USER MOD reduce.3.24.130724 H: found=0, std=0, add=687, rem=0, adj=8 USER MOD reduce.3.24.130724 removed 687 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: p 41 CYS SG : rot 180:sc= -0.588 USER MOD Set 1.2: p 43 ASN : amide:sc= -0.429 K(o=-1,f=-2.1!) USER MOD Single : p 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : p 1 MET N :NH3+ 179:sc= 1.01 (180deg=0.908) USER MOD Single : p 2 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 10 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 11 ASN : amide:sc= -0.134 K(o=-0.13,f=-1.2!) USER MOD Single : p 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 24 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 30 GLN : amide:sc= -0.925 K(o=-0.92,f=-0.0085) USER MOD Single : p 33 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 34 CYS SG : rot 180:sc= -0.57 USER MOD Single : p 36 CYS SG : rot 45:sc= 1.22 USER MOD Single : p 40 ASN : amide:sc= 0 K(o=0,f=-0.6) USER MOD Single : p 42 SER OG : rot 180:sc= 0 USER MOD Single : p 44 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : p 48 TYR OH : rot 180:sc= 0 USER MOD Single : p 49 SER OG : rot -5:sc= 0.929 USER MOD Single : p 51 GLN : amide:sc= -0.587 K(o=-0.59,f=-6.7!) USER MOD Single : p 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 55 LYS NZ :NH3+ -133:sc= 0 (180deg=-0.738) USER MOD Single : p 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 59 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 65 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 71 ASN : amide:sc= -1.15 K(o=-1.2,f=-6.4!) USER MOD Single : p 73 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 79 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET p 1 -9.541 23.660 3.849 1.00 0.00 N ATOM 2 CA MET p 1 -9.687 22.940 2.554 1.00 0.00 C ATOM 3 C MET p 1 -8.372 22.283 2.134 1.00 0.00 C ATOM 4 O MET p 1 -8.373 21.154 1.643 1.00 0.00 O ATOM 5 CB MET p 1 -10.161 23.902 1.457 1.00 0.00 C ATOM 6 CG MET p 1 -11.630 24.291 1.570 1.00 0.00 C ATOM 7 SD MET p 1 -11.993 25.261 3.051 1.00 0.00 S ATOM 8 CE MET p 1 -11.463 26.896 2.539 1.00 0.00 C ATOM 0 H1 MET p 1 -10.445 24.110 4.100 1.00 0.00 H new ATOM 0 H2 MET p 1 -9.272 22.985 4.593 1.00 0.00 H new ATOM 0 H3 MET p 1 -8.805 24.389 3.760 1.00 0.00 H new ATOM 0 HA MET p 1 -10.433 22.157 2.692 1.00 0.00 H new ATOM 0 HB2 MET p 1 -9.552 24.805 1.492 1.00 0.00 H new ATOM 0 HB3 MET p 1 -9.991 23.440 0.484 1.00 0.00 H new ATOM 0 HG2 MET p 1 -11.917 24.864 0.688 1.00 0.00 H new ATOM 0 HG3 MET p 1 -12.240 23.388 1.576 1.00 0.00 H new ATOM 0 HE1 MET p 1 -11.627 27.603 3.352 1.00 0.00 H new ATOM 0 HE2 MET p 1 -10.403 26.872 2.287 1.00 0.00 H new ATOM 0 HE3 MET p 1 -12.037 27.208 1.666 1.00 0.00 H new ATOM 20 N GLN p 2 -7.256 22.996 2.353 1.00 0.00 N ATOM 21 CA GLN p 2 -5.918 22.521 2.003 1.00 0.00 C ATOM 22 C GLN p 2 -5.342 21.602 3.090 1.00 0.00 C ATOM 23 O GLN p 2 -4.224 21.120 2.968 1.00 0.00 O ATOM 24 CB GLN p 2 -5.011 23.731 1.795 1.00 0.00 C ATOM 25 CG GLN p 2 -5.037 24.277 0.377 1.00 0.00 C ATOM 26 CD GLN p 2 -4.058 25.417 0.172 1.00 0.00 C ATOM 27 OE1 GLN p 2 -4.396 26.584 0.366 1.00 0.00 O ATOM 28 NE2 GLN p 2 -2.836 25.081 -0.224 1.00 0.00 N ATOM 0 H GLN p 2 -7.262 23.922 2.780 1.00 0.00 H new ATOM 0 HA GLN p 2 -5.979 21.934 1.086 1.00 0.00 H new ATOM 0 HB2 GLN p 2 -5.310 24.521 2.485 1.00 0.00 H new ATOM 0 HB3 GLN p 2 -3.988 23.455 2.050 1.00 0.00 H new ATOM 0 HG2 GLN p 2 -4.805 23.473 -0.322 1.00 0.00 H new ATOM 0 HG3 GLN p 2 -6.044 24.622 0.143 1.00 0.00 H new ATOM 0 HE21 GLN p 2 -2.600 24.100 -0.373 1.00 0.00 H new ATOM 0 HE22 GLN p 2 -2.133 25.804 -0.380 1.00 0.00 H new ATOM 37 N ALA p 3 -6.138 21.399 4.141 1.00 0.00 N ATOM 38 CA ALA p 3 -5.807 20.557 5.295 1.00 0.00 C ATOM 39 C ALA p 3 -6.328 19.148 5.064 1.00 0.00 C ATOM 40 O ALA p 3 -5.913 18.196 5.721 1.00 0.00 O ATOM 41 CB ALA p 3 -6.397 21.144 6.569 1.00 0.00 C ATOM 0 H ALA p 3 -7.060 21.829 4.216 1.00 0.00 H new ATOM 0 HA ALA p 3 -4.724 20.520 5.410 1.00 0.00 H new ATOM 0 HB1 ALA p 3 -6.142 20.507 7.416 1.00 0.00 H new ATOM 0 HB2 ALA p 3 -5.991 22.143 6.731 1.00 0.00 H new ATOM 0 HB3 ALA p 3 -7.481 21.204 6.474 1.00 0.00 H new ATOM 47 N LEU p 4 -7.264 19.069 4.115 1.00 0.00 N ATOM 48 CA LEU p 4 -7.921 17.852 3.689 1.00 0.00 C ATOM 49 C LEU p 4 -7.103 17.285 2.549 1.00 0.00 C ATOM 50 O LEU p 4 -6.800 16.096 2.502 1.00 0.00 O ATOM 51 CB LEU p 4 -9.336 18.214 3.223 1.00 0.00 C ATOM 52 CG LEU p 4 -10.370 17.092 3.149 1.00 0.00 C ATOM 53 CD1 LEU p 4 -11.715 17.718 2.888 1.00 0.00 C ATOM 54 CD2 LEU p 4 -10.038 16.094 2.047 1.00 0.00 C ATOM 0 H LEU p 4 -7.591 19.891 3.607 1.00 0.00 H new ATOM 0 HA LEU p 4 -7.996 17.115 4.489 1.00 0.00 H new ATOM 0 HB2 LEU p 4 -9.723 18.982 3.892 1.00 0.00 H new ATOM 0 HB3 LEU p 4 -9.258 18.663 2.233 1.00 0.00 H new ATOM 0 HG LEU p 4 -10.372 16.543 4.090 1.00 0.00 H new ATOM 0 HD11 LEU p 4 -12.474 16.938 2.830 1.00 0.00 H new ATOM 0 HD12 LEU p 4 -11.960 18.404 3.699 1.00 0.00 H new ATOM 0 HD13 LEU p 4 -11.685 18.266 1.946 1.00 0.00 H new ATOM 0 HD21 LEU p 4 -10.796 15.311 2.025 1.00 0.00 H new ATOM 0 HD22 LEU p 4 -10.018 16.607 1.085 1.00 0.00 H new ATOM 0 HD23 LEU p 4 -9.062 15.649 2.241 1.00 0.00 H new ATOM 66 N GLU p 5 -6.779 18.198 1.631 1.00 0.00 N ATOM 67 CA GLU p 5 -5.921 17.924 0.470 1.00 0.00 C ATOM 68 C GLU p 5 -4.504 17.678 0.957 1.00 0.00 C ATOM 69 O GLU p 5 -3.698 17.035 0.285 1.00 0.00 O ATOM 70 CB GLU p 5 -5.908 19.103 -0.503 1.00 0.00 C ATOM 71 CG GLU p 5 -7.269 19.735 -0.705 1.00 0.00 C ATOM 72 CD GLU p 5 -7.638 19.899 -2.166 1.00 0.00 C ATOM 73 OE1 GLU p 5 -7.317 20.959 -2.744 1.00 0.00 O ATOM 74 OE2 GLU p 5 -8.248 18.968 -2.733 1.00 0.00 O ATOM 0 H GLU p 5 -7.108 19.163 1.671 1.00 0.00 H new ATOM 0 HA GLU p 5 -6.314 17.051 -0.051 1.00 0.00 H new ATOM 0 HB2 GLU p 5 -5.216 19.860 -0.135 1.00 0.00 H new ATOM 0 HB3 GLU p 5 -5.527 18.764 -1.466 1.00 0.00 H new ATOM 0 HG2 GLU p 5 -8.024 19.122 -0.212 1.00 0.00 H new ATOM 0 HG3 GLU p 5 -7.285 20.711 -0.221 1.00 0.00 H new ATOM 81 N LYS p 6 -4.241 18.237 2.143 1.00 0.00 N ATOM 82 CA LYS p 6 -2.953 18.098 2.840 1.00 0.00 C ATOM 83 C LYS p 6 -2.932 16.810 3.638 1.00 0.00 C ATOM 84 O LYS p 6 -1.883 16.228 3.855 1.00 0.00 O ATOM 85 CB LYS p 6 -2.689 19.265 3.779 1.00 0.00 C ATOM 86 CG LYS p 6 -1.399 20.010 3.476 1.00 0.00 C ATOM 87 CD LYS p 6 -1.192 21.178 4.430 1.00 0.00 C ATOM 88 CE LYS p 6 0.068 21.963 4.094 1.00 0.00 C ATOM 89 NZ LYS p 6 1.308 21.226 4.470 1.00 0.00 N ATOM 0 H LYS p 6 -4.920 18.803 2.652 1.00 0.00 H new ATOM 0 HA LYS p 6 -2.172 18.085 2.080 1.00 0.00 H new ATOM 0 HB2 LYS p 6 -3.524 19.963 3.721 1.00 0.00 H new ATOM 0 HB3 LYS p 6 -2.653 18.895 4.804 1.00 0.00 H new ATOM 0 HG2 LYS p 6 -0.555 19.324 3.551 1.00 0.00 H new ATOM 0 HG3 LYS p 6 -1.422 20.377 2.450 1.00 0.00 H new ATOM 0 HD2 LYS p 6 -2.056 21.841 4.387 1.00 0.00 H new ATOM 0 HD3 LYS p 6 -1.127 20.806 5.452 1.00 0.00 H new ATOM 0 HE2 LYS p 6 0.085 22.179 3.026 1.00 0.00 H new ATOM 0 HE3 LYS p 6 0.046 22.922 4.612 1.00 0.00 H new ATOM 0 HZ1 LYS p 6 2.140 21.798 4.223 1.00 0.00 H new ATOM 0 HZ2 LYS p 6 1.306 21.042 5.494 1.00 0.00 H new ATOM 0 HZ3 LYS p 6 1.344 20.323 3.956 1.00 0.00 H new ATOM 103 N GLU p 7 -4.133 16.390 4.041 1.00 0.00 N ATOM 104 CA GLU p 7 -4.382 15.166 4.791 1.00 0.00 C ATOM 105 C GLU p 7 -4.440 14.031 3.782 1.00 0.00 C ATOM 106 O GLU p 7 -4.266 12.862 4.106 1.00 0.00 O ATOM 107 CB GLU p 7 -5.703 15.325 5.558 1.00 0.00 C ATOM 108 CG GLU p 7 -6.471 14.040 5.803 1.00 0.00 C ATOM 109 CD GLU p 7 -6.729 13.775 7.273 1.00 0.00 C ATOM 110 OE1 GLU p 7 -7.776 14.226 7.783 1.00 0.00 O ATOM 111 OE2 GLU p 7 -5.884 13.116 7.914 1.00 0.00 O ATOM 0 H GLU p 7 -4.986 16.914 3.845 1.00 0.00 H new ATOM 0 HA GLU p 7 -3.600 14.955 5.521 1.00 0.00 H new ATOM 0 HB2 GLU p 7 -5.491 15.791 6.520 1.00 0.00 H new ATOM 0 HB3 GLU p 7 -6.344 16.012 5.006 1.00 0.00 H new ATOM 0 HG2 GLU p 7 -7.424 14.086 5.275 1.00 0.00 H new ATOM 0 HG3 GLU p 7 -5.913 13.204 5.381 1.00 0.00 H new ATOM 118 N LEU p 8 -4.715 14.467 2.558 1.00 0.00 N ATOM 119 CA LEU p 8 -4.780 13.656 1.367 1.00 0.00 C ATOM 120 C LEU p 8 -3.396 13.711 0.733 1.00 0.00 C ATOM 121 O LEU p 8 -3.057 12.911 -0.130 1.00 0.00 O ATOM 122 CB LEU p 8 -5.867 14.194 0.412 1.00 0.00 C ATOM 123 CG LEU p 8 -6.164 13.382 -0.868 1.00 0.00 C ATOM 124 CD1 LEU p 8 -5.396 13.967 -2.039 1.00 0.00 C ATOM 125 CD2 LEU p 8 -5.816 11.912 -0.689 1.00 0.00 C ATOM 0 H LEU p 8 -4.908 15.451 2.369 1.00 0.00 H new ATOM 0 HA LEU p 8 -5.052 12.625 1.595 1.00 0.00 H new ATOM 0 HB2 LEU p 8 -6.795 14.282 0.976 1.00 0.00 H new ATOM 0 HB3 LEU p 8 -5.580 15.202 0.111 1.00 0.00 H new ATOM 0 HG LEU p 8 -7.233 13.446 -1.070 1.00 0.00 H new ATOM 0 HD11 LEU p 8 -5.610 13.390 -2.939 1.00 0.00 H new ATOM 0 HD12 LEU p 8 -5.699 15.003 -2.192 1.00 0.00 H new ATOM 0 HD13 LEU p 8 -4.327 13.929 -1.829 1.00 0.00 H new ATOM 0 HD21 LEU p 8 -6.038 11.371 -1.609 1.00 0.00 H new ATOM 0 HD22 LEU p 8 -4.755 11.815 -0.457 1.00 0.00 H new ATOM 0 HD23 LEU p 8 -6.405 11.495 0.128 1.00 0.00 H new ATOM 137 N ALA p 9 -2.644 14.726 1.181 1.00 0.00 N ATOM 138 CA ALA p 9 -1.246 14.941 0.800 1.00 0.00 C ATOM 139 C ALA p 9 -0.388 14.206 1.815 1.00 0.00 C ATOM 140 O ALA p 9 0.765 13.865 1.559 1.00 0.00 O ATOM 141 CB ALA p 9 -0.868 16.411 0.749 1.00 0.00 C ATOM 0 H ALA p 9 -2.998 15.430 1.828 1.00 0.00 H new ATOM 0 HA ALA p 9 -1.088 14.561 -0.209 1.00 0.00 H new ATOM 0 HB1 ALA p 9 0.179 16.508 0.461 1.00 0.00 H new ATOM 0 HB2 ALA p 9 -1.494 16.922 0.018 1.00 0.00 H new ATOM 0 HB3 ALA p 9 -1.017 16.859 1.731 1.00 0.00 H new ATOM 147 N GLN p 10 -1.009 13.999 2.990 1.00 0.00 N ATOM 148 CA GLN p 10 -0.446 13.245 4.105 1.00 0.00 C ATOM 149 C GLN p 10 -0.806 11.814 3.877 1.00 0.00 C ATOM 150 O GLN p 10 -0.111 10.894 4.279 1.00 0.00 O ATOM 151 CB GLN p 10 -1.081 13.668 5.403 1.00 0.00 C ATOM 152 CG GLN p 10 -0.678 15.039 5.845 1.00 0.00 C ATOM 153 CD GLN p 10 0.104 15.048 7.144 1.00 0.00 C ATOM 154 OE1 GLN p 10 1.331 14.958 7.145 1.00 0.00 O ATOM 155 NE2 GLN p 10 -0.607 15.158 8.260 1.00 0.00 N ATOM 0 H GLN p 10 -1.941 14.365 3.187 1.00 0.00 H new ATOM 0 HA GLN p 10 0.630 13.410 4.161 1.00 0.00 H new ATOM 0 HB2 GLN p 10 -2.165 13.633 5.296 1.00 0.00 H new ATOM 0 HB3 GLN p 10 -0.814 12.951 6.180 1.00 0.00 H new ATOM 0 HG2 GLN p 10 -0.075 15.502 5.064 1.00 0.00 H new ATOM 0 HG3 GLN p 10 -1.572 15.652 5.963 1.00 0.00 H new ATOM 0 HE21 GLN p 10 -1.623 15.230 8.212 1.00 0.00 H new ATOM 0 HE22 GLN p 10 -0.137 15.170 9.165 1.00 0.00 H new ATOM 164 N ASN p 11 -1.990 11.709 3.287 1.00 0.00 N ATOM 165 CA ASN p 11 -2.591 10.442 2.854 1.00 0.00 C ATOM 166 C ASN p 11 -1.926 10.033 1.551 1.00 0.00 C ATOM 167 O ASN p 11 -1.964 8.871 1.155 1.00 0.00 O ATOM 168 CB ASN p 11 -4.106 10.534 2.651 1.00 0.00 C ATOM 169 CG ASN p 11 -4.830 9.233 2.967 1.00 0.00 C ATOM 170 OD1 ASN p 11 -4.455 8.496 3.883 1.00 0.00 O ATOM 171 ND2 ASN p 11 -5.877 8.943 2.203 1.00 0.00 N ATOM 0 H ASN p 11 -2.578 12.519 3.089 1.00 0.00 H new ATOM 0 HA ASN p 11 -2.431 9.703 3.639 1.00 0.00 H new ATOM 0 HB2 ASN p 11 -4.504 11.327 3.284 1.00 0.00 H new ATOM 0 HB3 ASN p 11 -4.312 10.816 1.618 1.00 0.00 H new ATOM 0 HD21 ASN p 11 -6.403 8.084 2.364 1.00 0.00 H new ATOM 0 HD22 ASN p 11 -6.155 9.579 1.456 1.00 0.00 H new ATOM 178 N GLU p 12 -1.349 11.052 0.890 1.00 0.00 N ATOM 179 CA GLU p 12 -0.579 10.922 -0.314 1.00 0.00 C ATOM 180 C GLU p 12 0.826 10.572 0.114 1.00 0.00 C ATOM 181 O GLU p 12 1.573 9.899 -0.581 1.00 0.00 O ATOM 182 CB GLU p 12 -0.578 12.264 -0.990 1.00 0.00 C ATOM 183 CG GLU p 12 0.156 12.288 -2.282 1.00 0.00 C ATOM 184 CD GLU p 12 -0.720 12.633 -3.471 1.00 0.00 C ATOM 185 OE1 GLU p 12 -0.842 13.835 -3.790 1.00 0.00 O ATOM 186 OE2 GLU p 12 -1.283 11.701 -4.084 1.00 0.00 O ATOM 0 H GLU p 12 -1.422 12.018 1.210 1.00 0.00 H new ATOM 0 HA GLU p 12 -0.976 10.165 -0.991 1.00 0.00 H new ATOM 0 HB2 GLU p 12 -1.609 12.573 -1.163 1.00 0.00 H new ATOM 0 HB3 GLU p 12 -0.134 12.998 -0.318 1.00 0.00 H new ATOM 0 HG2 GLU p 12 0.967 13.013 -2.216 1.00 0.00 H new ATOM 0 HG3 GLU p 12 0.613 11.313 -2.449 1.00 0.00 H new ATOM 193 N TRP p 13 1.137 11.149 1.270 1.00 0.00 N ATOM 194 CA TRP p 13 2.397 10.954 1.987 1.00 0.00 C ATOM 195 C TRP p 13 2.329 9.624 2.728 1.00 0.00 C ATOM 196 O TRP p 13 3.350 9.040 3.083 1.00 0.00 O ATOM 197 CB TRP p 13 2.665 12.093 2.974 1.00 0.00 C ATOM 198 CG TRP p 13 4.128 12.340 3.220 1.00 0.00 C ATOM 199 CD1 TRP p 13 4.897 11.771 4.193 1.00 0.00 C ATOM 200 CD2 TRP p 13 4.997 13.218 2.484 1.00 0.00 C ATOM 201 NE1 TRP p 13 6.187 12.235 4.111 1.00 0.00 N ATOM 202 CE2 TRP p 13 6.274 13.125 3.071 1.00 0.00 C ATOM 203 CE3 TRP p 13 4.822 14.073 1.388 1.00 0.00 C ATOM 204 CZ2 TRP p 13 7.366 13.851 2.600 1.00 0.00 C ATOM 205 CZ3 TRP p 13 5.907 14.792 0.923 1.00 0.00 C ATOM 206 CH2 TRP p 13 7.165 14.676 1.528 1.00 0.00 C ATOM 0 H TRP p 13 0.501 11.785 1.751 1.00 0.00 H new ATOM 0 HA TRP p 13 3.217 10.949 1.268 1.00 0.00 H new ATOM 0 HB2 TRP p 13 2.209 13.007 2.594 1.00 0.00 H new ATOM 0 HB3 TRP p 13 2.179 11.864 3.922 1.00 0.00 H new ATOM 0 HD1 TRP p 13 4.542 11.058 4.923 1.00 0.00 H new ATOM 0 HE1 TRP p 13 6.955 11.962 4.724 1.00 0.00 H new ATOM 0 HE3 TRP p 13 3.856 14.169 0.915 1.00 0.00 H new ATOM 0 HZ2 TRP p 13 8.337 13.765 3.065 1.00 0.00 H new ATOM 0 HZ3 TRP p 13 5.783 15.454 0.079 1.00 0.00 H new ATOM 0 HH2 TRP p 13 7.993 15.250 1.140 1.00 0.00 H new ATOM 217 N GLU p 14 1.079 9.192 2.965 1.00 0.00 N ATOM 218 CA GLU p 14 0.736 7.940 3.581 1.00 0.00 C ATOM 219 C GLU p 14 0.703 6.905 2.483 1.00 0.00 C ATOM 220 O GLU p 14 0.917 5.718 2.694 1.00 0.00 O ATOM 221 CB GLU p 14 -0.642 8.106 4.158 1.00 0.00 C ATOM 222 CG GLU p 14 -1.148 6.900 4.863 1.00 0.00 C ATOM 223 CD GLU p 14 -1.448 7.135 6.330 1.00 0.00 C ATOM 224 OE1 GLU p 14 -2.596 7.510 6.649 1.00 0.00 O ATOM 225 OE2 GLU p 14 -0.534 6.943 7.161 1.00 0.00 O ATOM 0 H GLU p 14 0.259 9.744 2.714 1.00 0.00 H new ATOM 0 HA GLU p 14 1.440 7.642 4.358 1.00 0.00 H new ATOM 0 HB2 GLU p 14 -0.636 8.945 4.853 1.00 0.00 H new ATOM 0 HB3 GLU p 14 -1.333 8.362 3.355 1.00 0.00 H new ATOM 0 HG2 GLU p 14 -2.054 6.553 4.367 1.00 0.00 H new ATOM 0 HG3 GLU p 14 -0.411 6.102 4.775 1.00 0.00 H new ATOM 232 N LEU p 15 0.326 7.441 1.330 1.00 0.00 N ATOM 233 CA LEU p 15 0.266 6.749 0.059 1.00 0.00 C ATOM 234 C LEU p 15 1.697 6.558 -0.393 1.00 0.00 C ATOM 235 O LEU p 15 2.067 5.524 -0.918 1.00 0.00 O ATOM 236 CB LEU p 15 -0.491 7.612 -0.945 1.00 0.00 C ATOM 237 CG LEU p 15 -1.123 6.935 -2.161 1.00 0.00 C ATOM 238 CD1 LEU p 15 -1.779 8.010 -2.992 1.00 0.00 C ATOM 239 CD2 LEU p 15 -0.093 6.189 -2.996 1.00 0.00 C ATOM 0 H LEU p 15 0.041 8.418 1.257 1.00 0.00 H new ATOM 0 HA LEU p 15 -0.247 5.791 0.142 1.00 0.00 H new ATOM 0 HB2 LEU p 15 -1.284 8.130 -0.405 1.00 0.00 H new ATOM 0 HB3 LEU p 15 0.196 8.375 -1.311 1.00 0.00 H new ATOM 0 HG LEU p 15 -1.851 6.197 -1.824 1.00 0.00 H new ATOM 0 HD11 LEU p 15 -2.241 7.560 -3.870 1.00 0.00 H new ATOM 0 HD12 LEU p 15 -2.542 8.514 -2.399 1.00 0.00 H new ATOM 0 HD13 LEU p 15 -1.028 8.734 -3.308 1.00 0.00 H new ATOM 0 HD21 LEU p 15 -0.585 5.723 -3.850 1.00 0.00 H new ATOM 0 HD22 LEU p 15 0.664 6.889 -3.351 1.00 0.00 H new ATOM 0 HD23 LEU p 15 0.382 5.420 -2.387 1.00 0.00 H new ATOM 251 N GLN p 16 2.470 7.619 -0.153 1.00 0.00 N ATOM 252 CA GLN p 16 3.882 7.706 -0.394 1.00 0.00 C ATOM 253 C GLN p 16 4.560 6.780 0.582 1.00 0.00 C ATOM 254 O GLN p 16 5.612 6.225 0.318 1.00 0.00 O ATOM 255 CB GLN p 16 4.273 9.130 -0.108 1.00 0.00 C ATOM 256 CG GLN p 16 5.688 9.439 -0.424 1.00 0.00 C ATOM 257 CD GLN p 16 5.856 10.473 -1.520 1.00 0.00 C ATOM 258 OE1 GLN p 16 5.919 11.673 -1.254 1.00 0.00 O ATOM 259 NE2 GLN p 16 5.928 10.010 -2.763 1.00 0.00 N ATOM 0 H GLN p 16 2.090 8.481 0.237 1.00 0.00 H new ATOM 0 HA GLN p 16 4.159 7.431 -1.412 1.00 0.00 H new ATOM 0 HB2 GLN p 16 3.629 9.796 -0.682 1.00 0.00 H new ATOM 0 HB3 GLN p 16 4.092 9.342 0.946 1.00 0.00 H new ATOM 0 HG2 GLN p 16 6.183 9.796 0.479 1.00 0.00 H new ATOM 0 HG3 GLN p 16 6.193 8.521 -0.723 1.00 0.00 H new ATOM 0 HE21 GLN p 16 5.871 9.007 -2.938 1.00 0.00 H new ATOM 0 HE22 GLN p 16 6.040 10.658 -3.543 1.00 0.00 H new ATOM 268 N ALA p 17 3.918 6.734 1.743 1.00 0.00 N ATOM 269 CA ALA p 17 4.276 5.857 2.856 1.00 0.00 C ATOM 270 C ALA p 17 3.712 4.478 2.567 1.00 0.00 C ATOM 271 O ALA p 17 4.105 3.497 3.185 1.00 0.00 O ATOM 272 CB ALA p 17 3.748 6.375 4.184 1.00 0.00 C ATOM 0 H ALA p 17 3.110 7.323 1.944 1.00 0.00 H new ATOM 0 HA ALA p 17 5.362 5.821 2.944 1.00 0.00 H new ATOM 0 HB1 ALA p 17 4.038 5.692 4.982 1.00 0.00 H new ATOM 0 HB2 ALA p 17 4.166 7.362 4.382 1.00 0.00 H new ATOM 0 HB3 ALA p 17 2.661 6.443 4.142 1.00 0.00 H new ATOM 278 N LEU p 18 2.741 4.460 1.630 1.00 0.00 N ATOM 279 CA LEU p 18 2.116 3.244 1.130 1.00 0.00 C ATOM 280 C LEU p 18 2.934 2.785 -0.073 1.00 0.00 C ATOM 281 O LEU p 18 2.940 1.611 -0.435 1.00 0.00 O ATOM 282 CB LEU p 18 0.645 3.500 0.742 1.00 0.00 C ATOM 283 CG LEU p 18 -0.207 2.284 0.322 1.00 0.00 C ATOM 284 CD1 LEU p 18 -0.221 2.170 -1.191 1.00 0.00 C ATOM 285 CD2 LEU p 18 0.316 0.999 0.944 1.00 0.00 C ATOM 0 H LEU p 18 2.372 5.309 1.201 1.00 0.00 H new ATOM 0 HA LEU p 18 2.103 2.471 1.899 1.00 0.00 H new ATOM 0 HB2 LEU p 18 0.153 3.978 1.589 1.00 0.00 H new ATOM 0 HB3 LEU p 18 0.634 4.217 -0.079 1.00 0.00 H new ATOM 0 HG LEU p 18 -1.224 2.436 0.684 1.00 0.00 H new ATOM 0 HD11 LEU p 18 -0.823 1.311 -1.486 1.00 0.00 H new ATOM 0 HD12 LEU p 18 -0.648 3.076 -1.620 1.00 0.00 H new ATOM 0 HD13 LEU p 18 0.798 2.041 -1.556 1.00 0.00 H new ATOM 0 HD21 LEU p 18 -0.307 0.162 0.628 1.00 0.00 H new ATOM 0 HD22 LEU p 18 1.343 0.830 0.620 1.00 0.00 H new ATOM 0 HD23 LEU p 18 0.287 1.083 2.030 1.00 0.00 H new ATOM 297 N GLU p 19 3.594 3.776 -0.684 1.00 0.00 N ATOM 298 CA GLU p 19 4.518 3.572 -1.815 1.00 0.00 C ATOM 299 C GLU p 19 5.859 3.266 -1.217 1.00 0.00 C ATOM 300 O GLU p 19 6.706 2.619 -1.820 1.00 0.00 O ATOM 301 CB GLU p 19 4.651 4.801 -2.715 1.00 0.00 C ATOM 302 CG GLU p 19 3.331 5.308 -3.226 1.00 0.00 C ATOM 303 CD GLU p 19 3.278 5.423 -4.737 1.00 0.00 C ATOM 304 OE1 GLU p 19 3.631 6.499 -5.264 1.00 0.00 O ATOM 305 OE2 GLU p 19 2.882 4.436 -5.394 1.00 0.00 O ATOM 0 H GLU p 19 3.503 4.754 -0.407 1.00 0.00 H new ATOM 0 HA GLU p 19 4.132 2.769 -2.443 1.00 0.00 H new ATOM 0 HB2 GLU p 19 5.148 5.597 -2.161 1.00 0.00 H new ATOM 0 HB3 GLU p 19 5.291 4.555 -3.562 1.00 0.00 H new ATOM 0 HG2 GLU p 19 2.538 4.639 -2.891 1.00 0.00 H new ATOM 0 HG3 GLU p 19 3.130 6.285 -2.787 1.00 0.00 H new ATOM 312 N LYS p 20 6.020 3.831 -0.020 1.00 0.00 N ATOM 313 CA LYS p 20 7.195 3.632 0.829 1.00 0.00 C ATOM 314 C LYS p 20 7.010 2.354 1.632 1.00 0.00 C ATOM 315 O LYS p 20 7.970 1.786 2.150 1.00 0.00 O ATOM 316 CB LYS p 20 7.395 4.815 1.765 1.00 0.00 C ATOM 317 CG LYS p 20 8.749 5.490 1.638 1.00 0.00 C ATOM 318 CD LYS p 20 9.647 5.172 2.822 1.00 0.00 C ATOM 319 CE LYS p 20 10.999 5.854 2.694 1.00 0.00 C ATOM 320 NZ LYS p 20 11.884 5.554 3.854 1.00 0.00 N ATOM 0 H LYS p 20 5.324 4.451 0.394 1.00 0.00 H new ATOM 0 HA LYS p 20 8.081 3.550 0.200 1.00 0.00 H new ATOM 0 HB2 LYS p 20 6.615 5.552 1.572 1.00 0.00 H new ATOM 0 HB3 LYS p 20 7.266 4.476 2.793 1.00 0.00 H new ATOM 0 HG2 LYS p 20 9.233 5.166 0.717 1.00 0.00 H new ATOM 0 HG3 LYS p 20 8.613 6.569 1.564 1.00 0.00 H new ATOM 0 HD2 LYS p 20 9.162 5.493 3.744 1.00 0.00 H new ATOM 0 HD3 LYS p 20 9.788 4.094 2.894 1.00 0.00 H new ATOM 0 HE2 LYS p 20 11.484 5.529 1.774 1.00 0.00 H new ATOM 0 HE3 LYS p 20 10.856 6.932 2.615 1.00 0.00 H new ATOM 0 HZ1 LYS p 20 12.796 6.037 3.729 1.00 0.00 H new ATOM 0 HZ2 LYS p 20 11.433 5.887 4.730 1.00 0.00 H new ATOM 0 HZ3 LYS p 20 12.042 4.528 3.914 1.00 0.00 H new ATOM 334 N GLU p 21 5.737 1.937 1.723 1.00 0.00 N ATOM 335 CA GLU p 21 5.332 0.701 2.361 1.00 0.00 C ATOM 336 C GLU p 21 5.426 -0.339 1.264 1.00 0.00 C ATOM 337 O GLU p 21 5.711 -1.516 1.497 1.00 0.00 O ATOM 338 CB GLU p 21 3.910 0.829 2.921 1.00 0.00 C ATOM 339 CG GLU p 21 3.099 -0.453 2.943 1.00 0.00 C ATOM 340 CD GLU p 21 2.841 -0.966 4.346 1.00 0.00 C ATOM 341 OE1 GLU p 21 3.667 -1.754 4.851 1.00 0.00 O ATOM 342 OE2 GLU p 21 1.812 -0.580 4.940 1.00 0.00 O ATOM 0 H GLU p 21 4.954 2.470 1.343 1.00 0.00 H new ATOM 0 HA GLU p 21 5.956 0.434 3.214 1.00 0.00 H new ATOM 0 HB2 GLU p 21 3.972 1.217 3.938 1.00 0.00 H new ATOM 0 HB3 GLU p 21 3.371 1.569 2.330 1.00 0.00 H new ATOM 0 HG2 GLU p 21 2.145 -0.282 2.443 1.00 0.00 H new ATOM 0 HG3 GLU p 21 3.625 -1.219 2.373 1.00 0.00 H new ATOM 349 N LEU p 22 5.167 0.168 0.048 1.00 0.00 N ATOM 350 CA LEU p 22 5.298 -0.596 -1.175 1.00 0.00 C ATOM 351 C LEU p 22 6.788 -0.742 -1.421 1.00 0.00 C ATOM 352 O LEU p 22 7.278 -1.802 -1.820 1.00 0.00 O ATOM 353 CB LEU p 22 4.643 0.176 -2.318 1.00 0.00 C ATOM 354 CG LEU p 22 4.239 -0.592 -3.576 1.00 0.00 C ATOM 355 CD1 LEU p 22 3.576 0.384 -4.515 1.00 0.00 C ATOM 356 CD2 LEU p 22 5.438 -1.234 -4.255 1.00 0.00 C ATOM 0 H LEU p 22 4.859 1.129 -0.101 1.00 0.00 H new ATOM 0 HA LEU p 22 4.816 -1.571 -1.106 1.00 0.00 H new ATOM 0 HB2 LEU p 22 3.750 0.660 -1.923 1.00 0.00 H new ATOM 0 HB3 LEU p 22 5.328 0.969 -2.619 1.00 0.00 H new ATOM 0 HG LEU p 22 3.559 -1.399 -3.303 1.00 0.00 H new ATOM 0 HD11 LEU p 22 3.275 -0.134 -5.425 1.00 0.00 H new ATOM 0 HD12 LEU p 22 2.697 0.812 -4.034 1.00 0.00 H new ATOM 0 HD13 LEU p 22 4.276 1.181 -4.766 1.00 0.00 H new ATOM 0 HD21 LEU p 22 5.108 -1.770 -5.145 1.00 0.00 H new ATOM 0 HD22 LEU p 22 6.151 -0.461 -4.541 1.00 0.00 H new ATOM 0 HD23 LEU p 22 5.915 -1.932 -3.567 1.00 0.00 H new ATOM 368 N ALA p 23 7.483 0.374 -1.165 1.00 0.00 N ATOM 369 CA ALA p 23 8.947 0.435 -1.271 1.00 0.00 C ATOM 370 C ALA p 23 9.596 -0.298 -0.090 1.00 0.00 C ATOM 371 O ALA p 23 10.794 -0.583 -0.106 1.00 0.00 O ATOM 372 CB ALA p 23 9.449 1.872 -1.335 1.00 0.00 C ATOM 0 H ALA p 23 7.051 1.253 -0.881 1.00 0.00 H new ATOM 0 HA ALA p 23 9.231 -0.058 -2.201 1.00 0.00 H new ATOM 0 HB1 ALA p 23 10.536 1.874 -1.413 1.00 0.00 H new ATOM 0 HB2 ALA p 23 9.022 2.368 -2.206 1.00 0.00 H new ATOM 0 HB3 ALA p 23 9.149 2.403 -0.432 1.00 0.00 H new ATOM 378 N GLN p 24 8.765 -0.590 0.929 1.00 0.00 N ATOM 379 CA GLN p 24 9.158 -1.305 2.132 1.00 0.00 C ATOM 380 C GLN p 24 9.098 -2.814 1.882 1.00 0.00 C ATOM 381 O GLN p 24 9.862 -3.572 2.450 1.00 0.00 O ATOM 382 CB GLN p 24 8.198 -0.898 3.248 1.00 0.00 C ATOM 383 CG GLN p 24 8.091 -1.875 4.394 1.00 0.00 C ATOM 384 CD GLN p 24 8.717 -1.361 5.676 1.00 0.00 C ATOM 385 OE1 GLN p 24 9.902 -1.575 5.931 1.00 0.00 O ATOM 386 NE2 GLN p 24 7.921 -0.678 6.490 1.00 0.00 N ATOM 0 H GLN p 24 7.780 -0.323 0.926 1.00 0.00 H new ATOM 0 HA GLN p 24 10.181 -1.057 2.416 1.00 0.00 H new ATOM 0 HB2 GLN p 24 8.514 0.067 3.643 1.00 0.00 H new ATOM 0 HB3 GLN p 24 7.206 -0.757 2.818 1.00 0.00 H new ATOM 0 HG2 GLN p 24 7.040 -2.100 4.575 1.00 0.00 H new ATOM 0 HG3 GLN p 24 8.573 -2.811 4.112 1.00 0.00 H new ATOM 0 HE21 GLN p 24 6.945 -0.524 6.238 1.00 0.00 H new ATOM 0 HE22 GLN p 24 8.286 -0.307 7.367 1.00 0.00 H new ATOM 395 N LEU p 25 8.159 -3.184 1.012 1.00 0.00 N ATOM 396 CA LEU p 25 7.882 -4.554 0.574 1.00 0.00 C ATOM 397 C LEU p 25 8.884 -4.921 -0.491 1.00 0.00 C ATOM 398 O LEU p 25 9.188 -6.079 -0.741 1.00 0.00 O ATOM 399 CB LEU p 25 6.469 -4.594 -0.017 1.00 0.00 C ATOM 400 CG LEU p 25 5.856 -5.981 -0.318 1.00 0.00 C ATOM 401 CD1 LEU p 25 6.069 -6.320 -1.781 1.00 0.00 C ATOM 402 CD2 LEU p 25 6.454 -7.068 0.565 1.00 0.00 C ATOM 0 H LEU p 25 7.540 -2.504 0.571 1.00 0.00 H new ATOM 0 HA LEU p 25 7.954 -5.253 1.407 1.00 0.00 H new ATOM 0 HB2 LEU p 25 5.802 -4.075 0.672 1.00 0.00 H new ATOM 0 HB3 LEU p 25 6.477 -4.022 -0.945 1.00 0.00 H new ATOM 0 HG LEU p 25 4.789 -5.935 -0.100 1.00 0.00 H new ATOM 0 HD11 LEU p 25 5.637 -7.298 -1.995 1.00 0.00 H new ATOM 0 HD12 LEU p 25 5.586 -5.566 -2.403 1.00 0.00 H new ATOM 0 HD13 LEU p 25 7.137 -6.340 -1.998 1.00 0.00 H new ATOM 0 HD21 LEU p 25 5.996 -8.027 0.322 1.00 0.00 H new ATOM 0 HD22 LEU p 25 7.529 -7.125 0.394 1.00 0.00 H new ATOM 0 HD23 LEU p 25 6.265 -6.831 1.612 1.00 0.00 H new ATOM 414 N GLU p 26 9.304 -3.848 -1.119 1.00 0.00 N ATOM 415 CA GLU p 26 10.297 -3.768 -2.140 1.00 0.00 C ATOM 416 C GLU p 26 11.641 -3.822 -1.449 1.00 0.00 C ATOM 417 O GLU p 26 12.636 -4.271 -1.997 1.00 0.00 O ATOM 418 CB GLU p 26 10.096 -2.422 -2.788 1.00 0.00 C ATOM 419 CG GLU p 26 10.995 -2.163 -3.945 1.00 0.00 C ATOM 420 CD GLU p 26 10.261 -2.030 -5.264 1.00 0.00 C ATOM 421 OE1 GLU p 26 10.062 -3.061 -5.940 1.00 0.00 O ATOM 422 OE2 GLU p 26 9.885 -0.894 -5.623 1.00 0.00 O ATOM 0 H GLU p 26 8.917 -2.930 -0.901 1.00 0.00 H new ATOM 0 HA GLU p 26 10.238 -4.566 -2.880 1.00 0.00 H new ATOM 0 HB2 GLU p 26 9.061 -2.342 -3.121 1.00 0.00 H new ATOM 0 HB3 GLU p 26 10.251 -1.644 -2.040 1.00 0.00 H new ATOM 0 HG2 GLU p 26 11.559 -1.249 -3.759 1.00 0.00 H new ATOM 0 HG3 GLU p 26 11.719 -2.975 -4.021 1.00 0.00 H new ATOM 429 N LYS p 27 11.602 -3.239 -0.257 1.00 0.00 N ATOM 430 CA LYS p 27 12.721 -3.209 0.692 1.00 0.00 C ATOM 431 C LYS p 27 12.788 -4.547 1.403 1.00 0.00 C ATOM 432 O LYS p 27 13.872 -5.039 1.725 1.00 0.00 O ATOM 433 CB LYS p 27 12.574 -2.077 1.710 1.00 0.00 C ATOM 434 CG LYS p 27 13.461 -0.868 1.435 1.00 0.00 C ATOM 435 CD LYS p 27 14.809 -0.987 2.133 1.00 0.00 C ATOM 436 CE LYS p 27 15.699 0.209 1.833 1.00 0.00 C ATOM 437 NZ LYS p 27 17.022 0.102 2.508 1.00 0.00 N ATOM 0 H LYS p 27 10.771 -2.760 0.091 1.00 0.00 H new ATOM 0 HA LYS p 27 13.643 -3.025 0.140 1.00 0.00 H new ATOM 0 HB2 LYS p 27 11.533 -1.753 1.728 1.00 0.00 H new ATOM 0 HB3 LYS p 27 12.805 -2.464 2.702 1.00 0.00 H new ATOM 0 HG2 LYS p 27 13.615 -0.767 0.361 1.00 0.00 H new ATOM 0 HG3 LYS p 27 12.956 0.038 1.771 1.00 0.00 H new ATOM 0 HD2 LYS p 27 14.657 -1.068 3.209 1.00 0.00 H new ATOM 0 HD3 LYS p 27 15.307 -1.902 1.812 1.00 0.00 H new ATOM 0 HE2 LYS p 27 15.847 0.290 0.756 1.00 0.00 H new ATOM 0 HE3 LYS p 27 15.200 1.123 2.156 1.00 0.00 H new ATOM 0 HZ1 LYS p 27 17.598 0.937 2.278 1.00 0.00 H new ATOM 0 HZ2 LYS p 27 16.883 0.050 3.537 1.00 0.00 H new ATOM 0 HZ3 LYS p 27 17.510 -0.756 2.181 1.00 0.00 H new ATOM 451 N GLU p 28 11.597 -5.126 1.647 1.00 0.00 N ATOM 452 CA GLU p 28 11.503 -6.477 2.242 1.00 0.00 C ATOM 453 C GLU p 28 11.890 -7.432 1.152 1.00 0.00 C ATOM 454 O GLU p 28 12.479 -8.491 1.379 1.00 0.00 O ATOM 455 CB GLU p 28 10.100 -6.836 2.735 1.00 0.00 C ATOM 456 CG GLU p 28 9.537 -5.850 3.723 1.00 0.00 C ATOM 457 CD GLU p 28 9.242 -6.465 5.078 1.00 0.00 C ATOM 458 OE1 GLU p 28 10.144 -6.462 5.941 1.00 0.00 O ATOM 459 OE2 GLU p 28 8.106 -6.947 5.275 1.00 0.00 O ATOM 0 H GLU p 28 10.698 -4.689 1.446 1.00 0.00 H new ATOM 0 HA GLU p 28 12.150 -6.523 3.118 1.00 0.00 H new ATOM 0 HB2 GLU p 28 9.429 -6.902 1.878 1.00 0.00 H new ATOM 0 HB3 GLU p 28 10.128 -7.823 3.196 1.00 0.00 H new ATOM 0 HG2 GLU p 28 10.243 -5.029 3.850 1.00 0.00 H new ATOM 0 HG3 GLU p 28 8.620 -5.422 3.318 1.00 0.00 H new ATOM 466 N LEU p 29 11.521 -6.998 -0.053 1.00 0.00 N ATOM 467 CA LEU p 29 11.845 -7.696 -1.285 1.00 0.00 C ATOM 468 C LEU p 29 13.339 -7.573 -1.552 1.00 0.00 C ATOM 469 O LEU p 29 14.016 -8.558 -1.858 1.00 0.00 O ATOM 470 CB LEU p 29 11.069 -7.066 -2.439 1.00 0.00 C ATOM 471 CG LEU p 29 10.686 -7.963 -3.612 1.00 0.00 C ATOM 472 CD1 LEU p 29 9.896 -7.135 -4.597 1.00 0.00 C ATOM 473 CD2 LEU p 29 11.914 -8.551 -4.283 1.00 0.00 C ATOM 0 H LEU p 29 10.984 -6.143 -0.197 1.00 0.00 H new ATOM 0 HA LEU p 29 11.575 -8.748 -1.195 1.00 0.00 H new ATOM 0 HB2 LEU p 29 10.153 -6.637 -2.032 1.00 0.00 H new ATOM 0 HB3 LEU p 29 11.662 -6.239 -2.829 1.00 0.00 H new ATOM 0 HG LEU p 29 10.087 -8.798 -3.249 1.00 0.00 H new ATOM 0 HD11 LEU p 29 9.610 -7.755 -5.447 1.00 0.00 H new ATOM 0 HD12 LEU p 29 9.000 -6.749 -4.111 1.00 0.00 H new ATOM 0 HD13 LEU p 29 10.507 -6.302 -4.945 1.00 0.00 H new ATOM 0 HD21 LEU p 29 11.606 -9.185 -5.114 1.00 0.00 H new ATOM 0 HD22 LEU p 29 12.546 -7.745 -4.656 1.00 0.00 H new ATOM 0 HD23 LEU p 29 12.473 -9.146 -3.561 1.00 0.00 H new ATOM 485 N GLN p 30 13.828 -6.334 -1.426 1.00 0.00 N ATOM 486 CA GLN p 30 15.261 -6.027 -1.633 1.00 0.00 C ATOM 487 C GLN p 30 16.148 -6.773 -0.631 1.00 0.00 C ATOM 488 O GLN p 30 17.231 -7.259 -0.972 1.00 0.00 O ATOM 489 CB GLN p 30 15.479 -4.494 -1.585 1.00 0.00 C ATOM 490 CG GLN p 30 16.305 -3.944 -0.417 1.00 0.00 C ATOM 491 CD GLN p 30 17.782 -3.824 -0.747 1.00 0.00 C ATOM 492 OE1 GLN p 30 18.230 -2.801 -1.267 1.00 0.00 O ATOM 493 NE2 GLN p 30 18.549 -4.863 -0.441 1.00 0.00 N ATOM 0 H GLN p 30 13.259 -5.524 -1.182 1.00 0.00 H new ATOM 0 HA GLN p 30 15.558 -6.380 -2.620 1.00 0.00 H new ATOM 0 HB2 GLN p 30 15.963 -4.192 -2.514 1.00 0.00 H new ATOM 0 HB3 GLN p 30 14.501 -4.013 -1.564 1.00 0.00 H new ATOM 0 HG2 GLN p 30 15.920 -2.964 -0.135 1.00 0.00 H new ATOM 0 HG3 GLN p 30 16.182 -4.596 0.448 1.00 0.00 H new ATOM 0 HE21 GLN p 30 18.138 -5.691 -0.011 1.00 0.00 H new ATOM 0 HE22 GLN p 30 19.550 -4.833 -0.636 1.00 0.00 H new ATOM 502 N ALA p 31 15.655 -6.846 0.596 1.00 0.00 N ATOM 503 CA ALA p 31 16.345 -7.526 1.702 1.00 0.00 C ATOM 504 C ALA p 31 16.204 -9.054 1.623 1.00 0.00 C ATOM 505 O ALA p 31 16.942 -9.784 2.292 1.00 0.00 O ATOM 506 CB ALA p 31 15.816 -7.021 3.036 1.00 0.00 C ATOM 0 H ALA p 31 14.760 -6.435 0.863 1.00 0.00 H new ATOM 0 HA ALA p 31 17.406 -7.292 1.616 1.00 0.00 H new ATOM 0 HB1 ALA p 31 16.333 -7.531 3.849 1.00 0.00 H new ATOM 0 HB2 ALA p 31 15.988 -5.947 3.113 1.00 0.00 H new ATOM 0 HB3 ALA p 31 14.747 -7.223 3.103 1.00 0.00 H new ATOM 512 N TRP p 32 15.254 -9.522 0.802 1.00 0.00 N ATOM 513 CA TRP p 32 15.005 -10.956 0.620 1.00 0.00 C ATOM 514 C TRP p 32 15.779 -11.505 -0.587 1.00 0.00 C ATOM 515 O TRP p 32 16.063 -12.704 -0.653 1.00 0.00 O ATOM 516 CB TRP p 32 13.504 -11.211 0.437 1.00 0.00 C ATOM 517 CG TRP p 32 13.062 -12.584 0.868 1.00 0.00 C ATOM 518 CD1 TRP p 32 13.143 -13.733 0.135 1.00 0.00 C ATOM 519 CD2 TRP p 32 12.469 -12.951 2.125 1.00 0.00 C ATOM 520 NE1 TRP p 32 12.641 -14.790 0.855 1.00 0.00 N ATOM 521 CE2 TRP p 32 12.220 -14.337 2.077 1.00 0.00 C ATOM 522 CE3 TRP p 32 12.123 -12.246 3.285 1.00 0.00 C ATOM 523 CZ2 TRP p 32 11.647 -15.028 3.142 1.00 0.00 C ATOM 524 CZ3 TRP p 32 11.553 -12.934 4.339 1.00 0.00 C ATOM 525 CH2 TRP p 32 11.320 -14.313 4.261 1.00 0.00 C ATOM 0 H TRP p 32 14.642 -8.922 0.250 1.00 0.00 H new ATOM 0 HA TRP p 32 15.354 -11.475 1.513 1.00 0.00 H new ATOM 0 HB2 TRP p 32 12.947 -10.466 1.005 1.00 0.00 H new ATOM 0 HB3 TRP p 32 13.247 -11.070 -0.613 1.00 0.00 H new ATOM 0 HD1 TRP p 32 13.544 -13.801 -0.866 1.00 0.00 H new ATOM 0 HE1 TRP p 32 12.590 -15.756 0.532 1.00 0.00 H new ATOM 0 HE3 TRP p 32 12.299 -11.183 3.354 1.00 0.00 H new ATOM 0 HZ2 TRP p 32 11.467 -16.091 3.086 1.00 0.00 H new ATOM 0 HZ3 TRP p 32 11.283 -12.400 5.238 1.00 0.00 H new ATOM 0 HH2 TRP p 32 10.873 -14.822 5.102 1.00 0.00 H new ATOM 536 N ASN p 33 16.116 -10.608 -1.542 1.00 0.00 N ATOM 537 CA ASN p 33 16.860 -10.954 -2.778 1.00 0.00 C ATOM 538 C ASN p 33 16.072 -11.922 -3.667 1.00 0.00 C ATOM 539 O ASN p 33 15.769 -13.049 -3.261 1.00 0.00 O ATOM 540 CB ASN p 33 18.253 -11.535 -2.467 1.00 0.00 C ATOM 541 CG ASN p 33 19.188 -10.513 -1.847 1.00 0.00 C ATOM 542 OD1 ASN p 33 19.239 -10.361 -0.627 1.00 0.00 O ATOM 543 ND2 ASN p 33 19.931 -9.804 -2.689 1.00 0.00 N ATOM 0 H ASN p 33 15.879 -9.618 -1.478 1.00 0.00 H new ATOM 0 HA ASN p 33 16.994 -10.021 -3.325 1.00 0.00 H new ATOM 0 HB2 ASN p 33 18.146 -12.382 -1.789 1.00 0.00 H new ATOM 0 HB3 ASN p 33 18.697 -11.917 -3.387 1.00 0.00 H new ATOM 0 HD21 ASN p 33 20.576 -9.100 -2.331 1.00 0.00 H new ATOM 0 HD22 ASN p 33 19.856 -9.963 -3.694 1.00 0.00 H new ATOM 550 N CYS p 34 15.743 -11.459 -4.878 1.00 0.00 N ATOM 551 CA CYS p 34 14.991 -12.260 -5.845 1.00 0.00 C ATOM 552 C CYS p 34 15.662 -12.226 -7.215 1.00 0.00 C ATOM 553 O CYS p 34 16.252 -11.212 -7.596 1.00 0.00 O ATOM 554 CB CYS p 34 13.553 -11.749 -5.957 1.00 0.00 C ATOM 555 SG CYS p 34 12.625 -11.816 -4.407 1.00 0.00 S ATOM 0 H CYS p 34 15.989 -10.527 -5.211 1.00 0.00 H new ATOM 0 HA CYS p 34 14.975 -13.291 -5.491 1.00 0.00 H new ATOM 0 HB2 CYS p 34 13.571 -10.719 -6.313 1.00 0.00 H new ATOM 0 HB3 CYS p 34 13.027 -12.337 -6.709 1.00 0.00 H new ATOM 0 HG CYS p 34 11.423 -11.362 -4.601 1.00 0.00 H new ATOM 561 N ILE p 35 15.557 -13.354 -7.949 1.00 0.00 N ATOM 562 CA ILE p 35 16.138 -13.537 -9.311 1.00 0.00 C ATOM 563 C ILE p 35 17.582 -12.995 -9.455 1.00 0.00 C ATOM 564 O ILE p 35 17.986 -12.535 -10.530 1.00 0.00 O ATOM 565 CB ILE p 35 15.217 -12.972 -10.456 1.00 0.00 C ATOM 566 CG1 ILE p 35 14.775 -11.512 -10.228 1.00 0.00 C ATOM 567 CG2 ILE p 35 13.995 -13.861 -10.631 1.00 0.00 C ATOM 568 CD1 ILE p 35 15.725 -10.483 -10.807 1.00 0.00 C ATOM 0 H ILE p 35 15.060 -14.180 -7.614 1.00 0.00 H new ATOM 0 HA ILE p 35 16.193 -14.619 -9.432 1.00 0.00 H new ATOM 0 HB ILE p 35 15.820 -12.976 -11.364 1.00 0.00 H new ATOM 0 HG12 ILE p 35 13.788 -11.369 -10.668 1.00 0.00 H new ATOM 0 HG13 ILE p 35 14.674 -11.337 -9.157 1.00 0.00 H new ATOM 0 HG21 ILE p 35 13.365 -13.461 -11.425 1.00 0.00 H new ATOM 0 HG22 ILE p 35 14.314 -14.870 -10.894 1.00 0.00 H new ATOM 0 HG23 ILE p 35 13.430 -13.890 -9.699 1.00 0.00 H new ATOM 0 HD11 ILE p 35 15.344 -9.482 -10.605 1.00 0.00 H new ATOM 0 HD12 ILE p 35 16.708 -10.597 -10.349 1.00 0.00 H new ATOM 0 HD13 ILE p 35 15.808 -10.629 -11.884 1.00 0.00 H new ATOM 580 N CYS p 36 18.353 -13.083 -8.364 1.00 0.00 N ATOM 581 CA CYS p 36 19.741 -12.615 -8.345 1.00 0.00 C ATOM 582 C CYS p 36 20.703 -13.752 -7.992 1.00 0.00 C ATOM 583 O CYS p 36 21.769 -13.877 -8.603 1.00 0.00 O ATOM 584 CB CYS p 36 19.900 -11.462 -7.349 1.00 0.00 C ATOM 585 SG CYS p 36 18.903 -10.006 -7.740 1.00 0.00 S ATOM 0 H CYS p 36 18.035 -13.477 -7.479 1.00 0.00 H new ATOM 0 HA CYS p 36 19.989 -12.258 -9.345 1.00 0.00 H new ATOM 0 HB2 CYS p 36 19.632 -11.816 -6.354 1.00 0.00 H new ATOM 0 HB3 CYS p 36 20.950 -11.171 -7.311 1.00 0.00 H new ATOM 0 HG CYS p 36 17.701 -10.378 -8.065 1.00 0.00 H new ATOM 591 N ASP p 37 20.317 -14.571 -7.005 1.00 0.00 N ATOM 592 CA ASP p 37 21.136 -15.702 -6.562 1.00 0.00 C ATOM 593 C ASP p 37 20.331 -16.998 -6.581 1.00 0.00 C ATOM 594 O ASP p 37 19.107 -16.981 -6.413 1.00 0.00 O ATOM 595 CB ASP p 37 21.687 -15.448 -5.155 1.00 0.00 C ATOM 596 CG ASP p 37 22.722 -14.338 -5.123 1.00 0.00 C ATOM 597 OD1 ASP p 37 22.329 -13.166 -4.944 1.00 0.00 O ATOM 598 OD2 ASP p 37 23.923 -14.642 -5.276 1.00 0.00 O ATOM 0 H ASP p 37 19.438 -14.469 -6.497 1.00 0.00 H new ATOM 0 HA ASP p 37 21.971 -15.804 -7.255 1.00 0.00 H new ATOM 0 HB2 ASP p 37 20.864 -15.191 -4.488 1.00 0.00 H new ATOM 0 HB3 ASP p 37 22.133 -16.366 -4.773 1.00 0.00 H new ATOM 603 N ILE p 38 21.032 -18.117 -6.785 1.00 0.00 N ATOM 604 CA ILE p 38 20.402 -19.444 -6.834 1.00 0.00 C ATOM 605 C ILE p 38 20.803 -20.321 -5.640 1.00 0.00 C ATOM 606 O ILE p 38 20.026 -21.178 -5.212 1.00 0.00 O ATOM 607 CB ILE p 38 20.710 -20.204 -8.162 1.00 0.00 C ATOM 608 CG1 ILE p 38 22.146 -19.952 -8.677 1.00 0.00 C ATOM 609 CG2 ILE p 38 19.700 -19.813 -9.229 1.00 0.00 C ATOM 610 CD1 ILE p 38 23.207 -20.806 -8.011 1.00 0.00 C ATOM 0 H ILE p 38 22.043 -18.132 -6.920 1.00 0.00 H new ATOM 0 HA ILE p 38 19.329 -19.256 -6.786 1.00 0.00 H new ATOM 0 HB ILE p 38 20.631 -21.269 -7.946 1.00 0.00 H new ATOM 0 HG12 ILE p 38 22.171 -20.134 -9.751 1.00 0.00 H new ATOM 0 HG13 ILE p 38 22.394 -18.901 -8.526 1.00 0.00 H new ATOM 0 HG21 ILE p 38 19.921 -20.347 -10.153 1.00 0.00 H new ATOM 0 HG22 ILE p 38 18.696 -20.071 -8.892 1.00 0.00 H new ATOM 0 HG23 ILE p 38 19.757 -18.739 -9.408 1.00 0.00 H new ATOM 0 HD11 ILE p 38 24.184 -20.566 -8.431 1.00 0.00 H new ATOM 0 HD12 ILE p 38 23.214 -20.608 -6.939 1.00 0.00 H new ATOM 0 HD13 ILE p 38 22.987 -21.860 -8.184 1.00 0.00 H new ATOM 622 N GLU p 39 22.016 -20.098 -5.113 1.00 0.00 N ATOM 623 CA GLU p 39 22.527 -20.866 -3.970 1.00 0.00 C ATOM 624 C GLU p 39 22.227 -20.179 -2.631 1.00 0.00 C ATOM 625 O GLU p 39 22.353 -20.804 -1.573 1.00 0.00 O ATOM 626 CB GLU p 39 24.037 -21.089 -4.114 1.00 0.00 C ATOM 627 CG GLU p 39 24.405 -22.286 -4.984 1.00 0.00 C ATOM 628 CD GLU p 39 24.379 -23.599 -4.220 1.00 0.00 C ATOM 629 OE1 GLU p 39 23.311 -24.244 -4.184 1.00 0.00 O ATOM 630 OE2 GLU p 39 25.429 -23.980 -3.659 1.00 0.00 O ATOM 0 H GLU p 39 22.662 -19.390 -5.462 1.00 0.00 H new ATOM 0 HA GLU p 39 22.013 -21.827 -3.971 1.00 0.00 H new ATOM 0 HB2 GLU p 39 24.488 -20.192 -4.538 1.00 0.00 H new ATOM 0 HB3 GLU p 39 24.470 -21.226 -3.123 1.00 0.00 H new ATOM 0 HG2 GLU p 39 23.713 -22.346 -5.824 1.00 0.00 H new ATOM 0 HG3 GLU p 39 25.400 -22.134 -5.402 1.00 0.00 H new ATOM 637 N ASN p 40 21.832 -18.900 -2.685 1.00 0.00 N ATOM 638 CA ASN p 40 21.515 -18.128 -1.477 1.00 0.00 C ATOM 639 C ASN p 40 20.018 -18.181 -1.158 1.00 0.00 C ATOM 640 O ASN p 40 19.634 -18.356 0.002 1.00 0.00 O ATOM 641 CB ASN p 40 21.968 -16.670 -1.631 1.00 0.00 C ATOM 642 CG ASN p 40 23.478 -16.527 -1.670 1.00 0.00 C ATOM 643 OD1 ASN p 40 24.089 -16.570 -2.739 1.00 0.00 O ATOM 644 ND2 ASN p 40 24.087 -16.353 -0.504 1.00 0.00 N ATOM 0 H ASN p 40 21.724 -18.378 -3.554 1.00 0.00 H new ATOM 0 HA ASN p 40 22.057 -18.581 -0.647 1.00 0.00 H new ATOM 0 HB2 ASN p 40 21.544 -16.257 -2.546 1.00 0.00 H new ATOM 0 HB3 ASN p 40 21.573 -16.082 -0.803 1.00 0.00 H new ATOM 0 HD21 ASN p 40 25.101 -16.249 -0.469 1.00 0.00 H new ATOM 0 HD22 ASN p 40 23.541 -16.324 0.357 1.00 0.00 H new ATOM 651 N CYS p 41 19.184 -18.030 -2.195 1.00 0.00 N ATOM 652 CA CYS p 41 17.730 -18.060 -2.039 1.00 0.00 C ATOM 653 C CYS p 41 17.166 -19.396 -2.518 1.00 0.00 C ATOM 654 O CYS p 41 17.397 -19.802 -3.661 1.00 0.00 O ATOM 655 CB CYS p 41 17.089 -16.905 -2.814 1.00 0.00 C ATOM 656 SG CYS p 41 15.306 -16.739 -2.558 1.00 0.00 S ATOM 0 H CYS p 41 19.497 -17.885 -3.155 1.00 0.00 H new ATOM 0 HA CYS p 41 17.494 -17.946 -0.981 1.00 0.00 H new ATOM 0 HB2 CYS p 41 17.575 -15.974 -2.523 1.00 0.00 H new ATOM 0 HB3 CYS p 41 17.280 -17.046 -3.878 1.00 0.00 H new ATOM 0 HG CYS p 41 14.859 -15.735 -3.253 1.00 0.00 H new ATOM 662 N SER p 42 16.430 -20.074 -1.629 1.00 0.00 N ATOM 663 CA SER p 42 15.825 -21.371 -1.942 1.00 0.00 C ATOM 664 C SER p 42 14.362 -21.431 -1.495 1.00 0.00 C ATOM 665 O SER p 42 13.501 -21.895 -2.247 1.00 0.00 O ATOM 666 CB SER p 42 16.624 -22.505 -1.285 1.00 0.00 C ATOM 667 OG SER p 42 16.773 -22.289 0.108 1.00 0.00 O ATOM 0 H SER p 42 16.239 -19.743 -0.683 1.00 0.00 H new ATOM 0 HA SER p 42 15.851 -21.495 -3.025 1.00 0.00 H new ATOM 0 HB2 SER p 42 16.119 -23.455 -1.456 1.00 0.00 H new ATOM 0 HB3 SER p 42 17.607 -22.578 -1.751 1.00 0.00 H new ATOM 0 HG SER p 42 17.284 -23.027 0.501 1.00 0.00 H new ATOM 673 N ASN p 43 14.088 -20.950 -0.258 1.00 0.00 N ATOM 674 CA ASN p 43 12.730 -20.938 0.343 1.00 0.00 C ATOM 675 C ASN p 43 12.186 -22.356 0.546 1.00 0.00 C ATOM 676 O ASN p 43 12.201 -23.172 -0.381 1.00 0.00 O ATOM 677 CB ASN p 43 11.737 -20.111 -0.495 1.00 0.00 C ATOM 678 CG ASN p 43 12.060 -18.629 -0.488 1.00 0.00 C ATOM 679 OD1 ASN p 43 11.587 -17.883 0.369 1.00 0.00 O ATOM 680 ND2 ASN p 43 12.868 -18.195 -1.447 1.00 0.00 N ATOM 0 H ASN p 43 14.804 -20.558 0.354 1.00 0.00 H new ATOM 0 HA ASN p 43 12.832 -20.464 1.319 1.00 0.00 H new ATOM 0 HB2 ASN p 43 11.743 -20.475 -1.522 1.00 0.00 H new ATOM 0 HB3 ASN p 43 10.729 -20.261 -0.109 1.00 0.00 H new ATOM 0 HD21 ASN p 43 13.120 -17.208 -1.494 1.00 0.00 H new ATOM 0 HD22 ASN p 43 13.237 -18.849 -2.137 1.00 0.00 H new ATOM 687 N MET p 44 11.705 -22.634 1.762 1.00 0.00 N ATOM 688 CA MET p 44 11.162 -23.954 2.100 1.00 0.00 C ATOM 689 C MET p 44 9.634 -23.995 1.947 1.00 0.00 C ATOM 690 O MET p 44 9.109 -24.832 1.207 1.00 0.00 O ATOM 691 CB MET p 44 11.599 -24.401 3.520 1.00 0.00 C ATOM 692 CG MET p 44 11.370 -23.382 4.641 1.00 0.00 C ATOM 693 SD MET p 44 12.512 -21.988 4.567 1.00 0.00 S ATOM 694 CE MET p 44 11.952 -21.017 5.965 1.00 0.00 C ATOM 0 H MET p 44 11.681 -21.962 2.529 1.00 0.00 H new ATOM 0 HA MET p 44 11.579 -24.666 1.388 1.00 0.00 H new ATOM 0 HB2 MET p 44 11.064 -25.317 3.773 1.00 0.00 H new ATOM 0 HB3 MET p 44 12.660 -24.649 3.492 1.00 0.00 H new ATOM 0 HG2 MET p 44 10.347 -23.010 4.584 1.00 0.00 H new ATOM 0 HG3 MET p 44 11.475 -23.880 5.605 1.00 0.00 H new ATOM 0 HE1 MET p 44 12.563 -20.118 6.052 1.00 0.00 H new ATOM 0 HE2 MET p 44 10.910 -20.735 5.818 1.00 0.00 H new ATOM 0 HE3 MET p 44 12.043 -21.607 6.877 1.00 0.00 H new ATOM 704 N ALA p 45 8.929 -23.091 2.651 1.00 0.00 N ATOM 705 CA ALA p 45 7.461 -23.022 2.600 1.00 0.00 C ATOM 706 C ALA p 45 6.954 -21.613 2.956 1.00 0.00 C ATOM 707 O ALA p 45 7.292 -21.102 4.029 1.00 0.00 O ATOM 708 CB ALA p 45 6.839 -24.050 3.547 1.00 0.00 C ATOM 0 H ALA p 45 9.356 -22.396 3.264 1.00 0.00 H new ATOM 0 HA ALA p 45 7.158 -23.249 1.578 1.00 0.00 H new ATOM 0 HB1 ALA p 45 5.752 -23.983 3.494 1.00 0.00 H new ATOM 0 HB2 ALA p 45 7.155 -25.052 3.255 1.00 0.00 H new ATOM 0 HB3 ALA p 45 7.166 -23.849 4.567 1.00 0.00 H new ATOM 714 N PRO p 46 6.140 -20.944 2.070 1.00 0.00 N ATOM 715 CA PRO p 46 5.591 -19.599 2.356 1.00 0.00 C ATOM 716 C PRO p 46 4.499 -19.639 3.432 1.00 0.00 C ATOM 717 O PRO p 46 3.989 -20.715 3.760 1.00 0.00 O ATOM 718 CB PRO p 46 4.990 -19.145 1.013 1.00 0.00 C ATOM 719 CG PRO p 46 5.466 -20.124 -0.006 1.00 0.00 C ATOM 720 CD PRO p 46 5.711 -21.409 0.730 1.00 0.00 C ATOM 0 HA PRO p 46 6.360 -18.927 2.738 1.00 0.00 H new ATOM 0 HB2 PRO p 46 3.901 -19.129 1.059 1.00 0.00 H new ATOM 0 HB3 PRO p 46 5.313 -18.134 0.763 1.00 0.00 H new ATOM 0 HG2 PRO p 46 4.723 -20.261 -0.791 1.00 0.00 H new ATOM 0 HG3 PRO p 46 6.378 -19.772 -0.488 1.00 0.00 H new ATOM 0 HD2 PRO p 46 4.811 -22.022 0.784 1.00 0.00 H new ATOM 0 HD3 PRO p 46 6.479 -22.012 0.246 1.00 0.00 H new ATOM 728 N LEU p 47 4.148 -18.464 3.974 1.00 0.00 N ATOM 729 CA LEU p 47 3.120 -18.367 5.016 1.00 0.00 C ATOM 730 C LEU p 47 1.721 -18.173 4.429 1.00 0.00 C ATOM 731 O LEU p 47 0.720 -18.317 5.137 1.00 0.00 O ATOM 732 CB LEU p 47 3.444 -17.211 5.970 1.00 0.00 C ATOM 733 CG LEU p 47 4.677 -17.410 6.865 1.00 0.00 C ATOM 734 CD1 LEU p 47 5.259 -16.066 7.272 1.00 0.00 C ATOM 735 CD2 LEU p 47 4.323 -18.226 8.104 1.00 0.00 C ATOM 0 H LEU p 47 4.561 -17.570 3.708 1.00 0.00 H new ATOM 0 HA LEU p 47 3.123 -19.310 5.562 1.00 0.00 H new ATOM 0 HB2 LEU p 47 3.589 -16.307 5.379 1.00 0.00 H new ATOM 0 HB3 LEU p 47 2.578 -17.038 6.609 1.00 0.00 H new ATOM 0 HG LEU p 47 5.425 -17.960 6.294 1.00 0.00 H new ATOM 0 HD11 LEU p 47 6.132 -16.224 7.906 1.00 0.00 H new ATOM 0 HD12 LEU p 47 5.553 -15.512 6.381 1.00 0.00 H new ATOM 0 HD13 LEU p 47 4.510 -15.497 7.822 1.00 0.00 H new ATOM 0 HD21 LEU p 47 5.212 -18.354 8.722 1.00 0.00 H new ATOM 0 HD22 LEU p 47 3.555 -17.705 8.676 1.00 0.00 H new ATOM 0 HD23 LEU p 47 3.948 -19.204 7.801 1.00 0.00 H new ATOM 747 N TYR p 48 1.665 -17.850 3.135 1.00 0.00 N ATOM 748 CA TYR p 48 0.397 -17.620 2.438 1.00 0.00 C ATOM 749 C TYR p 48 0.381 -18.370 1.100 1.00 0.00 C ATOM 750 O TYR p 48 -0.294 -19.396 0.968 1.00 0.00 O ATOM 751 CB TYR p 48 0.156 -16.105 2.217 1.00 0.00 C ATOM 752 CG TYR p 48 0.602 -15.218 3.369 1.00 0.00 C ATOM 753 CD1 TYR p 48 1.943 -14.888 3.532 1.00 0.00 C ATOM 754 CD2 TYR p 48 -0.311 -14.723 4.291 1.00 0.00 C ATOM 755 CE1 TYR p 48 2.362 -14.095 4.578 1.00 0.00 C ATOM 756 CE2 TYR p 48 0.100 -13.924 5.342 1.00 0.00 C ATOM 757 CZ TYR p 48 1.438 -13.614 5.481 1.00 0.00 C ATOM 758 OH TYR p 48 1.851 -12.820 6.527 1.00 0.00 O ATOM 0 H TYR p 48 2.490 -17.741 2.545 1.00 0.00 H new ATOM 0 HA TYR p 48 -0.411 -18.003 3.061 1.00 0.00 H new ATOM 0 HB2 TYR p 48 0.681 -15.795 1.313 1.00 0.00 H new ATOM 0 HB3 TYR p 48 -0.907 -15.942 2.040 1.00 0.00 H new ATOM 0 HD1 TYR p 48 2.670 -15.260 2.825 1.00 0.00 H new ATOM 0 HD2 TYR p 48 -1.358 -14.966 4.185 1.00 0.00 H new ATOM 0 HE1 TYR p 48 3.408 -13.852 4.690 1.00 0.00 H new ATOM 0 HE2 TYR p 48 -0.622 -13.545 6.050 1.00 0.00 H new ATOM 0 HH TYR p 48 1.076 -12.565 7.070 1.00 0.00 H new ATOM 768 N SER p 49 1.132 -17.846 0.112 1.00 0.00 N ATOM 769 CA SER p 49 1.232 -18.442 -1.230 1.00 0.00 C ATOM 770 C SER p 49 2.471 -17.907 -1.960 1.00 0.00 C ATOM 771 O SER p 49 3.152 -17.005 -1.460 1.00 0.00 O ATOM 772 CB SER p 49 -0.033 -18.141 -2.060 1.00 0.00 C ATOM 773 OG SER p 49 -1.180 -18.742 -1.484 1.00 0.00 O ATOM 0 H SER p 49 1.686 -16.997 0.224 1.00 0.00 H new ATOM 0 HA SER p 49 1.324 -19.522 -1.114 1.00 0.00 H new ATOM 0 HB2 SER p 49 -0.179 -17.063 -2.127 1.00 0.00 H new ATOM 0 HB3 SER p 49 0.101 -18.508 -3.078 1.00 0.00 H new ATOM 0 HG SER p 49 -0.912 -19.289 -0.716 1.00 0.00 H new ATOM 779 N ASP p 50 2.754 -18.470 -3.147 1.00 0.00 N ATOM 780 CA ASP p 50 3.900 -18.050 -3.970 1.00 0.00 C ATOM 781 C ASP p 50 3.575 -16.749 -4.719 1.00 0.00 C ATOM 782 O ASP p 50 4.448 -15.901 -4.918 1.00 0.00 O ATOM 783 CB ASP p 50 4.269 -19.158 -4.965 1.00 0.00 C ATOM 784 CG ASP p 50 5.723 -19.101 -5.397 1.00 0.00 C ATOM 785 OD1 ASP p 50 6.569 -19.719 -4.719 1.00 0.00 O ATOM 786 OD2 ASP p 50 6.015 -18.436 -6.414 1.00 0.00 O ATOM 0 H ASP p 50 2.201 -19.221 -3.559 1.00 0.00 H new ATOM 0 HA ASP p 50 4.752 -17.868 -3.314 1.00 0.00 H new ATOM 0 HB2 ASP p 50 4.067 -20.129 -4.512 1.00 0.00 H new ATOM 0 HB3 ASP p 50 3.630 -19.078 -5.844 1.00 0.00 H new ATOM 791 N GLN p 51 2.306 -16.620 -5.123 1.00 0.00 N ATOM 792 CA GLN p 51 1.806 -15.434 -5.829 1.00 0.00 C ATOM 793 C GLN p 51 1.232 -14.405 -4.839 1.00 0.00 C ATOM 794 O GLN p 51 0.919 -13.278 -5.220 1.00 0.00 O ATOM 795 CB GLN p 51 0.751 -15.821 -6.896 1.00 0.00 C ATOM 796 CG GLN p 51 -0.421 -16.675 -6.395 1.00 0.00 C ATOM 797 CD GLN p 51 -0.088 -18.154 -6.330 1.00 0.00 C ATOM 798 OE1 GLN p 51 0.381 -18.653 -5.307 1.00 0.00 O ATOM 799 NE2 GLN p 51 -0.329 -18.863 -7.427 1.00 0.00 N ATOM 0 H GLN p 51 1.596 -17.336 -4.970 1.00 0.00 H new ATOM 0 HA GLN p 51 2.649 -14.974 -6.344 1.00 0.00 H new ATOM 0 HB2 GLN p 51 0.349 -14.906 -7.332 1.00 0.00 H new ATOM 0 HB3 GLN p 51 1.254 -16.362 -7.698 1.00 0.00 H new ATOM 0 HG2 GLN p 51 -0.718 -16.331 -5.404 1.00 0.00 H new ATOM 0 HG3 GLN p 51 -1.278 -16.529 -7.053 1.00 0.00 H new ATOM 0 HE21 GLN p 51 -0.719 -18.408 -8.253 1.00 0.00 H new ATOM 0 HE22 GLN p 51 -0.125 -19.862 -7.444 1.00 0.00 H new ATOM 808 N ALA p 52 1.117 -14.825 -3.560 1.00 0.00 N ATOM 809 CA ALA p 52 0.577 -14.012 -2.441 1.00 0.00 C ATOM 810 C ALA p 52 1.174 -12.589 -2.317 1.00 0.00 C ATOM 811 O ALA p 52 0.733 -11.805 -1.484 1.00 0.00 O ATOM 812 CB ALA p 52 0.774 -14.775 -1.134 1.00 0.00 C ATOM 0 H ALA p 52 1.403 -15.759 -3.267 1.00 0.00 H new ATOM 0 HA ALA p 52 -0.479 -13.858 -2.661 1.00 0.00 H new ATOM 0 HB1 ALA p 52 0.380 -14.186 -0.306 1.00 0.00 H new ATOM 0 HB2 ALA p 52 0.246 -15.727 -1.185 1.00 0.00 H new ATOM 0 HB3 ALA p 52 1.837 -14.958 -0.976 1.00 0.00 H new ATOM 818 N LEU p 53 2.192 -12.290 -3.121 1.00 0.00 N ATOM 819 CA LEU p 53 2.857 -11.003 -3.139 1.00 0.00 C ATOM 820 C LEU p 53 2.231 -10.136 -4.223 1.00 0.00 C ATOM 821 O LEU p 53 1.607 -9.114 -3.942 1.00 0.00 O ATOM 822 CB LEU p 53 4.346 -11.239 -3.398 1.00 0.00 C ATOM 823 CG LEU p 53 5.280 -10.072 -3.120 1.00 0.00 C ATOM 824 CD1 LEU p 53 6.613 -10.625 -2.695 1.00 0.00 C ATOM 825 CD2 LEU p 53 5.431 -9.201 -4.358 1.00 0.00 C ATOM 0 H LEU p 53 2.581 -12.955 -3.790 1.00 0.00 H new ATOM 0 HA LEU p 53 2.744 -10.484 -2.187 1.00 0.00 H new ATOM 0 HB2 LEU p 53 4.667 -12.085 -2.790 1.00 0.00 H new ATOM 0 HB3 LEU p 53 4.468 -11.532 -4.441 1.00 0.00 H new ATOM 0 HG LEU p 53 4.868 -9.447 -2.327 1.00 0.00 H new ATOM 0 HD11 LEU p 53 7.299 -9.803 -2.490 1.00 0.00 H new ATOM 0 HD12 LEU p 53 6.487 -11.226 -1.794 1.00 0.00 H new ATOM 0 HD13 LEU p 53 7.020 -11.247 -3.492 1.00 0.00 H new ATOM 0 HD21 LEU p 53 6.103 -8.371 -4.139 1.00 0.00 H new ATOM 0 HD22 LEU p 53 5.842 -9.796 -5.173 1.00 0.00 H new ATOM 0 HD23 LEU p 53 4.456 -8.811 -4.650 1.00 0.00 H new ATOM 837 N LYS p 54 2.412 -10.594 -5.464 1.00 0.00 N ATOM 838 CA LYS p 54 1.866 -9.945 -6.673 1.00 0.00 C ATOM 839 C LYS p 54 0.329 -10.005 -6.695 1.00 0.00 C ATOM 840 O LYS p 54 -0.317 -9.347 -7.508 1.00 0.00 O ATOM 841 CB LYS p 54 2.422 -10.621 -7.930 1.00 0.00 C ATOM 842 CG LYS p 54 3.882 -10.294 -8.212 1.00 0.00 C ATOM 843 CD LYS p 54 4.371 -10.976 -9.479 1.00 0.00 C ATOM 844 CE LYS p 54 5.818 -10.621 -9.779 1.00 0.00 C ATOM 845 NZ LYS p 54 6.304 -11.270 -11.027 1.00 0.00 N ATOM 0 H LYS p 54 2.948 -11.437 -5.667 1.00 0.00 H new ATOM 0 HA LYS p 54 2.169 -8.898 -6.654 1.00 0.00 H new ATOM 0 HB2 LYS p 54 2.315 -11.701 -7.827 1.00 0.00 H new ATOM 0 HB3 LYS p 54 1.820 -10.321 -8.788 1.00 0.00 H new ATOM 0 HG2 LYS p 54 4.002 -9.215 -8.309 1.00 0.00 H new ATOM 0 HG3 LYS p 54 4.496 -10.609 -7.368 1.00 0.00 H new ATOM 0 HD2 LYS p 54 4.275 -12.056 -9.372 1.00 0.00 H new ATOM 0 HD3 LYS p 54 3.741 -10.681 -10.318 1.00 0.00 H new ATOM 0 HE2 LYS p 54 5.914 -9.539 -9.872 1.00 0.00 H new ATOM 0 HE3 LYS p 54 6.447 -10.926 -8.943 1.00 0.00 H new ATOM 0 HZ1 LYS p 54 7.295 -11.002 -11.195 1.00 0.00 H new ATOM 0 HZ2 LYS p 54 6.237 -12.303 -10.930 1.00 0.00 H new ATOM 0 HZ3 LYS p 54 5.721 -10.959 -11.830 1.00 0.00 H new ATOM 859 N LYS p 55 -0.217 -10.816 -5.782 1.00 0.00 N ATOM 860 CA LYS p 55 -1.642 -11.019 -5.604 1.00 0.00 C ATOM 861 C LYS p 55 -2.142 -10.098 -4.511 1.00 0.00 C ATOM 862 O LYS p 55 -3.219 -9.515 -4.624 1.00 0.00 O ATOM 863 CB LYS p 55 -1.932 -12.479 -5.256 1.00 0.00 C ATOM 864 CG LYS p 55 -2.258 -13.349 -6.463 1.00 0.00 C ATOM 865 CD LYS p 55 -3.752 -13.355 -6.772 1.00 0.00 C ATOM 866 CE LYS p 55 -4.071 -14.200 -7.999 1.00 0.00 C ATOM 867 NZ LYS p 55 -3.950 -15.660 -7.723 1.00 0.00 N ATOM 0 H LYS p 55 0.347 -11.362 -5.131 1.00 0.00 H new ATOM 0 HA LYS p 55 -2.162 -10.786 -6.533 1.00 0.00 H new ATOM 0 HB2 LYS p 55 -1.067 -12.898 -4.741 1.00 0.00 H new ATOM 0 HB3 LYS p 55 -2.768 -12.516 -4.557 1.00 0.00 H new ATOM 0 HG2 LYS p 55 -1.709 -12.986 -7.332 1.00 0.00 H new ATOM 0 HG3 LYS p 55 -1.921 -14.369 -6.277 1.00 0.00 H new ATOM 0 HD2 LYS p 55 -4.300 -13.741 -5.912 1.00 0.00 H new ATOM 0 HD3 LYS p 55 -4.094 -12.333 -6.935 1.00 0.00 H new ATOM 0 HE2 LYS p 55 -5.083 -13.978 -8.338 1.00 0.00 H new ATOM 0 HE3 LYS p 55 -3.396 -13.928 -8.811 1.00 0.00 H new ATOM 0 HZ1 LYS p 55 -3.405 -16.113 -8.484 1.00 0.00 H new ATOM 0 HZ2 LYS p 55 -3.462 -15.803 -6.816 1.00 0.00 H new ATOM 0 HZ3 LYS p 55 -4.898 -16.084 -7.677 1.00 0.00 H new ATOM 881 N LYS p 56 -1.331 -9.985 -3.444 1.00 0.00 N ATOM 882 CA LYS p 56 -1.640 -9.073 -2.319 1.00 0.00 C ATOM 883 C LYS p 56 -1.346 -7.628 -2.738 1.00 0.00 C ATOM 884 O LYS p 56 -1.725 -6.668 -2.066 1.00 0.00 O ATOM 885 CB LYS p 56 -0.840 -9.425 -1.070 1.00 0.00 C ATOM 886 CG LYS p 56 -1.529 -10.453 -0.187 1.00 0.00 C ATOM 887 CD LYS p 56 -0.785 -10.655 1.126 1.00 0.00 C ATOM 888 CE LYS p 56 -1.471 -11.685 2.012 1.00 0.00 C ATOM 889 NZ LYS p 56 -2.727 -11.161 2.620 1.00 0.00 N ATOM 0 H LYS p 56 -0.462 -10.508 -3.334 1.00 0.00 H new ATOM 0 HA LYS p 56 -2.697 -9.182 -2.075 1.00 0.00 H new ATOM 0 HB2 LYS p 56 0.136 -9.807 -1.368 1.00 0.00 H new ATOM 0 HB3 LYS p 56 -0.664 -8.518 -0.491 1.00 0.00 H new ATOM 0 HG2 LYS p 56 -2.550 -10.131 0.019 1.00 0.00 H new ATOM 0 HG3 LYS p 56 -1.596 -11.403 -0.718 1.00 0.00 H new ATOM 0 HD2 LYS p 56 0.236 -10.976 0.920 1.00 0.00 H new ATOM 0 HD3 LYS p 56 -0.720 -9.705 1.657 1.00 0.00 H new ATOM 0 HE2 LYS p 56 -1.698 -12.574 1.423 1.00 0.00 H new ATOM 0 HE3 LYS p 56 -0.788 -11.993 2.803 1.00 0.00 H new ATOM 0 HZ1 LYS p 56 -3.158 -11.897 3.214 1.00 0.00 H new ATOM 0 HZ2 LYS p 56 -2.509 -10.328 3.204 1.00 0.00 H new ATOM 0 HZ3 LYS p 56 -3.391 -10.891 1.867 1.00 0.00 H new ATOM 903 N LEU p 57 -0.653 -7.538 -3.874 1.00 0.00 N ATOM 904 CA LEU p 57 -0.260 -6.312 -4.532 1.00 0.00 C ATOM 905 C LEU p 57 -1.323 -5.978 -5.535 1.00 0.00 C ATOM 906 O LEU p 57 -1.698 -4.824 -5.729 1.00 0.00 O ATOM 907 CB LEU p 57 1.093 -6.496 -5.246 1.00 0.00 C ATOM 908 CG LEU p 57 2.269 -5.724 -4.654 1.00 0.00 C ATOM 909 CD1 LEU p 57 1.916 -4.254 -4.567 1.00 0.00 C ATOM 910 CD2 LEU p 57 2.634 -6.294 -3.294 1.00 0.00 C ATOM 0 H LEU p 57 -0.339 -8.367 -4.378 1.00 0.00 H new ATOM 0 HA LEU p 57 -0.149 -5.510 -3.802 1.00 0.00 H new ATOM 0 HB2 LEU p 57 1.342 -7.557 -5.244 1.00 0.00 H new ATOM 0 HB3 LEU p 57 0.976 -6.198 -6.288 1.00 0.00 H new ATOM 0 HG LEU p 57 3.141 -5.827 -5.299 1.00 0.00 H new ATOM 0 HD11 LEU p 57 2.756 -3.703 -4.144 1.00 0.00 H new ATOM 0 HD12 LEU p 57 1.697 -3.873 -5.564 1.00 0.00 H new ATOM 0 HD13 LEU p 57 1.041 -4.127 -3.930 1.00 0.00 H new ATOM 0 HD21 LEU p 57 3.474 -5.737 -2.880 1.00 0.00 H new ATOM 0 HD22 LEU p 57 1.778 -6.212 -2.624 1.00 0.00 H new ATOM 0 HD23 LEU p 57 2.912 -7.342 -3.402 1.00 0.00 H new ATOM 922 N ALA p 58 -1.775 -7.052 -6.180 1.00 0.00 N ATOM 923 CA ALA p 58 -2.882 -6.989 -7.158 1.00 0.00 C ATOM 924 C ALA p 58 -4.195 -6.709 -6.426 1.00 0.00 C ATOM 925 O ALA p 58 -5.188 -6.287 -7.024 1.00 0.00 O ATOM 926 CB ALA p 58 -2.990 -8.277 -7.959 1.00 0.00 C ATOM 0 H ALA p 58 -1.393 -7.989 -6.047 1.00 0.00 H new ATOM 0 HA ALA p 58 -2.675 -6.181 -7.860 1.00 0.00 H new ATOM 0 HB1 ALA p 58 -3.814 -8.196 -8.668 1.00 0.00 H new ATOM 0 HB2 ALA p 58 -2.060 -8.447 -8.501 1.00 0.00 H new ATOM 0 HB3 ALA p 58 -3.174 -9.112 -7.283 1.00 0.00 H new ATOM 932 N GLN p 59 -4.156 -6.965 -5.114 1.00 0.00 N ATOM 933 CA GLN p 59 -5.243 -6.737 -4.202 1.00 0.00 C ATOM 934 C GLN p 59 -5.049 -5.359 -3.569 1.00 0.00 C ATOM 935 O GLN p 59 -5.994 -4.742 -3.100 1.00 0.00 O ATOM 936 CB GLN p 59 -5.214 -7.853 -3.155 1.00 0.00 C ATOM 937 CG GLN p 59 -5.941 -7.535 -1.870 1.00 0.00 C ATOM 938 CD GLN p 59 -6.948 -8.598 -1.475 1.00 0.00 C ATOM 939 OE1 GLN p 59 -6.618 -9.547 -0.764 1.00 0.00 O ATOM 940 NE2 GLN p 59 -8.184 -8.443 -1.933 1.00 0.00 N ATOM 0 H GLN p 59 -3.329 -7.350 -4.658 1.00 0.00 H new ATOM 0 HA GLN p 59 -6.212 -6.752 -4.700 1.00 0.00 H new ATOM 0 HB2 GLN p 59 -5.651 -8.752 -3.590 1.00 0.00 H new ATOM 0 HB3 GLN p 59 -4.175 -8.085 -2.920 1.00 0.00 H new ATOM 0 HG2 GLN p 59 -5.213 -7.417 -1.068 1.00 0.00 H new ATOM 0 HG3 GLN p 59 -6.454 -6.579 -1.977 1.00 0.00 H new ATOM 0 HE21 GLN p 59 -8.414 -7.641 -2.520 1.00 0.00 H new ATOM 0 HE22 GLN p 59 -8.904 -9.126 -1.698 1.00 0.00 H new ATOM 949 N LEU p 60 -3.784 -4.930 -3.566 1.00 0.00 N ATOM 950 CA LEU p 60 -3.352 -3.630 -3.045 1.00 0.00 C ATOM 951 C LEU p 60 -3.473 -2.567 -4.148 1.00 0.00 C ATOM 952 O LEU p 60 -3.406 -1.368 -3.897 1.00 0.00 O ATOM 953 CB LEU p 60 -1.898 -3.735 -2.544 1.00 0.00 C ATOM 954 CG LEU p 60 -1.319 -2.529 -1.775 1.00 0.00 C ATOM 955 CD1 LEU p 60 -0.547 -1.642 -2.732 1.00 0.00 C ATOM 956 CD2 LEU p 60 -2.416 -1.737 -1.079 1.00 0.00 C ATOM 0 H LEU p 60 -3.014 -5.489 -3.934 1.00 0.00 H new ATOM 0 HA LEU p 60 -3.988 -3.336 -2.210 1.00 0.00 H new ATOM 0 HB2 LEU p 60 -1.827 -4.610 -1.898 1.00 0.00 H new ATOM 0 HB3 LEU p 60 -1.258 -3.922 -3.406 1.00 0.00 H new ATOM 0 HG LEU p 60 -0.645 -2.901 -1.003 1.00 0.00 H new ATOM 0 HD11 LEU p 60 -0.138 -0.790 -2.189 1.00 0.00 H new ATOM 0 HD12 LEU p 60 0.267 -2.212 -3.180 1.00 0.00 H new ATOM 0 HD13 LEU p 60 -1.215 -1.286 -3.517 1.00 0.00 H new ATOM 0 HD21 LEU p 60 -1.975 -0.895 -0.547 1.00 0.00 H new ATOM 0 HD22 LEU p 60 -3.124 -1.367 -1.821 1.00 0.00 H new ATOM 0 HD23 LEU p 60 -2.936 -2.381 -0.371 1.00 0.00 H new ATOM 968 N LYS p 61 -3.627 -3.081 -5.358 1.00 0.00 N ATOM 969 CA LYS p 61 -3.801 -2.332 -6.591 1.00 0.00 C ATOM 970 C LYS p 61 -5.290 -2.242 -6.835 1.00 0.00 C ATOM 971 O LYS p 61 -5.804 -1.287 -7.425 1.00 0.00 O ATOM 972 CB LYS p 61 -3.098 -3.058 -7.738 1.00 0.00 C ATOM 973 CG LYS p 61 -1.759 -2.451 -8.129 1.00 0.00 C ATOM 974 CD LYS p 61 -1.906 -1.429 -9.251 1.00 0.00 C ATOM 975 CE LYS p 61 -0.568 -0.802 -9.621 1.00 0.00 C ATOM 976 NZ LYS p 61 0.302 -1.740 -10.385 1.00 0.00 N ATOM 0 H LYS p 61 -3.634 -4.089 -5.514 1.00 0.00 H new ATOM 0 HA LYS p 61 -3.367 -1.335 -6.523 1.00 0.00 H new ATOM 0 HB2 LYS p 61 -2.944 -4.099 -7.455 1.00 0.00 H new ATOM 0 HB3 LYS p 61 -3.753 -3.058 -8.609 1.00 0.00 H new ATOM 0 HG2 LYS p 61 -1.309 -1.973 -7.259 1.00 0.00 H new ATOM 0 HG3 LYS p 61 -1.080 -3.243 -8.445 1.00 0.00 H new ATOM 0 HD2 LYS p 61 -2.337 -1.911 -10.128 1.00 0.00 H new ATOM 0 HD3 LYS p 61 -2.601 -0.648 -8.943 1.00 0.00 H new ATOM 0 HE2 LYS p 61 -0.741 0.095 -10.215 1.00 0.00 H new ATOM 0 HE3 LYS p 61 -0.052 -0.489 -8.713 1.00 0.00 H new ATOM 0 HZ1 LYS p 61 1.201 -1.270 -10.615 1.00 0.00 H new ATOM 0 HZ2 LYS p 61 0.490 -2.586 -9.810 1.00 0.00 H new ATOM 0 HZ3 LYS p 61 -0.177 -2.020 -11.265 1.00 0.00 H new ATOM 990 N TRP p 62 -5.956 -3.296 -6.348 1.00 0.00 N ATOM 991 CA TRP p 62 -7.401 -3.418 -6.375 1.00 0.00 C ATOM 992 C TRP p 62 -7.940 -2.660 -5.180 1.00 0.00 C ATOM 993 O TRP p 62 -9.049 -2.126 -5.215 1.00 0.00 O ATOM 994 CB TRP p 62 -7.828 -4.884 -6.320 1.00 0.00 C ATOM 995 CG TRP p 62 -8.839 -5.250 -7.368 1.00 0.00 C ATOM 996 CD1 TRP p 62 -8.582 -5.804 -8.589 1.00 0.00 C ATOM 997 CD2 TRP p 62 -10.265 -5.086 -7.294 1.00 0.00 C ATOM 998 NE1 TRP p 62 -9.754 -5.996 -9.277 1.00 0.00 N ATOM 999 CE2 TRP p 62 -10.801 -5.565 -8.505 1.00 0.00 C ATOM 1000 CE3 TRP p 62 -11.143 -4.584 -6.322 1.00 0.00 C ATOM 1001 CZ2 TRP p 62 -12.168 -5.556 -8.771 1.00 0.00 C ATOM 1002 CZ3 TRP p 62 -12.500 -4.577 -6.590 1.00 0.00 C ATOM 1003 CH2 TRP p 62 -13.000 -5.060 -7.805 1.00 0.00 C ATOM 0 H TRP p 62 -5.490 -4.096 -5.919 1.00 0.00 H new ATOM 0 HA TRP p 62 -7.798 -3.006 -7.303 1.00 0.00 H new ATOM 0 HB2 TRP p 62 -6.948 -5.516 -6.438 1.00 0.00 H new ATOM 0 HB3 TRP p 62 -8.243 -5.097 -5.335 1.00 0.00 H new ATOM 0 HD1 TRP p 62 -7.599 -6.055 -8.960 1.00 0.00 H new ATOM 0 HE1 TRP p 62 -9.833 -6.395 -10.212 1.00 0.00 H new ATOM 0 HE3 TRP p 62 -10.766 -4.210 -5.382 1.00 0.00 H new ATOM 0 HZ2 TRP p 62 -12.558 -5.928 -9.707 1.00 0.00 H new ATOM 0 HZ3 TRP p 62 -13.185 -4.192 -5.849 1.00 0.00 H new ATOM 0 HH2 TRP p 62 -14.065 -5.041 -7.984 1.00 0.00 H new ATOM 1014 N LYS p 63 -7.114 -2.635 -4.117 1.00 0.00 N ATOM 1015 CA LYS p 63 -7.436 -1.872 -2.897 1.00 0.00 C ATOM 1016 C LYS p 63 -6.984 -0.416 -3.066 1.00 0.00 C ATOM 1017 O LYS p 63 -7.352 0.457 -2.284 1.00 0.00 O ATOM 1018 CB LYS p 63 -6.783 -2.475 -1.652 1.00 0.00 C ATOM 1019 CG LYS p 63 -7.664 -3.474 -0.908 1.00 0.00 C ATOM 1020 CD LYS p 63 -8.578 -2.788 0.101 1.00 0.00 C ATOM 1021 CE LYS p 63 -9.454 -3.793 0.831 1.00 0.00 C ATOM 1022 NZ LYS p 63 -10.349 -3.133 1.822 1.00 0.00 N ATOM 0 H LYS p 63 -6.224 -3.131 -4.078 1.00 0.00 H new ATOM 0 HA LYS p 63 -8.516 -1.915 -2.755 1.00 0.00 H new ATOM 0 HB2 LYS p 63 -5.857 -2.971 -1.944 1.00 0.00 H new ATOM 0 HB3 LYS p 63 -6.511 -1.669 -0.971 1.00 0.00 H new ATOM 0 HG2 LYS p 63 -8.268 -4.029 -1.625 1.00 0.00 H new ATOM 0 HG3 LYS p 63 -7.034 -4.199 -0.392 1.00 0.00 H new ATOM 0 HD2 LYS p 63 -7.976 -2.236 0.823 1.00 0.00 H new ATOM 0 HD3 LYS p 63 -9.207 -2.060 -0.412 1.00 0.00 H new ATOM 0 HE2 LYS p 63 -10.056 -4.343 0.108 1.00 0.00 H new ATOM 0 HE3 LYS p 63 -8.823 -4.522 1.340 1.00 0.00 H new ATOM 0 HZ1 LYS p 63 -10.930 -3.852 2.298 1.00 0.00 H new ATOM 0 HZ2 LYS p 63 -9.774 -2.629 2.527 1.00 0.00 H new ATOM 0 HZ3 LYS p 63 -10.969 -2.456 1.333 1.00 0.00 H new ATOM 1036 N LEU p 64 -6.158 -0.207 -4.102 1.00 0.00 N ATOM 1037 CA LEU p 64 -5.600 1.097 -4.492 1.00 0.00 C ATOM 1038 C LEU p 64 -6.608 1.881 -5.306 1.00 0.00 C ATOM 1039 O LEU p 64 -6.726 3.094 -5.223 1.00 0.00 O ATOM 1040 CB LEU p 64 -4.370 0.827 -5.358 1.00 0.00 C ATOM 1041 CG LEU p 64 -3.389 1.963 -5.547 1.00 0.00 C ATOM 1042 CD1 LEU p 64 -2.496 2.021 -4.341 1.00 0.00 C ATOM 1043 CD2 LEU p 64 -2.590 1.734 -6.812 1.00 0.00 C ATOM 0 H LEU p 64 -5.850 -0.965 -4.711 1.00 0.00 H new ATOM 0 HA LEU p 64 -5.346 1.675 -3.603 1.00 0.00 H new ATOM 0 HB2 LEU p 64 -3.831 -0.015 -4.924 1.00 0.00 H new ATOM 0 HB3 LEU p 64 -4.714 0.512 -6.343 1.00 0.00 H new ATOM 0 HG LEU p 64 -3.911 2.914 -5.649 1.00 0.00 H new ATOM 0 HD11 LEU p 64 -1.780 2.835 -4.457 1.00 0.00 H new ATOM 0 HD12 LEU p 64 -3.099 2.193 -3.450 1.00 0.00 H new ATOM 0 HD13 LEU p 64 -1.960 1.078 -4.240 1.00 0.00 H new ATOM 0 HD21 LEU p 64 -1.883 2.552 -6.949 1.00 0.00 H new ATOM 0 HD22 LEU p 64 -2.045 0.793 -6.733 1.00 0.00 H new ATOM 0 HD23 LEU p 64 -3.266 1.692 -7.666 1.00 0.00 H new ATOM 1055 N GLN p 65 -7.259 1.096 -6.116 1.00 0.00 N ATOM 1056 CA GLN p 65 -8.326 1.454 -7.020 1.00 0.00 C ATOM 1057 C GLN p 65 -9.610 1.523 -6.204 1.00 0.00 C ATOM 1058 O GLN p 65 -10.609 2.100 -6.618 1.00 0.00 O ATOM 1059 CB GLN p 65 -8.387 0.367 -8.102 1.00 0.00 C ATOM 1060 CG GLN p 65 -9.747 0.174 -8.738 1.00 0.00 C ATOM 1061 CD GLN p 65 -9.698 0.140 -10.253 1.00 0.00 C ATOM 1062 OE1 GLN p 65 -9.537 -0.920 -10.857 1.00 0.00 O ATOM 1063 NE2 GLN p 65 -9.837 1.305 -10.876 1.00 0.00 N ATOM 0 H GLN p 65 -7.041 0.101 -6.169 1.00 0.00 H new ATOM 0 HA GLN p 65 -8.174 2.419 -7.504 1.00 0.00 H new ATOM 0 HB2 GLN p 65 -7.668 0.613 -8.884 1.00 0.00 H new ATOM 0 HB3 GLN p 65 -8.070 -0.579 -7.664 1.00 0.00 H new ATOM 0 HG2 GLN p 65 -10.182 -0.757 -8.374 1.00 0.00 H new ATOM 0 HG3 GLN p 65 -10.407 0.981 -8.420 1.00 0.00 H new ATOM 0 HE21 GLN p 65 -9.968 2.160 -10.335 1.00 0.00 H new ATOM 0 HE22 GLN p 65 -9.812 1.345 -11.895 1.00 0.00 H new ATOM 1072 N ALA p 66 -9.510 0.898 -5.034 1.00 0.00 N ATOM 1073 CA ALA p 66 -10.573 0.842 -4.034 1.00 0.00 C ATOM 1074 C ALA p 66 -10.336 1.971 -3.061 1.00 0.00 C ATOM 1075 O ALA p 66 -11.254 2.442 -2.395 1.00 0.00 O ATOM 1076 CB ALA p 66 -10.606 -0.491 -3.308 1.00 0.00 C ATOM 0 H ALA p 66 -8.665 0.403 -4.747 1.00 0.00 H new ATOM 0 HA ALA p 66 -11.541 0.945 -4.525 1.00 0.00 H new ATOM 0 HB1 ALA p 66 -11.412 -0.486 -2.574 1.00 0.00 H new ATOM 0 HB2 ALA p 66 -10.775 -1.293 -4.027 1.00 0.00 H new ATOM 0 HB3 ALA p 66 -9.655 -0.653 -2.801 1.00 0.00 H new ATOM 1082 N LEU p 67 -9.056 2.375 -3.002 1.00 0.00 N ATOM 1083 CA LEU p 67 -8.600 3.492 -2.208 1.00 0.00 C ATOM 1084 C LEU p 67 -8.832 4.732 -3.050 1.00 0.00 C ATOM 1085 O LEU p 67 -9.203 5.780 -2.545 1.00 0.00 O ATOM 1086 CB LEU p 67 -7.107 3.322 -1.843 1.00 0.00 C ATOM 1087 CG LEU p 67 -6.124 4.325 -2.477 1.00 0.00 C ATOM 1088 CD1 LEU p 67 -6.174 5.658 -1.766 1.00 0.00 C ATOM 1089 CD2 LEU p 67 -4.719 3.784 -2.492 1.00 0.00 C ATOM 0 H LEU p 67 -8.307 1.915 -3.520 1.00 0.00 H new ATOM 0 HA LEU p 67 -9.140 3.563 -1.264 1.00 0.00 H new ATOM 0 HB2 LEU p 67 -7.011 3.390 -0.759 1.00 0.00 H new ATOM 0 HB3 LEU p 67 -6.799 2.316 -2.128 1.00 0.00 H new ATOM 0 HG LEU p 67 -6.435 4.477 -3.511 1.00 0.00 H new ATOM 0 HD11 LEU p 67 -5.471 6.347 -2.234 1.00 0.00 H new ATOM 0 HD12 LEU p 67 -7.182 6.068 -1.832 1.00 0.00 H new ATOM 0 HD13 LEU p 67 -5.906 5.522 -0.718 1.00 0.00 H new ATOM 0 HD21 LEU p 67 -4.052 4.517 -2.946 1.00 0.00 H new ATOM 0 HD22 LEU p 67 -4.396 3.582 -1.471 1.00 0.00 H new ATOM 0 HD23 LEU p 67 -4.691 2.861 -3.070 1.00 0.00 H new ATOM 1101 N LYS p 68 -8.530 4.562 -4.344 1.00 0.00 N ATOM 1102 CA LYS p 68 -8.742 5.589 -5.367 1.00 0.00 C ATOM 1103 C LYS p 68 -10.227 5.710 -5.615 1.00 0.00 C ATOM 1104 O LYS p 68 -10.722 6.773 -5.994 1.00 0.00 O ATOM 1105 CB LYS p 68 -8.003 5.277 -6.670 1.00 0.00 C ATOM 1106 CG LYS p 68 -6.561 5.762 -6.682 1.00 0.00 C ATOM 1107 CD LYS p 68 -5.876 5.441 -8.003 1.00 0.00 C ATOM 1108 CE LYS p 68 -4.435 5.934 -8.026 1.00 0.00 C ATOM 1109 NZ LYS p 68 -4.349 7.417 -8.158 1.00 0.00 N ATOM 0 H LYS p 68 -8.128 3.699 -4.711 1.00 0.00 H new ATOM 0 HA LYS p 68 -8.335 6.533 -5.004 1.00 0.00 H new ATOM 0 HB2 LYS p 68 -8.017 4.200 -6.837 1.00 0.00 H new ATOM 0 HB3 LYS p 68 -8.539 5.736 -7.501 1.00 0.00 H new ATOM 0 HG2 LYS p 68 -6.536 6.838 -6.510 1.00 0.00 H new ATOM 0 HG3 LYS p 68 -6.012 5.296 -5.864 1.00 0.00 H new ATOM 0 HD2 LYS p 68 -5.895 4.364 -8.170 1.00 0.00 H new ATOM 0 HD3 LYS p 68 -6.431 5.900 -8.821 1.00 0.00 H new ATOM 0 HE2 LYS p 68 -3.932 5.623 -7.111 1.00 0.00 H new ATOM 0 HE3 LYS p 68 -3.906 5.466 -8.856 1.00 0.00 H new ATOM 0 HZ1 LYS p 68 -3.350 7.707 -8.169 1.00 0.00 H new ATOM 0 HZ2 LYS p 68 -4.806 7.714 -9.044 1.00 0.00 H new ATOM 0 HZ3 LYS p 68 -4.831 7.866 -7.353 1.00 0.00 H new ATOM 1123 N LYS p 69 -10.926 4.581 -5.406 1.00 0.00 N ATOM 1124 CA LYS p 69 -12.384 4.552 -5.482 1.00 0.00 C ATOM 1125 C LYS p 69 -12.915 5.145 -4.188 1.00 0.00 C ATOM 1126 O LYS p 69 -13.992 5.727 -4.158 1.00 0.00 O ATOM 1127 CB LYS p 69 -12.910 3.132 -5.663 1.00 0.00 C ATOM 1128 CG LYS p 69 -13.685 2.910 -6.952 1.00 0.00 C ATOM 1129 CD LYS p 69 -15.186 2.978 -6.721 1.00 0.00 C ATOM 1130 CE LYS p 69 -15.960 2.734 -8.005 1.00 0.00 C ATOM 1131 NZ LYS p 69 -17.432 2.724 -7.773 1.00 0.00 N ATOM 0 H LYS p 69 -10.499 3.682 -5.184 1.00 0.00 H new ATOM 0 HA LYS p 69 -12.719 5.126 -6.346 1.00 0.00 H new ATOM 0 HB2 LYS p 69 -12.069 2.439 -5.635 1.00 0.00 H new ATOM 0 HB3 LYS p 69 -13.554 2.886 -4.819 1.00 0.00 H new ATOM 0 HG2 LYS p 69 -13.395 3.662 -7.686 1.00 0.00 H new ATOM 0 HG3 LYS p 69 -13.424 1.938 -7.371 1.00 0.00 H new ATOM 0 HD2 LYS p 69 -15.474 2.237 -5.975 1.00 0.00 H new ATOM 0 HD3 LYS p 69 -15.449 3.956 -6.317 1.00 0.00 H new ATOM 0 HE2 LYS p 69 -15.712 3.508 -8.731 1.00 0.00 H new ATOM 0 HE3 LYS p 69 -15.654 1.782 -8.438 1.00 0.00 H new ATOM 0 HZ1 LYS p 69 -17.924 2.555 -8.673 1.00 0.00 H new ATOM 0 HZ2 LYS p 69 -17.672 1.969 -7.100 1.00 0.00 H new ATOM 0 HZ3 LYS p 69 -17.728 3.642 -7.384 1.00 0.00 H new ATOM 1145 N LYS p 70 -12.084 4.999 -3.138 1.00 0.00 N ATOM 1146 CA LYS p 70 -12.341 5.535 -1.803 1.00 0.00 C ATOM 1147 C LYS p 70 -11.835 6.960 -1.762 1.00 0.00 C ATOM 1148 O LYS p 70 -12.204 7.738 -0.889 1.00 0.00 O ATOM 1149 CB LYS p 70 -11.644 4.701 -0.734 1.00 0.00 C ATOM 1150 CG LYS p 70 -12.586 4.048 0.267 1.00 0.00 C ATOM 1151 CD LYS p 70 -12.448 4.667 1.648 1.00 0.00 C ATOM 1152 CE LYS p 70 -13.392 4.017 2.646 1.00 0.00 C ATOM 1153 NZ LYS p 70 -13.257 4.608 4.006 1.00 0.00 N ATOM 0 H LYS p 70 -11.200 4.494 -3.204 1.00 0.00 H new ATOM 0 HA LYS p 70 -13.411 5.504 -1.598 1.00 0.00 H new ATOM 0 HB2 LYS p 70 -11.057 3.923 -1.223 1.00 0.00 H new ATOM 0 HB3 LYS p 70 -10.943 5.337 -0.193 1.00 0.00 H new ATOM 0 HG2 LYS p 70 -13.615 4.152 -0.078 1.00 0.00 H new ATOM 0 HG3 LYS p 70 -12.375 2.980 0.323 1.00 0.00 H new ATOM 0 HD2 LYS p 70 -11.420 4.560 1.995 1.00 0.00 H new ATOM 0 HD3 LYS p 70 -12.656 5.736 1.591 1.00 0.00 H new ATOM 0 HE2 LYS p 70 -14.420 4.132 2.301 1.00 0.00 H new ATOM 0 HE3 LYS p 70 -13.189 2.947 2.694 1.00 0.00 H new ATOM 0 HZ1 LYS p 70 -13.918 4.137 4.656 1.00 0.00 H new ATOM 0 HZ2 LYS p 70 -12.283 4.476 4.347 1.00 0.00 H new ATOM 0 HZ3 LYS p 70 -13.476 5.624 3.966 1.00 0.00 H new ATOM 1167 N ASN p 71 -10.934 7.249 -2.716 1.00 0.00 N ATOM 1168 CA ASN p 71 -10.391 8.586 -2.936 1.00 0.00 C ATOM 1169 C ASN p 71 -11.356 9.286 -3.884 1.00 0.00 C ATOM 1170 O ASN p 71 -11.293 10.490 -4.098 1.00 0.00 O ATOM 1171 CB ASN p 71 -8.981 8.548 -3.533 1.00 0.00 C ATOM 1172 CG ASN p 71 -8.162 9.770 -3.163 1.00 0.00 C ATOM 1173 OD1 ASN p 71 -7.463 9.779 -2.150 1.00 0.00 O ATOM 1174 ND2 ASN p 71 -8.245 10.810 -3.985 1.00 0.00 N ATOM 0 H ASN p 71 -10.563 6.549 -3.359 1.00 0.00 H new ATOM 0 HA ASN p 71 -10.297 9.116 -1.988 1.00 0.00 H new ATOM 0 HB2 ASN p 71 -8.467 7.651 -3.187 1.00 0.00 H new ATOM 0 HB3 ASN p 71 -9.051 8.476 -4.618 1.00 0.00 H new ATOM 0 HD21 ASN p 71 -7.717 11.660 -3.787 1.00 0.00 H new ATOM 0 HD22 ASN p 71 -8.837 10.759 -4.814 1.00 0.00 H new ATOM 1181 N ALA p 72 -12.224 8.435 -4.463 1.00 0.00 N ATOM 1182 CA ALA p 72 -13.312 8.811 -5.350 1.00 0.00 C ATOM 1183 C ALA p 72 -14.539 8.976 -4.479 1.00 0.00 C ATOM 1184 O ALA p 72 -15.481 9.681 -4.826 1.00 0.00 O ATOM 1185 CB ALA p 72 -13.550 7.756 -6.421 1.00 0.00 C ATOM 0 H ALA p 72 -12.174 7.428 -4.311 1.00 0.00 H new ATOM 0 HA ALA p 72 -13.073 9.734 -5.878 1.00 0.00 H new ATOM 0 HB1 ALA p 72 -14.371 8.071 -7.066 1.00 0.00 H new ATOM 0 HB2 ALA p 72 -12.646 7.633 -7.018 1.00 0.00 H new ATOM 0 HB3 ALA p 72 -13.804 6.808 -5.947 1.00 0.00 H new ATOM 1191 N GLN p 73 -14.483 8.265 -3.333 1.00 0.00 N ATOM 1192 CA GLN p 73 -15.490 8.317 -2.282 1.00 0.00 C ATOM 1193 C GLN p 73 -15.129 9.481 -1.415 1.00 0.00 C ATOM 1194 O GLN p 73 -15.970 10.106 -0.782 1.00 0.00 O ATOM 1195 CB GLN p 73 -15.461 7.061 -1.437 1.00 0.00 C ATOM 1196 CG GLN p 73 -15.779 5.818 -2.215 1.00 0.00 C ATOM 1197 CD GLN p 73 -17.037 5.118 -1.739 1.00 0.00 C ATOM 1198 OE1 GLN p 73 -16.987 4.251 -0.866 1.00 0.00 O ATOM 1199 NE2 GLN p 73 -18.175 5.491 -2.312 1.00 0.00 N ATOM 0 H GLN p 73 -13.715 7.629 -3.120 1.00 0.00 H new ATOM 0 HA GLN p 73 -16.485 8.408 -2.717 1.00 0.00 H new ATOM 0 HB2 GLN p 73 -14.474 6.957 -0.986 1.00 0.00 H new ATOM 0 HB3 GLN p 73 -16.176 7.164 -0.620 1.00 0.00 H new ATOM 0 HG2 GLN p 73 -15.891 6.076 -3.268 1.00 0.00 H new ATOM 0 HG3 GLN p 73 -14.938 5.128 -2.144 1.00 0.00 H new ATOM 0 HE21 GLN p 73 -18.171 6.214 -3.032 1.00 0.00 H new ATOM 0 HE22 GLN p 73 -19.054 5.055 -2.033 1.00 0.00 H new ATOM 1208 N LEU p 74 -13.814 9.692 -1.386 1.00 0.00 N ATOM 1209 CA LEU p 74 -13.179 10.807 -0.689 1.00 0.00 C ATOM 1210 C LEU p 74 -13.294 12.039 -1.567 1.00 0.00 C ATOM 1211 O LEU p 74 -13.365 13.140 -1.087 1.00 0.00 O ATOM 1212 CB LEU p 74 -11.712 10.504 -0.401 1.00 0.00 C ATOM 1213 CG LEU p 74 -11.040 11.317 0.709 1.00 0.00 C ATOM 1214 CD1 LEU p 74 -11.481 10.861 2.097 1.00 0.00 C ATOM 1215 CD2 LEU p 74 -9.542 11.184 0.555 1.00 0.00 C ATOM 0 H LEU p 74 -13.148 9.080 -1.856 1.00 0.00 H new ATOM 0 HA LEU p 74 -13.676 10.973 0.267 1.00 0.00 H new ATOM 0 HB2 LEU p 74 -11.628 9.448 -0.146 1.00 0.00 H new ATOM 0 HB3 LEU p 74 -11.148 10.655 -1.321 1.00 0.00 H new ATOM 0 HG LEU p 74 -11.339 12.361 0.615 1.00 0.00 H new ATOM 0 HD11 LEU p 74 -10.980 11.464 2.854 1.00 0.00 H new ATOM 0 HD12 LEU p 74 -12.560 10.980 2.193 1.00 0.00 H new ATOM 0 HD13 LEU p 74 -11.218 9.812 2.236 1.00 0.00 H new ATOM 0 HD21 LEU p 74 -9.044 11.757 1.337 1.00 0.00 H new ATOM 0 HD22 LEU p 74 -9.260 10.134 0.638 1.00 0.00 H new ATOM 0 HD23 LEU p 74 -9.241 11.565 -0.421 1.00 0.00 H new ATOM 1227 N LYS p 75 -13.330 11.794 -2.873 1.00 0.00 N ATOM 1228 CA LYS p 75 -13.507 12.833 -3.884 1.00 0.00 C ATOM 1229 C LYS p 75 -14.989 13.091 -3.969 1.00 0.00 C ATOM 1230 O LYS p 75 -15.446 14.136 -4.442 1.00 0.00 O ATOM 1231 CB LYS p 75 -12.979 12.379 -5.239 1.00 0.00 C ATOM 1232 CG LYS p 75 -11.877 13.255 -5.813 1.00 0.00 C ATOM 1233 CD LYS p 75 -12.362 14.040 -7.021 1.00 0.00 C ATOM 1234 CE LYS p 75 -11.261 14.922 -7.588 1.00 0.00 C ATOM 1235 NZ LYS p 75 -11.725 15.699 -8.770 1.00 0.00 N ATOM 0 H LYS p 75 -13.236 10.857 -3.265 1.00 0.00 H new ATOM 0 HA LYS p 75 -12.954 13.732 -3.612 1.00 0.00 H new ATOM 0 HB2 LYS p 75 -12.604 11.360 -5.145 1.00 0.00 H new ATOM 0 HB3 LYS p 75 -13.808 12.350 -5.946 1.00 0.00 H new ATOM 0 HG2 LYS p 75 -11.523 13.945 -5.047 1.00 0.00 H new ATOM 0 HG3 LYS p 75 -11.028 12.634 -6.098 1.00 0.00 H new ATOM 0 HD2 LYS p 75 -12.709 13.350 -7.790 1.00 0.00 H new ATOM 0 HD3 LYS p 75 -13.215 14.657 -6.737 1.00 0.00 H new ATOM 0 HE2 LYS p 75 -10.912 15.609 -6.816 1.00 0.00 H new ATOM 0 HE3 LYS p 75 -10.410 14.303 -7.872 1.00 0.00 H new ATOM 0 HZ1 LYS p 75 -10.945 16.287 -9.127 1.00 0.00 H new ATOM 0 HZ2 LYS p 75 -12.034 15.044 -9.516 1.00 0.00 H new ATOM 0 HZ3 LYS p 75 -12.521 16.309 -8.494 1.00 0.00 H new ATOM 1249 N LYS p 76 -15.723 12.080 -3.487 1.00 0.00 N ATOM 1250 CA LYS p 76 -17.173 12.138 -3.399 1.00 0.00 C ATOM 1251 C LYS p 76 -17.536 12.735 -2.059 1.00 0.00 C ATOM 1252 O LYS p 76 -18.550 13.427 -1.922 1.00 0.00 O ATOM 1253 CB LYS p 76 -17.791 10.755 -3.551 1.00 0.00 C ATOM 1254 CG LYS p 76 -18.442 10.508 -4.904 1.00 0.00 C ATOM 1255 CD LYS p 76 -19.935 10.814 -4.878 1.00 0.00 C ATOM 1256 CE LYS p 76 -20.590 10.547 -6.227 1.00 0.00 C ATOM 1257 NZ LYS p 76 -20.229 11.577 -7.243 1.00 0.00 N ATOM 0 H LYS p 76 -15.322 11.205 -3.150 1.00 0.00 H new ATOM 0 HA LYS p 76 -17.564 12.754 -4.208 1.00 0.00 H new ATOM 0 HB2 LYS p 76 -17.018 10.004 -3.390 1.00 0.00 H new ATOM 0 HB3 LYS p 76 -18.538 10.615 -2.770 1.00 0.00 H new ATOM 0 HG2 LYS p 76 -17.957 11.127 -5.659 1.00 0.00 H new ATOM 0 HG3 LYS p 76 -18.289 9.469 -5.197 1.00 0.00 H new ATOM 0 HD2 LYS p 76 -20.418 10.206 -4.113 1.00 0.00 H new ATOM 0 HD3 LYS p 76 -20.088 11.857 -4.600 1.00 0.00 H new ATOM 0 HE2 LYS p 76 -20.289 9.563 -6.587 1.00 0.00 H new ATOM 0 HE3 LYS p 76 -21.673 10.524 -6.105 1.00 0.00 H new ATOM 0 HZ1 LYS p 76 -20.697 11.354 -8.145 1.00 0.00 H new ATOM 0 HZ2 LYS p 76 -20.539 12.513 -6.914 1.00 0.00 H new ATOM 0 HZ3 LYS p 76 -19.198 11.583 -7.381 1.00 0.00 H new ATOM 1271 N LYS p 77 -16.680 12.450 -1.071 1.00 0.00 N ATOM 1272 CA LYS p 77 -16.841 12.996 0.264 1.00 0.00 C ATOM 1273 C LYS p 77 -16.143 14.349 0.367 1.00 0.00 C ATOM 1274 O LYS p 77 -16.405 15.119 1.295 1.00 0.00 O ATOM 1275 CB LYS p 77 -16.295 12.032 1.308 1.00 0.00 C ATOM 1276 CG LYS p 77 -17.339 11.085 1.868 1.00 0.00 C ATOM 1277 CD LYS p 77 -16.847 10.397 3.131 1.00 0.00 C ATOM 1278 CE LYS p 77 -17.899 9.458 3.700 1.00 0.00 C ATOM 1279 NZ LYS p 77 -17.431 8.790 4.946 1.00 0.00 N ATOM 0 H LYS p 77 -15.869 11.841 -1.180 1.00 0.00 H new ATOM 0 HA LYS p 77 -17.905 13.137 0.455 1.00 0.00 H new ATOM 0 HB2 LYS p 77 -15.488 11.448 0.864 1.00 0.00 H new ATOM 0 HB3 LYS p 77 -15.860 12.605 2.127 1.00 0.00 H new ATOM 0 HG2 LYS p 77 -18.253 11.637 2.086 1.00 0.00 H new ATOM 0 HG3 LYS p 77 -17.591 10.335 1.118 1.00 0.00 H new ATOM 0 HD2 LYS p 77 -15.938 9.837 2.911 1.00 0.00 H new ATOM 0 HD3 LYS p 77 -16.586 11.147 3.877 1.00 0.00 H new ATOM 0 HE2 LYS p 77 -18.811 10.018 3.909 1.00 0.00 H new ATOM 0 HE3 LYS p 77 -18.152 8.703 2.956 1.00 0.00 H new ATOM 0 HZ1 LYS p 77 -18.177 8.158 5.302 1.00 0.00 H new ATOM 0 HZ2 LYS p 77 -16.575 8.235 4.742 1.00 0.00 H new ATOM 0 HZ3 LYS p 77 -17.214 9.509 5.665 1.00 0.00 H new ATOM 1293 N LEU p 78 -15.246 14.625 -0.599 1.00 0.00 N ATOM 1294 CA LEU p 78 -14.509 15.897 -0.655 1.00 0.00 C ATOM 1295 C LEU p 78 -15.438 17.109 -0.734 1.00 0.00 C ATOM 1296 O LEU p 78 -15.423 17.986 0.135 1.00 0.00 O ATOM 1297 CB LEU p 78 -13.589 15.894 -1.882 1.00 0.00 C ATOM 1298 CG LEU p 78 -12.086 15.839 -1.607 1.00 0.00 C ATOM 1299 CD1 LEU p 78 -11.337 15.646 -2.910 1.00 0.00 C ATOM 1300 CD2 LEU p 78 -11.620 17.105 -0.912 1.00 0.00 C ATOM 0 H LEU p 78 -15.015 13.979 -1.354 1.00 0.00 H new ATOM 0 HA LEU p 78 -13.933 15.981 0.267 1.00 0.00 H new ATOM 0 HB2 LEU p 78 -13.853 15.039 -2.505 1.00 0.00 H new ATOM 0 HB3 LEU p 78 -13.796 16.790 -2.466 1.00 0.00 H new ATOM 0 HG LEU p 78 -11.880 14.996 -0.947 1.00 0.00 H new ATOM 0 HD11 LEU p 78 -10.266 15.607 -2.712 1.00 0.00 H new ATOM 0 HD12 LEU p 78 -11.654 14.713 -3.377 1.00 0.00 H new ATOM 0 HD13 LEU p 78 -11.552 16.479 -3.580 1.00 0.00 H new ATOM 0 HD21 LEU p 78 -10.548 17.044 -0.726 1.00 0.00 H new ATOM 0 HD22 LEU p 78 -11.830 17.966 -1.546 1.00 0.00 H new ATOM 0 HD23 LEU p 78 -12.147 17.215 0.036 1.00 0.00 H new ATOM 1312 N GLN p 79 -16.234 17.123 -1.792 1.00 0.00 N ATOM 1313 CA GLN p 79 -17.205 18.177 -2.064 1.00 0.00 C ATOM 1314 C GLN p 79 -18.523 17.952 -1.321 1.00 0.00 C ATOM 1315 O GLN p 79 -19.113 18.891 -0.779 1.00 0.00 O ATOM 1316 CB GLN p 79 -17.460 18.278 -3.577 1.00 0.00 C ATOM 1317 CG GLN p 79 -17.469 16.947 -4.330 1.00 0.00 C ATOM 1318 CD GLN p 79 -17.738 17.117 -5.813 1.00 0.00 C ATOM 1319 OE1 GLN p 79 -16.814 17.277 -6.610 1.00 0.00 O ATOM 1320 NE2 GLN p 79 -19.012 17.085 -6.191 1.00 0.00 N ATOM 0 H GLN p 79 -16.225 16.389 -2.500 1.00 0.00 H new ATOM 0 HA GLN p 79 -16.783 19.114 -1.701 1.00 0.00 H new ATOM 0 HB2 GLN p 79 -18.419 18.772 -3.735 1.00 0.00 H new ATOM 0 HB3 GLN p 79 -16.695 18.919 -4.015 1.00 0.00 H new ATOM 0 HG2 GLN p 79 -16.508 16.450 -4.193 1.00 0.00 H new ATOM 0 HG3 GLN p 79 -18.229 16.295 -3.899 1.00 0.00 H new ATOM 0 HE21 GLN p 79 -19.747 16.950 -5.497 1.00 0.00 H new ATOM 0 HE22 GLN p 79 -19.255 17.195 -7.176 1.00 0.00 H new ATOM 1329 N ALA p 80 -18.957 16.702 -1.315 1.00 0.00 N ATOM 1330 CA ALA p 80 -20.201 16.300 -0.656 1.00 0.00 C ATOM 1331 C ALA p 80 -19.934 15.730 0.738 1.00 0.00 C ATOM 1332 O ALA p 80 -20.398 16.341 1.722 1.00 0.00 O ATOM 1333 CB ALA p 80 -20.956 15.294 -1.517 1.00 0.00 C ATOM 1334 OXT ALA p 80 -19.255 14.684 0.835 1.00 0.00 O ATOM 0 H ALA p 80 -18.461 15.933 -1.765 1.00 0.00 H new ATOM 0 HA ALA p 80 -20.821 17.188 -0.535 1.00 0.00 H new ATOM 0 HB1 ALA p 80 -21.879 15.005 -1.014 1.00 0.00 H new ATOM 0 HB2 ALA p 80 -21.194 15.746 -2.480 1.00 0.00 H new ATOM 0 HB3 ALA p 80 -20.336 14.411 -1.674 1.00 0.00 H new TER 1340 ALA p 80