USER MOD reduce.3.24.130724 H: found=0, std=0, add=560, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 560 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 180:sc= 0.0156 USER MOD Single : A 3 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ 164:sc= -0.031 (180deg=-0.315) USER MOD Single : A 5 GLN : amide:sc= 0.873 K(o=0.87,f=0) USER MOD Single : A 9 LYS NZ :NH3+ -119:sc= 0.126 (180deg=-0.199) USER MOD Single : A 15 SER OG : rot 70:sc= 0.938 USER MOD Single : A 16 LYS NZ :NH3+ -162:sc= 0.0064 (180deg=-0.299) USER MOD Single : A 17 ASN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 18 TYR OH : rot 180:sc= 0 USER MOD Single : A 19 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 22 ASN : amide:sc= -2.38! C(o=-2.4!,f=-2.9!) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ -178:sc= 0.754 (180deg=0.655) USER MOD Single : B 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 2 SER OG : rot 180:sc= 0.0171 USER MOD Single : B 3 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 4 LYS NZ :NH3+ 164:sc= -0.041 (180deg=-0.3) USER MOD Single : B 5 GLN : amide:sc= 0.868 K(o=0.87,f=0) USER MOD Single : B 9 LYS NZ :NH3+ -120:sc= 0.139 (180deg=-0.192) USER MOD Single : B 15 SER OG : rot 71:sc= 1.01 USER MOD Single : B 16 LYS NZ :NH3+ -163:sc= 0.0123 (180deg=-0.295) USER MOD Single : B 17 ASN : amide:sc= -0.0814 X(o=-0.081,f=-0.45) USER MOD Single : B 18 TYR OH : rot 180:sc= 0 USER MOD Single : B 19 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 22 ASN : amide:sc= -2.33 K(o=-2.3,f=-2.9!) USER MOD Single : B 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 29 LYS NZ :NH3+ -177:sc= 0.792 (180deg=0.694) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 23.277 8.056 -7.815 1.00 0.00 N ATOM 2 CA GLY A 1 22.784 8.032 -6.417 1.00 0.00 C ATOM 3 C GLY A 1 21.906 6.828 -6.144 1.00 0.00 C ATOM 4 O GLY A 1 20.775 6.753 -6.627 1.00 0.00 O ATOM 0 H1 GLY A 1 23.873 8.896 -7.958 1.00 0.00 H new ATOM 0 H2 GLY A 1 23.836 7.199 -8.001 1.00 0.00 H new ATOM 0 H3 GLY A 1 22.468 8.090 -8.468 1.00 0.00 H new ATOM 0 HA2 GLY A 1 23.633 8.024 -5.734 1.00 0.00 H new ATOM 0 HA3 GLY A 1 22.222 8.944 -6.215 1.00 0.00 H new ATOM 10 N SER A 2 22.425 5.884 -5.372 1.00 0.00 N ATOM 11 CA SER A 2 21.692 4.671 -5.050 1.00 0.00 C ATOM 12 C SER A 2 20.673 4.922 -3.942 1.00 0.00 C ATOM 13 O SER A 2 19.501 4.575 -4.076 1.00 0.00 O ATOM 14 CB SER A 2 22.673 3.572 -4.640 1.00 0.00 C ATOM 15 OG SER A 2 23.587 4.044 -3.660 1.00 0.00 O ATOM 0 H SER A 2 23.355 5.937 -4.956 1.00 0.00 H new ATOM 0 HA SER A 2 21.144 4.350 -5.936 1.00 0.00 H new ATOM 0 HB2 SER A 2 22.123 2.717 -4.247 1.00 0.00 H new ATOM 0 HB3 SER A 2 23.221 3.224 -5.516 1.00 0.00 H new ATOM 0 HG SER A 2 24.203 3.323 -3.413 1.00 0.00 H new ATOM 21 N MET A 3 21.122 5.554 -2.862 1.00 0.00 N ATOM 22 CA MET A 3 20.271 5.807 -1.702 1.00 0.00 C ATOM 23 C MET A 3 19.127 6.758 -2.030 1.00 0.00 C ATOM 24 O MET A 3 18.048 6.662 -1.444 1.00 0.00 O ATOM 25 CB MET A 3 21.095 6.363 -0.540 1.00 0.00 C ATOM 26 CG MET A 3 21.720 5.289 0.332 1.00 0.00 C ATOM 27 SD MET A 3 20.477 4.300 1.188 1.00 0.00 S ATOM 28 CE MET A 3 21.515 3.142 2.075 1.00 0.00 C ATOM 0 H MET A 3 22.076 5.902 -2.765 1.00 0.00 H new ATOM 0 HA MET A 3 19.836 4.851 -1.409 1.00 0.00 H new ATOM 0 HB2 MET A 3 21.884 7.001 -0.938 1.00 0.00 H new ATOM 0 HB3 MET A 3 20.456 6.994 0.078 1.00 0.00 H new ATOM 0 HG2 MET A 3 22.339 4.637 -0.284 1.00 0.00 H new ATOM 0 HG3 MET A 3 22.379 5.755 1.065 1.00 0.00 H new ATOM 0 HE1 MET A 3 20.890 2.462 2.653 1.00 0.00 H new ATOM 0 HE2 MET A 3 22.112 2.571 1.364 1.00 0.00 H new ATOM 0 HE3 MET A 3 22.176 3.688 2.748 1.00 0.00 H new ATOM 38 N LYS A 4 19.356 7.674 -2.958 1.00 0.00 N ATOM 39 CA LYS A 4 18.311 8.602 -3.372 1.00 0.00 C ATOM 40 C LYS A 4 17.176 7.857 -4.062 1.00 0.00 C ATOM 41 O LYS A 4 16.015 7.965 -3.661 1.00 0.00 O ATOM 42 CB LYS A 4 18.873 9.687 -4.293 1.00 0.00 C ATOM 43 CG LYS A 4 19.744 10.711 -3.580 1.00 0.00 C ATOM 44 CD LYS A 4 18.979 11.420 -2.472 1.00 0.00 C ATOM 45 CE LYS A 4 19.792 12.551 -1.862 1.00 0.00 C ATOM 46 NZ LYS A 4 20.074 13.625 -2.847 1.00 0.00 N ATOM 0 H LYS A 4 20.248 7.796 -3.437 1.00 0.00 H new ATOM 0 HA LYS A 4 17.918 9.085 -2.478 1.00 0.00 H new ATOM 0 HB2 LYS A 4 19.458 9.213 -5.082 1.00 0.00 H new ATOM 0 HB3 LYS A 4 18.044 10.204 -4.777 1.00 0.00 H new ATOM 0 HG2 LYS A 4 20.619 10.216 -3.160 1.00 0.00 H new ATOM 0 HG3 LYS A 4 20.108 11.445 -4.299 1.00 0.00 H new ATOM 0 HD2 LYS A 4 18.045 11.817 -2.871 1.00 0.00 H new ATOM 0 HD3 LYS A 4 18.714 10.702 -1.696 1.00 0.00 H new ATOM 0 HE2 LYS A 4 19.251 12.970 -1.013 1.00 0.00 H new ATOM 0 HE3 LYS A 4 20.732 12.156 -1.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 20.383 14.483 -2.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 20.825 13.313 -3.495 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 19.212 13.833 -3.390 1.00 0.00 H new ATOM 60 N GLN A 5 17.522 7.078 -5.079 1.00 0.00 N ATOM 61 CA GLN A 5 16.535 6.309 -5.828 1.00 0.00 C ATOM 62 C GLN A 5 15.907 5.236 -4.946 1.00 0.00 C ATOM 63 O GLN A 5 14.751 4.859 -5.133 1.00 0.00 O ATOM 64 CB GLN A 5 17.179 5.659 -7.055 1.00 0.00 C ATOM 65 CG GLN A 5 17.711 6.659 -8.068 1.00 0.00 C ATOM 66 CD GLN A 5 18.396 5.991 -9.244 1.00 0.00 C ATOM 67 OE1 GLN A 5 17.767 5.678 -10.257 1.00 0.00 O ATOM 68 NE2 GLN A 5 19.693 5.766 -9.116 1.00 0.00 N ATOM 0 H GLN A 5 18.481 6.962 -5.405 1.00 0.00 H new ATOM 0 HA GLN A 5 15.754 6.994 -6.159 1.00 0.00 H new ATOM 0 HB2 GLN A 5 17.997 5.017 -6.728 1.00 0.00 H new ATOM 0 HB3 GLN A 5 16.445 5.017 -7.542 1.00 0.00 H new ATOM 0 HG2 GLN A 5 16.888 7.273 -8.433 1.00 0.00 H new ATOM 0 HG3 GLN A 5 18.415 7.330 -7.575 1.00 0.00 H new ATOM 0 HE21 GLN A 5 20.176 6.041 -8.261 1.00 0.00 H new ATOM 0 HE22 GLN A 5 20.210 5.318 -9.873 1.00 0.00 H new ATOM 77 N LEU A 6 16.680 4.748 -3.986 1.00 0.00 N ATOM 78 CA LEU A 6 16.209 3.728 -3.063 1.00 0.00 C ATOM 79 C LEU A 6 15.157 4.298 -2.116 1.00 0.00 C ATOM 80 O LEU A 6 14.130 3.665 -1.863 1.00 0.00 O ATOM 81 CB LEU A 6 17.386 3.151 -2.270 1.00 0.00 C ATOM 82 CG LEU A 6 17.034 2.034 -1.291 1.00 0.00 C ATOM 83 CD1 LEU A 6 16.544 0.803 -2.039 1.00 0.00 C ATOM 84 CD2 LEU A 6 18.240 1.701 -0.427 1.00 0.00 C ATOM 0 H LEU A 6 17.643 5.045 -3.827 1.00 0.00 H new ATOM 0 HA LEU A 6 15.747 2.927 -3.640 1.00 0.00 H new ATOM 0 HB2 LEU A 6 18.126 2.773 -2.975 1.00 0.00 H new ATOM 0 HB3 LEU A 6 17.860 3.961 -1.715 1.00 0.00 H new ATOM 0 HG LEU A 6 16.227 2.375 -0.642 1.00 0.00 H new ATOM 0 HD11 LEU A 6 16.298 0.017 -1.325 1.00 0.00 H new ATOM 0 HD12 LEU A 6 15.656 1.058 -2.618 1.00 0.00 H new ATOM 0 HD13 LEU A 6 17.326 0.450 -2.711 1.00 0.00 H new ATOM 0 HD21 LEU A 6 17.980 0.903 0.269 1.00 0.00 H new ATOM 0 HD22 LEU A 6 19.064 1.375 -1.062 1.00 0.00 H new ATOM 0 HD23 LEU A 6 18.542 2.586 0.133 1.00 0.00 H new ATOM 96 N GLU A 7 15.405 5.502 -1.611 1.00 0.00 N ATOM 97 CA GLU A 7 14.487 6.150 -0.700 1.00 0.00 C ATOM 98 C GLU A 7 13.172 6.450 -1.404 1.00 0.00 C ATOM 99 O GLU A 7 12.099 6.294 -0.827 1.00 0.00 O ATOM 100 CB GLU A 7 15.112 7.436 -0.168 1.00 0.00 C ATOM 101 CG GLU A 7 14.388 8.002 1.034 1.00 0.00 C ATOM 102 CD GLU A 7 15.050 9.252 1.580 1.00 0.00 C ATOM 103 OE1 GLU A 7 15.886 9.127 2.500 1.00 0.00 O ATOM 104 OE2 GLU A 7 14.733 10.355 1.090 1.00 0.00 O ATOM 0 H GLU A 7 16.241 6.046 -1.823 1.00 0.00 H new ATOM 0 HA GLU A 7 14.284 5.483 0.138 1.00 0.00 H new ATOM 0 HB2 GLU A 7 16.151 7.243 0.100 1.00 0.00 H new ATOM 0 HB3 GLU A 7 15.121 8.183 -0.962 1.00 0.00 H new ATOM 0 HG2 GLU A 7 13.359 8.232 0.758 1.00 0.00 H new ATOM 0 HG3 GLU A 7 14.347 7.246 1.818 1.00 0.00 H new ATOM 111 N ASP A 8 13.266 6.864 -2.663 1.00 0.00 N ATOM 112 CA ASP A 8 12.080 7.178 -3.455 1.00 0.00 C ATOM 113 C ASP A 8 11.174 5.962 -3.596 1.00 0.00 C ATOM 114 O ASP A 8 9.958 6.087 -3.536 1.00 0.00 O ATOM 115 CB ASP A 8 12.466 7.704 -4.838 1.00 0.00 C ATOM 116 CG ASP A 8 12.787 9.189 -4.833 1.00 0.00 C ATOM 117 OD1 ASP A 8 13.949 9.546 -4.556 1.00 0.00 O ATOM 118 OD2 ASP A 8 11.874 9.993 -5.112 1.00 0.00 O ATOM 0 H ASP A 8 14.149 6.990 -3.157 1.00 0.00 H new ATOM 0 HA ASP A 8 11.533 7.958 -2.925 1.00 0.00 H new ATOM 0 HB2 ASP A 8 13.331 7.151 -5.204 1.00 0.00 H new ATOM 0 HB3 ASP A 8 11.649 7.516 -5.535 1.00 0.00 H new ATOM 123 N LYS A 9 11.772 4.788 -3.757 1.00 0.00 N ATOM 124 CA LYS A 9 11.011 3.552 -3.931 1.00 0.00 C ATOM 125 C LYS A 9 10.119 3.270 -2.725 1.00 0.00 C ATOM 126 O LYS A 9 8.905 3.095 -2.866 1.00 0.00 O ATOM 127 CB LYS A 9 11.949 2.367 -4.162 1.00 0.00 C ATOM 128 CG LYS A 9 12.697 2.432 -5.480 1.00 0.00 C ATOM 129 CD LYS A 9 13.666 1.271 -5.633 1.00 0.00 C ATOM 130 CE LYS A 9 14.394 1.325 -6.967 1.00 0.00 C ATOM 131 NZ LYS A 9 15.207 2.563 -7.109 1.00 0.00 N ATOM 0 H LYS A 9 12.784 4.663 -3.771 1.00 0.00 H new ATOM 0 HA LYS A 9 10.376 3.684 -4.807 1.00 0.00 H new ATOM 0 HB2 LYS A 9 12.671 2.321 -3.346 1.00 0.00 H new ATOM 0 HB3 LYS A 9 11.370 1.444 -4.128 1.00 0.00 H new ATOM 0 HG2 LYS A 9 11.984 2.422 -6.304 1.00 0.00 H new ATOM 0 HG3 LYS A 9 13.243 3.373 -5.543 1.00 0.00 H new ATOM 0 HD2 LYS A 9 14.392 1.292 -4.820 1.00 0.00 H new ATOM 0 HD3 LYS A 9 13.123 0.329 -5.551 1.00 0.00 H new ATOM 0 HE2 LYS A 9 15.041 0.453 -7.062 1.00 0.00 H new ATOM 0 HE3 LYS A 9 13.668 1.273 -7.778 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 14.865 3.111 -7.924 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 15.121 3.136 -6.245 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 16.204 2.308 -7.257 1.00 0.00 H new ATOM 145 N VAL A 10 10.721 3.234 -1.545 1.00 0.00 N ATOM 146 CA VAL A 10 9.989 2.924 -0.323 1.00 0.00 C ATOM 147 C VAL A 10 9.033 4.064 0.046 1.00 0.00 C ATOM 148 O VAL A 10 7.934 3.823 0.548 1.00 0.00 O ATOM 149 CB VAL A 10 10.957 2.614 0.848 1.00 0.00 C ATOM 150 CG1 VAL A 10 11.844 3.809 1.173 1.00 0.00 C ATOM 151 CG2 VAL A 10 10.191 2.161 2.081 1.00 0.00 C ATOM 0 H VAL A 10 11.715 3.416 -1.407 1.00 0.00 H new ATOM 0 HA VAL A 10 9.395 2.030 -0.509 1.00 0.00 H new ATOM 0 HB VAL A 10 11.605 1.798 0.528 1.00 0.00 H new ATOM 0 HG11 VAL A 10 12.509 3.555 1.998 1.00 0.00 H new ATOM 0 HG12 VAL A 10 12.437 4.071 0.297 1.00 0.00 H new ATOM 0 HG13 VAL A 10 11.222 4.658 1.457 1.00 0.00 H new ATOM 0 HG21 VAL A 10 10.893 1.950 2.888 1.00 0.00 H new ATOM 0 HG22 VAL A 10 9.505 2.949 2.393 1.00 0.00 H new ATOM 0 HG23 VAL A 10 9.625 1.259 1.847 1.00 0.00 H new ATOM 161 N GLU A 11 9.435 5.302 -0.232 1.00 0.00 N ATOM 162 CA GLU A 11 8.570 6.450 0.015 1.00 0.00 C ATOM 163 C GLU A 11 7.362 6.418 -0.910 1.00 0.00 C ATOM 164 O GLU A 11 6.239 6.676 -0.484 1.00 0.00 O ATOM 165 CB GLU A 11 9.334 7.761 -0.160 1.00 0.00 C ATOM 166 CG GLU A 11 10.317 8.048 0.963 1.00 0.00 C ATOM 167 CD GLU A 11 9.631 8.258 2.299 1.00 0.00 C ATOM 168 OE1 GLU A 11 9.322 7.255 2.975 1.00 0.00 O ATOM 169 OE2 GLU A 11 9.404 9.429 2.668 1.00 0.00 O ATOM 0 H GLU A 11 10.347 5.534 -0.625 1.00 0.00 H new ATOM 0 HA GLU A 11 8.223 6.392 1.047 1.00 0.00 H new ATOM 0 HB2 GLU A 11 9.874 7.733 -1.106 1.00 0.00 H new ATOM 0 HB3 GLU A 11 8.620 8.582 -0.225 1.00 0.00 H new ATOM 0 HG2 GLU A 11 11.020 7.219 1.046 1.00 0.00 H new ATOM 0 HG3 GLU A 11 10.899 8.936 0.714 1.00 0.00 H new ATOM 176 N GLU A 12 7.595 6.106 -2.176 1.00 0.00 N ATOM 177 CA GLU A 12 6.502 5.945 -3.131 1.00 0.00 C ATOM 178 C GLU A 12 5.565 4.798 -2.743 1.00 0.00 C ATOM 179 O GLU A 12 4.366 4.861 -3.005 1.00 0.00 O ATOM 180 CB GLU A 12 7.039 5.740 -4.547 1.00 0.00 C ATOM 181 CG GLU A 12 7.558 7.020 -5.184 1.00 0.00 C ATOM 182 CD GLU A 12 6.507 8.114 -5.241 1.00 0.00 C ATOM 183 OE1 GLU A 12 5.730 8.142 -6.215 1.00 0.00 O ATOM 184 OE2 GLU A 12 6.461 8.940 -4.305 1.00 0.00 O ATOM 0 H GLU A 12 8.525 5.959 -2.567 1.00 0.00 H new ATOM 0 HA GLU A 12 5.920 6.867 -3.108 1.00 0.00 H new ATOM 0 HB2 GLU A 12 7.842 5.004 -4.521 1.00 0.00 H new ATOM 0 HB3 GLU A 12 6.248 5.326 -5.172 1.00 0.00 H new ATOM 0 HG2 GLU A 12 8.419 7.378 -4.620 1.00 0.00 H new ATOM 0 HG3 GLU A 12 7.906 6.803 -6.194 1.00 0.00 H new ATOM 191 N LEU A 13 6.096 3.736 -2.149 1.00 0.00 N ATOM 192 CA LEU A 13 5.250 2.668 -1.645 1.00 0.00 C ATOM 193 C LEU A 13 4.499 3.065 -0.382 1.00 0.00 C ATOM 194 O LEU A 13 3.381 2.604 -0.169 1.00 0.00 O ATOM 195 CB LEU A 13 6.058 1.397 -1.455 1.00 0.00 C ATOM 196 CG LEU A 13 5.986 0.486 -2.665 1.00 0.00 C ATOM 197 CD1 LEU A 13 7.236 -0.370 -2.768 1.00 0.00 C ATOM 198 CD2 LEU A 13 4.741 -0.386 -2.594 1.00 0.00 C ATOM 0 H LEU A 13 7.096 3.594 -2.007 1.00 0.00 H new ATOM 0 HA LEU A 13 4.484 2.472 -2.395 1.00 0.00 H new ATOM 0 HB2 LEU A 13 7.098 1.656 -1.259 1.00 0.00 H new ATOM 0 HB3 LEU A 13 5.692 0.863 -0.578 1.00 0.00 H new ATOM 0 HG LEU A 13 5.925 1.104 -3.561 1.00 0.00 H new ATOM 0 HD11 LEU A 13 7.163 -1.016 -3.643 1.00 0.00 H new ATOM 0 HD12 LEU A 13 8.111 0.273 -2.863 1.00 0.00 H new ATOM 0 HD13 LEU A 13 7.332 -0.983 -1.872 1.00 0.00 H new ATOM 0 HD21 LEU A 13 4.701 -1.035 -3.469 1.00 0.00 H new ATOM 0 HD22 LEU A 13 4.775 -0.995 -1.691 1.00 0.00 H new ATOM 0 HD23 LEU A 13 3.854 0.247 -2.572 1.00 0.00 H new ATOM 210 N LEU A 14 5.091 3.916 0.451 1.00 0.00 N ATOM 211 CA LEU A 14 4.332 4.542 1.528 1.00 0.00 C ATOM 212 C LEU A 14 3.221 5.381 0.922 1.00 0.00 C ATOM 213 O LEU A 14 2.070 5.316 1.355 1.00 0.00 O ATOM 214 CB LEU A 14 5.217 5.440 2.401 1.00 0.00 C ATOM 215 CG LEU A 14 6.297 4.740 3.255 1.00 0.00 C ATOM 216 CD1 LEU A 14 6.588 5.536 4.524 1.00 0.00 C ATOM 217 CD2 LEU A 14 5.896 3.318 3.626 1.00 0.00 C ATOM 0 H LEU A 14 6.074 4.184 0.404 1.00 0.00 H new ATOM 0 HA LEU A 14 3.925 3.753 2.160 1.00 0.00 H new ATOM 0 HB2 LEU A 14 5.713 6.161 1.752 1.00 0.00 H new ATOM 0 HB3 LEU A 14 4.570 6.006 3.071 1.00 0.00 H new ATOM 0 HG LEU A 14 7.199 4.692 2.645 1.00 0.00 H new ATOM 0 HD11 LEU A 14 7.352 5.023 5.108 1.00 0.00 H new ATOM 0 HD12 LEU A 14 6.944 6.531 4.256 1.00 0.00 H new ATOM 0 HD13 LEU A 14 5.677 5.624 5.115 1.00 0.00 H new ATOM 0 HD21 LEU A 14 6.684 2.863 4.226 1.00 0.00 H new ATOM 0 HD22 LEU A 14 4.969 3.339 4.199 1.00 0.00 H new ATOM 0 HD23 LEU A 14 5.748 2.733 2.718 1.00 0.00 H new ATOM 229 N SER A 15 3.587 6.163 -0.089 1.00 0.00 N ATOM 230 CA SER A 15 2.630 6.952 -0.842 1.00 0.00 C ATOM 231 C SER A 15 1.494 6.072 -1.347 1.00 0.00 C ATOM 232 O SER A 15 0.327 6.408 -1.165 1.00 0.00 O ATOM 233 CB SER A 15 3.321 7.652 -2.015 1.00 0.00 C ATOM 234 OG SER A 15 4.365 8.500 -1.561 1.00 0.00 O ATOM 0 H SER A 15 4.552 6.264 -0.405 1.00 0.00 H new ATOM 0 HA SER A 15 2.213 7.711 -0.180 1.00 0.00 H new ATOM 0 HB2 SER A 15 3.726 6.907 -2.700 1.00 0.00 H new ATOM 0 HB3 SER A 15 2.591 8.237 -2.575 1.00 0.00 H new ATOM 0 HG SER A 15 5.104 7.955 -1.220 1.00 0.00 H new ATOM 240 N LYS A 16 1.824 4.935 -1.963 1.00 0.00 N ATOM 241 CA LYS A 16 0.789 4.025 -2.424 1.00 0.00 C ATOM 242 C LYS A 16 -0.005 3.436 -1.259 1.00 0.00 C ATOM 243 O LYS A 16 -1.220 3.547 -1.240 1.00 0.00 O ATOM 244 CB LYS A 16 1.370 2.917 -3.298 1.00 0.00 C ATOM 245 CG LYS A 16 1.643 3.371 -4.724 1.00 0.00 C ATOM 246 CD LYS A 16 2.074 2.218 -5.611 1.00 0.00 C ATOM 247 CE LYS A 16 3.483 1.752 -5.289 1.00 0.00 C ATOM 248 NZ LYS A 16 4.498 2.795 -5.596 1.00 0.00 N ATOM 0 H LYS A 16 2.780 4.632 -2.149 1.00 0.00 H new ATOM 0 HA LYS A 16 0.099 4.609 -3.034 1.00 0.00 H new ATOM 0 HB2 LYS A 16 2.298 2.558 -2.852 1.00 0.00 H new ATOM 0 HB3 LYS A 16 0.678 2.075 -3.316 1.00 0.00 H new ATOM 0 HG2 LYS A 16 0.745 3.831 -5.137 1.00 0.00 H new ATOM 0 HG3 LYS A 16 2.420 4.136 -4.719 1.00 0.00 H new ATOM 0 HD2 LYS A 16 1.380 1.387 -5.489 1.00 0.00 H new ATOM 0 HD3 LYS A 16 2.023 2.525 -6.656 1.00 0.00 H new ATOM 0 HE2 LYS A 16 3.545 1.485 -4.234 1.00 0.00 H new ATOM 0 HE3 LYS A 16 3.706 0.850 -5.859 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 5.439 2.356 -5.658 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 4.267 3.248 -6.503 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 4.499 3.511 -4.842 1.00 0.00 H new ATOM 262 N ASN A 17 0.684 2.842 -0.287 1.00 0.00 N ATOM 263 CA ASN A 17 0.030 2.182 0.848 1.00 0.00 C ATOM 264 C ASN A 17 -0.950 3.113 1.573 1.00 0.00 C ATOM 265 O ASN A 17 -2.147 2.832 1.648 1.00 0.00 O ATOM 266 CB ASN A 17 1.089 1.676 1.835 1.00 0.00 C ATOM 267 CG ASN A 17 0.495 0.954 3.032 1.00 0.00 C ATOM 268 OD1 ASN A 17 -0.549 0.310 2.939 1.00 0.00 O ATOM 269 ND2 ASN A 17 1.165 1.052 4.171 1.00 0.00 N ATOM 0 H ASN A 17 1.703 2.803 -0.260 1.00 0.00 H new ATOM 0 HA ASN A 17 -0.544 1.344 0.453 1.00 0.00 H new ATOM 0 HB2 ASN A 17 1.770 1.003 1.314 1.00 0.00 H new ATOM 0 HB3 ASN A 17 1.682 2.520 2.186 1.00 0.00 H new ATOM 0 HD21 ASN A 17 0.818 0.584 5.009 1.00 0.00 H new ATOM 0 HD22 ASN A 17 2.028 1.595 4.210 1.00 0.00 H new ATOM 276 N TYR A 18 -0.447 4.227 2.090 1.00 0.00 N ATOM 277 CA TYR A 18 -1.262 5.130 2.896 1.00 0.00 C ATOM 278 C TYR A 18 -2.369 5.789 2.076 1.00 0.00 C ATOM 279 O TYR A 18 -3.498 5.928 2.551 1.00 0.00 O ATOM 280 CB TYR A 18 -0.391 6.196 3.560 1.00 0.00 C ATOM 281 CG TYR A 18 0.504 5.649 4.651 1.00 0.00 C ATOM 282 CD1 TYR A 18 1.859 5.443 4.430 1.00 0.00 C ATOM 283 CD2 TYR A 18 -0.009 5.338 5.903 1.00 0.00 C ATOM 284 CE1 TYR A 18 2.677 4.945 5.425 1.00 0.00 C ATOM 285 CE2 TYR A 18 0.803 4.839 6.904 1.00 0.00 C ATOM 286 CZ TYR A 18 2.145 4.645 6.660 1.00 0.00 C ATOM 287 OH TYR A 18 2.959 4.149 7.653 1.00 0.00 O ATOM 0 H TYR A 18 0.520 4.527 1.966 1.00 0.00 H new ATOM 0 HA TYR A 18 -1.739 4.528 3.669 1.00 0.00 H new ATOM 0 HB2 TYR A 18 0.227 6.675 2.800 1.00 0.00 H new ATOM 0 HB3 TYR A 18 -1.034 6.969 3.981 1.00 0.00 H new ATOM 0 HD1 TYR A 18 2.281 5.676 3.463 1.00 0.00 H new ATOM 0 HD2 TYR A 18 -1.061 5.489 6.098 1.00 0.00 H new ATOM 0 HE1 TYR A 18 3.729 4.791 5.236 1.00 0.00 H new ATOM 0 HE2 TYR A 18 0.388 4.602 7.872 1.00 0.00 H new ATOM 0 HH TYR A 18 2.429 3.991 8.462 1.00 0.00 H new ATOM 297 N HIS A 19 -2.059 6.183 0.845 1.00 0.00 N ATOM 298 CA HIS A 19 -3.048 6.840 -0.006 1.00 0.00 C ATOM 299 C HIS A 19 -4.061 5.839 -0.549 1.00 0.00 C ATOM 300 O HIS A 19 -5.203 6.195 -0.835 1.00 0.00 O ATOM 301 CB HIS A 19 -2.381 7.600 -1.154 1.00 0.00 C ATOM 302 CG HIS A 19 -1.784 8.912 -0.736 1.00 0.00 C ATOM 303 ND1 HIS A 19 -2.305 10.128 -1.118 1.00 0.00 N ATOM 304 CD2 HIS A 19 -0.709 9.194 0.039 1.00 0.00 C ATOM 305 CE1 HIS A 19 -1.580 11.099 -0.597 1.00 0.00 C ATOM 306 NE2 HIS A 19 -0.607 10.560 0.109 1.00 0.00 N ATOM 0 H HIS A 19 -1.141 6.061 0.417 1.00 0.00 H new ATOM 0 HA HIS A 19 -3.579 7.562 0.615 1.00 0.00 H new ATOM 0 HB2 HIS A 19 -1.599 6.976 -1.587 1.00 0.00 H new ATOM 0 HB3 HIS A 19 -3.117 7.778 -1.938 1.00 0.00 H new ATOM 0 HD2 HIS A 19 -0.055 8.477 0.513 1.00 0.00 H new ATOM 0 HE1 HIS A 19 -1.754 12.157 -0.727 1.00 0.00 H new ATOM 0 HE2 HIS A 19 0.107 11.075 0.624 1.00 0.00 H new ATOM 315 N LEU A 20 -3.651 4.588 -0.686 1.00 0.00 N ATOM 316 CA LEU A 20 -4.567 3.542 -1.077 1.00 0.00 C ATOM 317 C LEU A 20 -5.511 3.255 0.075 1.00 0.00 C ATOM 318 O LEU A 20 -6.695 3.002 -0.130 1.00 0.00 O ATOM 319 CB LEU A 20 -3.804 2.281 -1.482 1.00 0.00 C ATOM 320 CG LEU A 20 -4.669 1.093 -1.880 1.00 0.00 C ATOM 321 CD1 LEU A 20 -5.526 1.427 -3.091 1.00 0.00 C ATOM 322 CD2 LEU A 20 -3.798 -0.117 -2.163 1.00 0.00 C ATOM 0 H LEU A 20 -2.692 4.278 -0.532 1.00 0.00 H new ATOM 0 HA LEU A 20 -5.144 3.870 -1.942 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -3.148 2.527 -2.317 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -3.165 1.981 -0.651 1.00 0.00 H new ATOM 0 HG LEU A 20 -5.335 0.860 -1.049 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -6.135 0.562 -3.356 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -6.176 2.270 -2.856 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -4.883 1.689 -3.931 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -4.428 -0.960 -2.447 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -3.110 0.112 -2.977 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -3.230 -0.373 -1.269 1.00 0.00 H new ATOM 334 N GLU A 21 -4.987 3.334 1.297 1.00 0.00 N ATOM 335 CA GLU A 21 -5.815 3.166 2.485 1.00 0.00 C ATOM 336 C GLU A 21 -6.860 4.280 2.563 1.00 0.00 C ATOM 337 O GLU A 21 -7.971 4.072 3.050 1.00 0.00 O ATOM 338 CB GLU A 21 -4.955 3.142 3.748 1.00 0.00 C ATOM 339 CG GLU A 21 -5.720 2.713 4.989 1.00 0.00 C ATOM 340 CD GLU A 21 -4.830 2.567 6.205 1.00 0.00 C ATOM 341 OE1 GLU A 21 -4.163 1.520 6.324 1.00 0.00 O ATOM 342 OE2 GLU A 21 -4.803 3.495 7.038 1.00 0.00 O ATOM 0 H GLU A 21 -4.001 3.512 1.488 1.00 0.00 H new ATOM 0 HA GLU A 21 -6.332 2.209 2.413 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -4.116 2.464 3.595 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -4.536 4.135 3.913 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -6.500 3.445 5.201 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -6.218 1.764 4.793 1.00 0.00 H new ATOM 349 N ASN A 22 -6.497 5.457 2.060 1.00 0.00 N ATOM 350 CA ASN A 22 -7.436 6.574 1.960 1.00 0.00 C ATOM 351 C ASN A 22 -8.594 6.205 1.043 1.00 0.00 C ATOM 352 O ASN A 22 -9.739 6.600 1.270 1.00 0.00 O ATOM 353 CB ASN A 22 -6.744 7.826 1.411 1.00 0.00 C ATOM 354 CG ASN A 22 -5.688 8.393 2.338 1.00 0.00 C ATOM 355 OD1 ASN A 22 -4.676 8.927 1.882 1.00 0.00 O ATOM 356 ND2 ASN A 22 -5.918 8.304 3.638 1.00 0.00 N ATOM 0 H ASN A 22 -5.560 5.663 1.715 1.00 0.00 H new ATOM 0 HA ASN A 22 -7.810 6.786 2.962 1.00 0.00 H new ATOM 0 HB2 ASN A 22 -6.283 7.585 0.453 1.00 0.00 H new ATOM 0 HB3 ASN A 22 -7.496 8.592 1.219 1.00 0.00 H new ATOM 0 HD21 ASN A 22 -5.245 8.686 4.302 1.00 0.00 H new ATOM 0 HD22 ASN A 22 -6.769 7.854 3.976 1.00 0.00 H new ATOM 363 N GLU A 23 -8.283 5.429 0.014 1.00 0.00 N ATOM 364 CA GLU A 23 -9.263 5.024 -0.982 1.00 0.00 C ATOM 365 C GLU A 23 -10.225 3.989 -0.406 1.00 0.00 C ATOM 366 O GLU A 23 -11.422 4.017 -0.690 1.00 0.00 O ATOM 367 CB GLU A 23 -8.555 4.453 -2.212 1.00 0.00 C ATOM 368 CG GLU A 23 -9.499 4.030 -3.324 1.00 0.00 C ATOM 369 CD GLU A 23 -8.776 3.346 -4.466 1.00 0.00 C ATOM 370 OE1 GLU A 23 -8.764 2.098 -4.491 1.00 0.00 O ATOM 371 OE2 GLU A 23 -8.219 4.055 -5.330 1.00 0.00 O ATOM 0 H GLU A 23 -7.346 5.063 -0.153 1.00 0.00 H new ATOM 0 HA GLU A 23 -9.838 5.902 -1.275 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -7.863 5.200 -2.601 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -7.958 3.593 -1.909 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -10.254 3.356 -2.919 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -10.025 4.906 -3.703 1.00 0.00 H new ATOM 378 N VAL A 24 -9.702 3.079 0.409 1.00 0.00 N ATOM 379 CA VAL A 24 -10.540 2.049 1.012 1.00 0.00 C ATOM 380 C VAL A 24 -11.484 2.687 2.021 1.00 0.00 C ATOM 381 O VAL A 24 -12.613 2.237 2.216 1.00 0.00 O ATOM 382 CB VAL A 24 -9.712 0.922 1.688 1.00 0.00 C ATOM 383 CG1 VAL A 24 -8.330 0.830 1.088 1.00 0.00 C ATOM 384 CG2 VAL A 24 -9.622 1.086 3.197 1.00 0.00 C ATOM 0 H VAL A 24 -8.716 3.033 0.665 1.00 0.00 H new ATOM 0 HA VAL A 24 -11.111 1.581 0.210 1.00 0.00 H new ATOM 0 HB VAL A 24 -10.245 -0.009 1.495 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -7.772 0.033 1.580 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -8.410 0.613 0.023 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -7.809 1.777 1.228 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -9.032 0.271 3.617 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -9.145 2.038 3.432 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -10.624 1.067 3.625 1.00 0.00 H new ATOM 394 N ALA A 25 -11.010 3.759 2.640 1.00 0.00 N ATOM 395 CA ALA A 25 -11.820 4.521 3.576 1.00 0.00 C ATOM 396 C ALA A 25 -13.013 5.143 2.863 1.00 0.00 C ATOM 397 O ALA A 25 -14.086 5.283 3.442 1.00 0.00 O ATOM 398 CB ALA A 25 -10.990 5.594 4.256 1.00 0.00 C ATOM 0 H ALA A 25 -10.065 4.121 2.509 1.00 0.00 H new ATOM 0 HA ALA A 25 -12.190 3.839 4.342 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -11.616 6.152 4.952 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -10.169 5.128 4.800 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -10.588 6.274 3.505 1.00 0.00 H new ATOM 404 N ARG A 26 -12.815 5.501 1.597 1.00 0.00 N ATOM 405 CA ARG A 26 -13.889 6.050 0.778 1.00 0.00 C ATOM 406 C ARG A 26 -14.980 5.006 0.596 1.00 0.00 C ATOM 407 O ARG A 26 -16.153 5.261 0.866 1.00 0.00 O ATOM 408 CB ARG A 26 -13.368 6.486 -0.596 1.00 0.00 C ATOM 409 CG ARG A 26 -12.268 7.533 -0.545 1.00 0.00 C ATOM 410 CD ARG A 26 -12.719 8.783 0.194 1.00 0.00 C ATOM 411 NE ARG A 26 -11.718 9.844 0.132 1.00 0.00 N ATOM 412 CZ ARG A 26 -11.872 11.044 0.685 1.00 0.00 C ATOM 413 NH1 ARG A 26 -12.978 11.335 1.359 1.00 0.00 N ATOM 414 NH2 ARG A 26 -10.915 11.953 0.567 1.00 0.00 N ATOM 0 H ARG A 26 -11.919 5.420 1.117 1.00 0.00 H new ATOM 0 HA ARG A 26 -14.293 6.925 1.288 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -12.994 5.609 -1.125 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -14.201 6.879 -1.179 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -11.390 7.115 -0.052 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -11.969 7.797 -1.559 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -13.654 9.141 -0.236 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -12.921 8.535 1.236 1.00 0.00 H new ATOM 0 HE ARG A 26 -10.848 9.654 -0.365 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -13.715 10.637 1.455 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -13.090 12.257 1.781 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -10.062 11.732 0.053 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -11.031 12.874 0.990 1.00 0.00 H new ATOM 428 N LEU A 27 -14.570 3.822 0.156 1.00 0.00 N ATOM 429 CA LEU A 27 -15.486 2.707 -0.037 1.00 0.00 C ATOM 430 C LEU A 27 -16.199 2.368 1.260 1.00 0.00 C ATOM 431 O LEU A 27 -17.396 2.107 1.265 1.00 0.00 O ATOM 432 CB LEU A 27 -14.735 1.483 -0.548 1.00 0.00 C ATOM 433 CG LEU A 27 -14.065 1.647 -1.906 1.00 0.00 C ATOM 434 CD1 LEU A 27 -12.893 0.695 -2.047 1.00 0.00 C ATOM 435 CD2 LEU A 27 -15.073 1.401 -3.013 1.00 0.00 C ATOM 0 H LEU A 27 -13.600 3.610 -0.075 1.00 0.00 H new ATOM 0 HA LEU A 27 -16.228 3.003 -0.778 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -13.973 1.214 0.184 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -15.433 0.647 -0.605 1.00 0.00 H new ATOM 0 HG LEU A 27 -13.688 2.667 -1.984 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -12.430 0.830 -3.025 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -12.160 0.902 -1.267 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -13.245 -0.332 -1.951 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -14.587 1.520 -3.981 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -15.468 0.389 -2.927 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -15.890 2.117 -2.927 1.00 0.00 H new ATOM 447 N LYS A 28 -15.451 2.395 2.355 1.00 0.00 N ATOM 448 CA LYS A 28 -16.001 2.130 3.679 1.00 0.00 C ATOM 449 C LYS A 28 -17.220 3.015 3.958 1.00 0.00 C ATOM 450 O LYS A 28 -18.226 2.550 4.495 1.00 0.00 O ATOM 451 CB LYS A 28 -14.922 2.362 4.743 1.00 0.00 C ATOM 452 CG LYS A 28 -15.355 2.015 6.158 1.00 0.00 C ATOM 453 CD LYS A 28 -15.665 0.535 6.305 1.00 0.00 C ATOM 454 CE LYS A 28 -16.061 0.192 7.730 1.00 0.00 C ATOM 455 NZ LYS A 28 -16.427 -1.242 7.873 1.00 0.00 N ATOM 0 H LYS A 28 -14.452 2.600 2.352 1.00 0.00 H new ATOM 0 HA LYS A 28 -16.327 1.090 3.715 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -14.044 1.769 4.488 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -14.619 3.409 4.714 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -14.567 2.293 6.858 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -16.236 2.599 6.422 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -16.472 0.261 5.625 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -14.793 -0.052 6.017 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -15.235 0.425 8.402 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -16.904 0.814 8.032 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -16.691 -1.436 8.860 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -17.231 -1.459 7.250 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -15.615 -1.836 7.609 1.00 0.00 H new ATOM 469 N LYS A 29 -17.136 4.282 3.568 1.00 0.00 N ATOM 470 CA LYS A 29 -18.216 5.227 3.800 1.00 0.00 C ATOM 471 C LYS A 29 -19.396 4.924 2.882 1.00 0.00 C ATOM 472 O LYS A 29 -20.555 5.104 3.257 1.00 0.00 O ATOM 473 CB LYS A 29 -17.731 6.659 3.561 1.00 0.00 C ATOM 474 CG LYS A 29 -16.421 7.002 4.262 1.00 0.00 C ATOM 475 CD LYS A 29 -16.468 6.713 5.755 1.00 0.00 C ATOM 476 CE LYS A 29 -17.479 7.590 6.472 1.00 0.00 C ATOM 477 NZ LYS A 29 -17.573 7.249 7.915 1.00 0.00 N ATOM 0 H LYS A 29 -16.327 4.677 3.088 1.00 0.00 H new ATOM 0 HA LYS A 29 -18.539 5.129 4.836 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -17.608 6.814 2.489 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -18.502 7.352 3.897 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -15.610 6.431 3.810 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -16.194 8.057 4.106 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -16.720 5.665 5.914 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -15.480 6.872 6.186 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -17.196 8.637 6.363 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -18.457 7.474 6.006 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -18.297 7.844 8.366 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -17.834 6.248 8.019 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -16.654 7.416 8.372 1.00 0.00 H new ATOM 491 N LEU A 30 -19.093 4.454 1.681 1.00 0.00 N ATOM 492 CA LEU A 30 -20.120 4.124 0.701 1.00 0.00 C ATOM 493 C LEU A 30 -20.822 2.820 1.064 1.00 0.00 C ATOM 494 O LEU A 30 -22.000 2.636 0.758 1.00 0.00 O ATOM 495 CB LEU A 30 -19.512 4.019 -0.704 1.00 0.00 C ATOM 496 CG LEU A 30 -19.416 5.325 -1.512 1.00 0.00 C ATOM 497 CD1 LEU A 30 -20.799 5.857 -1.861 1.00 0.00 C ATOM 498 CD2 LEU A 30 -18.615 6.376 -0.762 1.00 0.00 C ATOM 0 H LEU A 30 -18.139 4.291 1.359 1.00 0.00 H new ATOM 0 HA LEU A 30 -20.857 4.927 0.707 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -18.510 3.601 -0.611 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -20.103 3.305 -1.278 1.00 0.00 H new ATOM 0 HG LEU A 30 -18.894 5.098 -2.441 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -20.700 6.780 -2.432 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -21.334 5.117 -2.457 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -21.355 6.055 -0.944 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -18.564 7.288 -1.357 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -19.099 6.591 0.191 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -17.607 6.004 -0.581 1.00 0.00 H new ATOM 510 N VAL A 31 -20.098 1.917 1.717 1.00 0.00 N ATOM 511 CA VAL A 31 -20.671 0.647 2.140 1.00 0.00 C ATOM 512 C VAL A 31 -21.706 0.861 3.245 1.00 0.00 C ATOM 513 O VAL A 31 -22.701 0.138 3.321 1.00 0.00 O ATOM 514 CB VAL A 31 -19.584 -0.356 2.613 1.00 0.00 C ATOM 515 CG1 VAL A 31 -20.212 -1.644 3.125 1.00 0.00 C ATOM 516 CG2 VAL A 31 -18.618 -0.665 1.482 1.00 0.00 C ATOM 0 H VAL A 31 -19.116 2.042 1.964 1.00 0.00 H new ATOM 0 HA VAL A 31 -21.163 0.214 1.269 1.00 0.00 H new ATOM 0 HB VAL A 31 -19.036 0.109 3.433 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -19.427 -2.327 3.449 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -20.868 -1.420 3.966 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -20.791 -2.109 2.327 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -17.863 -1.369 1.831 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -19.164 -1.103 0.646 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -18.133 0.255 1.156 1.00 0.00 H new ATOM 526 N GLY A 32 -21.498 1.873 4.081 1.00 0.00 N ATOM 527 CA GLY A 32 -22.443 2.127 5.147 1.00 0.00 C ATOM 528 C GLY A 32 -21.924 3.090 6.191 1.00 0.00 C ATOM 529 O GLY A 32 -22.060 2.834 7.386 1.00 0.00 O ATOM 0 H GLY A 32 -20.704 2.512 4.040 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -23.363 2.526 4.720 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -22.699 1.183 5.629 1.00 0.00 H new ATOM 533 N GLU A 33 -21.340 4.196 5.735 1.00 0.00 N ATOM 534 CA GLU A 33 -20.845 5.254 6.618 1.00 0.00 C ATOM 535 C GLU A 33 -19.794 4.725 7.594 1.00 0.00 C ATOM 536 O GLU A 33 -20.159 4.336 8.724 1.00 0.00 O ATOM 537 CB GLU A 33 -22.005 5.899 7.384 1.00 0.00 C ATOM 538 CG GLU A 33 -23.087 6.473 6.482 1.00 0.00 C ATOM 539 CD GLU A 33 -24.211 7.123 7.263 1.00 0.00 C ATOM 540 OE1 GLU A 33 -24.182 8.361 7.421 1.00 0.00 O ATOM 541 OE2 GLU A 33 -25.119 6.395 7.716 1.00 0.00 O ATOM 542 OXT GLU A 33 -18.602 4.696 7.228 1.00 0.00 O ATOM 0 H GLU A 33 -21.196 4.386 4.743 1.00 0.00 H new ATOM 0 HA GLU A 33 -20.369 6.010 5.993 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -22.451 5.155 8.044 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -21.613 6.694 8.018 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -22.643 7.208 5.811 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -23.495 5.678 5.859 1.00 0.00 H new TER 549 GLU A 33 ATOM 550 N GLY B 1 23.295 -8.318 7.082 1.00 0.00 N ATOM 551 CA GLY B 1 22.797 -8.270 5.688 1.00 0.00 C ATOM 552 C GLY B 1 21.918 -7.063 5.439 1.00 0.00 C ATOM 553 O GLY B 1 20.788 -6.997 5.925 1.00 0.00 O ATOM 0 H1 GLY B 1 23.892 -9.160 7.208 1.00 0.00 H new ATOM 0 H2 GLY B 1 23.854 -7.464 7.281 1.00 0.00 H new ATOM 0 H3 GLY B 1 22.489 -8.364 7.737 1.00 0.00 H new ATOM 0 HA2 GLY B 1 23.643 -8.249 5.002 1.00 0.00 H new ATOM 0 HA3 GLY B 1 22.234 -9.178 5.473 1.00 0.00 H new ATOM 559 N SER B 2 22.435 -6.105 4.681 1.00 0.00 N ATOM 560 CA SER B 2 21.701 -4.887 4.381 1.00 0.00 C ATOM 561 C SER B 2 20.678 -5.120 3.273 1.00 0.00 C ATOM 562 O SER B 2 19.506 -4.772 3.420 1.00 0.00 O ATOM 563 CB SER B 2 22.679 -3.777 3.987 1.00 0.00 C ATOM 564 OG SER B 2 23.603 -4.233 3.010 1.00 0.00 O ATOM 0 H SER B 2 23.364 -6.150 4.262 1.00 0.00 H new ATOM 0 HA SER B 2 21.157 -4.581 5.275 1.00 0.00 H new ATOM 0 HB2 SER B 2 22.126 -2.922 3.598 1.00 0.00 H new ATOM 0 HB3 SER B 2 23.218 -3.433 4.870 1.00 0.00 H new ATOM 0 HG SER B 2 24.215 -3.505 2.774 1.00 0.00 H new ATOM 570 N MET B 3 21.122 -5.735 2.181 1.00 0.00 N ATOM 571 CA MET B 3 20.267 -5.970 1.018 1.00 0.00 C ATOM 572 C MET B 3 19.124 -6.925 1.334 1.00 0.00 C ATOM 573 O MET B 3 18.043 -6.821 0.756 1.00 0.00 O ATOM 574 CB MET B 3 21.087 -6.508 -0.156 1.00 0.00 C ATOM 575 CG MET B 3 21.709 -5.419 -1.013 1.00 0.00 C ATOM 576 SD MET B 3 20.467 -4.408 -1.844 1.00 0.00 S ATOM 577 CE MET B 3 21.506 -3.246 -2.725 1.00 0.00 C ATOM 0 H MET B 3 22.075 -6.082 2.075 1.00 0.00 H new ATOM 0 HA MET B 3 19.833 -5.009 0.742 1.00 0.00 H new ATOM 0 HB2 MET B 3 21.878 -7.152 0.229 1.00 0.00 H new ATOM 0 HB3 MET B 3 20.446 -7.129 -0.782 1.00 0.00 H new ATOM 0 HG2 MET B 3 22.335 -4.781 -0.389 1.00 0.00 H new ATOM 0 HG3 MET B 3 22.361 -5.874 -1.758 1.00 0.00 H new ATOM 0 HE1 MET B 3 20.881 -2.553 -3.288 1.00 0.00 H new ATOM 0 HE2 MET B 3 22.114 -2.689 -2.012 1.00 0.00 H new ATOM 0 HE3 MET B 3 22.156 -3.788 -3.412 1.00 0.00 H new ATOM 587 N LYS B 4 19.357 -7.858 2.247 1.00 0.00 N ATOM 588 CA LYS B 4 18.315 -8.793 2.647 1.00 0.00 C ATOM 589 C LYS B 4 17.182 -8.062 3.353 1.00 0.00 C ATOM 590 O LYS B 4 16.021 -8.169 2.953 1.00 0.00 O ATOM 591 CB LYS B 4 18.880 -9.892 3.550 1.00 0.00 C ATOM 592 CG LYS B 4 19.748 -10.905 2.820 1.00 0.00 C ATOM 593 CD LYS B 4 18.979 -11.598 1.705 1.00 0.00 C ATOM 594 CE LYS B 4 19.794 -12.717 1.075 1.00 0.00 C ATOM 595 NZ LYS B 4 20.090 -13.803 2.047 1.00 0.00 N ATOM 0 H LYS B 4 20.251 -7.987 2.721 1.00 0.00 H new ATOM 0 HA LYS B 4 17.921 -9.261 1.745 1.00 0.00 H new ATOM 0 HB2 LYS B 4 19.467 -9.430 4.344 1.00 0.00 H new ATOM 0 HB3 LYS B 4 18.053 -10.416 4.029 1.00 0.00 H new ATOM 0 HG2 LYS B 4 20.622 -10.404 2.404 1.00 0.00 H new ATOM 0 HG3 LYS B 4 20.114 -11.649 3.528 1.00 0.00 H new ATOM 0 HD2 LYS B 4 18.048 -12.004 2.102 1.00 0.00 H new ATOM 0 HD3 LYS B 4 18.709 -10.869 0.941 1.00 0.00 H new ATOM 0 HE2 LYS B 4 19.249 -13.129 0.225 1.00 0.00 H new ATOM 0 HE3 LYS B 4 20.729 -12.312 0.688 1.00 0.00 H new ATOM 0 HZ1 LYS B 4 20.400 -14.653 1.534 1.00 0.00 H new ATOM 0 HZ2 LYS B 4 20.844 -13.494 2.693 1.00 0.00 H new ATOM 0 HZ3 LYS B 4 19.233 -14.022 2.594 1.00 0.00 H new ATOM 609 N GLN B 5 17.531 -7.297 4.381 1.00 0.00 N ATOM 610 CA GLN B 5 16.547 -6.538 5.144 1.00 0.00 C ATOM 611 C GLN B 5 15.917 -5.451 4.283 1.00 0.00 C ATOM 612 O GLN B 5 14.763 -5.071 4.487 1.00 0.00 O ATOM 613 CB GLN B 5 17.194 -5.912 6.379 1.00 0.00 C ATOM 614 CG GLN B 5 17.730 -6.928 7.371 1.00 0.00 C ATOM 615 CD GLN B 5 18.417 -6.277 8.556 1.00 0.00 C ATOM 616 OE1 GLN B 5 17.787 -5.987 9.576 1.00 0.00 O ATOM 617 NE2 GLN B 5 19.712 -6.045 8.431 1.00 0.00 N ATOM 0 H GLN B 5 18.491 -7.186 4.706 1.00 0.00 H new ATOM 0 HA GLN B 5 15.765 -7.227 5.464 1.00 0.00 H new ATOM 0 HB2 GLN B 5 18.010 -5.263 6.061 1.00 0.00 H new ATOM 0 HB3 GLN B 5 16.461 -5.280 6.881 1.00 0.00 H new ATOM 0 HG2 GLN B 5 16.909 -7.550 7.728 1.00 0.00 H new ATOM 0 HG3 GLN B 5 18.434 -7.588 6.865 1.00 0.00 H new ATOM 0 HE21 GLN B 5 20.195 -6.301 7.570 1.00 0.00 H new ATOM 0 HE22 GLN B 5 20.228 -5.610 9.196 1.00 0.00 H new ATOM 626 N LEU B 6 16.684 -4.951 3.326 1.00 0.00 N ATOM 627 CA LEU B 6 16.211 -3.913 2.423 1.00 0.00 C ATOM 628 C LEU B 6 15.156 -4.466 1.469 1.00 0.00 C ATOM 629 O LEU B 6 14.130 -3.827 1.229 1.00 0.00 O ATOM 630 CB LEU B 6 17.387 -3.323 1.637 1.00 0.00 C ATOM 631 CG LEU B 6 17.032 -2.191 0.677 1.00 0.00 C ATOM 632 CD1 LEU B 6 16.544 -0.972 1.448 1.00 0.00 C ATOM 633 CD2 LEU B 6 18.233 -1.845 -0.188 1.00 0.00 C ATOM 0 H LEU B 6 17.644 -5.250 3.154 1.00 0.00 H new ATOM 0 HA LEU B 6 15.752 -3.122 3.015 1.00 0.00 H new ATOM 0 HB2 LEU B 6 18.128 -2.955 2.347 1.00 0.00 H new ATOM 0 HB3 LEU B 6 17.860 -4.124 1.068 1.00 0.00 H new ATOM 0 HG LEU B 6 16.223 -2.521 0.025 1.00 0.00 H new ATOM 0 HD11 LEU B 6 16.295 -0.174 0.748 1.00 0.00 H new ATOM 0 HD12 LEU B 6 15.658 -1.237 2.025 1.00 0.00 H new ATOM 0 HD13 LEU B 6 17.329 -0.631 2.123 1.00 0.00 H new ATOM 0 HD21 LEU B 6 17.970 -1.036 -0.870 1.00 0.00 H new ATOM 0 HD22 LEU B 6 19.060 -1.529 0.448 1.00 0.00 H new ATOM 0 HD23 LEU B 6 18.532 -2.721 -0.763 1.00 0.00 H new ATOM 645 N GLU B 7 15.401 -5.664 0.945 1.00 0.00 N ATOM 646 CA GLU B 7 14.479 -6.299 0.029 1.00 0.00 C ATOM 647 C GLU B 7 13.167 -6.613 0.734 1.00 0.00 C ATOM 648 O GLU B 7 12.090 -6.445 0.166 1.00 0.00 O ATOM 649 CB GLU B 7 15.103 -7.577 -0.529 1.00 0.00 C ATOM 650 CG GLU B 7 14.372 -8.124 -1.735 1.00 0.00 C ATOM 651 CD GLU B 7 15.031 -9.363 -2.314 1.00 0.00 C ATOM 652 OE1 GLU B 7 15.859 -9.215 -3.237 1.00 0.00 O ATOM 653 OE2 GLU B 7 14.724 -10.476 -1.842 1.00 0.00 O ATOM 0 H GLU B 7 16.238 -6.211 1.145 1.00 0.00 H new ATOM 0 HA GLU B 7 14.271 -5.618 -0.796 1.00 0.00 H new ATOM 0 HB2 GLU B 7 16.140 -7.378 -0.801 1.00 0.00 H new ATOM 0 HB3 GLU B 7 15.119 -8.336 0.253 1.00 0.00 H new ATOM 0 HG2 GLU B 7 13.346 -8.362 -1.454 1.00 0.00 H new ATOM 0 HG3 GLU B 7 14.322 -7.353 -2.504 1.00 0.00 H new ATOM 660 N ASP B 8 13.265 -7.047 1.986 1.00 0.00 N ATOM 661 CA ASP B 8 12.084 -7.375 2.776 1.00 0.00 C ATOM 662 C ASP B 8 11.175 -6.162 2.940 1.00 0.00 C ATOM 663 O ASP B 8 9.959 -6.289 2.886 1.00 0.00 O ATOM 664 CB ASP B 8 12.474 -7.923 4.151 1.00 0.00 C ATOM 665 CG ASP B 8 12.791 -9.408 4.123 1.00 0.00 C ATOM 666 OD1 ASP B 8 13.952 -9.765 3.841 1.00 0.00 O ATOM 667 OD2 ASP B 8 11.873 -10.213 4.382 1.00 0.00 O ATOM 0 H ASP B 8 14.150 -7.180 2.475 1.00 0.00 H new ATOM 0 HA ASP B 8 11.538 -8.148 2.235 1.00 0.00 H new ATOM 0 HB2 ASP B 8 13.342 -7.378 4.522 1.00 0.00 H new ATOM 0 HB3 ASP B 8 11.660 -7.743 4.853 1.00 0.00 H new ATOM 672 N LYS B 9 11.773 -4.989 3.118 1.00 0.00 N ATOM 673 CA LYS B 9 11.010 -3.756 3.313 1.00 0.00 C ATOM 674 C LYS B 9 10.115 -3.457 2.115 1.00 0.00 C ATOM 675 O LYS B 9 8.903 -3.290 2.260 1.00 0.00 O ATOM 676 CB LYS B 9 11.953 -2.575 3.557 1.00 0.00 C ATOM 677 CG LYS B 9 12.703 -2.657 4.873 1.00 0.00 C ATOM 678 CD LYS B 9 13.673 -1.499 5.039 1.00 0.00 C ATOM 679 CE LYS B 9 14.406 -1.576 6.370 1.00 0.00 C ATOM 680 NZ LYS B 9 15.221 -2.815 6.491 1.00 0.00 N ATOM 0 H LYS B 9 12.785 -4.863 3.132 1.00 0.00 H new ATOM 0 HA LYS B 9 10.376 -3.900 4.188 1.00 0.00 H new ATOM 0 HB2 LYS B 9 12.673 -2.522 2.741 1.00 0.00 H new ATOM 0 HB3 LYS B 9 11.377 -1.650 3.534 1.00 0.00 H new ATOM 0 HG2 LYS B 9 11.991 -2.657 5.698 1.00 0.00 H new ATOM 0 HG3 LYS B 9 13.249 -3.599 4.923 1.00 0.00 H new ATOM 0 HD2 LYS B 9 14.395 -1.508 4.223 1.00 0.00 H new ATOM 0 HD3 LYS B 9 13.131 -0.556 4.975 1.00 0.00 H new ATOM 0 HE2 LYS B 9 15.053 -0.705 6.478 1.00 0.00 H new ATOM 0 HE3 LYS B 9 13.682 -1.538 7.184 1.00 0.00 H new ATOM 0 HZ1 LYS B 9 14.893 -3.368 7.308 1.00 0.00 H new ATOM 0 HZ2 LYS B 9 15.120 -3.383 5.626 1.00 0.00 H new ATOM 0 HZ3 LYS B 9 16.221 -2.561 6.624 1.00 0.00 H new ATOM 694 N VAL B 10 10.717 -3.401 0.936 1.00 0.00 N ATOM 695 CA VAL B 10 9.982 -3.072 -0.279 1.00 0.00 C ATOM 696 C VAL B 10 9.023 -4.204 -0.664 1.00 0.00 C ATOM 697 O VAL B 10 7.925 -3.955 -1.162 1.00 0.00 O ATOM 698 CB VAL B 10 10.944 -2.746 -1.449 1.00 0.00 C ATOM 699 CG1 VAL B 10 11.831 -3.933 -1.793 1.00 0.00 C ATOM 700 CG2 VAL B 10 10.172 -2.277 -2.673 1.00 0.00 C ATOM 0 H VAL B 10 11.711 -3.579 0.794 1.00 0.00 H new ATOM 0 HA VAL B 10 9.391 -2.179 -0.074 1.00 0.00 H new ATOM 0 HB VAL B 10 11.593 -1.934 -1.121 1.00 0.00 H new ATOM 0 HG11 VAL B 10 12.492 -3.666 -2.618 1.00 0.00 H new ATOM 0 HG12 VAL B 10 12.428 -4.205 -0.923 1.00 0.00 H new ATOM 0 HG13 VAL B 10 11.209 -4.779 -2.085 1.00 0.00 H new ATOM 0 HG21 VAL B 10 10.870 -2.055 -3.480 1.00 0.00 H new ATOM 0 HG22 VAL B 10 9.486 -3.061 -2.993 1.00 0.00 H new ATOM 0 HG23 VAL B 10 9.607 -1.379 -2.424 1.00 0.00 H new ATOM 710 N GLU B 11 9.425 -5.448 -0.407 1.00 0.00 N ATOM 711 CA GLU B 11 8.558 -6.592 -0.669 1.00 0.00 C ATOM 712 C GLU B 11 7.353 -6.575 0.259 1.00 0.00 C ATOM 713 O GLU B 11 6.228 -6.833 -0.166 1.00 0.00 O ATOM 714 CB GLU B 11 9.324 -7.906 -0.514 1.00 0.00 C ATOM 715 CG GLU B 11 10.304 -8.175 -1.643 1.00 0.00 C ATOM 716 CD GLU B 11 9.616 -8.367 -2.981 1.00 0.00 C ATOM 717 OE1 GLU B 11 9.315 -7.353 -3.645 1.00 0.00 O ATOM 718 OE2 GLU B 11 9.381 -9.529 -3.368 1.00 0.00 O ATOM 0 H GLU B 11 10.338 -5.687 -0.021 1.00 0.00 H new ATOM 0 HA GLU B 11 8.208 -6.518 -1.699 1.00 0.00 H new ATOM 0 HB2 GLU B 11 9.867 -7.891 0.431 1.00 0.00 H new ATOM 0 HB3 GLU B 11 8.611 -8.728 -0.459 1.00 0.00 H new ATOM 0 HG2 GLU B 11 11.006 -7.344 -1.716 1.00 0.00 H new ATOM 0 HG3 GLU B 11 10.888 -9.065 -1.408 1.00 0.00 H new ATOM 725 N GLU B 12 7.591 -6.281 1.531 1.00 0.00 N ATOM 726 CA GLU B 12 6.501 -6.137 2.491 1.00 0.00 C ATOM 727 C GLU B 12 5.563 -4.983 2.127 1.00 0.00 C ATOM 728 O GLU B 12 4.366 -5.052 2.392 1.00 0.00 O ATOM 729 CB GLU B 12 7.042 -5.957 3.907 1.00 0.00 C ATOM 730 CG GLU B 12 7.565 -7.244 4.522 1.00 0.00 C ATOM 731 CD GLU B 12 6.511 -8.331 4.570 1.00 0.00 C ATOM 732 OE1 GLU B 12 5.732 -8.357 5.543 1.00 0.00 O ATOM 733 OE2 GLU B 12 6.462 -9.153 3.631 1.00 0.00 O ATOM 0 H GLU B 12 8.522 -6.138 1.921 1.00 0.00 H new ATOM 0 HA GLU B 12 5.919 -7.058 2.453 1.00 0.00 H new ATOM 0 HB2 GLU B 12 7.844 -5.219 3.890 1.00 0.00 H new ATOM 0 HB3 GLU B 12 6.252 -5.555 4.541 1.00 0.00 H new ATOM 0 HG2 GLU B 12 8.421 -7.597 3.947 1.00 0.00 H new ATOM 0 HG3 GLU B 12 7.921 -7.042 5.532 1.00 0.00 H new ATOM 740 N LEU B 13 6.094 -3.914 1.546 1.00 0.00 N ATOM 741 CA LEU B 13 5.246 -2.839 1.060 1.00 0.00 C ATOM 742 C LEU B 13 4.490 -3.217 -0.207 1.00 0.00 C ATOM 743 O LEU B 13 3.372 -2.753 -0.408 1.00 0.00 O ATOM 744 CB LEU B 13 6.055 -1.565 0.888 1.00 0.00 C ATOM 745 CG LEU B 13 5.985 -0.669 2.110 1.00 0.00 C ATOM 746 CD1 LEU B 13 7.234 0.187 2.223 1.00 0.00 C ATOM 747 CD2 LEU B 13 4.739 0.203 2.055 1.00 0.00 C ATOM 0 H LEU B 13 7.094 -3.771 1.402 1.00 0.00 H new ATOM 0 HA LEU B 13 4.481 -2.655 1.814 1.00 0.00 H new ATOM 0 HB2 LEU B 13 7.095 -1.822 0.688 1.00 0.00 H new ATOM 0 HB3 LEU B 13 5.689 -1.019 0.019 1.00 0.00 H new ATOM 0 HG LEU B 13 5.927 -1.300 2.997 1.00 0.00 H new ATOM 0 HD11 LEU B 13 7.162 0.821 3.106 1.00 0.00 H new ATOM 0 HD12 LEU B 13 8.110 -0.457 2.309 1.00 0.00 H new ATOM 0 HD13 LEU B 13 7.329 0.812 1.335 1.00 0.00 H new ATOM 0 HD21 LEU B 13 4.702 0.841 2.938 1.00 0.00 H new ATOM 0 HD22 LEU B 13 4.769 0.824 1.160 1.00 0.00 H new ATOM 0 HD23 LEU B 13 3.852 -0.431 2.027 1.00 0.00 H new ATOM 759 N LEU B 14 5.077 -4.056 -1.056 1.00 0.00 N ATOM 760 CA LEU B 14 4.316 -4.663 -2.141 1.00 0.00 C ATOM 761 C LEU B 14 3.205 -5.511 -1.545 1.00 0.00 C ATOM 762 O LEU B 14 2.049 -5.434 -1.967 1.00 0.00 O ATOM 763 CB LEU B 14 5.199 -5.546 -3.030 1.00 0.00 C ATOM 764 CG LEU B 14 6.279 -4.834 -3.875 1.00 0.00 C ATOM 765 CD1 LEU B 14 6.564 -5.610 -5.159 1.00 0.00 C ATOM 766 CD2 LEU B 14 5.876 -3.407 -4.221 1.00 0.00 C ATOM 0 H LEU B 14 6.060 -4.327 -1.015 1.00 0.00 H new ATOM 0 HA LEU B 14 3.908 -3.864 -2.760 1.00 0.00 H new ATOM 0 HB2 LEU B 14 5.695 -6.278 -2.393 1.00 0.00 H new ATOM 0 HB3 LEU B 14 4.550 -6.101 -3.708 1.00 0.00 H new ATOM 0 HG LEU B 14 7.184 -4.797 -3.268 1.00 0.00 H new ATOM 0 HD11 LEU B 14 7.327 -5.089 -5.737 1.00 0.00 H new ATOM 0 HD12 LEU B 14 6.918 -6.610 -4.909 1.00 0.00 H new ATOM 0 HD13 LEU B 14 5.651 -5.685 -5.749 1.00 0.00 H new ATOM 0 HD21 LEU B 14 6.662 -2.941 -4.815 1.00 0.00 H new ATOM 0 HD22 LEU B 14 4.948 -3.419 -4.792 1.00 0.00 H new ATOM 0 HD23 LEU B 14 5.729 -2.838 -3.303 1.00 0.00 H new ATOM 778 N SER B 15 3.575 -6.307 -0.546 1.00 0.00 N ATOM 779 CA SER B 15 2.623 -7.109 0.199 1.00 0.00 C ATOM 780 C SER B 15 1.488 -6.240 0.730 1.00 0.00 C ATOM 781 O SER B 15 0.319 -6.585 0.569 1.00 0.00 O ATOM 782 CB SER B 15 3.321 -7.831 1.353 1.00 0.00 C ATOM 783 OG SER B 15 4.371 -8.661 0.880 1.00 0.00 O ATOM 0 H SER B 15 4.541 -6.411 -0.235 1.00 0.00 H new ATOM 0 HA SER B 15 2.201 -7.854 -0.476 1.00 0.00 H new ATOM 0 HB2 SER B 15 3.721 -7.099 2.055 1.00 0.00 H new ATOM 0 HB3 SER B 15 2.596 -8.434 1.900 1.00 0.00 H new ATOM 0 HG SER B 15 5.111 -8.103 0.562 1.00 0.00 H new ATOM 789 N LYS B 16 1.820 -5.110 1.353 1.00 0.00 N ATOM 790 CA LYS B 16 0.785 -4.206 1.830 1.00 0.00 C ATOM 791 C LYS B 16 -0.011 -3.602 0.675 1.00 0.00 C ATOM 792 O LYS B 16 -1.225 -3.722 0.650 1.00 0.00 O ATOM 793 CB LYS B 16 1.370 -3.111 2.721 1.00 0.00 C ATOM 794 CG LYS B 16 1.650 -3.588 4.139 1.00 0.00 C ATOM 795 CD LYS B 16 2.085 -2.448 5.045 1.00 0.00 C ATOM 796 CE LYS B 16 3.490 -1.973 4.720 1.00 0.00 C ATOM 797 NZ LYS B 16 4.508 -3.018 5.002 1.00 0.00 N ATOM 0 H LYS B 16 2.777 -4.807 1.535 1.00 0.00 H new ATOM 0 HA LYS B 16 0.095 -4.796 2.433 1.00 0.00 H new ATOM 0 HB2 LYS B 16 2.295 -2.744 2.277 1.00 0.00 H new ATOM 0 HB3 LYS B 16 0.678 -2.270 2.756 1.00 0.00 H new ATOM 0 HG2 LYS B 16 0.754 -4.055 4.548 1.00 0.00 H new ATOM 0 HG3 LYS B 16 2.427 -4.352 4.118 1.00 0.00 H new ATOM 0 HD2 LYS B 16 1.388 -1.616 4.943 1.00 0.00 H new ATOM 0 HD3 LYS B 16 2.043 -2.774 6.084 1.00 0.00 H new ATOM 0 HE2 LYS B 16 3.543 -1.689 3.669 1.00 0.00 H new ATOM 0 HE3 LYS B 16 3.715 -1.080 5.303 1.00 0.00 H new ATOM 0 HZ1 LYS B 16 5.451 -2.581 5.047 1.00 0.00 H new ATOM 0 HZ2 LYS B 16 4.294 -3.475 5.912 1.00 0.00 H new ATOM 0 HZ3 LYS B 16 4.493 -3.731 4.245 1.00 0.00 H new ATOM 811 N ASN B 17 0.675 -2.988 -0.286 1.00 0.00 N ATOM 812 CA ASN B 17 0.016 -2.312 -1.409 1.00 0.00 C ATOM 813 C ASN B 17 -0.966 -3.232 -2.143 1.00 0.00 C ATOM 814 O ASN B 17 -2.164 -2.952 -2.209 1.00 0.00 O ATOM 815 CB ASN B 17 1.072 -1.791 -2.391 1.00 0.00 C ATOM 816 CG ASN B 17 0.471 -1.046 -3.573 1.00 0.00 C ATOM 817 OD1 ASN B 17 -0.571 -0.402 -3.458 1.00 0.00 O ATOM 818 ND2 ASN B 17 1.132 -1.126 -4.718 1.00 0.00 N ATOM 0 H ASN B 17 1.694 -2.943 -0.312 1.00 0.00 H new ATOM 0 HA ASN B 17 -0.558 -1.480 -1.001 1.00 0.00 H new ATOM 0 HB2 ASN B 17 1.757 -1.128 -1.861 1.00 0.00 H new ATOM 0 HB3 ASN B 17 1.662 -2.630 -2.760 1.00 0.00 H new ATOM 0 HD21 ASN B 17 0.780 -0.643 -5.545 1.00 0.00 H new ATOM 0 HD22 ASN B 17 1.993 -1.670 -4.773 1.00 0.00 H new ATOM 825 N TYR B 18 -0.464 -4.338 -2.678 1.00 0.00 N ATOM 826 CA TYR B 18 -1.282 -5.230 -3.495 1.00 0.00 C ATOM 827 C TYR B 18 -2.385 -5.904 -2.683 1.00 0.00 C ATOM 828 O TYR B 18 -3.512 -6.043 -3.161 1.00 0.00 O ATOM 829 CB TYR B 18 -0.412 -6.285 -4.178 1.00 0.00 C ATOM 830 CG TYR B 18 0.479 -5.722 -5.263 1.00 0.00 C ATOM 831 CD1 TYR B 18 1.836 -5.520 -5.044 1.00 0.00 C ATOM 832 CD2 TYR B 18 -0.039 -5.394 -6.508 1.00 0.00 C ATOM 833 CE1 TYR B 18 2.648 -5.006 -6.034 1.00 0.00 C ATOM 834 CE2 TYR B 18 0.768 -4.878 -7.503 1.00 0.00 C ATOM 835 CZ TYR B 18 2.110 -4.688 -7.262 1.00 0.00 C ATOM 836 OH TYR B 18 2.918 -4.183 -8.255 1.00 0.00 O ATOM 0 H TYR B 18 0.503 -4.640 -2.562 1.00 0.00 H new ATOM 0 HA TYR B 18 -1.762 -4.615 -4.256 1.00 0.00 H new ATOM 0 HB2 TYR B 18 0.208 -6.775 -3.427 1.00 0.00 H new ATOM 0 HB3 TYR B 18 -1.056 -7.052 -4.609 1.00 0.00 H new ATOM 0 HD1 TYR B 18 2.262 -5.769 -4.083 1.00 0.00 H new ATOM 0 HD2 TYR B 18 -1.091 -5.545 -6.702 1.00 0.00 H new ATOM 0 HE1 TYR B 18 3.701 -4.854 -5.847 1.00 0.00 H new ATOM 0 HE2 TYR B 18 0.348 -4.625 -8.465 1.00 0.00 H new ATOM 0 HH TYR B 18 2.382 -4.013 -9.058 1.00 0.00 H new ATOM 846 N HIS B 19 -2.072 -6.313 -1.457 1.00 0.00 N ATOM 847 CA HIS B 19 -3.058 -6.985 -0.614 1.00 0.00 C ATOM 848 C HIS B 19 -4.067 -5.994 -0.046 1.00 0.00 C ATOM 849 O HIS B 19 -5.205 -6.356 0.253 1.00 0.00 O ATOM 850 CB HIS B 19 -2.388 -7.764 0.520 1.00 0.00 C ATOM 851 CG HIS B 19 -1.795 -9.068 0.080 1.00 0.00 C ATOM 852 ND1 HIS B 19 -2.318 -10.290 0.444 1.00 0.00 N ATOM 853 CD2 HIS B 19 -0.719 -9.339 -0.696 1.00 0.00 C ATOM 854 CE1 HIS B 19 -1.591 -11.254 -0.089 1.00 0.00 C ATOM 855 NE2 HIS B 19 -0.615 -10.704 -0.786 1.00 0.00 N ATOM 0 H HIS B 19 -1.154 -6.193 -1.028 1.00 0.00 H new ATOM 0 HA HIS B 19 -3.590 -7.695 -1.248 1.00 0.00 H new ATOM 0 HB2 HIS B 19 -1.604 -7.148 0.960 1.00 0.00 H new ATOM 0 HB3 HIS B 19 -3.122 -7.954 1.303 1.00 0.00 H new ATOM 0 HD2 HIS B 19 -0.064 -8.615 -1.158 1.00 0.00 H new ATOM 0 HE1 HIS B 19 -1.765 -12.314 0.026 1.00 0.00 H new ATOM 0 HE2 HIS B 19 0.100 -11.211 -1.307 1.00 0.00 H new ATOM 864 N LEU B 20 -3.657 -4.743 0.105 1.00 0.00 N ATOM 865 CA LEU B 20 -4.573 -3.705 0.517 1.00 0.00 C ATOM 866 C LEU B 20 -5.522 -3.400 -0.628 1.00 0.00 C ATOM 867 O LEU B 20 -6.704 -3.151 -0.412 1.00 0.00 O ATOM 868 CB LEU B 20 -3.808 -2.452 0.938 1.00 0.00 C ATOM 869 CG LEU B 20 -4.671 -1.270 1.356 1.00 0.00 C ATOM 870 CD1 LEU B 20 -5.526 -1.625 2.563 1.00 0.00 C ATOM 871 CD2 LEU B 20 -3.800 -0.062 1.653 1.00 0.00 C ATOM 0 H LEU B 20 -2.699 -4.429 -0.052 1.00 0.00 H new ATOM 0 HA LEU B 20 -5.148 -4.046 1.378 1.00 0.00 H new ATOM 0 HB2 LEU B 20 -3.149 -2.710 1.767 1.00 0.00 H new ATOM 0 HB3 LEU B 20 -3.171 -2.140 0.110 1.00 0.00 H new ATOM 0 HG LEU B 20 -5.339 -1.022 0.531 1.00 0.00 H new ATOM 0 HD11 LEU B 20 -6.134 -0.765 2.844 1.00 0.00 H new ATOM 0 HD12 LEU B 20 -6.176 -2.464 2.314 1.00 0.00 H new ATOM 0 HD13 LEU B 20 -4.881 -1.901 3.397 1.00 0.00 H new ATOM 0 HD21 LEU B 20 -4.430 0.776 1.951 1.00 0.00 H new ATOM 0 HD22 LEU B 20 -3.109 -0.302 2.461 1.00 0.00 H new ATOM 0 HD23 LEU B 20 -3.235 0.208 0.761 1.00 0.00 H new ATOM 883 N GLU B 21 -5.002 -3.464 -1.854 1.00 0.00 N ATOM 884 CA GLU B 21 -5.833 -3.276 -3.037 1.00 0.00 C ATOM 885 C GLU B 21 -6.877 -4.390 -3.129 1.00 0.00 C ATOM 886 O GLU B 21 -7.992 -4.173 -3.604 1.00 0.00 O ATOM 887 CB GLU B 21 -4.977 -3.232 -4.304 1.00 0.00 C ATOM 888 CG GLU B 21 -5.747 -2.780 -5.533 1.00 0.00 C ATOM 889 CD GLU B 21 -4.866 -2.610 -6.751 1.00 0.00 C ATOM 890 OE1 GLU B 21 -4.200 -1.560 -6.860 1.00 0.00 O ATOM 891 OE2 GLU B 21 -4.847 -3.524 -7.598 1.00 0.00 O ATOM 0 H GLU B 21 -4.017 -3.643 -2.050 1.00 0.00 H new ATOM 0 HA GLU B 21 -6.349 -2.320 -2.948 1.00 0.00 H new ATOM 0 HB2 GLU B 21 -4.136 -2.558 -4.143 1.00 0.00 H new ATOM 0 HB3 GLU B 21 -4.561 -4.223 -4.488 1.00 0.00 H new ATOM 0 HG2 GLU B 21 -6.528 -3.508 -5.754 1.00 0.00 H new ATOM 0 HG3 GLU B 21 -6.245 -1.835 -5.316 1.00 0.00 H new ATOM 898 N ASN B 22 -6.512 -5.575 -2.647 1.00 0.00 N ATOM 899 CA ASN B 22 -7.448 -6.694 -2.564 1.00 0.00 C ATOM 900 C ASN B 22 -8.605 -6.342 -1.636 1.00 0.00 C ATOM 901 O ASN B 22 -9.750 -6.734 -1.866 1.00 0.00 O ATOM 902 CB ASN B 22 -6.748 -7.954 -2.040 1.00 0.00 C ATOM 903 CG ASN B 22 -5.694 -8.504 -2.987 1.00 0.00 C ATOM 904 OD1 ASN B 22 -4.675 -9.044 -2.551 1.00 0.00 O ATOM 905 ND2 ASN B 22 -5.936 -8.397 -4.285 1.00 0.00 N ATOM 0 H ASN B 22 -5.574 -5.786 -2.307 1.00 0.00 H new ATOM 0 HA ASN B 22 -7.827 -6.891 -3.567 1.00 0.00 H new ATOM 0 HB2 ASN B 22 -6.281 -7.728 -1.082 1.00 0.00 H new ATOM 0 HB3 ASN B 22 -7.496 -8.725 -1.856 1.00 0.00 H new ATOM 0 HD21 ASN B 22 -5.268 -8.768 -4.961 1.00 0.00 H new ATOM 0 HD22 ASN B 22 -6.790 -7.944 -4.609 1.00 0.00 H new ATOM 912 N GLU B 23 -8.289 -5.578 -0.596 1.00 0.00 N ATOM 913 CA GLU B 23 -9.266 -5.188 0.411 1.00 0.00 C ATOM 914 C GLU B 23 -10.230 -4.148 -0.146 1.00 0.00 C ATOM 915 O GLU B 23 -11.426 -4.181 0.139 1.00 0.00 O ATOM 916 CB GLU B 23 -8.555 -4.636 1.650 1.00 0.00 C ATOM 917 CG GLU B 23 -9.503 -4.234 2.770 1.00 0.00 C ATOM 918 CD GLU B 23 -8.785 -3.570 3.929 1.00 0.00 C ATOM 919 OE1 GLU B 23 -8.763 -2.322 3.975 1.00 0.00 O ATOM 920 OE2 GLU B 23 -8.242 -4.298 4.784 1.00 0.00 O ATOM 0 H GLU B 23 -7.351 -5.213 -0.429 1.00 0.00 H new ATOM 0 HA GLU B 23 -9.839 -6.071 0.694 1.00 0.00 H new ATOM 0 HB2 GLU B 23 -7.861 -5.388 2.025 1.00 0.00 H new ATOM 0 HB3 GLU B 23 -7.960 -3.770 1.361 1.00 0.00 H new ATOM 0 HG2 GLU B 23 -10.257 -3.553 2.376 1.00 0.00 H new ATOM 0 HG3 GLU B 23 -10.029 -5.118 3.131 1.00 0.00 H new ATOM 927 N VAL B 24 -9.711 -3.224 -0.948 1.00 0.00 N ATOM 928 CA VAL B 24 -10.552 -2.186 -1.532 1.00 0.00 C ATOM 929 C VAL B 24 -11.499 -2.809 -2.547 1.00 0.00 C ATOM 930 O VAL B 24 -12.628 -2.357 -2.729 1.00 0.00 O ATOM 931 CB VAL B 24 -9.728 -1.046 -2.192 1.00 0.00 C ATOM 932 CG1 VAL B 24 -8.341 -0.965 -1.598 1.00 0.00 C ATOM 933 CG2 VAL B 24 -9.647 -1.184 -3.704 1.00 0.00 C ATOM 0 H VAL B 24 -8.725 -3.172 -1.206 1.00 0.00 H new ATOM 0 HA VAL B 24 -11.121 -1.731 -0.721 1.00 0.00 H new ATOM 0 HB VAL B 24 -10.259 -0.118 -1.979 1.00 0.00 H new ATOM 0 HG11 VAL B 24 -7.786 -0.159 -2.078 1.00 0.00 H new ATOM 0 HG12 VAL B 24 -8.414 -0.768 -0.528 1.00 0.00 H new ATOM 0 HG13 VAL B 24 -7.821 -1.909 -1.758 1.00 0.00 H new ATOM 0 HG21 VAL B 24 -9.060 -0.362 -4.113 1.00 0.00 H new ATOM 0 HG22 VAL B 24 -9.171 -2.131 -3.958 1.00 0.00 H new ATOM 0 HG23 VAL B 24 -10.652 -1.158 -4.126 1.00 0.00 H new ATOM 943 N ALA B 25 -11.029 -3.868 -3.188 1.00 0.00 N ATOM 944 CA ALA B 25 -11.846 -4.615 -4.132 1.00 0.00 C ATOM 945 C ALA B 25 -13.033 -5.249 -3.422 1.00 0.00 C ATOM 946 O ALA B 25 -14.111 -5.381 -3.997 1.00 0.00 O ATOM 947 CB ALA B 25 -11.019 -5.674 -4.835 1.00 0.00 C ATOM 0 H ALA B 25 -10.083 -4.230 -3.071 1.00 0.00 H new ATOM 0 HA ALA B 25 -12.223 -3.921 -4.884 1.00 0.00 H new ATOM 0 HB1 ALA B 25 -11.649 -6.221 -5.536 1.00 0.00 H new ATOM 0 HB2 ALA B 25 -10.202 -5.197 -5.377 1.00 0.00 H new ATOM 0 HB3 ALA B 25 -10.611 -6.366 -4.098 1.00 0.00 H new ATOM 953 N ARG B 26 -12.830 -5.629 -2.163 1.00 0.00 N ATOM 954 CA ARG B 26 -13.902 -6.191 -1.348 1.00 0.00 C ATOM 955 C ARG B 26 -14.991 -5.150 -1.146 1.00 0.00 C ATOM 956 O ARG B 26 -16.165 -5.400 -1.414 1.00 0.00 O ATOM 957 CB ARG B 26 -13.376 -6.648 0.017 1.00 0.00 C ATOM 958 CG ARG B 26 -12.275 -7.693 -0.055 1.00 0.00 C ATOM 959 CD ARG B 26 -12.728 -8.930 -0.812 1.00 0.00 C ATOM 960 NE ARG B 26 -11.723 -9.990 -0.773 1.00 0.00 N ATOM 961 CZ ARG B 26 -11.874 -11.186 -1.338 1.00 0.00 C ATOM 962 NH1 ARG B 26 -12.980 -11.470 -2.014 1.00 0.00 N ATOM 963 NH2 ARG B 26 -10.919 -12.097 -1.226 1.00 0.00 N ATOM 0 H ARG B 26 -11.932 -5.558 -1.685 1.00 0.00 H new ATOM 0 HA ARG B 26 -14.308 -7.058 -1.870 1.00 0.00 H new ATOM 0 HB2 ARG B 26 -13.001 -5.779 0.558 1.00 0.00 H new ATOM 0 HB3 ARG B 26 -14.206 -7.051 0.597 1.00 0.00 H new ATOM 0 HG2 ARG B 26 -11.399 -7.267 -0.544 1.00 0.00 H new ATOM 0 HG3 ARG B 26 -11.972 -7.973 0.954 1.00 0.00 H new ATOM 0 HD2 ARG B 26 -13.660 -9.297 -0.383 1.00 0.00 H new ATOM 0 HD3 ARG B 26 -12.937 -8.665 -1.849 1.00 0.00 H new ATOM 0 HE ARG B 26 -10.849 -9.801 -0.281 1.00 0.00 H new ATOM 0 HH11 ARG B 26 -13.718 -10.771 -2.102 1.00 0.00 H new ATOM 0 HH12 ARG B 26 -13.093 -12.387 -2.446 1.00 0.00 H new ATOM 0 HH21 ARG B 26 -10.068 -11.882 -0.707 1.00 0.00 H new ATOM 0 HH22 ARG B 26 -11.035 -13.013 -1.659 1.00 0.00 H new ATOM 977 N LEU B 27 -14.579 -3.971 -0.691 1.00 0.00 N ATOM 978 CA LEU B 27 -15.497 -2.862 -0.477 1.00 0.00 C ATOM 979 C LEU B 27 -16.214 -2.504 -1.768 1.00 0.00 C ATOM 980 O LEU B 27 -17.412 -2.240 -1.765 1.00 0.00 O ATOM 981 CB LEU B 27 -14.745 -1.643 0.050 1.00 0.00 C ATOM 982 CG LEU B 27 -14.071 -1.825 1.404 1.00 0.00 C ATOM 983 CD1 LEU B 27 -12.900 -0.874 1.555 1.00 0.00 C ATOM 984 CD2 LEU B 27 -15.078 -1.597 2.519 1.00 0.00 C ATOM 0 H LEU B 27 -13.608 -3.760 -0.462 1.00 0.00 H new ATOM 0 HA LEU B 27 -16.236 -3.171 0.262 1.00 0.00 H new ATOM 0 HB2 LEU B 27 -13.986 -1.362 -0.680 1.00 0.00 H new ATOM 0 HB3 LEU B 27 -15.443 -0.809 0.120 1.00 0.00 H new ATOM 0 HG LEU B 27 -13.693 -2.845 1.467 1.00 0.00 H new ATOM 0 HD11 LEU B 27 -12.434 -1.022 2.529 1.00 0.00 H new ATOM 0 HD12 LEU B 27 -12.169 -1.069 0.770 1.00 0.00 H new ATOM 0 HD13 LEU B 27 -13.253 0.154 1.474 1.00 0.00 H new ATOM 0 HD21 LEU B 27 -14.589 -1.729 3.484 1.00 0.00 H new ATOM 0 HD22 LEU B 27 -15.475 -0.584 2.449 1.00 0.00 H new ATOM 0 HD23 LEU B 27 -15.894 -2.314 2.425 1.00 0.00 H new ATOM 996 N LYS B 28 -15.470 -2.512 -2.866 1.00 0.00 N ATOM 997 CA LYS B 28 -16.024 -2.226 -4.187 1.00 0.00 C ATOM 998 C LYS B 28 -17.246 -3.103 -4.480 1.00 0.00 C ATOM 999 O LYS B 28 -18.251 -2.625 -5.011 1.00 0.00 O ATOM 1000 CB LYS B 28 -14.948 -2.441 -5.256 1.00 0.00 C ATOM 1001 CG LYS B 28 -15.387 -2.075 -6.664 1.00 0.00 C ATOM 1002 CD LYS B 28 -15.703 -0.594 -6.788 1.00 0.00 C ATOM 1003 CE LYS B 28 -16.111 -0.230 -8.205 1.00 0.00 C ATOM 1004 NZ LYS B 28 -16.468 1.206 -8.327 1.00 0.00 N ATOM 0 H LYS B 28 -14.471 -2.716 -2.869 1.00 0.00 H new ATOM 0 HA LYS B 28 -16.349 -1.186 -4.205 1.00 0.00 H new ATOM 0 HB2 LYS B 28 -14.070 -1.850 -4.996 1.00 0.00 H new ATOM 0 HB3 LYS B 28 -14.643 -3.487 -5.243 1.00 0.00 H new ATOM 0 HG2 LYS B 28 -14.600 -2.339 -7.371 1.00 0.00 H new ATOM 0 HG3 LYS B 28 -16.267 -2.659 -6.934 1.00 0.00 H new ATOM 0 HD2 LYS B 28 -16.506 -0.333 -6.098 1.00 0.00 H new ATOM 0 HD3 LYS B 28 -14.830 -0.009 -6.498 1.00 0.00 H new ATOM 0 HE2 LYS B 28 -15.294 -0.460 -8.889 1.00 0.00 H new ATOM 0 HE3 LYS B 28 -16.961 -0.842 -8.507 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 -16.741 1.414 -9.309 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 -17.265 1.421 -7.694 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 -15.649 1.791 -8.064 1.00 0.00 H new ATOM 1018 N LYS B 29 -17.164 -4.375 -4.104 1.00 0.00 N ATOM 1019 CA LYS B 29 -18.242 -5.316 -4.344 1.00 0.00 C ATOM 1020 C LYS B 29 -19.417 -5.032 -3.415 1.00 0.00 C ATOM 1021 O LYS B 29 -20.579 -5.218 -3.782 1.00 0.00 O ATOM 1022 CB LYS B 29 -17.753 -6.750 -4.131 1.00 0.00 C ATOM 1023 CG LYS B 29 -16.445 -7.082 -4.838 1.00 0.00 C ATOM 1024 CD LYS B 29 -16.494 -6.769 -6.325 1.00 0.00 C ATOM 1025 CE LYS B 29 -17.505 -7.635 -7.053 1.00 0.00 C ATOM 1026 NZ LYS B 29 -17.607 -7.269 -8.489 1.00 0.00 N ATOM 0 H LYS B 29 -16.355 -4.776 -3.629 1.00 0.00 H new ATOM 0 HA LYS B 29 -18.572 -5.200 -5.376 1.00 0.00 H new ATOM 0 HB2 LYS B 29 -17.628 -6.923 -3.062 1.00 0.00 H new ATOM 0 HB3 LYS B 29 -18.524 -7.439 -4.477 1.00 0.00 H new ATOM 0 HG2 LYS B 29 -15.633 -6.519 -4.378 1.00 0.00 H new ATOM 0 HG3 LYS B 29 -16.218 -8.139 -4.699 1.00 0.00 H new ATOM 0 HD2 LYS B 29 -16.747 -5.718 -6.467 1.00 0.00 H new ATOM 0 HD3 LYS B 29 -15.506 -6.920 -6.760 1.00 0.00 H new ATOM 0 HE2 LYS B 29 -17.218 -8.683 -6.964 1.00 0.00 H new ATOM 0 HE3 LYS B 29 -18.482 -7.530 -6.580 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 -18.343 -7.847 -8.943 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 -17.855 -6.263 -8.574 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 -16.694 -7.441 -8.957 1.00 0.00 H new ATOM 1040 N LEU B 30 -19.107 -4.581 -2.209 1.00 0.00 N ATOM 1041 CA LEU B 30 -20.132 -4.264 -1.218 1.00 0.00 C ATOM 1042 C LEU B 30 -20.837 -2.955 -1.556 1.00 0.00 C ATOM 1043 O LEU B 30 -22.012 -2.774 -1.240 1.00 0.00 O ATOM 1044 CB LEU B 30 -19.520 -4.180 0.187 1.00 0.00 C ATOM 1045 CG LEU B 30 -19.420 -5.499 0.973 1.00 0.00 C ATOM 1046 CD1 LEU B 30 -20.801 -6.039 1.315 1.00 0.00 C ATOM 1047 CD2 LEU B 30 -18.620 -6.538 0.202 1.00 0.00 C ATOM 0 H LEU B 30 -18.151 -4.425 -1.889 1.00 0.00 H new ATOM 0 HA LEU B 30 -20.868 -5.067 -1.236 1.00 0.00 H new ATOM 0 HB2 LEU B 30 -18.518 -3.759 0.098 1.00 0.00 H new ATOM 0 HB3 LEU B 30 -20.110 -3.477 0.775 1.00 0.00 H new ATOM 0 HG LEU B 30 -18.895 -5.287 1.905 1.00 0.00 H new ATOM 0 HD11 LEU B 30 -20.700 -6.972 1.870 1.00 0.00 H new ATOM 0 HD12 LEU B 30 -21.336 -5.310 1.924 1.00 0.00 H new ATOM 0 HD13 LEU B 30 -21.358 -6.223 0.396 1.00 0.00 H new ATOM 0 HD21 LEU B 30 -18.566 -7.459 0.782 1.00 0.00 H new ATOM 0 HD22 LEU B 30 -19.107 -6.738 -0.752 1.00 0.00 H new ATOM 0 HD23 LEU B 30 -17.613 -6.162 0.023 1.00 0.00 H new ATOM 1059 N VAL B 31 -20.117 -2.044 -2.201 1.00 0.00 N ATOM 1060 CA VAL B 31 -20.691 -0.767 -2.603 1.00 0.00 C ATOM 1061 C VAL B 31 -21.728 -0.964 -3.707 1.00 0.00 C ATOM 1062 O VAL B 31 -22.724 -0.240 -3.767 1.00 0.00 O ATOM 1063 CB VAL B 31 -19.605 0.241 -3.063 1.00 0.00 C ATOM 1064 CG1 VAL B 31 -20.233 1.536 -3.553 1.00 0.00 C ATOM 1065 CG2 VAL B 31 -18.636 0.529 -1.932 1.00 0.00 C ATOM 0 H VAL B 31 -19.137 -2.166 -2.456 1.00 0.00 H new ATOM 0 HA VAL B 31 -21.181 -0.347 -1.725 1.00 0.00 H new ATOM 0 HB VAL B 31 -19.059 -0.210 -3.892 1.00 0.00 H new ATOM 0 HG11 VAL B 31 -19.449 2.224 -3.869 1.00 0.00 H new ATOM 0 HG12 VAL B 31 -20.892 1.325 -4.395 1.00 0.00 H new ATOM 0 HG13 VAL B 31 -20.809 1.989 -2.746 1.00 0.00 H new ATOM 0 HG21 VAL B 31 -17.881 1.238 -2.272 1.00 0.00 H new ATOM 0 HG22 VAL B 31 -19.179 0.954 -1.087 1.00 0.00 H new ATOM 0 HG23 VAL B 31 -18.151 -0.397 -1.623 1.00 0.00 H new ATOM 1075 N GLY B 32 -21.524 -1.962 -4.559 1.00 0.00 N ATOM 1076 CA GLY B 32 -22.471 -2.200 -5.631 1.00 0.00 C ATOM 1077 C GLY B 32 -21.952 -3.146 -6.692 1.00 0.00 C ATOM 1078 O GLY B 32 -22.087 -2.871 -7.884 1.00 0.00 O ATOM 0 H GLY B 32 -20.731 -2.603 -4.528 1.00 0.00 H new ATOM 0 HA2 GLY B 32 -23.390 -2.607 -5.210 1.00 0.00 H new ATOM 0 HA3 GLY B 32 -22.728 -1.249 -6.097 1.00 0.00 H new ATOM 1082 N GLU B 33 -21.368 -4.259 -6.253 1.00 0.00 N ATOM 1083 CA GLU B 33 -20.878 -5.307 -7.151 1.00 0.00 C ATOM 1084 C GLU B 33 -19.826 -4.768 -8.118 1.00 0.00 C ATOM 1085 O GLU B 33 -20.187 -4.377 -9.247 1.00 0.00 O ATOM 1086 CB GLU B 33 -22.039 -5.941 -7.926 1.00 0.00 C ATOM 1087 CG GLU B 33 -23.117 -6.530 -7.030 1.00 0.00 C ATOM 1088 CD GLU B 33 -24.250 -7.162 -7.816 1.00 0.00 C ATOM 1089 OE1 GLU B 33 -24.231 -8.396 -7.991 1.00 0.00 O ATOM 1090 OE2 GLU B 33 -25.155 -6.422 -8.253 1.00 0.00 O ATOM 1091 OXT GLU B 33 -18.637 -4.752 -7.750 1.00 0.00 O ATOM 0 H GLU B 33 -21.220 -4.461 -5.264 1.00 0.00 H new ATOM 0 HA GLU B 33 -20.406 -6.073 -6.536 1.00 0.00 H new ATOM 0 HB2 GLU B 33 -22.488 -5.187 -8.573 1.00 0.00 H new ATOM 0 HB3 GLU B 33 -21.648 -6.725 -8.574 1.00 0.00 H new ATOM 0 HG2 GLU B 33 -22.671 -7.280 -6.377 1.00 0.00 H new ATOM 0 HG3 GLU B 33 -23.519 -5.746 -6.388 1.00 0.00 H new TER 1098 GLU B 33