USER MOD reduce.3.24.130724 H: found=0, std=0, add=687, rem=0, adj=13 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 40 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Set 1.2: p 43 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Set 2.1: p 2 GLN : amide:sc= 1.02 K(o=2.2,f=-7.3!) USER MOD Set 2.2: p 6 LYS NZ :NH3+ 170:sc= 1.21 (180deg=0) USER MOD Single : p 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : p 1 MET N :NH3+ -176:sc= -0.159 (180deg=-0.161) USER MOD Single : p 10 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 11 ASN :FLIP amide:sc= 0.746 F(o=0,f=0.75) 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= -0.102 K(o=-0.1,f=-2.2) USER MOD Single : p 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 30 GLN :FLIP amide:sc= -0.0162 F(o=-0.96,f=-0.016) USER MOD Single : p 33 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 34 CYS SG : rot 180:sc= -0.245 USER MOD Single : p 36 CYS SG : rot 180:sc= 0 USER MOD Single : p 41 CYS SG : rot 180:sc= 0 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 180:sc= 0 USER MOD Single : p 51 GLN : amide:sc=-0.00601 X(o=-0.006,f=0) USER MOD Single : p 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 59 GLN : amide:sc= -0.172 X(o=-0.17,f=-0.17) USER MOD Single : p 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 63 LYS NZ :NH3+ -174:sc= -0.165 (180deg=-0.191) 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+ 179:sc= 0 (180deg=-0.000893) USER MOD Single : p 71 ASN : amide:sc= 0 X(o=0,f=0) 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+ -177:sc= 0 (180deg=-0.00541) 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 -7.370 23.753 5.270 1.00 0.00 N ATOM 2 CA MET p 1 -6.630 23.227 4.088 1.00 0.00 C ATOM 3 C MET p 1 -5.524 22.245 4.505 1.00 0.00 C ATOM 4 O MET p 1 -4.783 21.735 3.659 1.00 0.00 O ATOM 5 CB MET p 1 -6.028 24.389 3.283 1.00 0.00 C ATOM 6 CG MET p 1 -7.057 25.196 2.504 1.00 0.00 C ATOM 7 SD MET p 1 -6.312 26.527 1.543 1.00 0.00 S ATOM 8 CE MET p 1 -7.763 27.240 0.773 1.00 0.00 C ATOM 0 H1 MET p 1 -8.152 24.359 4.949 1.00 0.00 H new ATOM 0 H2 MET p 1 -7.752 22.959 5.822 1.00 0.00 H new ATOM 0 H3 MET p 1 -6.723 24.309 5.865 1.00 0.00 H new ATOM 0 HA MET p 1 -7.340 22.684 3.464 1.00 0.00 H new ATOM 0 HB2 MET p 1 -5.498 25.055 3.965 1.00 0.00 H new ATOM 0 HB3 MET p 1 -5.289 23.992 2.587 1.00 0.00 H new ATOM 0 HG2 MET p 1 -7.603 24.531 1.835 1.00 0.00 H new ATOM 0 HG3 MET p 1 -7.784 25.617 3.198 1.00 0.00 H new ATOM 0 HE1 MET p 1 -7.466 28.079 0.144 1.00 0.00 H new ATOM 0 HE2 MET p 1 -8.259 26.486 0.162 1.00 0.00 H new ATOM 0 HE3 MET p 1 -8.449 27.590 1.544 1.00 0.00 H new ATOM 20 N GLN p 2 -5.415 21.998 5.811 1.00 0.00 N ATOM 21 CA GLN p 2 -4.430 21.088 6.364 1.00 0.00 C ATOM 22 C GLN p 2 -5.104 19.857 6.991 1.00 0.00 C ATOM 23 O GLN p 2 -4.438 18.939 7.467 1.00 0.00 O ATOM 24 CB GLN p 2 -3.639 21.843 7.424 1.00 0.00 C ATOM 25 CG GLN p 2 -2.550 22.739 6.857 1.00 0.00 C ATOM 26 CD GLN p 2 -1.622 23.279 7.928 1.00 0.00 C ATOM 27 OE1 GLN p 2 -0.609 22.662 8.256 1.00 0.00 O ATOM 28 NE2 GLN p 2 -1.964 24.438 8.479 1.00 0.00 N ATOM 0 H GLN p 2 -6.015 22.430 6.514 1.00 0.00 H new ATOM 0 HA GLN p 2 -3.773 20.734 5.570 1.00 0.00 H new ATOM 0 HB2 GLN p 2 -4.326 22.451 8.012 1.00 0.00 H new ATOM 0 HB3 GLN p 2 -3.186 21.124 8.106 1.00 0.00 H new ATOM 0 HG2 GLN p 2 -1.968 22.178 6.126 1.00 0.00 H new ATOM 0 HG3 GLN p 2 -3.010 23.573 6.326 1.00 0.00 H new ATOM 0 HE21 GLN p 2 -2.813 24.916 8.177 1.00 0.00 H new ATOM 0 HE22 GLN p 2 -1.378 24.850 9.205 1.00 0.00 H new ATOM 37 N ALA p 3 -6.431 19.857 6.970 1.00 0.00 N ATOM 38 CA ALA p 3 -7.241 18.790 7.565 1.00 0.00 C ATOM 39 C ALA p 3 -7.582 17.704 6.561 1.00 0.00 C ATOM 40 O ALA p 3 -7.625 16.527 6.896 1.00 0.00 O ATOM 41 CB ALA p 3 -8.507 19.369 8.183 1.00 0.00 C ATOM 0 H ALA p 3 -6.983 20.599 6.539 1.00 0.00 H new ATOM 0 HA ALA p 3 -6.644 18.325 8.349 1.00 0.00 H new ATOM 0 HB1 ALA p 3 -9.099 18.565 8.621 1.00 0.00 H new ATOM 0 HB2 ALA p 3 -8.238 20.086 8.959 1.00 0.00 H new ATOM 0 HB3 ALA p 3 -9.092 19.871 7.412 1.00 0.00 H new ATOM 47 N LEU p 4 -7.890 18.155 5.353 1.00 0.00 N ATOM 48 CA LEU p 4 -8.264 17.328 4.232 1.00 0.00 C ATOM 49 C LEU p 4 -7.049 17.052 3.364 1.00 0.00 C ATOM 50 O LEU p 4 -6.630 15.914 3.186 1.00 0.00 O ATOM 51 CB LEU p 4 -9.351 18.072 3.450 1.00 0.00 C ATOM 52 CG LEU p 4 -10.210 17.249 2.499 1.00 0.00 C ATOM 53 CD1 LEU p 4 -11.523 17.966 2.311 1.00 0.00 C ATOM 54 CD2 LEU p 4 -9.508 17.067 1.161 1.00 0.00 C ATOM 0 H LEU p 4 -7.883 19.149 5.126 1.00 0.00 H new ATOM 0 HA LEU p 4 -8.648 16.365 4.567 1.00 0.00 H new ATOM 0 HB2 LEU p 4 -10.012 18.557 4.168 1.00 0.00 H new ATOM 0 HB3 LEU p 4 -8.871 18.863 2.873 1.00 0.00 H new ATOM 0 HG LEU p 4 -10.381 16.258 2.919 1.00 0.00 H new ATOM 0 HD11 LEU p 4 -12.156 17.394 1.632 1.00 0.00 H new ATOM 0 HD12 LEU p 4 -12.023 18.068 3.274 1.00 0.00 H new ATOM 0 HD13 LEU p 4 -11.341 18.955 1.890 1.00 0.00 H new ATOM 0 HD21 LEU p 4 -10.139 16.476 0.497 1.00 0.00 H new ATOM 0 HD22 LEU p 4 -9.322 18.043 0.712 1.00 0.00 H new ATOM 0 HD23 LEU p 4 -8.560 16.551 1.315 1.00 0.00 H new ATOM 66 N GLU p 5 -6.515 18.152 2.834 1.00 0.00 N ATOM 67 CA GLU p 5 -5.340 18.168 1.942 1.00 0.00 C ATOM 68 C GLU p 5 -4.111 17.558 2.586 1.00 0.00 C ATOM 69 O GLU p 5 -3.280 16.974 1.898 1.00 0.00 O ATOM 70 CB GLU p 5 -5.003 19.597 1.504 1.00 0.00 C ATOM 71 CG GLU p 5 -6.216 20.497 1.344 1.00 0.00 C ATOM 72 CD GLU p 5 -6.288 21.158 -0.019 1.00 0.00 C ATOM 73 OE1 GLU p 5 -5.734 22.267 -0.172 1.00 0.00 O ATOM 74 OE2 GLU p 5 -6.898 20.565 -0.935 1.00 0.00 O ATOM 0 H GLU p 5 -6.891 19.083 3.013 1.00 0.00 H new ATOM 0 HA GLU p 5 -5.613 17.564 1.077 1.00 0.00 H new ATOM 0 HB2 GLU p 5 -4.328 20.041 2.236 1.00 0.00 H new ATOM 0 HB3 GLU p 5 -4.465 19.558 0.557 1.00 0.00 H new ATOM 0 HG2 GLU p 5 -7.120 19.910 1.505 1.00 0.00 H new ATOM 0 HG3 GLU p 5 -6.194 21.268 2.115 1.00 0.00 H new ATOM 81 N LYS p 6 -4.012 17.716 3.901 1.00 0.00 N ATOM 82 CA LYS p 6 -2.886 17.170 4.671 1.00 0.00 C ATOM 83 C LYS p 6 -3.234 15.800 5.231 1.00 0.00 C ATOM 84 O LYS p 6 -2.371 15.104 5.752 1.00 0.00 O ATOM 85 CB LYS p 6 -2.445 18.104 5.787 1.00 0.00 C ATOM 86 CG LYS p 6 -1.368 19.098 5.365 1.00 0.00 C ATOM 87 CD LYS p 6 -0.610 19.644 6.564 1.00 0.00 C ATOM 88 CE LYS p 6 0.551 20.527 6.132 1.00 0.00 C ATOM 89 NZ LYS p 6 1.368 20.977 7.292 1.00 0.00 N ATOM 0 H LYS p 6 -4.698 18.219 4.464 1.00 0.00 H new ATOM 0 HA LYS p 6 -2.047 17.069 3.983 1.00 0.00 H new ATOM 0 HB2 LYS p 6 -3.312 18.655 6.152 1.00 0.00 H new ATOM 0 HB3 LYS p 6 -2.071 17.509 6.620 1.00 0.00 H new ATOM 0 HG2 LYS p 6 -0.670 18.612 4.683 1.00 0.00 H new ATOM 0 HG3 LYS p 6 -1.826 19.922 4.818 1.00 0.00 H new ATOM 0 HD2 LYS p 6 -1.289 20.217 7.196 1.00 0.00 H new ATOM 0 HD3 LYS p 6 -0.235 18.817 7.167 1.00 0.00 H new ATOM 0 HE2 LYS p 6 1.183 19.979 5.433 1.00 0.00 H new ATOM 0 HE3 LYS p 6 0.167 21.397 5.599 1.00 0.00 H new ATOM 0 HZ1 LYS p 6 2.238 21.431 6.948 1.00 0.00 H new ATOM 0 HZ2 LYS p 6 0.822 21.658 7.858 1.00 0.00 H new ATOM 0 HZ3 LYS p 6 1.615 20.157 7.882 1.00 0.00 H new ATOM 103 N GLU p 7 -4.524 15.459 5.139 1.00 0.00 N ATOM 104 CA GLU p 7 -5.055 14.155 5.529 1.00 0.00 C ATOM 105 C GLU p 7 -4.959 13.271 4.287 1.00 0.00 C ATOM 106 O GLU p 7 -4.924 12.041 4.347 1.00 0.00 O ATOM 107 CB GLU p 7 -6.505 14.324 5.992 1.00 0.00 C ATOM 108 CG GLU p 7 -7.421 13.144 5.717 1.00 0.00 C ATOM 109 CD GLU p 7 -7.995 12.534 6.981 1.00 0.00 C ATOM 110 OE1 GLU p 7 -7.360 11.614 7.537 1.00 0.00 O ATOM 111 OE2 GLU p 7 -9.080 12.976 7.413 1.00 0.00 O ATOM 0 H GLU p 7 -5.238 16.095 4.785 1.00 0.00 H new ATOM 0 HA GLU p 7 -4.503 13.705 6.354 1.00 0.00 H new ATOM 0 HB2 GLU p 7 -6.505 14.520 7.064 1.00 0.00 H new ATOM 0 HB3 GLU p 7 -6.922 15.206 5.507 1.00 0.00 H new ATOM 0 HG2 GLU p 7 -8.238 13.468 5.073 1.00 0.00 H new ATOM 0 HG3 GLU p 7 -6.867 12.381 5.170 1.00 0.00 H new ATOM 118 N LEU p 8 -4.916 13.995 3.174 1.00 0.00 N ATOM 119 CA LEU p 8 -4.787 13.481 1.836 1.00 0.00 C ATOM 120 C LEU p 8 -3.304 13.453 1.516 1.00 0.00 C ATOM 121 O LEU p 8 -2.847 12.597 0.780 1.00 0.00 O ATOM 122 CB LEU p 8 -5.573 14.379 0.847 1.00 0.00 C ATOM 123 CG LEU p 8 -5.603 13.966 -0.645 1.00 0.00 C ATOM 124 CD1 LEU p 8 -4.508 14.686 -1.414 1.00 0.00 C ATOM 125 CD2 LEU p 8 -5.458 12.462 -0.809 1.00 0.00 C ATOM 0 H LEU p 8 -4.974 15.013 3.194 1.00 0.00 H new ATOM 0 HA LEU p 8 -5.203 12.477 1.748 1.00 0.00 H new ATOM 0 HB2 LEU p 8 -6.603 14.439 1.197 1.00 0.00 H new ATOM 0 HB3 LEU p 8 -5.157 15.385 0.907 1.00 0.00 H new ATOM 0 HG LEU p 8 -6.573 14.255 -1.051 1.00 0.00 H new ATOM 0 HD11 LEU p 8 -4.541 14.386 -2.461 1.00 0.00 H new ATOM 0 HD12 LEU p 8 -4.659 15.763 -1.340 1.00 0.00 H new ATOM 0 HD13 LEU p 8 -3.537 14.426 -0.993 1.00 0.00 H new ATOM 0 HD21 LEU p 8 -5.483 12.207 -1.869 1.00 0.00 H new ATOM 0 HD22 LEU p 8 -4.509 12.139 -0.381 1.00 0.00 H new ATOM 0 HD23 LEU p 8 -6.278 11.959 -0.295 1.00 0.00 H new ATOM 137 N ALA p 9 -2.586 14.412 2.122 1.00 0.00 N ATOM 138 CA ALA p 9 -1.126 14.533 2.016 1.00 0.00 C ATOM 139 C ALA p 9 -0.527 13.616 3.054 1.00 0.00 C ATOM 140 O ALA p 9 0.656 13.279 3.011 1.00 0.00 O ATOM 141 CB ALA p 9 -0.635 15.960 2.211 1.00 0.00 C ATOM 0 H ALA p 9 -3.010 15.133 2.706 1.00 0.00 H new ATOM 0 HA ALA p 9 -0.815 14.252 1.010 1.00 0.00 H new ATOM 0 HB1 ALA p 9 0.451 15.987 2.122 1.00 0.00 H new ATOM 0 HB2 ALA p 9 -1.077 16.604 1.451 1.00 0.00 H new ATOM 0 HB3 ALA p 9 -0.926 16.313 3.200 1.00 0.00 H new ATOM 147 N GLN p 10 -1.401 13.242 4.005 1.00 0.00 N ATOM 148 CA GLN p 10 -1.101 12.289 5.043 1.00 0.00 C ATOM 149 C GLN p 10 -1.411 10.943 4.427 1.00 0.00 C ATOM 150 O GLN p 10 -0.812 9.940 4.764 1.00 0.00 O ATOM 151 CB GLN p 10 -1.958 12.565 6.283 1.00 0.00 C ATOM 152 CG GLN p 10 -2.336 11.348 7.107 1.00 0.00 C ATOM 153 CD GLN p 10 -1.673 11.328 8.471 1.00 0.00 C ATOM 154 OE1 GLN p 10 -0.575 10.795 8.634 1.00 0.00 O ATOM 155 NE2 GLN p 10 -2.339 11.910 9.462 1.00 0.00 N ATOM 0 H GLN p 10 -2.350 13.612 4.059 1.00 0.00 H new ATOM 0 HA GLN p 10 -0.066 12.340 5.382 1.00 0.00 H new ATOM 0 HB2 GLN p 10 -1.421 13.263 6.925 1.00 0.00 H new ATOM 0 HB3 GLN p 10 -2.873 13.064 5.965 1.00 0.00 H new ATOM 0 HG2 GLN p 10 -3.418 11.324 7.235 1.00 0.00 H new ATOM 0 HG3 GLN p 10 -2.059 10.446 6.561 1.00 0.00 H new ATOM 0 HE21 GLN p 10 -3.246 12.340 9.283 1.00 0.00 H new ATOM 0 HE22 GLN p 10 -1.943 11.927 10.402 1.00 0.00 H new ATOM 164 N ASN p 11 -2.369 11.006 3.486 1.00 0.00 N ATOM 165 CA ASN p 11 -2.822 9.874 2.683 1.00 0.00 C ATOM 166 C ASN p 11 -1.872 9.738 1.507 1.00 0.00 C ATOM 167 O ASN p 11 -1.828 8.703 0.852 1.00 0.00 O ATOM 168 CB ASN p 11 -4.262 10.062 2.190 1.00 0.00 C ATOM 169 CG ASN p 11 -4.984 8.746 1.928 1.00 0.00 C ATOM 170 OD1 ASN p 11 -6.287 8.730 2.184 1.00 0.00 O flip ATOM 171 ND2 ASN p 11 -4.382 7.757 1.501 1.00 0.00 N flip ATOM 0 H ASN p 11 -2.858 11.873 3.263 1.00 0.00 H new ATOM 0 HA ASN p 11 -2.819 8.971 3.293 1.00 0.00 H new ATOM 0 HB2 ASN p 11 -4.821 10.634 2.931 1.00 0.00 H new ATOM 0 HB3 ASN p 11 -4.251 10.652 1.273 1.00 0.00 H new ATOM 0 HD21 ASN p 11 -3.380 7.810 1.317 1.00 0.00 H new ATOM 0 HD22 ASN p 11 -4.886 6.887 1.332 1.00 0.00 H new ATOM 178 N GLU p 12 -1.148 10.844 1.249 1.00 0.00 N ATOM 179 CA GLU p 12 -0.086 10.900 0.228 1.00 0.00 C ATOM 180 C GLU p 12 1.158 10.468 0.936 1.00 0.00 C ATOM 181 O GLU p 12 2.148 10.055 0.341 1.00 0.00 O ATOM 182 CB GLU p 12 0.139 12.294 -0.339 1.00 0.00 C ATOM 183 CG GLU p 12 -1.089 12.843 -0.997 1.00 0.00 C ATOM 184 CD GLU p 12 -0.823 13.451 -2.361 1.00 0.00 C ATOM 185 OE1 GLU p 12 -0.530 14.663 -2.423 1.00 0.00 O ATOM 186 OE2 GLU p 12 -0.908 12.713 -3.365 1.00 0.00 O ATOM 0 H GLU p 12 -1.284 11.725 1.744 1.00 0.00 H new ATOM 0 HA GLU p 12 -0.363 10.271 -0.618 1.00 0.00 H new ATOM 0 HB2 GLU p 12 0.450 12.964 0.462 1.00 0.00 H new ATOM 0 HB3 GLU p 12 0.954 12.263 -1.063 1.00 0.00 H new ATOM 0 HG2 GLU p 12 -1.824 12.045 -1.101 1.00 0.00 H new ATOM 0 HG3 GLU p 12 -1.531 13.601 -0.350 1.00 0.00 H new ATOM 193 N TRP p 13 1.044 10.646 2.250 1.00 0.00 N ATOM 194 CA TRP p 13 2.064 10.251 3.227 1.00 0.00 C ATOM 195 C TRP p 13 1.831 8.791 3.615 1.00 0.00 C ATOM 196 O TRP p 13 2.748 8.102 4.055 1.00 0.00 O ATOM 197 CB TRP p 13 2.046 11.140 4.471 1.00 0.00 C ATOM 198 CG TRP p 13 3.376 11.223 5.169 1.00 0.00 C ATOM 199 CD1 TRP p 13 3.810 10.428 6.190 1.00 0.00 C ATOM 200 CD2 TRP p 13 4.441 12.149 4.901 1.00 0.00 C ATOM 201 NE1 TRP p 13 5.076 10.800 6.573 1.00 0.00 N ATOM 202 CE2 TRP p 13 5.485 11.853 5.798 1.00 0.00 C ATOM 203 CE3 TRP p 13 4.618 13.201 3.990 1.00 0.00 C ATOM 204 CZ2 TRP p 13 6.682 12.564 5.812 1.00 0.00 C ATOM 205 CZ3 TRP p 13 5.807 13.906 4.006 1.00 0.00 C ATOM 206 CH2 TRP p 13 6.825 13.584 4.912 1.00 0.00 C ATOM 0 H TRP p 13 0.224 11.077 2.677 1.00 0.00 H new ATOM 0 HA TRP p 13 3.046 10.370 2.769 1.00 0.00 H new ATOM 0 HB2 TRP p 13 1.731 12.144 4.186 1.00 0.00 H new ATOM 0 HB3 TRP p 13 1.301 10.759 5.170 1.00 0.00 H new ATOM 0 HD1 TRP p 13 3.241 9.624 6.632 1.00 0.00 H new ATOM 0 HE1 TRP p 13 5.623 10.363 7.315 1.00 0.00 H new ATOM 0 HE3 TRP p 13 3.838 13.456 3.288 1.00 0.00 H new ATOM 0 HZ2 TRP p 13 7.470 12.319 6.509 1.00 0.00 H new ATOM 0 HZ3 TRP p 13 5.953 14.718 3.309 1.00 0.00 H new ATOM 0 HH2 TRP p 13 7.743 14.153 4.900 1.00 0.00 H new ATOM 217 N GLU p 14 0.565 8.362 3.459 1.00 0.00 N ATOM 218 CA GLU p 14 0.146 6.962 3.691 1.00 0.00 C ATOM 219 C GLU p 14 0.288 6.265 2.377 1.00 0.00 C ATOM 220 O GLU p 14 0.318 5.043 2.285 1.00 0.00 O ATOM 221 CB GLU p 14 -1.297 6.816 4.166 1.00 0.00 C ATOM 222 CG GLU p 14 -1.605 7.668 5.359 1.00 0.00 C ATOM 223 CD GLU p 14 -2.339 6.924 6.458 1.00 0.00 C ATOM 224 OE1 GLU p 14 -1.665 6.348 7.337 1.00 0.00 O ATOM 225 OE2 GLU p 14 -3.588 6.920 6.441 1.00 0.00 O ATOM 0 H GLU p 14 -0.198 8.974 3.169 1.00 0.00 H new ATOM 0 HA GLU p 14 0.766 6.542 4.483 1.00 0.00 H new ATOM 0 HB2 GLU p 14 -1.971 7.082 3.352 1.00 0.00 H new ATOM 0 HB3 GLU p 14 -1.490 5.772 4.412 1.00 0.00 H new ATOM 0 HG2 GLU p 14 -0.674 8.068 5.761 1.00 0.00 H new ATOM 0 HG3 GLU p 14 -2.207 8.520 5.042 1.00 0.00 H new ATOM 232 N LEU p 15 0.311 7.126 1.361 1.00 0.00 N ATOM 233 CA LEU p 15 0.531 6.751 -0.028 1.00 0.00 C ATOM 234 C LEU p 15 2.030 6.604 -0.204 1.00 0.00 C ATOM 235 O LEU p 15 2.501 5.761 -0.946 1.00 0.00 O ATOM 236 CB LEU p 15 -0.027 7.815 -0.994 1.00 0.00 C ATOM 237 CG LEU p 15 0.023 7.516 -2.509 1.00 0.00 C ATOM 238 CD1 LEU p 15 1.274 8.127 -3.110 1.00 0.00 C ATOM 239 CD2 LEU p 15 -0.021 6.023 -2.784 1.00 0.00 C ATOM 0 H LEU p 15 0.173 8.129 1.488 1.00 0.00 H new ATOM 0 HA LEU p 15 0.011 5.821 -0.259 1.00 0.00 H new ATOM 0 HB2 LEU p 15 -1.067 7.999 -0.724 1.00 0.00 H new ATOM 0 HB3 LEU p 15 0.517 8.743 -0.819 1.00 0.00 H new ATOM 0 HG LEU p 15 -0.857 7.961 -2.973 1.00 0.00 H new ATOM 0 HD11 LEU p 15 1.306 7.914 -4.179 1.00 0.00 H new ATOM 0 HD12 LEU p 15 1.262 9.206 -2.955 1.00 0.00 H new ATOM 0 HD13 LEU p 15 2.154 7.701 -2.629 1.00 0.00 H new ATOM 0 HD21 LEU p 15 0.016 5.850 -3.860 1.00 0.00 H new ATOM 0 HD22 LEU p 15 0.833 5.540 -2.309 1.00 0.00 H new ATOM 0 HD23 LEU p 15 -0.944 5.606 -2.381 1.00 0.00 H new ATOM 251 N GLN p 16 2.733 7.460 0.544 1.00 0.00 N ATOM 252 CA GLN p 16 4.164 7.529 0.645 1.00 0.00 C ATOM 253 C GLN p 16 4.590 6.377 1.512 1.00 0.00 C ATOM 254 O GLN p 16 5.662 5.807 1.359 1.00 0.00 O ATOM 255 CB GLN p 16 4.482 8.833 1.331 1.00 0.00 C ATOM 256 CG GLN p 16 5.935 9.119 1.441 1.00 0.00 C ATOM 257 CD GLN p 16 6.373 10.346 0.664 1.00 0.00 C ATOM 258 OE1 GLN p 16 6.374 11.459 1.189 1.00 0.00 O ATOM 259 NE2 GLN p 16 6.747 10.147 -0.595 1.00 0.00 N ATOM 0 H GLN p 16 2.273 8.161 1.125 1.00 0.00 H new ATOM 0 HA GLN p 16 4.668 7.478 -0.320 1.00 0.00 H new ATOM 0 HB2 GLN p 16 4.003 9.645 0.785 1.00 0.00 H new ATOM 0 HB3 GLN p 16 4.048 8.821 2.331 1.00 0.00 H new ATOM 0 HG2 GLN p 16 6.192 9.254 2.492 1.00 0.00 H new ATOM 0 HG3 GLN p 16 6.495 8.254 1.084 1.00 0.00 H new ATOM 0 HE21 GLN p 16 6.730 9.206 -0.989 1.00 0.00 H new ATOM 0 HE22 GLN p 16 7.051 10.935 -1.167 1.00 0.00 H new ATOM 268 N ALA p 17 3.700 6.133 2.469 1.00 0.00 N ATOM 269 CA ALA p 17 3.793 5.020 3.401 1.00 0.00 C ATOM 270 C ALA p 17 3.360 3.781 2.657 1.00 0.00 C ATOM 271 O ALA p 17 3.743 2.678 3.006 1.00 0.00 O ATOM 272 CB ALA p 17 2.945 5.224 4.645 1.00 0.00 C ATOM 0 H ALA p 17 2.878 6.717 2.619 1.00 0.00 H new ATOM 0 HA ALA p 17 4.820 4.932 3.757 1.00 0.00 H new ATOM 0 HB1 ALA p 17 3.053 4.363 5.304 1.00 0.00 H new ATOM 0 HB2 ALA p 17 3.274 6.123 5.166 1.00 0.00 H new ATOM 0 HB3 ALA p 17 1.899 5.332 4.359 1.00 0.00 H new ATOM 278 N LEU p 18 2.559 4.023 1.597 1.00 0.00 N ATOM 279 CA LEU p 18 2.077 2.993 0.693 1.00 0.00 C ATOM 280 C LEU p 18 3.153 2.776 -0.355 1.00 0.00 C ATOM 281 O LEU p 18 3.181 1.760 -1.017 1.00 0.00 O ATOM 282 CB LEU p 18 0.744 3.400 0.036 1.00 0.00 C ATOM 283 CG LEU p 18 0.013 2.339 -0.814 1.00 0.00 C ATOM 284 CD1 LEU p 18 0.374 2.522 -2.276 1.00 0.00 C ATOM 285 CD2 LEU p 18 0.357 0.931 -0.357 1.00 0.00 C ATOM 0 H LEU p 18 2.232 4.958 1.354 1.00 0.00 H new ATOM 0 HA LEU p 18 1.882 2.072 1.242 1.00 0.00 H new ATOM 0 HB2 LEU p 18 0.066 3.724 0.825 1.00 0.00 H new ATOM 0 HB3 LEU p 18 0.933 4.267 -0.598 1.00 0.00 H new ATOM 0 HG LEU p 18 -1.061 2.475 -0.685 1.00 0.00 H new ATOM 0 HD11 LEU p 18 -0.143 1.772 -2.875 1.00 0.00 H new ATOM 0 HD12 LEU p 18 0.074 3.518 -2.603 1.00 0.00 H new ATOM 0 HD13 LEU p 18 1.451 2.408 -2.402 1.00 0.00 H new ATOM 0 HD21 LEU p 18 -0.174 0.208 -0.976 1.00 0.00 H new ATOM 0 HD22 LEU p 18 1.431 0.770 -0.451 1.00 0.00 H new ATOM 0 HD23 LEU p 18 0.061 0.804 0.684 1.00 0.00 H new ATOM 297 N GLU p 19 3.975 3.812 -0.514 1.00 0.00 N ATOM 298 CA GLU p 19 5.168 3.787 -1.393 1.00 0.00 C ATOM 299 C GLU p 19 6.292 3.291 -0.532 1.00 0.00 C ATOM 300 O GLU p 19 7.359 2.916 -0.978 1.00 0.00 O ATOM 301 CB GLU p 19 5.536 5.158 -1.952 1.00 0.00 C ATOM 302 CG GLU p 19 4.388 5.824 -2.649 1.00 0.00 C ATOM 303 CD GLU p 19 4.752 6.391 -4.007 1.00 0.00 C ATOM 304 OE1 GLU p 19 5.167 7.568 -4.068 1.00 0.00 O ATOM 305 OE2 GLU p 19 4.624 5.657 -5.010 1.00 0.00 O ATOM 0 H GLU p 19 3.841 4.704 -0.038 1.00 0.00 H new ATOM 0 HA GLU p 19 4.968 3.155 -2.258 1.00 0.00 H new ATOM 0 HB2 GLU p 19 5.882 5.796 -1.139 1.00 0.00 H new ATOM 0 HB3 GLU p 19 6.367 5.051 -2.649 1.00 0.00 H new ATOM 0 HG2 GLU p 19 3.579 5.103 -2.770 1.00 0.00 H new ATOM 0 HG3 GLU p 19 4.007 6.628 -2.019 1.00 0.00 H new ATOM 312 N LYS p 20 6.033 3.424 0.743 1.00 0.00 N ATOM 313 CA LYS p 20 6.918 2.906 1.777 1.00 0.00 C ATOM 314 C LYS p 20 6.494 1.477 2.100 1.00 0.00 C ATOM 315 O LYS p 20 7.184 0.732 2.792 1.00 0.00 O ATOM 316 CB LYS p 20 6.861 3.778 3.012 1.00 0.00 C ATOM 317 CG LYS p 20 8.202 4.356 3.439 1.00 0.00 C ATOM 318 CD LYS p 20 8.766 3.675 4.687 1.00 0.00 C ATOM 319 CE LYS p 20 8.287 4.345 5.972 1.00 0.00 C ATOM 320 NZ LYS p 20 8.851 3.690 7.183 1.00 0.00 N ATOM 0 H LYS p 20 5.203 3.894 1.104 1.00 0.00 H new ATOM 0 HA LYS p 20 7.949 2.911 1.422 1.00 0.00 H new ATOM 0 HB2 LYS p 20 6.167 4.599 2.830 1.00 0.00 H new ATOM 0 HB3 LYS p 20 6.453 3.193 3.836 1.00 0.00 H new ATOM 0 HG2 LYS p 20 8.915 4.254 2.621 1.00 0.00 H new ATOM 0 HG3 LYS p 20 8.089 5.423 3.632 1.00 0.00 H new ATOM 0 HD2 LYS p 20 8.469 2.626 4.693 1.00 0.00 H new ATOM 0 HD3 LYS p 20 9.855 3.698 4.651 1.00 0.00 H new ATOM 0 HE2 LYS p 20 8.573 5.397 5.962 1.00 0.00 H new ATOM 0 HE3 LYS p 20 7.198 4.311 6.015 1.00 0.00 H new ATOM 0 HZ1 LYS p 20 8.502 4.175 8.034 1.00 0.00 H new ATOM 0 HZ2 LYS p 20 8.557 2.693 7.207 1.00 0.00 H new ATOM 0 HZ3 LYS p 20 9.889 3.744 7.155 1.00 0.00 H new ATOM 334 N GLU p 21 5.303 1.149 1.625 1.00 0.00 N ATOM 335 CA GLU p 21 4.740 -0.188 1.723 1.00 0.00 C ATOM 336 C GLU p 21 5.011 -0.871 0.418 1.00 0.00 C ATOM 337 O GLU p 21 5.356 -2.046 0.345 1.00 0.00 O ATOM 338 CB GLU p 21 3.240 -0.133 1.902 1.00 0.00 C ATOM 339 CG GLU p 21 2.795 0.355 3.244 1.00 0.00 C ATOM 340 CD GLU p 21 2.445 -0.764 4.205 1.00 0.00 C ATOM 341 OE1 GLU p 21 1.269 -1.182 4.226 1.00 0.00 O ATOM 342 OE2 GLU p 21 3.348 -1.222 4.936 1.00 0.00 O ATOM 0 H GLU p 21 4.691 1.815 1.153 1.00 0.00 H new ATOM 0 HA GLU p 21 5.180 -0.707 2.575 1.00 0.00 H new ATOM 0 HB2 GLU p 21 2.818 0.516 1.135 1.00 0.00 H new ATOM 0 HB3 GLU p 21 2.830 -1.129 1.737 1.00 0.00 H new ATOM 0 HG2 GLU p 21 3.585 0.965 3.681 1.00 0.00 H new ATOM 0 HG3 GLU p 21 1.926 1.001 3.118 1.00 0.00 H new ATOM 349 N LEU p 22 4.788 -0.069 -0.612 1.00 0.00 N ATOM 350 CA LEU p 22 4.974 -0.468 -1.992 1.00 0.00 C ATOM 351 C LEU p 22 6.420 -0.378 -2.448 1.00 0.00 C ATOM 352 O LEU p 22 6.960 -1.344 -2.990 1.00 0.00 O ATOM 353 CB LEU p 22 4.135 0.428 -2.897 1.00 0.00 C ATOM 354 CG LEU p 22 3.381 -0.231 -4.042 1.00 0.00 C ATOM 355 CD1 LEU p 22 2.667 0.855 -4.807 1.00 0.00 C ATOM 356 CD2 LEU p 22 4.323 -0.997 -4.955 1.00 0.00 C ATOM 0 H LEU p 22 4.467 0.893 -0.507 1.00 0.00 H new ATOM 0 HA LEU p 22 4.665 -1.511 -2.059 1.00 0.00 H new ATOM 0 HB2 LEU p 22 3.409 0.949 -2.273 1.00 0.00 H new ATOM 0 HB3 LEU p 22 4.793 1.186 -3.321 1.00 0.00 H new ATOM 0 HG LEU p 22 2.667 -0.953 -3.647 1.00 0.00 H new ATOM 0 HD11 LEU p 22 2.116 0.413 -5.637 1.00 0.00 H new ATOM 0 HD12 LEU p 22 1.973 1.371 -4.144 1.00 0.00 H new ATOM 0 HD13 LEU p 22 3.396 1.567 -5.194 1.00 0.00 H new ATOM 0 HD21 LEU p 22 3.753 -1.456 -5.763 1.00 0.00 H new ATOM 0 HD22 LEU p 22 5.060 -0.312 -5.374 1.00 0.00 H new ATOM 0 HD23 LEU p 22 4.832 -1.773 -4.384 1.00 0.00 H new ATOM 368 N ALA p 23 7.034 0.779 -2.221 1.00 0.00 N ATOM 369 CA ALA p 23 8.411 1.008 -2.695 1.00 0.00 C ATOM 370 C ALA p 23 9.506 0.667 -1.678 1.00 0.00 C ATOM 371 O ALA p 23 10.675 0.591 -2.057 1.00 0.00 O ATOM 372 CB ALA p 23 8.584 2.430 -3.220 1.00 0.00 C ATOM 0 H ALA p 23 6.617 1.565 -1.722 1.00 0.00 H new ATOM 0 HA ALA p 23 8.547 0.301 -3.513 1.00 0.00 H new ATOM 0 HB1 ALA p 23 9.609 2.569 -3.562 1.00 0.00 H new ATOM 0 HB2 ALA p 23 7.898 2.597 -4.051 1.00 0.00 H new ATOM 0 HB3 ALA p 23 8.368 3.141 -2.423 1.00 0.00 H new ATOM 378 N GLN p 24 9.146 0.443 -0.406 1.00 0.00 N ATOM 379 CA GLN p 24 10.133 0.116 0.626 1.00 0.00 C ATOM 380 C GLN p 24 10.297 -1.401 0.725 1.00 0.00 C ATOM 381 O GLN p 24 11.346 -1.895 1.097 1.00 0.00 O ATOM 382 CB GLN p 24 9.703 0.736 1.952 1.00 0.00 C ATOM 383 CG GLN p 24 10.116 -0.031 3.195 1.00 0.00 C ATOM 384 CD GLN p 24 11.175 0.683 4.012 1.00 0.00 C ATOM 385 OE1 GLN p 24 10.861 1.455 4.918 1.00 0.00 O ATOM 386 NE2 GLN p 24 12.439 0.430 3.693 1.00 0.00 N ATOM 0 H GLN p 24 8.183 0.483 -0.071 1.00 0.00 H new ATOM 0 HA GLN p 24 11.106 0.532 0.363 1.00 0.00 H new ATOM 0 HB2 GLN p 24 10.116 1.743 2.013 1.00 0.00 H new ATOM 0 HB3 GLN p 24 8.618 0.836 1.952 1.00 0.00 H new ATOM 0 HG2 GLN p 24 9.238 -0.200 3.818 1.00 0.00 H new ATOM 0 HG3 GLN p 24 10.492 -1.011 2.901 1.00 0.00 H new ATOM 0 HE21 GLN p 24 12.654 -0.217 2.934 1.00 0.00 H new ATOM 0 HE22 GLN p 24 13.195 0.883 4.207 1.00 0.00 H new ATOM 395 N LEU p 25 9.210 -2.080 0.383 1.00 0.00 N ATOM 396 CA LEU p 25 9.074 -3.538 0.337 1.00 0.00 C ATOM 397 C LEU p 25 9.796 -4.027 -0.903 1.00 0.00 C ATOM 398 O LEU p 25 10.373 -5.104 -0.943 1.00 0.00 O ATOM 399 CB LEU p 25 7.585 -3.854 0.222 1.00 0.00 C ATOM 400 CG LEU p 25 7.079 -5.196 0.742 1.00 0.00 C ATOM 401 CD1 LEU p 25 5.590 -5.245 0.499 1.00 0.00 C ATOM 402 CD2 LEU p 25 7.758 -6.364 0.049 1.00 0.00 C ATOM 0 H LEU p 25 8.348 -1.605 0.114 1.00 0.00 H new ATOM 0 HA LEU p 25 9.492 -4.017 1.223 1.00 0.00 H new ATOM 0 HB2 LEU p 25 7.039 -3.069 0.746 1.00 0.00 H new ATOM 0 HB3 LEU p 25 7.312 -3.783 -0.831 1.00 0.00 H new ATOM 0 HG LEU p 25 7.309 -5.282 1.804 1.00 0.00 H new ATOM 0 HD11 LEU p 25 5.193 -6.194 0.860 1.00 0.00 H new ATOM 0 HD12 LEU p 25 5.107 -4.425 1.030 1.00 0.00 H new ATOM 0 HD13 LEU p 25 5.392 -5.152 -0.569 1.00 0.00 H new ATOM 0 HD21 LEU p 25 7.369 -7.300 0.449 1.00 0.00 H new ATOM 0 HD22 LEU p 25 7.560 -6.317 -1.022 1.00 0.00 H new ATOM 0 HD23 LEU p 25 8.833 -6.315 0.222 1.00 0.00 H new ATOM 414 N GLU p 26 9.668 -3.175 -1.908 1.00 0.00 N ATOM 415 CA GLU p 26 10.276 -3.250 -3.197 1.00 0.00 C ATOM 416 C GLU p 26 11.752 -2.981 -3.012 1.00 0.00 C ATOM 417 O GLU p 26 12.593 -3.461 -3.752 1.00 0.00 O ATOM 418 CB GLU p 26 9.640 -2.141 -3.999 1.00 0.00 C ATOM 419 CG GLU p 26 10.058 -2.106 -5.427 1.00 0.00 C ATOM 420 CD GLU p 26 8.930 -2.405 -6.395 1.00 0.00 C ATOM 421 OE1 GLU p 26 8.734 -3.592 -6.727 1.00 0.00 O ATOM 422 OE2 GLU p 26 8.242 -1.453 -6.817 1.00 0.00 O ATOM 0 H GLU p 26 9.081 -2.346 -1.819 1.00 0.00 H new ATOM 0 HA GLU p 26 10.147 -4.213 -3.690 1.00 0.00 H new ATOM 0 HB2 GLU p 26 8.556 -2.248 -3.951 1.00 0.00 H new ATOM 0 HB3 GLU p 26 9.886 -1.185 -3.536 1.00 0.00 H new ATOM 0 HG2 GLU p 26 10.469 -1.122 -5.653 1.00 0.00 H new ATOM 0 HG3 GLU p 26 10.859 -2.829 -5.581 1.00 0.00 H new ATOM 429 N LYS p 27 11.977 -2.105 -2.036 1.00 0.00 N ATOM 430 CA LYS p 27 13.310 -1.721 -1.561 1.00 0.00 C ATOM 431 C LYS p 27 13.848 -2.826 -0.676 1.00 0.00 C ATOM 432 O LYS p 27 15.052 -3.088 -0.655 1.00 0.00 O ATOM 433 CB LYS p 27 13.291 -0.401 -0.799 1.00 0.00 C ATOM 434 CG LYS p 27 13.570 0.811 -1.671 1.00 0.00 C ATOM 435 CD LYS p 27 13.793 2.062 -0.837 1.00 0.00 C ATOM 436 CE LYS p 27 14.083 3.272 -1.711 1.00 0.00 C ATOM 437 NZ LYS p 27 14.305 4.501 -0.902 1.00 0.00 N ATOM 0 H LYS p 27 11.223 -1.630 -1.540 1.00 0.00 H new ATOM 0 HA LYS p 27 13.955 -1.578 -2.428 1.00 0.00 H new ATOM 0 HB2 LYS p 27 12.317 -0.280 -0.324 1.00 0.00 H new ATOM 0 HB3 LYS p 27 14.032 -0.442 -0.001 1.00 0.00 H new ATOM 0 HG2 LYS p 27 14.449 0.622 -2.287 1.00 0.00 H new ATOM 0 HG3 LYS p 27 12.733 0.971 -2.351 1.00 0.00 H new ATOM 0 HD2 LYS p 27 12.911 2.256 -0.227 1.00 0.00 H new ATOM 0 HD3 LYS p 27 14.625 1.900 -0.151 1.00 0.00 H new ATOM 0 HE2 LYS p 27 14.964 3.076 -2.322 1.00 0.00 H new ATOM 0 HE3 LYS p 27 13.250 3.433 -2.395 1.00 0.00 H new ATOM 0 HZ1 LYS p 27 14.499 5.303 -1.535 1.00 0.00 H new ATOM 0 HZ2 LYS p 27 13.455 4.703 -0.338 1.00 0.00 H new ATOM 0 HZ3 LYS p 27 15.116 4.357 -0.267 1.00 0.00 H new ATOM 451 N GLU p 28 12.927 -3.469 0.065 1.00 0.00 N ATOM 452 CA GLU p 28 13.283 -4.637 0.898 1.00 0.00 C ATOM 453 C GLU p 28 13.529 -5.765 -0.063 1.00 0.00 C ATOM 454 O GLU p 28 14.378 -6.638 0.143 1.00 0.00 O ATOM 455 CB GLU p 28 12.179 -5.051 1.873 1.00 0.00 C ATOM 456 CG GLU p 28 11.760 -3.952 2.813 1.00 0.00 C ATOM 457 CD GLU p 28 12.076 -4.256 4.264 1.00 0.00 C ATOM 458 OE1 GLU p 28 13.189 -3.909 4.715 1.00 0.00 O ATOM 459 OE2 GLU p 28 11.211 -4.840 4.950 1.00 0.00 O ATOM 0 H GLU p 28 11.942 -3.206 0.106 1.00 0.00 H new ATOM 0 HA GLU p 28 14.148 -4.386 1.511 1.00 0.00 H new ATOM 0 HB2 GLU p 28 11.310 -5.382 1.305 1.00 0.00 H new ATOM 0 HB3 GLU p 28 12.523 -5.905 2.457 1.00 0.00 H new ATOM 0 HG2 GLU p 28 12.259 -3.027 2.525 1.00 0.00 H new ATOM 0 HG3 GLU p 28 10.688 -3.782 2.709 1.00 0.00 H new ATOM 466 N LEU p 29 12.733 -5.700 -1.129 1.00 0.00 N ATOM 467 CA LEU p 29 12.830 -6.634 -2.255 1.00 0.00 C ATOM 468 C LEU p 29 14.117 -6.393 -3.010 1.00 0.00 C ATOM 469 O LEU p 29 14.877 -7.318 -3.312 1.00 0.00 O ATOM 470 CB LEU p 29 11.669 -6.410 -3.211 1.00 0.00 C ATOM 471 CG LEU p 29 10.745 -7.587 -3.445 1.00 0.00 C ATOM 472 CD1 LEU p 29 9.907 -7.830 -2.208 1.00 0.00 C ATOM 473 CD2 LEU p 29 9.876 -7.283 -4.642 1.00 0.00 C ATOM 0 H LEU p 29 12.001 -4.998 -1.239 1.00 0.00 H new ATOM 0 HA LEU p 29 12.806 -7.652 -1.866 1.00 0.00 H new ATOM 0 HB2 LEU p 29 11.073 -5.579 -2.834 1.00 0.00 H new ATOM 0 HB3 LEU p 29 12.076 -6.100 -4.174 1.00 0.00 H new ATOM 0 HG LEU p 29 11.319 -8.492 -3.643 1.00 0.00 H new ATOM 0 HD11 LEU p 29 9.243 -8.677 -2.379 1.00 0.00 H new ATOM 0 HD12 LEU p 29 10.560 -8.046 -1.363 1.00 0.00 H new ATOM 0 HD13 LEU p 29 9.313 -6.942 -1.990 1.00 0.00 H new ATOM 0 HD21 LEU p 29 9.203 -8.121 -4.825 1.00 0.00 H new ATOM 0 HD22 LEU p 29 9.291 -6.384 -4.448 1.00 0.00 H new ATOM 0 HD23 LEU p 29 10.505 -7.125 -5.518 1.00 0.00 H new ATOM 485 N GLN p 30 14.327 -5.114 -3.302 1.00 0.00 N ATOM 486 CA GLN p 30 15.526 -4.647 -4.032 1.00 0.00 C ATOM 487 C GLN p 30 16.821 -4.969 -3.275 1.00 0.00 C ATOM 488 O GLN p 30 17.832 -5.352 -3.872 1.00 0.00 O ATOM 489 CB GLN p 30 15.393 -3.138 -4.353 1.00 0.00 C ATOM 490 CG GLN p 30 16.394 -2.188 -3.679 1.00 0.00 C ATOM 491 CD GLN p 30 17.635 -1.949 -4.521 1.00 0.00 C ATOM 492 OE1 GLN p 30 18.676 -2.740 -4.288 1.00 0.00 O flip ATOM 493 NE2 GLN p 30 17.661 -1.053 -5.366 1.00 0.00 N flip ATOM 0 H GLN p 30 13.682 -4.367 -3.046 1.00 0.00 H new ATOM 0 HA GLN p 30 15.589 -5.190 -4.975 1.00 0.00 H new ATOM 0 HB2 GLN p 30 15.482 -3.013 -5.432 1.00 0.00 H new ATOM 0 HB3 GLN p 30 14.387 -2.821 -4.077 1.00 0.00 H new ATOM 0 HG2 GLN p 30 15.906 -1.234 -3.480 1.00 0.00 H new ATOM 0 HG3 GLN p 30 16.689 -2.602 -2.715 1.00 0.00 H new ATOM 0 HE21 GLN p 30 16.839 -0.467 -5.514 1.00 0.00 H new ATOM 0 HE22 GLN p 30 18.504 -0.897 -5.918 1.00 0.00 H new ATOM 502 N ALA p 31 16.749 -4.807 -1.963 1.00 0.00 N ATOM 503 CA ALA p 31 17.878 -5.065 -1.054 1.00 0.00 C ATOM 504 C ALA p 31 18.162 -6.565 -0.878 1.00 0.00 C ATOM 505 O ALA p 31 19.243 -6.944 -0.419 1.00 0.00 O ATOM 506 CB ALA p 31 17.619 -4.423 0.300 1.00 0.00 C ATOM 0 H ALA p 31 15.904 -4.491 -1.486 1.00 0.00 H new ATOM 0 HA ALA p 31 18.763 -4.620 -1.510 1.00 0.00 H new ATOM 0 HB1 ALA p 31 18.461 -4.621 0.963 1.00 0.00 H new ATOM 0 HB2 ALA p 31 17.500 -3.347 0.176 1.00 0.00 H new ATOM 0 HB3 ALA p 31 16.710 -4.841 0.733 1.00 0.00 H new ATOM 512 N TRP p 32 17.183 -7.405 -1.245 1.00 0.00 N ATOM 513 CA TRP p 32 17.318 -8.860 -1.138 1.00 0.00 C ATOM 514 C TRP p 32 17.811 -9.458 -2.464 1.00 0.00 C ATOM 515 O TRP p 32 18.748 -10.260 -2.475 1.00 0.00 O ATOM 516 CB TRP p 32 15.976 -9.487 -0.728 1.00 0.00 C ATOM 517 CG TRP p 32 16.115 -10.812 -0.029 1.00 0.00 C ATOM 518 CD1 TRP p 32 16.267 -12.033 -0.621 1.00 0.00 C ATOM 519 CD2 TRP p 32 16.113 -11.051 1.388 1.00 0.00 C ATOM 520 NE1 TRP p 32 16.360 -13.015 0.335 1.00 0.00 N ATOM 521 CE2 TRP p 32 16.269 -12.439 1.574 1.00 0.00 C ATOM 522 CE3 TRP p 32 15.996 -10.231 2.518 1.00 0.00 C ATOM 523 CZ2 TRP p 32 16.311 -13.022 2.839 1.00 0.00 C ATOM 524 CZ3 TRP p 32 16.038 -10.812 3.771 1.00 0.00 C ATOM 525 CH2 TRP p 32 16.194 -12.195 3.923 1.00 0.00 C ATOM 0 H TRP p 32 16.286 -7.097 -1.620 1.00 0.00 H new ATOM 0 HA TRP p 32 18.058 -9.085 -0.369 1.00 0.00 H new ATOM 0 HB2 TRP p 32 15.447 -8.795 -0.073 1.00 0.00 H new ATOM 0 HB3 TRP p 32 15.360 -9.619 -1.617 1.00 0.00 H new ATOM 0 HD1 TRP p 32 16.308 -12.202 -1.687 1.00 0.00 H new ATOM 0 HE1 TRP p 32 16.478 -14.011 0.152 1.00 0.00 H new ATOM 0 HE3 TRP p 32 15.875 -9.163 2.412 1.00 0.00 H new ATOM 0 HZ2 TRP p 32 16.432 -14.088 2.960 1.00 0.00 H new ATOM 0 HZ3 TRP p 32 15.949 -10.188 4.648 1.00 0.00 H new ATOM 0 HH2 TRP p 32 16.223 -12.618 4.916 1.00 0.00 H new ATOM 536 N ASN p 33 17.167 -9.042 -3.580 1.00 0.00 N ATOM 537 CA ASN p 33 17.494 -9.497 -4.955 1.00 0.00 C ATOM 538 C ASN p 33 17.192 -10.996 -5.160 1.00 0.00 C ATOM 539 O ASN p 33 16.302 -11.346 -5.941 1.00 0.00 O ATOM 540 CB ASN p 33 18.960 -9.172 -5.327 1.00 0.00 C ATOM 541 CG ASN p 33 19.166 -9.009 -6.823 1.00 0.00 C ATOM 542 OD1 ASN p 33 19.457 -9.974 -7.530 1.00 0.00 O ATOM 543 ND2 ASN p 33 19.017 -7.783 -7.311 1.00 0.00 N ATOM 0 H ASN p 33 16.397 -8.374 -3.552 1.00 0.00 H new ATOM 0 HA ASN p 33 16.844 -8.941 -5.631 1.00 0.00 H new ATOM 0 HB2 ASN p 33 19.264 -8.255 -4.821 1.00 0.00 H new ATOM 0 HB3 ASN p 33 19.608 -9.968 -4.960 1.00 0.00 H new ATOM 0 HD21 ASN p 33 19.144 -7.612 -8.309 1.00 0.00 H new ATOM 0 HD22 ASN p 33 18.775 -7.012 -6.688 1.00 0.00 H new ATOM 550 N CYS p 34 17.936 -11.866 -4.459 1.00 0.00 N ATOM 551 CA CYS p 34 17.756 -13.316 -4.564 1.00 0.00 C ATOM 552 C CYS p 34 17.769 -13.968 -3.182 1.00 0.00 C ATOM 553 O CYS p 34 18.372 -13.438 -2.244 1.00 0.00 O ATOM 554 CB CYS p 34 18.856 -13.927 -5.441 1.00 0.00 C ATOM 555 SG CYS p 34 18.636 -15.689 -5.790 1.00 0.00 S ATOM 0 H CYS p 34 18.671 -11.584 -3.811 1.00 0.00 H new ATOM 0 HA CYS p 34 16.787 -13.504 -5.026 1.00 0.00 H new ATOM 0 HB2 CYS p 34 18.896 -13.384 -6.385 1.00 0.00 H new ATOM 0 HB3 CYS p 34 19.818 -13.783 -4.950 1.00 0.00 H new ATOM 0 HG CYS p 34 19.613 -16.109 -6.538 1.00 0.00 H new ATOM 561 N ILE p 35 17.101 -15.123 -3.073 1.00 0.00 N ATOM 562 CA ILE p 35 17.025 -15.866 -1.810 1.00 0.00 C ATOM 563 C ILE p 35 18.092 -16.963 -1.743 1.00 0.00 C ATOM 564 O ILE p 35 18.248 -17.746 -2.684 1.00 0.00 O ATOM 565 CB ILE p 35 15.612 -16.484 -1.557 1.00 0.00 C ATOM 566 CG1 ILE p 35 15.038 -17.190 -2.805 1.00 0.00 C ATOM 567 CG2 ILE p 35 14.649 -15.409 -1.077 1.00 0.00 C ATOM 568 CD1 ILE p 35 15.349 -18.670 -2.867 1.00 0.00 C ATOM 0 H ILE p 35 16.604 -15.564 -3.847 1.00 0.00 H new ATOM 0 HA ILE p 35 17.213 -15.137 -1.021 1.00 0.00 H new ATOM 0 HB ILE p 35 15.731 -17.245 -0.785 1.00 0.00 H new ATOM 0 HG12 ILE p 35 13.957 -17.054 -2.822 1.00 0.00 H new ATOM 0 HG13 ILE p 35 15.434 -16.707 -3.698 1.00 0.00 H new ATOM 0 HG21 ILE p 35 13.668 -15.851 -0.904 1.00 0.00 H new ATOM 0 HG22 ILE p 35 15.021 -14.976 -0.149 1.00 0.00 H new ATOM 0 HG23 ILE p 35 14.567 -14.629 -1.834 1.00 0.00 H new ATOM 0 HD11 ILE p 35 14.913 -19.096 -3.771 1.00 0.00 H new ATOM 0 HD12 ILE p 35 16.429 -18.814 -2.882 1.00 0.00 H new ATOM 0 HD13 ILE p 35 14.929 -19.167 -1.993 1.00 0.00 H new ATOM 580 N CYS p 36 18.826 -16.995 -0.625 1.00 0.00 N ATOM 581 CA CYS p 36 19.885 -17.983 -0.409 1.00 0.00 C ATOM 582 C CYS p 36 19.763 -18.616 0.974 1.00 0.00 C ATOM 583 O CYS p 36 19.254 -17.989 1.908 1.00 0.00 O ATOM 584 CB CYS p 36 21.262 -17.330 -0.564 1.00 0.00 C ATOM 585 SG CYS p 36 21.556 -16.602 -2.192 1.00 0.00 S ATOM 0 H CYS p 36 18.703 -16.342 0.149 1.00 0.00 H new ATOM 0 HA CYS p 36 19.776 -18.766 -1.159 1.00 0.00 H new ATOM 0 HB2 CYS p 36 21.371 -16.554 0.194 1.00 0.00 H new ATOM 0 HB3 CYS p 36 22.031 -18.078 -0.368 1.00 0.00 H new ATOM 0 HG CYS p 36 22.744 -16.074 -2.223 1.00 0.00 H new ATOM 591 N ASP p 37 20.237 -19.861 1.093 1.00 0.00 N ATOM 592 CA ASP p 37 20.189 -20.596 2.359 1.00 0.00 C ATOM 593 C ASP p 37 21.521 -20.489 3.106 1.00 0.00 C ATOM 594 O ASP p 37 22.537 -21.052 2.679 1.00 0.00 O ATOM 595 CB ASP p 37 19.830 -22.068 2.115 1.00 0.00 C ATOM 596 CG ASP p 37 18.390 -22.252 1.671 1.00 0.00 C ATOM 597 OD1 ASP p 37 17.516 -22.422 2.548 1.00 0.00 O ATOM 598 OD2 ASP p 37 18.138 -22.226 0.449 1.00 0.00 O ATOM 0 H ASP p 37 20.660 -20.381 0.324 1.00 0.00 H new ATOM 0 HA ASP p 37 19.414 -20.147 2.980 1.00 0.00 H new ATOM 0 HB2 ASP p 37 20.496 -22.479 1.356 1.00 0.00 H new ATOM 0 HB3 ASP p 37 20.000 -22.636 3.030 1.00 0.00 H new ATOM 603 N ILE p 38 21.503 -19.743 4.217 1.00 0.00 N ATOM 604 CA ILE p 38 22.695 -19.539 5.054 1.00 0.00 C ATOM 605 C ILE p 38 22.317 -19.340 6.525 1.00 0.00 C ATOM 606 O ILE p 38 22.946 -19.922 7.414 1.00 0.00 O ATOM 607 CB ILE p 38 23.583 -18.348 4.573 1.00 0.00 C ATOM 608 CG1 ILE p 38 22.752 -17.172 4.023 1.00 0.00 C ATOM 609 CG2 ILE p 38 24.568 -18.826 3.518 1.00 0.00 C ATOM 610 CD1 ILE p 38 22.423 -16.115 5.057 1.00 0.00 C ATOM 0 H ILE p 38 20.669 -19.266 4.561 1.00 0.00 H new ATOM 0 HA ILE p 38 23.285 -20.450 4.953 1.00 0.00 H new ATOM 0 HB ILE p 38 24.123 -17.979 5.445 1.00 0.00 H new ATOM 0 HG12 ILE p 38 23.299 -16.706 3.203 1.00 0.00 H new ATOM 0 HG13 ILE p 38 21.823 -17.560 3.607 1.00 0.00 H new ATOM 0 HG21 ILE p 38 25.183 -17.989 3.188 1.00 0.00 H new ATOM 0 HG22 ILE p 38 25.207 -19.601 3.941 1.00 0.00 H new ATOM 0 HG23 ILE p 38 24.021 -19.232 2.667 1.00 0.00 H new ATOM 0 HD11 ILE p 38 21.837 -15.322 4.593 1.00 0.00 H new ATOM 0 HD12 ILE p 38 21.848 -16.565 5.867 1.00 0.00 H new ATOM 0 HD13 ILE p 38 23.347 -15.697 5.457 1.00 0.00 H new ATOM 622 N GLU p 39 21.290 -18.518 6.768 1.00 0.00 N ATOM 623 CA GLU p 39 20.811 -18.241 8.125 1.00 0.00 C ATOM 624 C GLU p 39 19.299 -18.417 8.206 1.00 0.00 C ATOM 625 O GLU p 39 18.561 -17.876 7.376 1.00 0.00 O ATOM 626 CB GLU p 39 21.193 -16.821 8.565 1.00 0.00 C ATOM 627 CG GLU p 39 22.693 -16.594 8.689 1.00 0.00 C ATOM 628 CD GLU p 39 23.031 -15.272 9.349 1.00 0.00 C ATOM 629 OE1 GLU p 39 23.156 -15.244 10.591 1.00 0.00 O ATOM 630 OE2 GLU p 39 23.172 -14.265 8.623 1.00 0.00 O ATOM 0 H GLU p 39 20.772 -18.031 6.037 1.00 0.00 H new ATOM 0 HA GLU p 39 21.289 -18.953 8.798 1.00 0.00 H new ATOM 0 HB2 GLU p 39 20.786 -16.108 7.848 1.00 0.00 H new ATOM 0 HB3 GLU p 39 20.723 -16.611 9.526 1.00 0.00 H new ATOM 0 HG2 GLU p 39 23.133 -17.407 9.267 1.00 0.00 H new ATOM 0 HG3 GLU p 39 23.145 -16.627 7.698 1.00 0.00 H new ATOM 637 N ASN p 40 18.849 -19.175 9.211 1.00 0.00 N ATOM 638 CA ASN p 40 17.423 -19.435 9.413 1.00 0.00 C ATOM 639 C ASN p 40 17.001 -19.088 10.838 1.00 0.00 C ATOM 640 O ASN p 40 17.623 -19.539 11.805 1.00 0.00 O ATOM 641 CB ASN p 40 17.096 -20.903 9.115 1.00 0.00 C ATOM 642 CG ASN p 40 17.194 -21.235 7.637 1.00 0.00 C ATOM 643 OD1 ASN p 40 16.216 -21.123 6.898 1.00 0.00 O ATOM 644 ND2 ASN p 40 18.378 -21.648 7.201 1.00 0.00 N ATOM 0 H ASN p 40 19.456 -19.620 9.899 1.00 0.00 H new ATOM 0 HA ASN p 40 16.867 -18.801 8.723 1.00 0.00 H new ATOM 0 HB2 ASN p 40 17.778 -21.544 9.673 1.00 0.00 H new ATOM 0 HB3 ASN p 40 16.089 -21.126 9.468 1.00 0.00 H new ATOM 0 HD21 ASN p 40 18.504 -21.887 6.218 1.00 0.00 H new ATOM 0 HD22 ASN p 40 19.161 -21.726 7.849 1.00 0.00 H new ATOM 651 N CYS p 41 15.941 -18.281 10.949 1.00 0.00 N ATOM 652 CA CYS p 41 15.413 -17.858 12.248 1.00 0.00 C ATOM 653 C CYS p 41 13.899 -18.073 12.323 1.00 0.00 C ATOM 654 O CYS p 41 13.391 -18.588 13.323 1.00 0.00 O ATOM 655 CB CYS p 41 15.751 -16.387 12.510 1.00 0.00 C ATOM 656 SG CYS p 41 17.524 -16.031 12.533 1.00 0.00 S ATOM 0 H CYS p 41 15.430 -17.906 10.150 1.00 0.00 H new ATOM 0 HA CYS p 41 15.883 -18.470 13.017 1.00 0.00 H new ATOM 0 HB2 CYS p 41 15.278 -15.774 11.743 1.00 0.00 H new ATOM 0 HB3 CYS p 41 15.319 -16.091 13.466 1.00 0.00 H new ATOM 0 HG CYS p 41 17.709 -14.764 12.759 1.00 0.00 H new ATOM 662 N SER p 42 13.189 -17.674 11.257 1.00 0.00 N ATOM 663 CA SER p 42 11.734 -17.818 11.185 1.00 0.00 C ATOM 664 C SER p 42 11.312 -18.401 9.839 1.00 0.00 C ATOM 665 O SER p 42 11.728 -17.908 8.786 1.00 0.00 O ATOM 666 CB SER p 42 11.053 -16.464 11.404 1.00 0.00 C ATOM 667 OG SER p 42 11.418 -15.906 12.655 1.00 0.00 O ATOM 0 H SER p 42 13.606 -17.247 10.430 1.00 0.00 H new ATOM 0 HA SER p 42 11.422 -18.504 11.973 1.00 0.00 H new ATOM 0 HB2 SER p 42 11.331 -15.780 10.602 1.00 0.00 H new ATOM 0 HB3 SER p 42 9.971 -16.586 11.358 1.00 0.00 H new ATOM 0 HG SER p 42 10.972 -15.041 12.770 1.00 0.00 H new ATOM 673 N ASN p 43 10.487 -19.452 9.889 1.00 0.00 N ATOM 674 CA ASN p 43 9.996 -20.121 8.679 1.00 0.00 C ATOM 675 C ASN p 43 8.480 -20.320 8.729 1.00 0.00 C ATOM 676 O ASN p 43 7.793 -20.130 7.722 1.00 0.00 O ATOM 677 CB ASN p 43 10.695 -21.474 8.490 1.00 0.00 C ATOM 678 CG ASN p 43 12.159 -21.329 8.118 1.00 0.00 C ATOM 679 OD1 ASN p 43 13.030 -21.276 8.986 1.00 0.00 O ATOM 680 ND2 ASN p 43 12.435 -21.263 6.820 1.00 0.00 N ATOM 0 H ASN p 43 10.144 -19.860 10.759 1.00 0.00 H new ATOM 0 HA ASN p 43 10.228 -19.478 7.830 1.00 0.00 H new ATOM 0 HB2 ASN p 43 10.614 -22.052 9.410 1.00 0.00 H new ATOM 0 HB3 ASN p 43 10.181 -22.039 7.712 1.00 0.00 H new ATOM 0 HD21 ASN p 43 13.401 -21.164 6.508 1.00 0.00 H new ATOM 0 HD22 ASN p 43 11.681 -21.311 6.135 1.00 0.00 H new ATOM 687 N MET p 44 7.971 -20.704 9.907 1.00 0.00 N ATOM 688 CA MET p 44 6.538 -20.938 10.104 1.00 0.00 C ATOM 689 C MET p 44 5.835 -19.699 10.681 1.00 0.00 C ATOM 690 O MET p 44 4.614 -19.704 10.877 1.00 0.00 O ATOM 691 CB MET p 44 6.330 -22.141 11.032 1.00 0.00 C ATOM 692 CG MET p 44 5.264 -23.112 10.549 1.00 0.00 C ATOM 693 SD MET p 44 3.614 -22.384 10.523 1.00 0.00 S ATOM 694 CE MET p 44 2.645 -23.761 9.910 1.00 0.00 C ATOM 0 H MET p 44 8.536 -20.859 10.742 1.00 0.00 H new ATOM 0 HA MET p 44 6.095 -21.147 9.130 1.00 0.00 H new ATOM 0 HB2 MET p 44 7.274 -22.675 11.136 1.00 0.00 H new ATOM 0 HB3 MET p 44 6.057 -21.780 12.024 1.00 0.00 H new ATOM 0 HG2 MET p 44 5.520 -23.456 9.547 1.00 0.00 H new ATOM 0 HG3 MET p 44 5.259 -23.989 11.196 1.00 0.00 H new ATOM 0 HE1 MET p 44 1.598 -23.466 9.838 1.00 0.00 H new ATOM 0 HE2 MET p 44 3.008 -24.051 8.924 1.00 0.00 H new ATOM 0 HE3 MET p 44 2.738 -24.604 10.594 1.00 0.00 H new ATOM 704 N ALA p 45 6.612 -18.636 10.935 1.00 0.00 N ATOM 705 CA ALA p 45 6.077 -17.388 11.490 1.00 0.00 C ATOM 706 C ALA p 45 5.573 -16.420 10.396 1.00 0.00 C ATOM 707 O ALA p 45 4.470 -15.884 10.541 1.00 0.00 O ATOM 708 CB ALA p 45 7.117 -16.706 12.373 1.00 0.00 C ATOM 0 H ALA p 45 7.617 -18.618 10.763 1.00 0.00 H new ATOM 0 HA ALA p 45 5.213 -17.655 12.099 1.00 0.00 H new ATOM 0 HB1 ALA p 45 6.703 -15.782 12.776 1.00 0.00 H new ATOM 0 HB2 ALA p 45 7.389 -17.370 13.194 1.00 0.00 H new ATOM 0 HB3 ALA p 45 8.004 -16.478 11.781 1.00 0.00 H new ATOM 714 N PRO p 46 6.346 -16.163 9.283 1.00 0.00 N ATOM 715 CA PRO p 46 5.908 -15.243 8.213 1.00 0.00 C ATOM 716 C PRO p 46 4.883 -15.875 7.270 1.00 0.00 C ATOM 717 O PRO p 46 4.867 -17.097 7.090 1.00 0.00 O ATOM 718 CB PRO p 46 7.206 -14.925 7.445 1.00 0.00 C ATOM 719 CG PRO p 46 8.314 -15.583 8.203 1.00 0.00 C ATOM 720 CD PRO p 46 7.683 -16.710 8.963 1.00 0.00 C ATOM 0 HA PRO p 46 5.412 -14.365 8.627 1.00 0.00 H new ATOM 0 HB2 PRO p 46 7.156 -15.303 6.424 1.00 0.00 H new ATOM 0 HB3 PRO p 46 7.365 -13.849 7.380 1.00 0.00 H new ATOM 0 HG2 PRO p 46 9.084 -15.952 7.526 1.00 0.00 H new ATOM 0 HG3 PRO p 46 8.796 -14.878 8.880 1.00 0.00 H new ATOM 0 HD2 PRO p 46 7.618 -17.619 8.364 1.00 0.00 H new ATOM 0 HD3 PRO p 46 8.246 -16.960 9.862 1.00 0.00 H new ATOM 728 N LEU p 47 4.034 -15.030 6.679 1.00 0.00 N ATOM 729 CA LEU p 47 2.996 -15.488 5.751 1.00 0.00 C ATOM 730 C LEU p 47 3.124 -14.814 4.390 1.00 0.00 C ATOM 731 O LEU p 47 2.894 -15.440 3.352 1.00 0.00 O ATOM 732 CB LEU p 47 1.593 -15.231 6.333 1.00 0.00 C ATOM 733 CG LEU p 47 1.294 -15.892 7.689 1.00 0.00 C ATOM 734 CD1 LEU p 47 0.126 -15.198 8.370 1.00 0.00 C ATOM 735 CD2 LEU p 47 0.996 -17.378 7.519 1.00 0.00 C ATOM 0 H LEU p 47 4.045 -14.021 6.827 1.00 0.00 H new ATOM 0 HA LEU p 47 3.134 -16.560 5.614 1.00 0.00 H new ATOM 0 HB2 LEU p 47 1.457 -14.155 6.438 1.00 0.00 H new ATOM 0 HB3 LEU p 47 0.853 -15.577 5.611 1.00 0.00 H new ATOM 0 HG LEU p 47 2.180 -15.791 8.316 1.00 0.00 H new ATOM 0 HD11 LEU p 47 -0.073 -15.677 9.328 1.00 0.00 H new ATOM 0 HD12 LEU p 47 0.371 -14.149 8.533 1.00 0.00 H new ATOM 0 HD13 LEU p 47 -0.759 -15.270 7.737 1.00 0.00 H new ATOM 0 HD21 LEU p 47 0.788 -17.821 8.493 1.00 0.00 H new ATOM 0 HD22 LEU p 47 0.129 -17.503 6.871 1.00 0.00 H new ATOM 0 HD23 LEU p 47 1.858 -17.873 7.072 1.00 0.00 H new ATOM 747 N TYR p 48 3.498 -13.539 4.417 1.00 0.00 N ATOM 748 CA TYR p 48 3.670 -12.728 3.220 1.00 0.00 C ATOM 749 C TYR p 48 5.104 -12.820 2.687 1.00 0.00 C ATOM 750 O TYR p 48 6.022 -12.183 3.219 1.00 0.00 O ATOM 751 CB TYR p 48 3.289 -11.267 3.517 1.00 0.00 C ATOM 752 CG TYR p 48 3.668 -10.772 4.903 1.00 0.00 C ATOM 753 CD1 TYR p 48 2.794 -10.915 5.974 1.00 0.00 C ATOM 754 CD2 TYR p 48 4.896 -10.166 5.135 1.00 0.00 C ATOM 755 CE1 TYR p 48 3.133 -10.466 7.235 1.00 0.00 C ATOM 756 CE2 TYR p 48 5.243 -9.715 6.394 1.00 0.00 C ATOM 757 CZ TYR p 48 4.358 -9.867 7.441 1.00 0.00 C ATOM 758 OH TYR p 48 4.698 -9.420 8.696 1.00 0.00 O ATOM 0 H TYR p 48 3.692 -13.035 5.282 1.00 0.00 H new ATOM 0 HA TYR p 48 3.008 -13.114 2.445 1.00 0.00 H new ATOM 0 HB2 TYR p 48 3.766 -10.625 2.776 1.00 0.00 H new ATOM 0 HB3 TYR p 48 2.212 -11.155 3.390 1.00 0.00 H new ATOM 0 HD1 TYR p 48 1.834 -11.385 5.818 1.00 0.00 H new ATOM 0 HD2 TYR p 48 5.591 -10.045 4.317 1.00 0.00 H new ATOM 0 HE1 TYR p 48 2.442 -10.583 8.056 1.00 0.00 H new ATOM 0 HE2 TYR p 48 6.202 -9.246 6.557 1.00 0.00 H new ATOM 0 HH TYR p 48 5.594 -9.024 8.671 1.00 0.00 H new ATOM 768 N SER p 49 5.290 -13.644 1.643 1.00 0.00 N ATOM 769 CA SER p 49 6.606 -13.837 1.026 1.00 0.00 C ATOM 770 C SER p 49 6.498 -14.158 -0.471 1.00 0.00 C ATOM 771 O SER p 49 7.033 -13.416 -1.300 1.00 0.00 O ATOM 772 CB SER p 49 7.391 -14.949 1.745 1.00 0.00 C ATOM 773 OG SER p 49 7.590 -14.632 3.112 1.00 0.00 O ATOM 0 H SER p 49 4.542 -14.186 1.210 1.00 0.00 H new ATOM 0 HA SER p 49 7.145 -12.895 1.129 1.00 0.00 H new ATOM 0 HB2 SER p 49 6.850 -15.892 1.662 1.00 0.00 H new ATOM 0 HB3 SER p 49 8.355 -15.091 1.257 1.00 0.00 H new ATOM 0 HG SER p 49 8.089 -15.355 3.546 1.00 0.00 H new ATOM 779 N ASP p 50 5.812 -15.261 -0.812 1.00 0.00 N ATOM 780 CA ASP p 50 5.673 -15.683 -2.213 1.00 0.00 C ATOM 781 C ASP p 50 4.336 -15.251 -2.845 1.00 0.00 C ATOM 782 O ASP p 50 4.319 -14.365 -3.704 1.00 0.00 O ATOM 783 CB ASP p 50 5.897 -17.207 -2.356 1.00 0.00 C ATOM 784 CG ASP p 50 5.110 -18.046 -1.358 1.00 0.00 C ATOM 785 OD1 ASP p 50 5.626 -18.286 -0.246 1.00 0.00 O ATOM 786 OD2 ASP p 50 3.979 -18.460 -1.690 1.00 0.00 O ATOM 0 H ASP p 50 5.348 -15.873 -0.140 1.00 0.00 H new ATOM 0 HA ASP p 50 6.452 -15.165 -2.772 1.00 0.00 H new ATOM 0 HB2 ASP p 50 5.623 -17.511 -3.366 1.00 0.00 H new ATOM 0 HB3 ASP p 50 6.959 -17.420 -2.236 1.00 0.00 H new ATOM 791 N GLN p 51 3.225 -15.875 -2.417 1.00 0.00 N ATOM 792 CA GLN p 51 1.895 -15.575 -2.963 1.00 0.00 C ATOM 793 C GLN p 51 1.158 -14.506 -2.154 1.00 0.00 C ATOM 794 O GLN p 51 0.602 -13.571 -2.727 1.00 0.00 O ATOM 795 CB GLN p 51 1.045 -16.854 -3.039 1.00 0.00 C ATOM 796 CG GLN p 51 1.480 -17.833 -4.128 1.00 0.00 C ATOM 797 CD GLN p 51 1.006 -17.428 -5.513 1.00 0.00 C ATOM 798 OE1 GLN p 51 -0.081 -17.810 -5.946 1.00 0.00 O ATOM 799 NE2 GLN p 51 1.825 -16.651 -6.214 1.00 0.00 N ATOM 0 H GLN p 51 3.225 -16.592 -1.692 1.00 0.00 H new ATOM 0 HA GLN p 51 2.047 -15.177 -3.966 1.00 0.00 H new ATOM 0 HB2 GLN p 51 1.084 -17.360 -2.075 1.00 0.00 H new ATOM 0 HB3 GLN p 51 0.005 -16.576 -3.211 1.00 0.00 H new ATOM 0 HG2 GLN p 51 2.567 -17.907 -4.129 1.00 0.00 H new ATOM 0 HG3 GLN p 51 1.093 -18.825 -3.893 1.00 0.00 H new ATOM 0 HE21 GLN p 51 2.717 -16.359 -5.815 1.00 0.00 H new ATOM 0 HE22 GLN p 51 1.562 -16.347 -7.151 1.00 0.00 H new ATOM 808 N ALA p 52 1.188 -14.644 -0.818 1.00 0.00 N ATOM 809 CA ALA p 52 0.510 -13.720 0.121 1.00 0.00 C ATOM 810 C ALA p 52 0.922 -12.237 -0.039 1.00 0.00 C ATOM 811 O ALA p 52 0.359 -11.364 0.615 1.00 0.00 O ATOM 812 CB ALA p 52 0.752 -14.190 1.549 1.00 0.00 C ATOM 0 H ALA p 52 1.685 -15.403 -0.351 1.00 0.00 H new ATOM 0 HA ALA p 52 -0.552 -13.751 -0.120 1.00 0.00 H new ATOM 0 HB1 ALA p 52 0.255 -13.513 2.244 1.00 0.00 H new ATOM 0 HB2 ALA p 52 0.352 -15.196 1.674 1.00 0.00 H new ATOM 0 HB3 ALA p 52 1.823 -14.198 1.753 1.00 0.00 H new ATOM 818 N LEU p 53 1.916 -11.983 -0.888 1.00 0.00 N ATOM 819 CA LEU p 53 2.430 -10.656 -1.161 1.00 0.00 C ATOM 820 C LEU p 53 1.749 -10.082 -2.389 1.00 0.00 C ATOM 821 O LEU p 53 0.950 -9.154 -2.300 1.00 0.00 O ATOM 822 CB LEU p 53 3.951 -10.729 -1.369 1.00 0.00 C ATOM 823 CG LEU p 53 4.812 -10.364 -0.159 1.00 0.00 C ATOM 824 CD1 LEU p 53 6.280 -10.566 -0.482 1.00 0.00 C ATOM 825 CD2 LEU p 53 4.556 -8.930 0.261 1.00 0.00 C ATOM 0 H LEU p 53 2.393 -12.716 -1.414 1.00 0.00 H new ATOM 0 HA LEU p 53 2.222 -10.002 -0.315 1.00 0.00 H new ATOM 0 HB2 LEU p 53 4.207 -11.742 -1.680 1.00 0.00 H new ATOM 0 HB3 LEU p 53 4.217 -10.066 -2.192 1.00 0.00 H new ATOM 0 HG LEU p 53 4.543 -11.018 0.670 1.00 0.00 H new ATOM 0 HD11 LEU p 53 6.883 -10.303 0.387 1.00 0.00 H new ATOM 0 HD12 LEU p 53 6.455 -11.610 -0.743 1.00 0.00 H new ATOM 0 HD13 LEU p 53 6.558 -9.931 -1.323 1.00 0.00 H new ATOM 0 HD21 LEU p 53 5.177 -8.687 1.123 1.00 0.00 H new ATOM 0 HD22 LEU p 53 4.801 -8.260 -0.563 1.00 0.00 H new ATOM 0 HD23 LEU p 53 3.505 -8.810 0.525 1.00 0.00 H new ATOM 837 N LYS p 54 2.064 -10.693 -3.530 1.00 0.00 N ATOM 838 CA LYS p 54 1.496 -10.331 -4.844 1.00 0.00 C ATOM 839 C LYS p 54 -0.035 -10.481 -4.860 1.00 0.00 C ATOM 840 O LYS p 54 -0.702 -10.027 -5.787 1.00 0.00 O ATOM 841 CB LYS p 54 2.110 -11.204 -5.944 1.00 0.00 C ATOM 842 CG LYS p 54 3.552 -10.850 -6.279 1.00 0.00 C ATOM 843 CD LYS p 54 4.104 -11.737 -7.386 1.00 0.00 C ATOM 844 CE LYS p 54 5.548 -11.389 -7.724 1.00 0.00 C ATOM 845 NZ LYS p 54 5.657 -10.103 -8.470 1.00 0.00 N ATOM 0 H LYS p 54 2.729 -11.465 -3.577 1.00 0.00 H new ATOM 0 HA LYS p 54 1.737 -9.284 -5.030 1.00 0.00 H new ATOM 0 HB2 LYS p 54 2.065 -12.248 -5.633 1.00 0.00 H new ATOM 0 HB3 LYS p 54 1.505 -11.114 -6.846 1.00 0.00 H new ATOM 0 HG2 LYS p 54 3.609 -9.806 -6.586 1.00 0.00 H new ATOM 0 HG3 LYS p 54 4.169 -10.954 -5.387 1.00 0.00 H new ATOM 0 HD2 LYS p 54 4.044 -12.781 -7.079 1.00 0.00 H new ATOM 0 HD3 LYS p 54 3.487 -11.631 -8.278 1.00 0.00 H new ATOM 0 HE2 LYS p 54 6.129 -11.324 -6.804 1.00 0.00 H new ATOM 0 HE3 LYS p 54 5.983 -12.191 -8.320 1.00 0.00 H new ATOM 0 HZ1 LYS p 54 6.657 -9.906 -8.679 1.00 0.00 H new ATOM 0 HZ2 LYS p 54 5.124 -10.172 -9.361 1.00 0.00 H new ATOM 0 HZ3 LYS p 54 5.266 -9.332 -7.892 1.00 0.00 H new ATOM 859 N LYS p 55 -0.550 -11.138 -3.815 1.00 0.00 N ATOM 860 CA LYS p 55 -1.965 -11.380 -3.608 1.00 0.00 C ATOM 861 C LYS p 55 -2.528 -10.307 -2.700 1.00 0.00 C ATOM 862 O LYS p 55 -3.630 -9.809 -2.928 1.00 0.00 O ATOM 863 CB LYS p 55 -2.188 -12.767 -3.006 1.00 0.00 C ATOM 864 CG LYS p 55 -2.445 -13.857 -4.039 1.00 0.00 C ATOM 865 CD LYS p 55 -3.928 -13.999 -4.357 1.00 0.00 C ATOM 866 CE LYS p 55 -4.172 -15.070 -5.407 1.00 0.00 C ATOM 867 NZ LYS p 55 -5.618 -15.204 -5.740 1.00 0.00 N ATOM 0 H LYS p 55 0.032 -11.524 -3.072 1.00 0.00 H new ATOM 0 HA LYS p 55 -2.481 -11.344 -4.567 1.00 0.00 H new ATOM 0 HB2 LYS p 55 -1.314 -13.040 -2.415 1.00 0.00 H new ATOM 0 HB3 LYS p 55 -3.035 -12.723 -2.321 1.00 0.00 H new ATOM 0 HG2 LYS p 55 -1.898 -13.627 -4.953 1.00 0.00 H new ATOM 0 HG3 LYS p 55 -2.061 -14.807 -3.668 1.00 0.00 H new ATOM 0 HD2 LYS p 55 -4.474 -14.249 -3.447 1.00 0.00 H new ATOM 0 HD3 LYS p 55 -4.318 -13.045 -4.711 1.00 0.00 H new ATOM 0 HE2 LYS p 55 -3.613 -14.827 -6.310 1.00 0.00 H new ATOM 0 HE3 LYS p 55 -3.793 -16.026 -5.045 1.00 0.00 H new ATOM 0 HZ1 LYS p 55 -5.741 -15.945 -6.460 1.00 0.00 H new ATOM 0 HZ2 LYS p 55 -6.149 -15.461 -4.884 1.00 0.00 H new ATOM 0 HZ3 LYS p 55 -5.974 -14.300 -6.109 1.00 0.00 H new ATOM 881 N LYS p 56 -1.747 -9.962 -1.660 1.00 0.00 N ATOM 882 CA LYS p 56 -2.133 -8.886 -0.713 1.00 0.00 C ATOM 883 C LYS p 56 -1.929 -7.514 -1.372 1.00 0.00 C ATOM 884 O LYS p 56 -2.384 -6.481 -0.878 1.00 0.00 O ATOM 885 CB LYS p 56 -1.330 -8.964 0.580 1.00 0.00 C ATOM 886 CG LYS p 56 -1.967 -9.856 1.634 1.00 0.00 C ATOM 887 CD LYS p 56 -1.232 -9.764 2.961 1.00 0.00 C ATOM 888 CE LYS p 56 -1.874 -10.653 4.015 1.00 0.00 C ATOM 889 NZ LYS p 56 -1.166 -10.566 5.323 1.00 0.00 N ATOM 0 H LYS p 56 -0.852 -10.405 -1.450 1.00 0.00 H new ATOM 0 HA LYS p 56 -3.185 -9.020 -0.463 1.00 0.00 H new ATOM 0 HB2 LYS p 56 -0.330 -9.336 0.356 1.00 0.00 H new ATOM 0 HB3 LYS p 56 -1.213 -7.960 0.987 1.00 0.00 H new ATOM 0 HG2 LYS p 56 -3.009 -9.569 1.774 1.00 0.00 H new ATOM 0 HG3 LYS p 56 -1.965 -10.889 1.287 1.00 0.00 H new ATOM 0 HD2 LYS p 56 -0.191 -10.055 2.823 1.00 0.00 H new ATOM 0 HD3 LYS p 56 -1.231 -8.730 3.307 1.00 0.00 H new ATOM 0 HE2 LYS p 56 -2.917 -10.364 4.147 1.00 0.00 H new ATOM 0 HE3 LYS p 56 -1.871 -11.687 3.669 1.00 0.00 H new ATOM 0 HZ1 LYS p 56 -1.635 -11.187 6.013 1.00 0.00 H new ATOM 0 HZ2 LYS p 56 -0.177 -10.866 5.203 1.00 0.00 H new ATOM 0 HZ3 LYS p 56 -1.191 -9.585 5.667 1.00 0.00 H new ATOM 903 N LEU p 57 -1.222 -7.571 -2.498 1.00 0.00 N ATOM 904 CA LEU p 57 -0.897 -6.451 -3.360 1.00 0.00 C ATOM 905 C LEU p 57 -1.963 -6.391 -4.414 1.00 0.00 C ATOM 906 O LEU p 57 -2.466 -5.329 -4.767 1.00 0.00 O ATOM 907 CB LEU p 57 0.457 -6.682 -4.021 1.00 0.00 C ATOM 908 CG LEU p 57 1.663 -5.963 -3.423 1.00 0.00 C ATOM 909 CD1 LEU p 57 1.912 -6.388 -1.981 1.00 0.00 C ATOM 910 CD2 LEU p 57 2.865 -6.271 -4.286 1.00 0.00 C ATOM 0 H LEU p 57 -0.842 -8.451 -2.847 1.00 0.00 H new ATOM 0 HA LEU p 57 -0.848 -5.523 -2.791 1.00 0.00 H new ATOM 0 HB2 LEU p 57 0.661 -7.753 -4.005 1.00 0.00 H new ATOM 0 HB3 LEU p 57 0.375 -6.389 -5.068 1.00 0.00 H new ATOM 0 HG LEU p 57 1.473 -4.890 -3.404 1.00 0.00 H new ATOM 0 HD11 LEU p 57 2.778 -5.855 -1.589 1.00 0.00 H new ATOM 0 HD12 LEU p 57 1.037 -6.152 -1.376 1.00 0.00 H new ATOM 0 HD13 LEU p 57 2.099 -7.461 -1.945 1.00 0.00 H new ATOM 0 HD21 LEU p 57 3.743 -5.768 -3.880 1.00 0.00 H new ATOM 0 HD22 LEU p 57 3.037 -7.347 -4.299 1.00 0.00 H new ATOM 0 HD23 LEU p 57 2.683 -5.920 -5.302 1.00 0.00 H new ATOM 922 N ALA p 58 -2.269 -7.595 -4.924 1.00 0.00 N ATOM 923 CA ALA p 58 -3.350 -7.781 -5.918 1.00 0.00 C ATOM 924 C ALA p 58 -4.705 -7.455 -5.282 1.00 0.00 C ATOM 925 O ALA p 58 -5.695 -7.198 -5.973 1.00 0.00 O ATOM 926 CB ALA p 58 -3.363 -9.197 -6.471 1.00 0.00 C ATOM 0 H ALA p 58 -1.786 -8.456 -4.668 1.00 0.00 H new ATOM 0 HA ALA p 58 -3.163 -7.100 -6.748 1.00 0.00 H new ATOM 0 HB1 ALA p 58 -4.169 -9.296 -7.198 1.00 0.00 H new ATOM 0 HB2 ALA p 58 -2.410 -9.407 -6.956 1.00 0.00 H new ATOM 0 HB3 ALA p 58 -3.519 -9.904 -5.656 1.00 0.00 H new ATOM 932 N GLN p 59 -4.706 -7.479 -3.944 1.00 0.00 N ATOM 933 CA GLN p 59 -5.841 -7.163 -3.121 1.00 0.00 C ATOM 934 C GLN p 59 -5.769 -5.682 -2.750 1.00 0.00 C ATOM 935 O GLN p 59 -6.780 -5.054 -2.468 1.00 0.00 O ATOM 936 CB GLN p 59 -5.777 -8.059 -1.882 1.00 0.00 C ATOM 937 CG GLN p 59 -6.615 -7.587 -0.722 1.00 0.00 C ATOM 938 CD GLN p 59 -7.556 -8.651 -0.194 1.00 0.00 C ATOM 939 OE1 GLN p 59 -7.202 -9.421 0.700 1.00 0.00 O ATOM 940 NE2 GLN p 59 -8.763 -8.701 -0.746 1.00 0.00 N ATOM 0 H GLN p 59 -3.879 -7.730 -3.402 1.00 0.00 H new ATOM 0 HA GLN p 59 -6.785 -7.339 -3.636 1.00 0.00 H new ATOM 0 HB2 GLN p 59 -6.097 -9.063 -2.159 1.00 0.00 H new ATOM 0 HB3 GLN p 59 -4.739 -8.133 -1.557 1.00 0.00 H new ATOM 0 HG2 GLN p 59 -5.958 -7.260 0.084 1.00 0.00 H new ATOM 0 HG3 GLN p 59 -7.196 -6.718 -1.031 1.00 0.00 H new ATOM 0 HE21 GLN p 59 -9.014 -8.043 -1.484 1.00 0.00 H new ATOM 0 HE22 GLN p 59 -9.439 -9.397 -0.432 1.00 0.00 H new ATOM 949 N LEU p 60 -4.534 -5.175 -2.753 1.00 0.00 N ATOM 950 CA LEU p 60 -4.215 -3.774 -2.459 1.00 0.00 C ATOM 951 C LEU p 60 -4.334 -2.943 -3.739 1.00 0.00 C ATOM 952 O LEU p 60 -4.305 -1.721 -3.715 1.00 0.00 O ATOM 953 CB LEU p 60 -2.791 -3.673 -1.877 1.00 0.00 C ATOM 954 CG LEU p 60 -2.345 -2.300 -1.322 1.00 0.00 C ATOM 955 CD1 LEU p 60 -1.611 -1.514 -2.397 1.00 0.00 C ATOM 956 CD2 LEU p 60 -3.534 -1.503 -0.804 1.00 0.00 C ATOM 0 H LEU p 60 -3.710 -5.738 -2.964 1.00 0.00 H new ATOM 0 HA LEU p 60 -4.918 -3.386 -1.722 1.00 0.00 H new ATOM 0 HB2 LEU p 60 -2.702 -4.406 -1.075 1.00 0.00 H new ATOM 0 HB3 LEU p 60 -2.087 -3.966 -2.656 1.00 0.00 H new ATOM 0 HG LEU p 60 -1.669 -2.476 -0.486 1.00 0.00 H new ATOM 0 HD11 LEU p 60 -1.302 -0.549 -1.995 1.00 0.00 H new ATOM 0 HD12 LEU p 60 -0.732 -2.072 -2.719 1.00 0.00 H new ATOM 0 HD13 LEU p 60 -2.273 -1.357 -3.249 1.00 0.00 H new ATOM 0 HD21 LEU p 60 -3.189 -0.543 -0.420 1.00 0.00 H new ATOM 0 HD22 LEU p 60 -4.242 -1.336 -1.616 1.00 0.00 H new ATOM 0 HD23 LEU p 60 -4.024 -2.059 -0.004 1.00 0.00 H new ATOM 968 N LYS p 61 -4.459 -3.677 -4.827 1.00 0.00 N ATOM 969 CA LYS p 61 -4.617 -3.178 -6.184 1.00 0.00 C ATOM 970 C LYS p 61 -6.103 -3.141 -6.461 1.00 0.00 C ATOM 971 O LYS p 61 -6.611 -2.329 -7.238 1.00 0.00 O ATOM 972 CB LYS p 61 -3.900 -4.113 -7.159 1.00 0.00 C ATOM 973 CG LYS p 61 -2.558 -3.587 -7.648 1.00 0.00 C ATOM 974 CD LYS p 61 -2.695 -2.818 -8.955 1.00 0.00 C ATOM 975 CE LYS p 61 -1.360 -2.249 -9.409 1.00 0.00 C ATOM 976 NZ LYS p 61 -1.484 -1.494 -10.686 1.00 0.00 N ATOM 0 H LYS p 61 -4.453 -4.696 -4.788 1.00 0.00 H new ATOM 0 HA LYS p 61 -4.184 -2.185 -6.304 1.00 0.00 H new ATOM 0 HB2 LYS p 61 -3.746 -5.077 -6.675 1.00 0.00 H new ATOM 0 HB3 LYS p 61 -4.545 -4.288 -8.020 1.00 0.00 H new ATOM 0 HG2 LYS p 61 -2.123 -2.938 -6.888 1.00 0.00 H new ATOM 0 HG3 LYS p 61 -1.870 -4.421 -7.787 1.00 0.00 H new ATOM 0 HD2 LYS p 61 -3.092 -3.478 -9.727 1.00 0.00 H new ATOM 0 HD3 LYS p 61 -3.413 -2.008 -8.828 1.00 0.00 H new ATOM 0 HE2 LYS p 61 -0.964 -1.591 -8.635 1.00 0.00 H new ATOM 0 HE3 LYS p 61 -0.643 -3.061 -9.535 1.00 0.00 H new ATOM 0 HZ1 LYS p 61 -0.553 -1.122 -10.961 1.00 0.00 H new ATOM 0 HZ2 LYS p 61 -1.838 -2.128 -11.431 1.00 0.00 H new ATOM 0 HZ3 LYS p 61 -2.148 -0.704 -10.559 1.00 0.00 H new ATOM 990 N TRP p 62 -6.773 -4.075 -5.777 1.00 0.00 N ATOM 991 CA TRP p 62 -8.215 -4.207 -5.789 1.00 0.00 C ATOM 992 C TRP p 62 -8.760 -3.273 -4.727 1.00 0.00 C ATOM 993 O TRP p 62 -9.880 -2.766 -4.833 1.00 0.00 O ATOM 994 CB TRP p 62 -8.631 -5.651 -5.501 1.00 0.00 C ATOM 995 CG TRP p 62 -9.591 -6.213 -6.510 1.00 0.00 C ATOM 996 CD1 TRP p 62 -9.273 -6.762 -7.720 1.00 0.00 C ATOM 997 CD2 TRP p 62 -11.022 -6.288 -6.399 1.00 0.00 C ATOM 998 NE1 TRP p 62 -10.414 -7.171 -8.368 1.00 0.00 N ATOM 999 CE2 TRP p 62 -11.499 -6.892 -7.579 1.00 0.00 C ATOM 1000 CE3 TRP p 62 -11.949 -5.904 -5.420 1.00 0.00 C ATOM 1001 CZ2 TRP p 62 -12.854 -7.120 -7.805 1.00 0.00 C ATOM 1002 CZ3 TRP p 62 -13.293 -6.133 -5.648 1.00 0.00 C ATOM 1003 CH2 TRP p 62 -13.734 -6.735 -6.831 1.00 0.00 C ATOM 0 H TRP p 62 -6.309 -4.769 -5.191 1.00 0.00 H new ATOM 0 HA TRP p 62 -8.613 -3.949 -6.770 1.00 0.00 H new ATOM 0 HB2 TRP p 62 -7.740 -6.278 -5.471 1.00 0.00 H new ATOM 0 HB3 TRP p 62 -9.087 -5.698 -4.512 1.00 0.00 H new ATOM 0 HD1 TRP p 62 -8.271 -6.860 -8.110 1.00 0.00 H new ATOM 0 HE1 TRP p 62 -10.448 -7.611 -9.288 1.00 0.00 H new ATOM 0 HE3 TRP p 62 -11.619 -5.437 -4.504 1.00 0.00 H new ATOM 0 HZ2 TRP p 62 -13.198 -7.585 -8.717 1.00 0.00 H new ATOM 0 HZ3 TRP p 62 -14.015 -5.842 -4.900 1.00 0.00 H new ATOM 0 HH2 TRP p 62 -14.791 -6.899 -6.979 1.00 0.00 H new ATOM 1014 N LYS p 63 -7.928 -3.063 -3.692 1.00 0.00 N ATOM 1015 CA LYS p 63 -8.264 -2.133 -2.608 1.00 0.00 C ATOM 1016 C LYS p 63 -7.782 -0.716 -2.940 1.00 0.00 C ATOM 1017 O LYS p 63 -8.170 0.241 -2.276 1.00 0.00 O ATOM 1018 CB LYS p 63 -7.678 -2.584 -1.273 1.00 0.00 C ATOM 1019 CG LYS p 63 -8.546 -3.592 -0.537 1.00 0.00 C ATOM 1020 CD LYS p 63 -8.050 -3.823 0.884 1.00 0.00 C ATOM 1021 CE LYS p 63 -8.973 -4.754 1.661 1.00 0.00 C ATOM 1022 NZ LYS p 63 -8.858 -6.169 1.205 1.00 0.00 N ATOM 0 H LYS p 63 -7.024 -3.523 -3.586 1.00 0.00 H new ATOM 0 HA LYS p 63 -9.350 -2.127 -2.514 1.00 0.00 H new ATOM 0 HB2 LYS p 63 -6.695 -3.022 -1.447 1.00 0.00 H new ATOM 0 HB3 LYS p 63 -7.530 -1.711 -0.637 1.00 0.00 H new ATOM 0 HG2 LYS p 63 -9.576 -3.236 -0.511 1.00 0.00 H new ATOM 0 HG3 LYS p 63 -8.549 -4.537 -1.081 1.00 0.00 H new ATOM 0 HD2 LYS p 63 -7.047 -4.248 0.854 1.00 0.00 H new ATOM 0 HD3 LYS p 63 -7.977 -2.867 1.403 1.00 0.00 H new ATOM 0 HE2 LYS p 63 -8.735 -4.696 2.723 1.00 0.00 H new ATOM 0 HE3 LYS p 63 -10.004 -4.420 1.546 1.00 0.00 H new ATOM 0 HZ1 LYS p 63 -9.574 -6.749 1.688 1.00 0.00 H new ATOM 0 HZ2 LYS p 63 -9.010 -6.216 0.177 1.00 0.00 H new ATOM 0 HZ3 LYS p 63 -7.909 -6.531 1.431 1.00 0.00 H new ATOM 1036 N LEU p 64 -6.915 -0.620 -3.962 1.00 0.00 N ATOM 1037 CA LEU p 64 -6.342 0.635 -4.457 1.00 0.00 C ATOM 1038 C LEU p 64 -7.294 1.341 -5.416 1.00 0.00 C ATOM 1039 O LEU p 64 -7.254 2.546 -5.579 1.00 0.00 O ATOM 1040 CB LEU p 64 -5.024 0.327 -5.176 1.00 0.00 C ATOM 1041 CG LEU p 64 -4.534 1.356 -6.188 1.00 0.00 C ATOM 1042 CD1 LEU p 64 -4.149 2.625 -5.473 1.00 0.00 C ATOM 1043 CD2 LEU p 64 -3.385 0.784 -6.989 1.00 0.00 C ATOM 0 H LEU p 64 -6.587 -1.437 -4.478 1.00 0.00 H new ATOM 0 HA LEU p 64 -6.169 1.298 -3.609 1.00 0.00 H new ATOM 0 HB2 LEU p 64 -4.248 0.197 -4.421 1.00 0.00 H new ATOM 0 HB3 LEU p 64 -5.133 -0.628 -5.689 1.00 0.00 H new ATOM 0 HG LEU p 64 -5.332 1.599 -6.889 1.00 0.00 H new ATOM 0 HD11 LEU p 64 -3.799 3.359 -6.198 1.00 0.00 H new ATOM 0 HD12 LEU p 64 -5.016 3.022 -4.944 1.00 0.00 H new ATOM 0 HD13 LEU p 64 -3.354 2.413 -4.758 1.00 0.00 H new ATOM 0 HD21 LEU p 64 -3.040 1.525 -7.710 1.00 0.00 H new ATOM 0 HD22 LEU p 64 -2.567 0.523 -6.317 1.00 0.00 H new ATOM 0 HD23 LEU p 64 -3.719 -0.109 -7.518 1.00 0.00 H new ATOM 1055 N GLN p 65 -8.048 0.512 -6.092 1.00 0.00 N ATOM 1056 CA GLN p 65 -9.084 0.860 -7.038 1.00 0.00 C ATOM 1057 C GLN p 65 -10.348 1.115 -6.228 1.00 0.00 C ATOM 1058 O GLN p 65 -11.298 1.735 -6.682 1.00 0.00 O ATOM 1059 CB GLN p 65 -9.242 -0.323 -8.006 1.00 0.00 C ATOM 1060 CG GLN p 65 -10.614 -0.459 -8.634 1.00 0.00 C ATOM 1061 CD GLN p 65 -10.565 -0.629 -10.140 1.00 0.00 C ATOM 1062 OE1 GLN p 65 -10.493 -1.749 -10.648 1.00 0.00 O ATOM 1063 NE2 GLN p 65 -10.604 0.485 -10.862 1.00 0.00 N ATOM 0 H GLN p 65 -7.949 -0.498 -5.990 1.00 0.00 H new ATOM 0 HA GLN p 65 -8.856 1.750 -7.625 1.00 0.00 H new ATOM 0 HB2 GLN p 65 -8.503 -0.223 -8.801 1.00 0.00 H new ATOM 0 HB3 GLN p 65 -9.011 -1.244 -7.471 1.00 0.00 H new ATOM 0 HG2 GLN p 65 -11.125 -1.315 -8.194 1.00 0.00 H new ATOM 0 HG3 GLN p 65 -11.206 0.424 -8.393 1.00 0.00 H new ATOM 0 HE21 GLN p 65 -10.664 1.391 -10.398 1.00 0.00 H new ATOM 0 HE22 GLN p 65 -10.574 0.434 -11.880 1.00 0.00 H new ATOM 1072 N ALA p 66 -10.281 0.581 -5.013 1.00 0.00 N ATOM 1073 CA ALA p 66 -11.310 0.702 -3.987 1.00 0.00 C ATOM 1074 C ALA p 66 -10.909 1.865 -3.104 1.00 0.00 C ATOM 1075 O ALA p 66 -11.704 2.401 -2.337 1.00 0.00 O ATOM 1076 CB ALA p 66 -11.439 -0.580 -3.175 1.00 0.00 C ATOM 0 H ALA p 66 -9.479 0.032 -4.705 1.00 0.00 H new ATOM 0 HA ALA p 66 -12.286 0.875 -4.441 1.00 0.00 H new ATOM 0 HB1 ALA p 66 -12.215 -0.456 -2.419 1.00 0.00 H new ATOM 0 HB2 ALA p 66 -11.706 -1.404 -3.836 1.00 0.00 H new ATOM 0 HB3 ALA p 66 -10.489 -0.799 -2.687 1.00 0.00 H new ATOM 1082 N LEU p 67 -9.616 2.205 -3.241 1.00 0.00 N ATOM 1083 CA LEU p 67 -8.976 3.326 -2.575 1.00 0.00 C ATOM 1084 C LEU p 67 -9.110 4.502 -3.530 1.00 0.00 C ATOM 1085 O LEU p 67 -9.438 5.609 -3.135 1.00 0.00 O ATOM 1086 CB LEU p 67 -7.486 2.991 -2.301 1.00 0.00 C ATOM 1087 CG LEU p 67 -6.576 4.030 -1.592 1.00 0.00 C ATOM 1088 CD1 LEU p 67 -5.371 4.313 -2.467 1.00 0.00 C ATOM 1089 CD2 LEU p 67 -7.297 5.329 -1.281 1.00 0.00 C ATOM 0 H LEU p 67 -8.977 1.683 -3.840 1.00 0.00 H new ATOM 0 HA LEU p 67 -9.433 3.553 -1.612 1.00 0.00 H new ATOM 0 HB2 LEU p 67 -7.463 2.079 -1.705 1.00 0.00 H new ATOM 0 HB3 LEU p 67 -7.024 2.756 -3.260 1.00 0.00 H new ATOM 0 HG LEU p 67 -6.270 3.601 -0.638 1.00 0.00 H new ATOM 0 HD11 LEU p 67 -4.727 5.042 -1.975 1.00 0.00 H new ATOM 0 HD12 LEU p 67 -4.815 3.390 -2.630 1.00 0.00 H new ATOM 0 HD13 LEU p 67 -5.703 4.711 -3.426 1.00 0.00 H new ATOM 0 HD21 LEU p 67 -6.611 6.016 -0.786 1.00 0.00 H new ATOM 0 HD22 LEU p 67 -7.654 5.778 -2.208 1.00 0.00 H new ATOM 0 HD23 LEU p 67 -8.144 5.127 -0.626 1.00 0.00 H new ATOM 1101 N LYS p 68 -8.862 4.192 -4.799 1.00 0.00 N ATOM 1102 CA LYS p 68 -8.968 5.143 -5.905 1.00 0.00 C ATOM 1103 C LYS p 68 -10.423 5.394 -6.209 1.00 0.00 C ATOM 1104 O LYS p 68 -10.769 6.444 -6.732 1.00 0.00 O ATOM 1105 CB LYS p 68 -8.231 4.678 -7.162 1.00 0.00 C ATOM 1106 CG LYS p 68 -6.776 5.113 -7.206 1.00 0.00 C ATOM 1107 CD LYS p 68 -6.145 4.809 -8.555 1.00 0.00 C ATOM 1108 CE LYS p 68 -4.744 5.390 -8.657 1.00 0.00 C ATOM 1109 NZ LYS p 68 -4.102 5.069 -9.961 1.00 0.00 N ATOM 0 H LYS p 68 -8.577 3.258 -5.094 1.00 0.00 H new ATOM 0 HA LYS p 68 -8.485 6.068 -5.591 1.00 0.00 H new ATOM 0 HB2 LYS p 68 -8.279 3.591 -7.221 1.00 0.00 H new ATOM 0 HB3 LYS p 68 -8.745 5.068 -8.040 1.00 0.00 H new ATOM 0 HG2 LYS p 68 -6.708 6.182 -7.004 1.00 0.00 H new ATOM 0 HG3 LYS p 68 -6.219 4.604 -6.419 1.00 0.00 H new ATOM 0 HD2 LYS p 68 -6.105 3.730 -8.704 1.00 0.00 H new ATOM 0 HD3 LYS p 68 -6.769 5.218 -9.350 1.00 0.00 H new ATOM 0 HE2 LYS p 68 -4.790 6.472 -8.532 1.00 0.00 H new ATOM 0 HE3 LYS p 68 -4.130 5.001 -7.845 1.00 0.00 H new ATOM 0 HZ1 LYS p 68 -3.149 5.483 -9.990 1.00 0.00 H new ATOM 0 HZ2 LYS p 68 -4.034 4.037 -10.070 1.00 0.00 H new ATOM 0 HZ3 LYS p 68 -4.674 5.462 -10.736 1.00 0.00 H new ATOM 1123 N LYS p 69 -11.267 4.395 -5.900 1.00 0.00 N ATOM 1124 CA LYS p 69 -12.716 4.556 -6.026 1.00 0.00 C ATOM 1125 C LYS p 69 -13.192 5.305 -4.791 1.00 0.00 C ATOM 1126 O LYS p 69 -14.281 5.877 -4.764 1.00 0.00 O ATOM 1127 CB LYS p 69 -13.430 3.212 -6.135 1.00 0.00 C ATOM 1128 CG LYS p 69 -13.998 2.916 -7.517 1.00 0.00 C ATOM 1129 CD LYS p 69 -15.449 3.362 -7.639 1.00 0.00 C ATOM 1130 CE LYS p 69 -16.010 3.055 -9.019 1.00 0.00 C ATOM 1131 NZ LYS p 69 -17.434 3.473 -9.142 1.00 0.00 N ATOM 0 H LYS p 69 -10.970 3.479 -5.565 1.00 0.00 H new ATOM 0 HA LYS p 69 -12.947 5.106 -6.938 1.00 0.00 H new ATOM 0 HB2 LYS p 69 -12.732 2.420 -5.864 1.00 0.00 H new ATOM 0 HB3 LYS p 69 -14.241 3.184 -5.408 1.00 0.00 H new ATOM 0 HG2 LYS p 69 -13.397 3.422 -8.273 1.00 0.00 H new ATOM 0 HG3 LYS p 69 -13.928 1.847 -7.717 1.00 0.00 H new ATOM 0 HD2 LYS p 69 -16.050 2.861 -6.880 1.00 0.00 H new ATOM 0 HD3 LYS p 69 -15.520 4.432 -7.446 1.00 0.00 H new ATOM 0 HE2 LYS p 69 -15.414 3.566 -9.776 1.00 0.00 H new ATOM 0 HE3 LYS p 69 -15.926 1.986 -9.216 1.00 0.00 H new ATOM 0 HZ1 LYS p 69 -17.781 3.247 -10.096 1.00 0.00 H new ATOM 0 HZ2 LYS p 69 -18.007 2.967 -8.437 1.00 0.00 H new ATOM 0 HZ3 LYS p 69 -17.510 4.497 -8.979 1.00 0.00 H new ATOM 1145 N LYS p 70 -12.323 5.256 -3.767 1.00 0.00 N ATOM 1146 CA LYS p 70 -12.510 5.939 -2.499 1.00 0.00 C ATOM 1147 C LYS p 70 -11.820 7.291 -2.557 1.00 0.00 C ATOM 1148 O LYS p 70 -12.178 8.213 -1.833 1.00 0.00 O ATOM 1149 CB LYS p 70 -11.933 5.117 -1.357 1.00 0.00 C ATOM 1150 CG LYS p 70 -12.979 4.444 -0.483 1.00 0.00 C ATOM 1151 CD LYS p 70 -13.316 5.284 0.743 1.00 0.00 C ATOM 1152 CE LYS p 70 -14.362 4.611 1.619 1.00 0.00 C ATOM 1153 NZ LYS p 70 -13.805 3.449 2.369 1.00 0.00 N ATOM 0 H LYS p 70 -11.454 4.724 -3.811 1.00 0.00 H new ATOM 0 HA LYS p 70 -13.577 6.073 -2.321 1.00 0.00 H new ATOM 0 HB2 LYS p 70 -11.275 4.353 -1.771 1.00 0.00 H new ATOM 0 HB3 LYS p 70 -11.317 5.765 -0.733 1.00 0.00 H new ATOM 0 HG2 LYS p 70 -13.884 4.272 -1.066 1.00 0.00 H new ATOM 0 HG3 LYS p 70 -12.614 3.467 -0.165 1.00 0.00 H new ATOM 0 HD2 LYS p 70 -12.411 5.457 1.325 1.00 0.00 H new ATOM 0 HD3 LYS p 70 -13.682 6.260 0.425 1.00 0.00 H new ATOM 0 HE2 LYS p 70 -14.764 5.338 2.325 1.00 0.00 H new ATOM 0 HE3 LYS p 70 -15.193 4.276 0.998 1.00 0.00 H new ATOM 0 HZ1 LYS p 70 -14.548 3.032 2.965 1.00 0.00 H new ATOM 0 HZ2 LYS p 70 -13.459 2.735 1.696 1.00 0.00 H new ATOM 0 HZ3 LYS p 70 -13.018 3.768 2.969 1.00 0.00 H new ATOM 1167 N ASN p 71 -10.794 7.354 -3.420 1.00 0.00 N ATOM 1168 CA ASN p 71 -10.012 8.571 -3.672 1.00 0.00 C ATOM 1169 C ASN p 71 -10.684 9.363 -4.785 1.00 0.00 C ATOM 1170 O ASN p 71 -10.376 10.528 -5.007 1.00 0.00 O ATOM 1171 CB ASN p 71 -8.564 8.248 -4.056 1.00 0.00 C ATOM 1172 CG ASN p 71 -7.587 9.297 -3.556 1.00 0.00 C ATOM 1173 OD1 ASN p 71 -7.079 9.207 -2.438 1.00 0.00 O ATOM 1174 ND2 ASN p 71 -7.320 10.299 -4.386 1.00 0.00 N ATOM 0 H ASN p 71 -10.482 6.552 -3.967 1.00 0.00 H new ATOM 0 HA ASN p 71 -9.979 9.159 -2.755 1.00 0.00 H new ATOM 0 HB2 ASN p 71 -8.290 7.276 -3.647 1.00 0.00 H new ATOM 0 HB3 ASN p 71 -8.487 8.171 -5.140 1.00 0.00 H new ATOM 0 HD21 ASN p 71 -6.671 11.034 -4.106 1.00 0.00 H new ATOM 0 HD22 ASN p 71 -7.764 10.333 -5.304 1.00 0.00 H new ATOM 1181 N ALA p 72 -11.583 8.661 -5.489 1.00 0.00 N ATOM 1182 CA ALA p 72 -12.420 9.210 -6.548 1.00 0.00 C ATOM 1183 C ALA p 72 -13.703 9.623 -5.877 1.00 0.00 C ATOM 1184 O ALA p 72 -14.462 10.437 -6.386 1.00 0.00 O ATOM 1185 CB ALA p 72 -12.699 8.200 -7.651 1.00 0.00 C ATOM 0 H ALA p 72 -11.747 7.667 -5.327 1.00 0.00 H new ATOM 0 HA ALA p 72 -11.917 10.045 -7.036 1.00 0.00 H new ATOM 0 HB1 ALA p 72 -13.326 8.659 -8.415 1.00 0.00 H new ATOM 0 HB2 ALA p 72 -11.758 7.881 -8.098 1.00 0.00 H new ATOM 0 HB3 ALA p 72 -13.213 7.335 -7.231 1.00 0.00 H new ATOM 1191 N GLN p 73 -13.902 8.995 -4.703 1.00 0.00 N ATOM 1192 CA GLN p 73 -14.989 9.236 -3.812 1.00 0.00 C ATOM 1193 C GLN p 73 -14.593 10.413 -2.950 1.00 0.00 C ATOM 1194 O GLN p 73 -15.410 11.236 -2.559 1.00 0.00 O ATOM 1195 CB GLN p 73 -15.127 7.999 -2.965 1.00 0.00 C ATOM 1196 CG GLN p 73 -16.291 8.022 -2.041 1.00 0.00 C ATOM 1197 CD GLN p 73 -17.348 6.986 -2.370 1.00 0.00 C ATOM 1198 OE1 GLN p 73 -18.275 7.250 -3.136 1.00 0.00 O ATOM 1199 NE2 GLN p 73 -17.213 5.799 -1.791 1.00 0.00 N ATOM 0 H GLN p 73 -13.264 8.277 -4.359 1.00 0.00 H new ATOM 0 HA GLN p 73 -15.928 9.449 -4.323 1.00 0.00 H new ATOM 0 HB2 GLN p 73 -15.214 7.132 -3.619 1.00 0.00 H new ATOM 0 HB3 GLN p 73 -14.216 7.868 -2.381 1.00 0.00 H new ATOM 0 HG2 GLN p 73 -15.939 7.859 -1.022 1.00 0.00 H new ATOM 0 HG3 GLN p 73 -16.745 9.013 -2.066 1.00 0.00 H new ATOM 0 HE21 GLN p 73 -16.429 5.624 -1.163 1.00 0.00 H new ATOM 0 HE22 GLN p 73 -17.894 5.062 -1.974 1.00 0.00 H new ATOM 1208 N LEU p 74 -13.299 10.395 -2.646 1.00 0.00 N ATOM 1209 CA LEU p 74 -12.617 11.435 -1.891 1.00 0.00 C ATOM 1210 C LEU p 74 -12.368 12.607 -2.814 1.00 0.00 C ATOM 1211 O LEU p 74 -12.336 13.734 -2.392 1.00 0.00 O ATOM 1212 CB LEU p 74 -11.295 10.910 -1.339 1.00 0.00 C ATOM 1213 CG LEU p 74 -10.737 11.609 -0.096 1.00 0.00 C ATOM 1214 CD1 LEU p 74 -11.498 11.212 1.167 1.00 0.00 C ATOM 1215 CD2 LEU p 74 -9.272 11.257 0.035 1.00 0.00 C ATOM 0 H LEU p 74 -12.681 9.634 -2.927 1.00 0.00 H new ATOM 0 HA LEU p 74 -13.234 11.747 -1.049 1.00 0.00 H new ATOM 0 HB2 LEU p 74 -11.421 9.853 -1.106 1.00 0.00 H new ATOM 0 HB3 LEU p 74 -10.547 10.976 -2.129 1.00 0.00 H new ATOM 0 HG LEU p 74 -10.857 12.686 -0.212 1.00 0.00 H new ATOM 0 HD11 LEU p 74 -11.071 11.729 2.026 1.00 0.00 H new ATOM 0 HD12 LEU p 74 -12.547 11.488 1.061 1.00 0.00 H new ATOM 0 HD13 LEU p 74 -11.419 10.135 1.316 1.00 0.00 H new ATOM 0 HD21 LEU p 74 -8.857 11.747 0.916 1.00 0.00 H new ATOM 0 HD22 LEU p 74 -9.165 10.177 0.136 1.00 0.00 H new ATOM 0 HD23 LEU p 74 -8.736 11.593 -0.853 1.00 0.00 H new ATOM 1227 N LYS p 75 -12.231 12.294 -4.099 1.00 0.00 N ATOM 1228 CA LYS p 75 -12.045 13.292 -5.149 1.00 0.00 C ATOM 1229 C LYS p 75 -13.416 13.797 -5.509 1.00 0.00 C ATOM 1230 O LYS p 75 -13.590 14.886 -6.062 1.00 0.00 O ATOM 1231 CB LYS p 75 -11.374 12.688 -6.371 1.00 0.00 C ATOM 1232 CG LYS p 75 -9.958 13.192 -6.622 1.00 0.00 C ATOM 1233 CD LYS p 75 -9.923 14.374 -7.590 1.00 0.00 C ATOM 1234 CE LYS p 75 -9.704 13.925 -9.031 1.00 0.00 C ATOM 1235 NZ LYS p 75 -9.625 15.081 -9.966 1.00 0.00 N ATOM 0 H LYS p 75 -12.246 11.334 -4.444 1.00 0.00 H new ATOM 0 HA LYS p 75 -11.400 14.098 -4.798 1.00 0.00 H new ATOM 0 HB2 LYS p 75 -11.347 11.604 -6.258 1.00 0.00 H new ATOM 0 HB3 LYS p 75 -11.984 12.901 -7.249 1.00 0.00 H new ATOM 0 HG2 LYS p 75 -9.508 13.488 -5.675 1.00 0.00 H new ATOM 0 HG3 LYS p 75 -9.352 12.380 -7.023 1.00 0.00 H new ATOM 0 HD2 LYS p 75 -10.860 14.927 -7.521 1.00 0.00 H new ATOM 0 HD3 LYS p 75 -9.126 15.058 -7.298 1.00 0.00 H new ATOM 0 HE2 LYS p 75 -8.784 13.343 -9.094 1.00 0.00 H new ATOM 0 HE3 LYS p 75 -10.519 13.268 -9.334 1.00 0.00 H new ATOM 0 HZ1 LYS p 75 -9.476 14.734 -10.935 1.00 0.00 H new ATOM 0 HZ2 LYS p 75 -10.512 15.622 -9.925 1.00 0.00 H new ATOM 0 HZ3 LYS p 75 -8.832 15.695 -9.692 1.00 0.00 H new ATOM 1249 N LYS p 76 -14.387 12.944 -5.167 1.00 0.00 N ATOM 1250 CA LYS p 76 -15.797 13.253 -5.344 1.00 0.00 C ATOM 1251 C LYS p 76 -16.261 14.001 -4.119 1.00 0.00 C ATOM 1252 O LYS p 76 -17.149 14.854 -4.189 1.00 0.00 O ATOM 1253 CB LYS p 76 -16.626 11.990 -5.541 1.00 0.00 C ATOM 1254 CG LYS p 76 -17.109 11.778 -6.968 1.00 0.00 C ATOM 1255 CD LYS p 76 -18.504 12.350 -7.186 1.00 0.00 C ATOM 1256 CE LYS p 76 -18.976 12.159 -8.621 1.00 0.00 C ATOM 1257 NZ LYS p 76 -18.270 13.065 -9.572 1.00 0.00 N ATOM 0 H LYS p 76 -14.212 12.025 -4.762 1.00 0.00 H new ATOM 0 HA LYS p 76 -15.928 13.860 -6.240 1.00 0.00 H new ATOM 0 HB2 LYS p 76 -16.032 11.128 -5.239 1.00 0.00 H new ATOM 0 HB3 LYS p 76 -17.491 12.029 -4.879 1.00 0.00 H new ATOM 0 HG2 LYS p 76 -16.411 12.248 -7.661 1.00 0.00 H new ATOM 0 HG3 LYS p 76 -17.114 10.712 -7.195 1.00 0.00 H new ATOM 0 HD2 LYS p 76 -19.205 11.867 -6.505 1.00 0.00 H new ATOM 0 HD3 LYS p 76 -18.503 13.412 -6.942 1.00 0.00 H new ATOM 0 HE2 LYS p 76 -18.814 11.123 -8.920 1.00 0.00 H new ATOM 0 HE3 LYS p 76 -20.049 12.342 -8.676 1.00 0.00 H new ATOM 0 HZ1 LYS p 76 -18.659 12.936 -10.528 1.00 0.00 H new ATOM 0 HZ2 LYS p 76 -18.403 14.053 -9.274 1.00 0.00 H new ATOM 0 HZ3 LYS p 76 -17.255 12.839 -9.578 1.00 0.00 H new ATOM 1271 N LYS p 77 -15.635 13.654 -2.989 1.00 0.00 N ATOM 1272 CA LYS p 77 -15.905 14.319 -1.730 1.00 0.00 C ATOM 1273 C LYS p 77 -14.999 15.537 -1.575 1.00 0.00 C ATOM 1274 O LYS p 77 -15.257 16.407 -0.738 1.00 0.00 O ATOM 1275 CB LYS p 77 -15.716 13.356 -0.568 1.00 0.00 C ATOM 1276 CG LYS p 77 -16.986 12.633 -0.160 1.00 0.00 C ATOM 1277 CD LYS p 77 -16.834 11.956 1.192 1.00 0.00 C ATOM 1278 CE LYS p 77 -18.117 11.256 1.612 1.00 0.00 C ATOM 1279 NZ LYS p 77 -17.986 10.607 2.945 1.00 0.00 N ATOM 0 H LYS p 77 -14.937 12.912 -2.931 1.00 0.00 H new ATOM 0 HA LYS p 77 -16.942 14.656 -1.726 1.00 0.00 H new ATOM 0 HB2 LYS p 77 -14.960 12.619 -0.838 1.00 0.00 H new ATOM 0 HB3 LYS p 77 -15.331 13.907 0.290 1.00 0.00 H new ATOM 0 HG2 LYS p 77 -17.813 13.342 -0.122 1.00 0.00 H new ATOM 0 HG3 LYS p 77 -17.240 11.888 -0.914 1.00 0.00 H new ATOM 0 HD2 LYS p 77 -16.021 11.232 1.148 1.00 0.00 H new ATOM 0 HD3 LYS p 77 -16.560 12.697 1.943 1.00 0.00 H new ATOM 0 HE2 LYS p 77 -18.932 11.979 1.639 1.00 0.00 H new ATOM 0 HE3 LYS p 77 -18.381 10.505 0.867 1.00 0.00 H new ATOM 0 HZ1 LYS p 77 -18.882 10.141 3.194 1.00 0.00 H new ATOM 0 HZ2 LYS p 77 -17.225 9.899 2.913 1.00 0.00 H new ATOM 0 HZ3 LYS p 77 -17.759 11.327 3.661 1.00 0.00 H new ATOM 1293 N LEU p 78 -13.930 15.586 -2.394 1.00 0.00 N ATOM 1294 CA LEU p 78 -12.976 16.703 -2.385 1.00 0.00 C ATOM 1295 C LEU p 78 -13.639 18.041 -2.745 1.00 0.00 C ATOM 1296 O LEU p 78 -13.626 18.990 -1.957 1.00 0.00 O ATOM 1297 CB LEU p 78 -11.829 16.374 -3.363 1.00 0.00 C ATOM 1298 CG LEU p 78 -10.735 17.429 -3.556 1.00 0.00 C ATOM 1299 CD1 LEU p 78 -10.045 17.738 -2.241 1.00 0.00 C ATOM 1300 CD2 LEU p 78 -9.740 16.933 -4.586 1.00 0.00 C ATOM 0 H LEU p 78 -13.708 14.858 -3.073 1.00 0.00 H new ATOM 0 HA LEU p 78 -12.586 16.822 -1.374 1.00 0.00 H new ATOM 0 HB2 LEU p 78 -11.352 15.454 -3.024 1.00 0.00 H new ATOM 0 HB3 LEU p 78 -12.269 16.164 -4.338 1.00 0.00 H new ATOM 0 HG LEU p 78 -11.188 18.354 -3.913 1.00 0.00 H new ATOM 0 HD11 LEU p 78 -9.272 18.490 -2.403 1.00 0.00 H new ATOM 0 HD12 LEU p 78 -10.776 18.117 -1.527 1.00 0.00 H new ATOM 0 HD13 LEU p 78 -9.590 16.829 -1.846 1.00 0.00 H new ATOM 0 HD21 LEU p 78 -8.959 17.680 -4.727 1.00 0.00 H new ATOM 0 HD22 LEU p 78 -9.292 16.001 -4.240 1.00 0.00 H new ATOM 0 HD23 LEU p 78 -10.252 16.760 -5.533 1.00 0.00 H new ATOM 1312 N GLN p 79 -14.205 18.077 -3.937 1.00 0.00 N ATOM 1313 CA GLN p 79 -14.887 19.251 -4.474 1.00 0.00 C ATOM 1314 C GLN p 79 -16.363 19.288 -4.082 1.00 0.00 C ATOM 1315 O GLN p 79 -16.895 20.342 -3.719 1.00 0.00 O ATOM 1316 CB GLN p 79 -14.741 19.291 -6.005 1.00 0.00 C ATOM 1317 CG GLN p 79 -14.782 17.932 -6.705 1.00 0.00 C ATOM 1318 CD GLN p 79 -14.589 18.043 -8.204 1.00 0.00 C ATOM 1319 OE1 GLN p 79 -13.465 17.994 -8.703 1.00 0.00 O ATOM 1320 NE2 GLN p 79 -15.689 18.195 -8.933 1.00 0.00 N ATOM 0 H GLN p 79 -14.206 17.280 -4.574 1.00 0.00 H new ATOM 0 HA GLN p 79 -14.414 20.132 -4.041 1.00 0.00 H new ATOM 0 HB2 GLN p 79 -15.537 19.914 -6.412 1.00 0.00 H new ATOM 0 HB3 GLN p 79 -13.797 19.778 -6.250 1.00 0.00 H new ATOM 0 HG2 GLN p 79 -14.006 17.290 -6.289 1.00 0.00 H new ATOM 0 HG3 GLN p 79 -15.738 17.450 -6.500 1.00 0.00 H new ATOM 0 HE21 GLN p 79 -16.601 18.231 -8.478 1.00 0.00 H new ATOM 0 HE22 GLN p 79 -15.621 18.276 -9.948 1.00 0.00 H new ATOM 1329 N ALA p 80 -16.997 18.129 -4.162 1.00 0.00 N ATOM 1330 CA ALA p 80 -18.415 17.981 -3.831 1.00 0.00 C ATOM 1331 C ALA p 80 -18.597 17.409 -2.426 1.00 0.00 C ATOM 1332 O ALA p 80 -19.168 18.119 -1.572 1.00 0.00 O ATOM 1333 CB ALA p 80 -19.113 17.110 -4.867 1.00 0.00 C ATOM 1334 OXT ALA p 80 -18.160 16.262 -2.186 1.00 0.00 O ATOM 0 H ALA p 80 -16.548 17.262 -4.457 1.00 0.00 H new ATOM 0 HA ALA p 80 -18.873 18.970 -3.846 1.00 0.00 H new ATOM 0 HB1 ALA p 80 -20.167 17.009 -4.607 1.00 0.00 H new ATOM 0 HB2 ALA p 80 -19.024 17.572 -5.850 1.00 0.00 H new ATOM 0 HB3 ALA p 80 -18.648 16.124 -4.886 1.00 0.00 H new TER 1340 ALA p 80