394 1.00 0.00 O ATOM 1598 CB SER A 101 44.922 -24.047 -12.656 1.00 0.00 C ATOM 1599 OG SER A 101 44.280 -25.061 -11.887 1.00 0.00 O ATOM 0 H SER A 101 42.240 -24.322 -13.769 1.00 0.00 H new ATOM 0 HA SER A 101 44.775 -23.048 -14.537 1.00 0.00 H new ATOM 0 HB2 SER A 101 45.974 -24.302 -12.786 1.00 0.00 H new ATOM 0 HB3 SER A 101 44.887 -23.103 -12.112 1.00 0.00 H new ATOM 0 HG SER A 101 43.988 -25.785 -12.479 1.00 0.00 H new ATOM 1605 N SER A 102 44.917 -24.964 -16.074 1.00 0.00 N ATOM 1606 CA SER A 102 45.117 -26.088 -16.974 1.00 0.00 C ATOM 1607 C SER A 102 46.179 -27.031 -16.407 1.00 0.00 C ATOM 1608 O SER A 102 47.365 -26.704 -16.400 1.00 0.00 O ATOM 1609 CB SER A 102 45.523 -25.610 -18.370 1.00 0.00 C ATOM 1610 OG SER A 102 45.305 -26.610 -19.361 1.00 0.00 O ATOM 0 H SER A 102 45.186 -24.058 -16.457 1.00 0.00 H new ATOM 0 HA SER A 102 44.173 -26.626 -17.063 1.00 0.00 H new ATOM 0 HB2 SER A 102 44.955 -24.716 -18.626 1.00 0.00 H new ATOM 0 HB3 SER A 102 46.576 -25.328 -18.365 1.00 0.00 H new ATOM 0 HG SER A 102 45.575 -26.266 -20.238 1.00 0.00 H new ATOM 1616 N GLY A 103 45.716 -28.182 -15.944 1.00 0.00 N ATOM 1617 CA GLY A 103 46.612 -29.175 -15.375 1.00 0.00 C ATOM 1618 C GLY A 103 45.985 -29.840 -14.148 1.00 0.00 C ATOM 1619 O GLY A 103 46.696 -30.278 -13.244 1.00 0.00 O ATOM 0 H GLY A 103 44.732 -28.450 -15.951 1.00 0.00 H new ATOM 0 HA2 GLY A 103 46.845 -29.932 -16.124 1.00 0.00 H new ATOM 0 HA3 GLY A 103 47.554 -28.703 -15.096 1.00 0.00 H new TER 1623 GLY A 103