USER MOD reduce.3.24.130724 H: found=0, std=0, add=964, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 959 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 12 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 157:sc= 0.195 (180deg=-0.205) USER MOD Single : A 3 GLN : amide:sc= 0 K(o=0,f=-0.88) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= -0.0139 K(o=-0.014,f=-1) USER MOD Single : A 10 HIS : no HD1:sc= -0.258 X(o=-0.26,f=-0.012) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 ASN : amide:sc= -3.65 K(o=-3.7,f=-16!) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 ASN : amide:sc= -1.81 K(o=-1.8,f=-1.1) USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 HIS : no HE2:sc= -2.17 K(o=-2.2,f=-4.3!) USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ 164:sc=-0.00442 (180deg=-0.11) USER MOD Single : A 56 SER OG : rot 177:sc= -0.377 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 61 ASN : amide:sc= -0.0431 X(o=-0.043,f=-0.24) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 HIS : no HD1:sc= -1.03 X(o=-1,f=-0.66) USER MOD Single : A 70 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 CYS SG : rot -89:sc= -3.74! USER MOD Single : A 83 SER OG : rot -43:sc= 0.808 USER MOD Single : A 84 MET CE :methyl -170:sc= -4.4 (180deg=-5.38) USER MOD Single : A 85 THR OG1 : rot 111:sc= -0.489 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 CYS SG : rot 140:sc= -0.703 USER MOD Single : A 91 SER OG : rot 180:sc= -0.154 USER MOD Single : A 96 SER OG : rot 62:sc= 0.393 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 105 CYS SG : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 32:sc= 0.616 USER MOD Single : A 112 ASN : amide:sc= 0 X(o=0,f=0.062) USER MOD Single : A 113 SER OG : rot 108:sc= 0.576 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.329 0.000 0.000 1.00 0.00 N ATOM 2 CA MET A 1 2.093 -0.001 -1.242 1.00 0.00 C ATOM 3 C MET A 1 1.969 1.341 -1.957 1.00 0.00 C ATOM 4 O MET A 1 2.064 1.412 -3.182 1.00 0.00 O ATOM 5 CB MET A 1 1.613 -1.127 -2.160 1.00 0.00 C ATOM 6 CG MET A 1 2.167 -2.492 -1.788 1.00 0.00 C ATOM 7 SD MET A 1 1.117 -3.372 -0.616 1.00 0.00 S ATOM 8 CE MET A 1 2.347 -4.218 0.374 1.00 0.00 C ATOM 0 H1 MET A 1 1.098 -0.978 0.267 1.00 0.00 H new ATOM 0 H2 MET A 1 1.893 0.441 0.754 1.00 0.00 H new ATOM 0 H3 MET A 1 0.449 0.539 -0.134 1.00 0.00 H new ATOM 0 HA MET A 1 3.142 -0.166 -0.994 1.00 0.00 H new ATOM 0 HB2 MET A 1 0.524 -1.167 -2.134 1.00 0.00 H new ATOM 0 HB3 MET A 1 1.899 -0.895 -3.186 1.00 0.00 H new ATOM 0 HG2 MET A 1 2.280 -3.092 -2.691 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.162 -2.371 -1.359 1.00 0.00 H new ATOM 0 HE1 MET A 1 1.851 -4.807 1.146 1.00 0.00 H new ATOM 0 HE2 MET A 1 2.936 -4.878 -0.263 1.00 0.00 H new ATOM 0 HE3 MET A 1 3.004 -3.485 0.843 1.00 0.00 H new ATOM 18 N GLU A 2 1.758 2.402 -1.184 1.00 0.00 N ATOM 19 CA GLU A 2 1.621 3.740 -1.745 1.00 0.00 C ATOM 20 C GLU A 2 2.895 4.553 -1.532 1.00 0.00 C ATOM 21 O GLU A 2 2.839 5.750 -1.252 1.00 0.00 O ATOM 22 CB GLU A 2 0.430 4.463 -1.112 1.00 0.00 C ATOM 23 CG GLU A 2 0.478 4.503 0.406 1.00 0.00 C ATOM 24 CD GLU A 2 -0.177 3.292 1.042 1.00 0.00 C ATOM 25 OE1 GLU A 2 -1.206 2.827 0.509 1.00 0.00 O ATOM 26 OE2 GLU A 2 0.339 2.810 2.072 1.00 0.00 O ATOM 0 H GLU A 2 1.678 2.360 -0.168 1.00 0.00 H new ATOM 0 HA GLU A 2 1.449 3.641 -2.817 1.00 0.00 H new ATOM 0 HB2 GLU A 2 0.391 5.484 -1.493 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -0.491 3.971 -1.425 1.00 0.00 H new ATOM 0 HG2 GLU A 2 1.517 4.563 0.732 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -0.019 5.407 0.758 1.00 0.00 H new ATOM 33 N GLN A 3 4.040 3.892 -1.665 1.00 0.00 N ATOM 34 CA GLN A 3 5.328 4.552 -1.486 1.00 0.00 C ATOM 35 C GLN A 3 5.880 5.040 -2.821 1.00 0.00 C ATOM 36 O GLN A 3 5.599 4.458 -3.869 1.00 0.00 O ATOM 37 CB GLN A 3 6.325 3.600 -0.825 1.00 0.00 C ATOM 38 CG GLN A 3 6.071 3.385 0.658 1.00 0.00 C ATOM 39 CD GLN A 3 7.070 2.437 1.291 1.00 0.00 C ATOM 40 OE1 GLN A 3 7.882 1.820 0.599 1.00 0.00 O ATOM 41 NE2 GLN A 3 7.017 2.315 2.612 1.00 0.00 N ATOM 0 H GLN A 3 4.102 2.900 -1.896 1.00 0.00 H new ATOM 0 HA GLN A 3 5.178 5.416 -0.839 1.00 0.00 H new ATOM 0 HB2 GLN A 3 6.288 2.637 -1.335 1.00 0.00 H new ATOM 0 HB3 GLN A 3 7.333 3.993 -0.959 1.00 0.00 H new ATOM 0 HG2 GLN A 3 6.111 4.345 1.172 1.00 0.00 H new ATOM 0 HG3 GLN A 3 5.064 2.991 0.797 1.00 0.00 H new ATOM 0 HE21 GLN A 3 6.328 2.845 3.146 1.00 0.00 H new ATOM 0 HE22 GLN A 3 7.665 1.691 3.093 1.00 0.00 H new ATOM 50 N GLU A 4 6.666 6.111 -2.775 1.00 0.00 N ATOM 51 CA GLU A 4 7.256 6.677 -3.983 1.00 0.00 C ATOM 52 C GLU A 4 8.776 6.749 -3.863 1.00 0.00 C ATOM 53 O GLU A 4 9.387 7.772 -4.173 1.00 0.00 O ATOM 54 CB GLU A 4 6.688 8.072 -4.249 1.00 0.00 C ATOM 55 CG GLU A 4 6.899 8.554 -5.675 1.00 0.00 C ATOM 56 CD GLU A 4 6.101 9.803 -5.993 1.00 0.00 C ATOM 57 OE1 GLU A 4 6.309 10.829 -5.311 1.00 0.00 O ATOM 58 OE2 GLU A 4 5.270 9.756 -6.923 1.00 0.00 O ATOM 0 H GLU A 4 6.909 6.604 -1.916 1.00 0.00 H new ATOM 0 HA GLU A 4 7.005 6.025 -4.820 1.00 0.00 H new ATOM 0 HB2 GLU A 4 5.620 8.068 -4.030 1.00 0.00 H new ATOM 0 HB3 GLU A 4 7.151 8.781 -3.563 1.00 0.00 H new ATOM 0 HG2 GLU A 4 7.959 8.754 -5.834 1.00 0.00 H new ATOM 0 HG3 GLU A 4 6.617 7.761 -6.368 1.00 0.00 H new ATOM 65 N THR A 5 9.381 5.655 -3.411 1.00 0.00 N ATOM 66 CA THR A 5 10.828 5.594 -3.248 1.00 0.00 C ATOM 67 C THR A 5 11.411 4.384 -3.969 1.00 0.00 C ATOM 68 O THR A 5 10.784 3.326 -4.036 1.00 0.00 O ATOM 69 CB THR A 5 11.223 5.531 -1.760 1.00 0.00 C ATOM 70 OG1 THR A 5 12.645 5.633 -1.627 1.00 0.00 O ATOM 71 CG2 THR A 5 10.741 4.235 -1.127 1.00 0.00 C ATOM 0 H THR A 5 8.891 4.799 -3.151 1.00 0.00 H new ATOM 0 HA THR A 5 11.235 6.505 -3.686 1.00 0.00 H new ATOM 0 HB THR A 5 10.749 6.366 -1.245 1.00 0.00 H new ATOM 0 HG1 THR A 5 12.888 5.594 -0.679 1.00 0.00 H new ATOM 0 HG21 THR A 5 11.031 4.213 -0.077 1.00 0.00 H new ATOM 0 HG22 THR A 5 9.655 4.174 -1.205 1.00 0.00 H new ATOM 0 HG23 THR A 5 11.190 3.388 -1.645 1.00 0.00 H new ATOM 79 N LEU A 6 12.615 4.546 -4.507 1.00 0.00 N ATOM 80 CA LEU A 6 13.285 3.466 -5.223 1.00 0.00 C ATOM 81 C LEU A 6 14.460 2.924 -4.416 1.00 0.00 C ATOM 82 O LEU A 6 14.904 3.549 -3.453 1.00 0.00 O ATOM 83 CB LEU A 6 13.771 3.957 -6.588 1.00 0.00 C ATOM 84 CG LEU A 6 12.822 4.888 -7.343 1.00 0.00 C ATOM 85 CD1 LEU A 6 13.386 5.227 -8.714 1.00 0.00 C ATOM 86 CD2 LEU A 6 11.444 4.255 -7.473 1.00 0.00 C ATOM 0 H LEU A 6 13.147 5.415 -4.461 1.00 0.00 H new ATOM 0 HA LEU A 6 12.566 2.659 -5.369 1.00 0.00 H new ATOM 0 HB2 LEU A 6 14.721 4.474 -6.449 1.00 0.00 H new ATOM 0 HB3 LEU A 6 13.970 3.088 -7.215 1.00 0.00 H new ATOM 0 HG LEU A 6 12.723 5.813 -6.774 1.00 0.00 H new ATOM 0 HD11 LEU A 6 12.697 5.890 -9.237 1.00 0.00 H new ATOM 0 HD12 LEU A 6 14.350 5.723 -8.599 1.00 0.00 H new ATOM 0 HD13 LEU A 6 13.516 4.311 -9.291 1.00 0.00 H new ATOM 0 HD21 LEU A 6 10.782 4.932 -8.013 1.00 0.00 H new ATOM 0 HD22 LEU A 6 11.525 3.315 -8.019 1.00 0.00 H new ATOM 0 HD23 LEU A 6 11.036 4.064 -6.480 1.00 0.00 H new ATOM 98 N GLU A 7 14.961 1.760 -4.818 1.00 0.00 N ATOM 99 CA GLU A 7 16.086 1.136 -4.132 1.00 0.00 C ATOM 100 C GLU A 7 17.084 0.563 -5.135 1.00 0.00 C ATOM 101 O GLU A 7 16.696 0.020 -6.170 1.00 0.00 O ATOM 102 CB GLU A 7 15.593 0.030 -3.198 1.00 0.00 C ATOM 103 CG GLU A 7 14.989 0.550 -1.904 1.00 0.00 C ATOM 104 CD GLU A 7 13.597 1.120 -2.098 1.00 0.00 C ATOM 105 OE1 GLU A 7 12.730 0.396 -2.632 1.00 0.00 O ATOM 106 OE2 GLU A 7 13.375 2.287 -1.716 1.00 0.00 O ATOM 0 H GLU A 7 14.606 1.231 -5.614 1.00 0.00 H new ATOM 0 HA GLU A 7 16.589 1.902 -3.542 1.00 0.00 H new ATOM 0 HB2 GLU A 7 14.849 -0.571 -3.721 1.00 0.00 H new ATOM 0 HB3 GLU A 7 16.426 -0.631 -2.960 1.00 0.00 H new ATOM 0 HG2 GLU A 7 14.948 -0.260 -1.175 1.00 0.00 H new ATOM 0 HG3 GLU A 7 15.638 1.320 -1.488 1.00 0.00 H new ATOM 113 N GLN A 8 18.369 0.688 -4.820 1.00 0.00 N ATOM 114 CA GLN A 8 19.422 0.183 -5.693 1.00 0.00 C ATOM 115 C GLN A 8 19.888 -1.197 -5.243 1.00 0.00 C ATOM 116 O GLN A 8 20.202 -1.406 -4.071 1.00 0.00 O ATOM 117 CB GLN A 8 20.605 1.153 -5.714 1.00 0.00 C ATOM 118 CG GLN A 8 20.461 2.267 -6.737 1.00 0.00 C ATOM 119 CD GLN A 8 21.308 3.479 -6.404 1.00 0.00 C ATOM 120 OE1 GLN A 8 22.168 3.427 -5.524 1.00 0.00 O ATOM 121 NE2 GLN A 8 21.069 4.581 -7.106 1.00 0.00 N ATOM 0 H GLN A 8 18.706 1.134 -3.967 1.00 0.00 H new ATOM 0 HA GLN A 8 19.014 0.097 -6.700 1.00 0.00 H new ATOM 0 HB2 GLN A 8 20.720 1.593 -4.724 1.00 0.00 H new ATOM 0 HB3 GLN A 8 21.518 0.595 -5.923 1.00 0.00 H new ATOM 0 HG2 GLN A 8 20.743 1.891 -7.720 1.00 0.00 H new ATOM 0 HG3 GLN A 8 19.415 2.566 -6.798 1.00 0.00 H new ATOM 0 HE21 GLN A 8 20.347 4.580 -7.826 1.00 0.00 H new ATOM 0 HE22 GLN A 8 21.608 5.428 -6.925 1.00 0.00 H new ATOM 130 N VAL A 9 19.931 -2.138 -6.182 1.00 0.00 N ATOM 131 CA VAL A 9 20.359 -3.498 -5.881 1.00 0.00 C ATOM 132 C VAL A 9 21.446 -3.958 -6.847 1.00 0.00 C ATOM 133 O VAL A 9 21.195 -4.147 -8.037 1.00 0.00 O ATOM 134 CB VAL A 9 19.179 -4.486 -5.947 1.00 0.00 C ATOM 135 CG1 VAL A 9 19.603 -5.859 -5.450 1.00 0.00 C ATOM 136 CG2 VAL A 9 17.999 -3.960 -5.144 1.00 0.00 C ATOM 0 H VAL A 9 19.675 -1.982 -7.157 1.00 0.00 H new ATOM 0 HA VAL A 9 20.758 -3.487 -4.867 1.00 0.00 H new ATOM 0 HB VAL A 9 18.867 -4.584 -6.987 1.00 0.00 H new ATOM 0 HG11 VAL A 9 18.756 -6.543 -5.504 1.00 0.00 H new ATOM 0 HG12 VAL A 9 20.415 -6.236 -6.072 1.00 0.00 H new ATOM 0 HG13 VAL A 9 19.943 -5.783 -4.417 1.00 0.00 H new ATOM 0 HG21 VAL A 9 17.174 -4.670 -5.201 1.00 0.00 H new ATOM 0 HG22 VAL A 9 18.296 -3.832 -4.103 1.00 0.00 H new ATOM 0 HG23 VAL A 9 17.680 -3.000 -5.551 1.00 0.00 H new ATOM 146 N HIS A 10 22.656 -4.136 -6.325 1.00 0.00 N ATOM 147 CA HIS A 10 23.783 -4.575 -7.141 1.00 0.00 C ATOM 148 C HIS A 10 23.726 -6.081 -7.381 1.00 0.00 C ATOM 149 O HIS A 10 23.751 -6.872 -6.437 1.00 0.00 O ATOM 150 CB HIS A 10 25.103 -4.204 -6.465 1.00 0.00 C ATOM 151 CG HIS A 10 25.352 -2.729 -6.405 1.00 0.00 C ATOM 152 ND1 HIS A 10 26.590 -2.164 -6.627 1.00 0.00 N ATOM 153 CD2 HIS A 10 24.512 -1.699 -6.148 1.00 0.00 C ATOM 154 CE1 HIS A 10 26.501 -0.852 -6.507 1.00 0.00 C ATOM 155 NE2 HIS A 10 25.250 -0.544 -6.217 1.00 0.00 N ATOM 0 H HIS A 10 22.881 -3.983 -5.342 1.00 0.00 H new ATOM 0 HA HIS A 10 23.722 -4.069 -8.105 1.00 0.00 H new ATOM 0 HB2 HIS A 10 25.108 -4.606 -5.452 1.00 0.00 H new ATOM 0 HB3 HIS A 10 25.923 -4.681 -7.002 1.00 0.00 H new ATOM 0 HD2 HIS A 10 23.457 -1.773 -5.929 1.00 0.00 H new ATOM 0 HE1 HIS A 10 27.313 -0.150 -6.626 1.00 0.00 H new ATOM 0 HE2 HIS A 10 24.891 0.399 -6.068 1.00 0.00 H new ATOM 163 N LEU A 11 23.648 -6.470 -8.649 1.00 0.00 N ATOM 164 CA LEU A 11 23.587 -7.881 -9.013 1.00 0.00 C ATOM 165 C LEU A 11 24.920 -8.571 -8.745 1.00 0.00 C ATOM 166 O LEU A 11 24.960 -9.707 -8.270 1.00 0.00 O ATOM 167 CB LEU A 11 23.209 -8.031 -10.488 1.00 0.00 C ATOM 168 CG LEU A 11 21.712 -8.075 -10.797 1.00 0.00 C ATOM 169 CD1 LEU A 11 21.051 -9.235 -10.069 1.00 0.00 C ATOM 170 CD2 LEU A 11 21.050 -6.758 -10.416 1.00 0.00 C ATOM 0 H LEU A 11 23.626 -5.828 -9.442 1.00 0.00 H new ATOM 0 HA LEU A 11 22.823 -8.357 -8.398 1.00 0.00 H new ATOM 0 HB2 LEU A 11 23.649 -7.201 -11.041 1.00 0.00 H new ATOM 0 HB3 LEU A 11 23.665 -8.945 -10.868 1.00 0.00 H new ATOM 0 HG LEU A 11 21.586 -8.226 -11.869 1.00 0.00 H new ATOM 0 HD11 LEU A 11 19.986 -9.251 -10.301 1.00 0.00 H new ATOM 0 HD12 LEU A 11 21.506 -10.172 -10.389 1.00 0.00 H new ATOM 0 HD13 LEU A 11 21.187 -9.115 -8.994 1.00 0.00 H new ATOM 0 HD21 LEU A 11 19.985 -6.807 -10.643 1.00 0.00 H new ATOM 0 HD22 LEU A 11 21.186 -6.577 -9.350 1.00 0.00 H new ATOM 0 HD23 LEU A 11 21.504 -5.945 -10.982 1.00 0.00 H new ATOM 182 N THR A 12 26.012 -7.877 -9.052 1.00 0.00 N ATOM 183 CA THR A 12 27.347 -8.422 -8.843 1.00 0.00 C ATOM 184 C THR A 12 28.252 -7.410 -8.149 1.00 0.00 C ATOM 185 O THR A 12 28.206 -6.217 -8.447 1.00 0.00 O ATOM 186 CB THR A 12 27.996 -8.845 -10.175 1.00 0.00 C ATOM 187 OG1 THR A 12 29.217 -9.550 -9.923 1.00 0.00 O ATOM 188 CG2 THR A 12 28.275 -7.633 -11.050 1.00 0.00 C ATOM 0 H THR A 12 25.997 -6.936 -9.446 1.00 0.00 H new ATOM 0 HA THR A 12 27.234 -9.300 -8.207 1.00 0.00 H new ATOM 0 HB THR A 12 27.301 -9.500 -10.701 1.00 0.00 H new ATOM 0 HG1 THR A 12 29.622 -9.817 -10.774 1.00 0.00 H new ATOM 0 HG21 THR A 12 28.733 -7.957 -11.985 1.00 0.00 H new ATOM 0 HG22 THR A 12 27.340 -7.116 -11.264 1.00 0.00 H new ATOM 0 HG23 THR A 12 28.953 -6.956 -10.529 1.00 0.00 H new ATOM 196 N GLU A 13 29.074 -7.895 -7.224 1.00 0.00 N ATOM 197 CA GLU A 13 29.989 -7.031 -6.488 1.00 0.00 C ATOM 198 C GLU A 13 30.978 -6.355 -7.433 1.00 0.00 C ATOM 199 O GLU A 13 31.527 -5.298 -7.123 1.00 0.00 O ATOM 200 CB GLU A 13 30.747 -7.836 -5.430 1.00 0.00 C ATOM 201 CG GLU A 13 31.544 -8.996 -6.004 1.00 0.00 C ATOM 202 CD GLU A 13 30.772 -10.301 -5.985 1.00 0.00 C ATOM 203 OE1 GLU A 13 30.192 -10.632 -4.930 1.00 0.00 O ATOM 204 OE2 GLU A 13 30.748 -10.990 -7.026 1.00 0.00 O ATOM 0 H GLU A 13 29.125 -8.881 -6.967 1.00 0.00 H new ATOM 0 HA GLU A 13 29.400 -6.259 -5.993 1.00 0.00 H new ATOM 0 HB2 GLU A 13 31.424 -7.170 -4.895 1.00 0.00 H new ATOM 0 HB3 GLU A 13 30.035 -8.221 -4.700 1.00 0.00 H new ATOM 0 HG2 GLU A 13 31.831 -8.763 -7.029 1.00 0.00 H new ATOM 0 HG3 GLU A 13 32.466 -9.115 -5.435 1.00 0.00 H new ATOM 211 N ASP A 14 31.201 -6.974 -8.588 1.00 0.00 N ATOM 212 CA ASP A 14 32.123 -6.433 -9.580 1.00 0.00 C ATOM 213 C ASP A 14 31.640 -5.078 -10.089 1.00 0.00 C ATOM 214 O ASP A 14 32.432 -4.260 -10.554 1.00 0.00 O ATOM 215 CB ASP A 14 32.275 -7.406 -10.750 1.00 0.00 C ATOM 216 CG ASP A 14 33.050 -8.652 -10.369 1.00 0.00 C ATOM 217 OD1 ASP A 14 34.293 -8.641 -10.495 1.00 0.00 O ATOM 218 OD2 ASP A 14 32.414 -9.639 -9.944 1.00 0.00 O ATOM 0 H ASP A 14 30.756 -7.851 -8.860 1.00 0.00 H new ATOM 0 HA ASP A 14 33.093 -6.297 -9.102 1.00 0.00 H new ATOM 0 HB2 ASP A 14 31.287 -7.692 -11.112 1.00 0.00 H new ATOM 0 HB3 ASP A 14 32.783 -6.903 -11.573 1.00 0.00 H new ATOM 223 N GLY A 15 30.333 -4.849 -9.998 1.00 0.00 N ATOM 224 CA GLY A 15 29.767 -3.593 -10.454 1.00 0.00 C ATOM 225 C GLY A 15 29.386 -3.627 -11.920 1.00 0.00 C ATOM 226 O GLY A 15 29.138 -2.587 -12.529 1.00 0.00 O ATOM 0 H GLY A 15 29.657 -5.511 -9.617 1.00 0.00 H new ATOM 0 HA2 GLY A 15 28.885 -3.358 -9.858 1.00 0.00 H new ATOM 0 HA3 GLY A 15 30.487 -2.792 -10.287 1.00 0.00 H new ATOM 230 N GLY A 16 29.340 -4.828 -12.490 1.00 0.00 N ATOM 231 CA GLY A 16 28.987 -4.971 -13.891 1.00 0.00 C ATOM 232 C GLY A 16 27.488 -5.015 -14.109 1.00 0.00 C ATOM 233 O GLY A 16 27.001 -4.693 -15.194 1.00 0.00 O ATOM 0 H GLY A 16 29.541 -5.704 -12.007 1.00 0.00 H new ATOM 0 HA2 GLY A 16 29.409 -4.140 -14.456 1.00 0.00 H new ATOM 0 HA3 GLY A 16 29.435 -5.883 -14.284 1.00 0.00 H new ATOM 237 N VAL A 17 26.753 -5.417 -13.078 1.00 0.00 N ATOM 238 CA VAL A 17 25.300 -5.503 -13.162 1.00 0.00 C ATOM 239 C VAL A 17 24.641 -4.918 -11.917 1.00 0.00 C ATOM 240 O VAL A 17 24.942 -5.322 -10.794 1.00 0.00 O ATOM 241 CB VAL A 17 24.833 -6.960 -13.339 1.00 0.00 C ATOM 242 CG1 VAL A 17 23.339 -7.012 -13.618 1.00 0.00 C ATOM 243 CG2 VAL A 17 25.616 -7.638 -14.453 1.00 0.00 C ATOM 0 H VAL A 17 27.140 -5.689 -12.174 1.00 0.00 H new ATOM 0 HA VAL A 17 24.999 -4.924 -14.035 1.00 0.00 H new ATOM 0 HB VAL A 17 25.023 -7.500 -12.411 1.00 0.00 H new ATOM 0 HG11 VAL A 17 23.028 -8.049 -13.740 1.00 0.00 H new ATOM 0 HG12 VAL A 17 22.797 -6.566 -12.784 1.00 0.00 H new ATOM 0 HG13 VAL A 17 23.120 -6.458 -14.530 1.00 0.00 H new ATOM 0 HG21 VAL A 17 25.273 -8.667 -14.565 1.00 0.00 H new ATOM 0 HG22 VAL A 17 25.459 -7.100 -15.388 1.00 0.00 H new ATOM 0 HG23 VAL A 17 26.678 -7.634 -14.206 1.00 0.00 H new ATOM 253 N VAL A 18 23.741 -3.962 -12.125 1.00 0.00 N ATOM 254 CA VAL A 18 23.038 -3.321 -11.020 1.00 0.00 C ATOM 255 C VAL A 18 21.594 -3.008 -11.395 1.00 0.00 C ATOM 256 O VAL A 18 21.334 -2.226 -12.310 1.00 0.00 O ATOM 257 CB VAL A 18 23.739 -2.019 -10.589 1.00 0.00 C ATOM 258 CG1 VAL A 18 22.980 -1.355 -9.450 1.00 0.00 C ATOM 259 CG2 VAL A 18 25.180 -2.297 -10.190 1.00 0.00 C ATOM 0 H VAL A 18 23.482 -3.614 -13.048 1.00 0.00 H new ATOM 0 HA VAL A 18 23.050 -4.024 -10.187 1.00 0.00 H new ATOM 0 HB VAL A 18 23.747 -1.333 -11.436 1.00 0.00 H new ATOM 0 HG11 VAL A 18 23.490 -0.437 -9.159 1.00 0.00 H new ATOM 0 HG12 VAL A 18 21.967 -1.119 -9.776 1.00 0.00 H new ATOM 0 HG13 VAL A 18 22.938 -2.032 -8.597 1.00 0.00 H new ATOM 0 HG21 VAL A 18 25.660 -1.366 -9.888 1.00 0.00 H new ATOM 0 HG22 VAL A 18 25.198 -3.001 -9.358 1.00 0.00 H new ATOM 0 HG23 VAL A 18 25.716 -2.724 -11.038 1.00 0.00 H new ATOM 269 N LYS A 19 20.657 -3.623 -10.682 1.00 0.00 N ATOM 270 CA LYS A 19 19.237 -3.410 -10.937 1.00 0.00 C ATOM 271 C LYS A 19 18.645 -2.427 -9.932 1.00 0.00 C ATOM 272 O LYS A 19 19.073 -2.369 -8.779 1.00 0.00 O ATOM 273 CB LYS A 19 18.481 -4.739 -10.874 1.00 0.00 C ATOM 274 CG LYS A 19 16.972 -4.584 -10.952 1.00 0.00 C ATOM 275 CD LYS A 19 16.351 -4.467 -9.571 1.00 0.00 C ATOM 276 CE LYS A 19 15.489 -5.677 -9.243 1.00 0.00 C ATOM 277 NZ LYS A 19 16.224 -6.673 -8.415 1.00 0.00 N ATOM 0 H LYS A 19 20.855 -4.274 -9.922 1.00 0.00 H new ATOM 0 HA LYS A 19 19.132 -2.987 -11.936 1.00 0.00 H new ATOM 0 HB2 LYS A 19 18.815 -5.377 -11.692 1.00 0.00 H new ATOM 0 HB3 LYS A 19 18.738 -5.250 -9.946 1.00 0.00 H new ATOM 0 HG2 LYS A 19 16.726 -3.699 -11.538 1.00 0.00 H new ATOM 0 HG3 LYS A 19 16.544 -5.440 -11.473 1.00 0.00 H new ATOM 0 HD2 LYS A 19 17.139 -4.367 -8.824 1.00 0.00 H new ATOM 0 HD3 LYS A 19 15.745 -3.562 -9.519 1.00 0.00 H new ATOM 0 HE2 LYS A 19 14.594 -5.352 -8.712 1.00 0.00 H new ATOM 0 HE3 LYS A 19 15.157 -6.148 -10.168 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 15.603 -7.482 -8.213 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 17.064 -7.002 -8.932 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 16.519 -6.231 -7.521 1.00 0.00 H new ATOM 291 N THR A 20 17.657 -1.657 -10.376 1.00 0.00 N ATOM 292 CA THR A 20 17.006 -0.677 -9.515 1.00 0.00 C ATOM 293 C THR A 20 15.504 -0.928 -9.434 1.00 0.00 C ATOM 294 O THR A 20 14.815 -0.959 -10.454 1.00 0.00 O ATOM 295 CB THR A 20 17.248 0.759 -10.015 1.00 0.00 C ATOM 296 OG1 THR A 20 18.652 1.041 -10.035 1.00 0.00 O ATOM 297 CG2 THR A 20 16.537 1.769 -9.127 1.00 0.00 C ATOM 0 H THR A 20 17.290 -1.693 -11.327 1.00 0.00 H new ATOM 0 HA THR A 20 17.445 -0.787 -8.523 1.00 0.00 H new ATOM 0 HB THR A 20 16.846 0.840 -11.025 1.00 0.00 H new ATOM 0 HG1 THR A 20 18.797 1.956 -10.356 1.00 0.00 H new ATOM 0 HG21 THR A 20 16.723 2.776 -9.500 1.00 0.00 H new ATOM 0 HG22 THR A 20 15.465 1.571 -9.136 1.00 0.00 H new ATOM 0 HG23 THR A 20 16.913 1.685 -8.107 1.00 0.00 H new ATOM 305 N ILE A 21 15.004 -1.105 -8.216 1.00 0.00 N ATOM 306 CA ILE A 21 13.583 -1.351 -8.003 1.00 0.00 C ATOM 307 C ILE A 21 12.741 -0.188 -8.515 1.00 0.00 C ATOM 308 O ILE A 21 12.692 0.877 -7.897 1.00 0.00 O ATOM 309 CB ILE A 21 13.269 -1.581 -6.513 1.00 0.00 C ATOM 310 CG1 ILE A 21 14.151 -2.698 -5.949 1.00 0.00 C ATOM 311 CG2 ILE A 21 11.796 -1.918 -6.328 1.00 0.00 C ATOM 312 CD1 ILE A 21 13.885 -4.050 -6.572 1.00 0.00 C ATOM 0 H ILE A 21 15.561 -1.083 -7.362 1.00 0.00 H new ATOM 0 HA ILE A 21 13.331 -2.252 -8.562 1.00 0.00 H new ATOM 0 HB ILE A 21 13.484 -0.663 -5.966 1.00 0.00 H new ATOM 0 HG12 ILE A 21 15.198 -2.436 -6.102 1.00 0.00 H new ATOM 0 HG13 ILE A 21 13.994 -2.766 -4.873 1.00 0.00 H new ATOM 0 HG21 ILE A 21 11.589 -2.078 -5.270 1.00 0.00 H new ATOM 0 HG22 ILE A 21 11.185 -1.094 -6.697 1.00 0.00 H new ATOM 0 HG23 ILE A 21 11.557 -2.824 -6.885 1.00 0.00 H new ATOM 0 HD11 ILE A 21 14.545 -4.793 -6.125 1.00 0.00 H new ATOM 0 HD12 ILE A 21 12.847 -4.334 -6.396 1.00 0.00 H new ATOM 0 HD13 ILE A 21 14.070 -3.999 -7.645 1.00 0.00 H new ATOM 324 N LEU A 22 12.077 -0.398 -9.646 1.00 0.00 N ATOM 325 CA LEU A 22 11.234 0.633 -10.242 1.00 0.00 C ATOM 326 C LEU A 22 9.759 0.352 -9.974 1.00 0.00 C ATOM 327 O LEU A 22 9.047 1.190 -9.421 1.00 0.00 O ATOM 328 CB LEU A 22 11.484 0.716 -11.748 1.00 0.00 C ATOM 329 CG LEU A 22 12.582 1.683 -12.194 1.00 0.00 C ATOM 330 CD1 LEU A 22 13.884 0.936 -12.436 1.00 0.00 C ATOM 331 CD2 LEU A 22 12.155 2.433 -13.447 1.00 0.00 C ATOM 0 H LEU A 22 12.106 -1.273 -10.169 1.00 0.00 H new ATOM 0 HA LEU A 22 11.492 1.588 -9.784 1.00 0.00 H new ATOM 0 HB2 LEU A 22 11.737 -0.281 -12.110 1.00 0.00 H new ATOM 0 HB3 LEU A 22 10.553 1.005 -12.235 1.00 0.00 H new ATOM 0 HG LEU A 22 12.746 2.409 -11.398 1.00 0.00 H new ATOM 0 HD11 LEU A 22 14.654 1.640 -12.753 1.00 0.00 H new ATOM 0 HD12 LEU A 22 14.198 0.445 -11.515 1.00 0.00 H new ATOM 0 HD13 LEU A 22 13.735 0.187 -13.214 1.00 0.00 H new ATOM 0 HD21 LEU A 22 12.948 3.116 -13.750 1.00 0.00 H new ATOM 0 HD22 LEU A 22 11.963 1.721 -14.250 1.00 0.00 H new ATOM 0 HD23 LEU A 22 11.247 3.000 -13.240 1.00 0.00 H new ATOM 343 N ARG A 23 9.307 -0.834 -10.368 1.00 0.00 N ATOM 344 CA ARG A 23 7.917 -1.227 -10.170 1.00 0.00 C ATOM 345 C ARG A 23 7.826 -2.645 -9.614 1.00 0.00 C ATOM 346 O ARG A 23 8.002 -3.622 -10.342 1.00 0.00 O ATOM 347 CB ARG A 23 7.146 -1.134 -11.488 1.00 0.00 C ATOM 348 CG ARG A 23 5.741 -0.573 -11.333 1.00 0.00 C ATOM 349 CD ARG A 23 4.907 -1.414 -10.379 1.00 0.00 C ATOM 350 NE ARG A 23 3.495 -1.421 -10.748 1.00 0.00 N ATOM 351 CZ ARG A 23 2.533 -1.900 -9.966 1.00 0.00 C ATOM 352 NH1 ARG A 23 2.832 -2.407 -8.778 1.00 0.00 N ATOM 353 NH2 ARG A 23 1.270 -1.872 -10.372 1.00 0.00 N ATOM 0 H ARG A 23 9.883 -1.540 -10.826 1.00 0.00 H new ATOM 0 HA ARG A 23 7.472 -0.543 -9.447 1.00 0.00 H new ATOM 0 HB2 ARG A 23 7.704 -0.506 -12.182 1.00 0.00 H new ATOM 0 HB3 ARG A 23 7.085 -2.127 -11.934 1.00 0.00 H new ATOM 0 HG2 ARG A 23 5.796 0.451 -10.964 1.00 0.00 H new ATOM 0 HG3 ARG A 23 5.254 -0.535 -12.307 1.00 0.00 H new ATOM 0 HD2 ARG A 23 5.285 -2.436 -10.372 1.00 0.00 H new ATOM 0 HD3 ARG A 23 5.015 -1.027 -9.366 1.00 0.00 H new ATOM 0 HE ARG A 23 3.232 -1.037 -11.656 1.00 0.00 H new ATOM 0 HH11 ARG A 23 3.802 -2.430 -8.463 1.00 0.00 H new ATOM 0 HH12 ARG A 23 2.092 -2.774 -8.179 1.00 0.00 H new ATOM 0 HH21 ARG A 23 1.036 -1.483 -11.285 1.00 0.00 H new ATOM 0 HH22 ARG A 23 0.533 -2.240 -9.771 1.00 0.00 H new ATOM 367 N LYS A 24 7.551 -2.750 -8.318 1.00 0.00 N ATOM 368 CA LYS A 24 7.436 -4.048 -7.663 1.00 0.00 C ATOM 369 C LYS A 24 6.295 -4.862 -8.265 1.00 0.00 C ATOM 370 O LYS A 24 5.226 -4.328 -8.558 1.00 0.00 O ATOM 371 CB LYS A 24 7.210 -3.865 -6.161 1.00 0.00 C ATOM 372 CG LYS A 24 8.493 -3.675 -5.370 1.00 0.00 C ATOM 373 CD LYS A 24 9.112 -5.008 -4.983 1.00 0.00 C ATOM 374 CE LYS A 24 9.992 -4.876 -3.750 1.00 0.00 C ATOM 375 NZ LYS A 24 9.190 -4.851 -2.496 1.00 0.00 N ATOM 0 H LYS A 24 7.404 -1.952 -7.700 1.00 0.00 H new ATOM 0 HA LYS A 24 8.368 -4.591 -7.820 1.00 0.00 H new ATOM 0 HB2 LYS A 24 6.564 -3.001 -6.002 1.00 0.00 H new ATOM 0 HB3 LYS A 24 6.680 -4.735 -5.773 1.00 0.00 H new ATOM 0 HG2 LYS A 24 9.205 -3.100 -5.962 1.00 0.00 H new ATOM 0 HG3 LYS A 24 8.285 -3.095 -4.471 1.00 0.00 H new ATOM 0 HD2 LYS A 24 8.323 -5.735 -4.792 1.00 0.00 H new ATOM 0 HD3 LYS A 24 9.704 -5.391 -5.815 1.00 0.00 H new ATOM 0 HE2 LYS A 24 10.695 -5.708 -3.715 1.00 0.00 H new ATOM 0 HE3 LYS A 24 10.583 -3.963 -3.822 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 9.827 -4.760 -1.679 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 8.537 -4.042 -2.518 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 8.646 -5.733 -2.414 1.00 0.00 H new ATOM 389 N GLY A 25 6.530 -6.158 -8.445 1.00 0.00 N ATOM 390 CA GLY A 25 5.512 -7.025 -9.010 1.00 0.00 C ATOM 391 C GLY A 25 4.829 -7.878 -7.959 1.00 0.00 C ATOM 392 O GLY A 25 4.190 -7.356 -7.047 1.00 0.00 O ATOM 0 H GLY A 25 7.407 -6.623 -8.210 1.00 0.00 H new ATOM 0 HA2 GLY A 25 4.766 -6.418 -9.522 1.00 0.00 H new ATOM 0 HA3 GLY A 25 5.966 -7.672 -9.760 1.00 0.00 H new ATOM 396 N GLU A 26 4.964 -9.194 -8.089 1.00 0.00 N ATOM 397 CA GLU A 26 4.352 -10.121 -7.144 1.00 0.00 C ATOM 398 C GLU A 26 5.260 -10.347 -5.938 1.00 0.00 C ATOM 399 O GLU A 26 4.976 -9.878 -4.837 1.00 0.00 O ATOM 400 CB GLU A 26 4.051 -11.456 -7.827 1.00 0.00 C ATOM 401 CG GLU A 26 3.043 -11.347 -8.959 1.00 0.00 C ATOM 402 CD GLU A 26 1.655 -10.979 -8.471 1.00 0.00 C ATOM 403 OE1 GLU A 26 1.369 -9.770 -8.353 1.00 0.00 O ATOM 404 OE2 GLU A 26 0.856 -11.902 -8.207 1.00 0.00 O ATOM 0 H GLU A 26 5.491 -9.642 -8.839 1.00 0.00 H new ATOM 0 HA GLU A 26 3.418 -9.681 -6.796 1.00 0.00 H new ATOM 0 HB2 GLU A 26 4.980 -11.872 -8.218 1.00 0.00 H new ATOM 0 HB3 GLU A 26 3.675 -12.158 -7.083 1.00 0.00 H new ATOM 0 HG2 GLU A 26 3.384 -10.597 -9.673 1.00 0.00 H new ATOM 0 HG3 GLU A 26 2.997 -12.297 -9.492 1.00 0.00 H new ATOM 411 N GLY A 27 6.354 -11.070 -6.156 1.00 0.00 N ATOM 412 CA GLY A 27 7.287 -11.347 -5.080 1.00 0.00 C ATOM 413 C GLY A 27 7.133 -12.749 -4.525 1.00 0.00 C ATOM 414 O GLY A 27 6.173 -13.040 -3.813 1.00 0.00 O ATOM 0 H GLY A 27 6.611 -11.469 -7.059 1.00 0.00 H new ATOM 0 HA2 GLY A 27 8.306 -11.213 -5.444 1.00 0.00 H new ATOM 0 HA3 GLY A 27 7.137 -10.624 -4.278 1.00 0.00 H new ATOM 418 N GLY A 28 8.081 -13.622 -4.854 1.00 0.00 N ATOM 419 CA GLY A 28 8.026 -14.991 -4.377 1.00 0.00 C ATOM 420 C GLY A 28 8.330 -15.998 -5.469 1.00 0.00 C ATOM 421 O GLY A 28 8.190 -15.699 -6.654 1.00 0.00 O ATOM 0 H GLY A 28 8.886 -13.405 -5.442 1.00 0.00 H new ATOM 0 HA2 GLY A 28 8.738 -15.117 -3.562 1.00 0.00 H new ATOM 0 HA3 GLY A 28 7.035 -15.191 -3.968 1.00 0.00 H new ATOM 425 N GLU A 29 8.750 -17.194 -5.068 1.00 0.00 N ATOM 426 CA GLU A 29 9.078 -18.247 -6.022 1.00 0.00 C ATOM 427 C GLU A 29 7.876 -18.576 -6.904 1.00 0.00 C ATOM 428 O GLU A 29 8.031 -18.969 -8.059 1.00 0.00 O ATOM 429 CB GLU A 29 9.544 -19.505 -5.287 1.00 0.00 C ATOM 430 CG GLU A 29 9.765 -20.698 -6.202 1.00 0.00 C ATOM 431 CD GLU A 29 10.355 -21.890 -5.474 1.00 0.00 C ATOM 432 OE1 GLU A 29 9.596 -22.594 -4.775 1.00 0.00 O ATOM 433 OE2 GLU A 29 11.576 -22.120 -5.603 1.00 0.00 O ATOM 0 H GLU A 29 8.871 -17.458 -4.090 1.00 0.00 H new ATOM 0 HA GLU A 29 9.886 -17.886 -6.658 1.00 0.00 H new ATOM 0 HB2 GLU A 29 10.473 -19.285 -4.760 1.00 0.00 H new ATOM 0 HB3 GLU A 29 8.804 -19.769 -4.532 1.00 0.00 H new ATOM 0 HG2 GLU A 29 8.815 -20.986 -6.653 1.00 0.00 H new ATOM 0 HG3 GLU A 29 10.430 -20.409 -7.016 1.00 0.00 H new ATOM 440 N GLU A 30 6.680 -18.412 -6.348 1.00 0.00 N ATOM 441 CA GLU A 30 5.452 -18.692 -7.083 1.00 0.00 C ATOM 442 C GLU A 30 5.359 -17.827 -8.337 1.00 0.00 C ATOM 443 O GLU A 30 4.690 -18.188 -9.304 1.00 0.00 O ATOM 444 CB GLU A 30 4.231 -18.451 -6.192 1.00 0.00 C ATOM 445 CG GLU A 30 4.333 -19.115 -4.829 1.00 0.00 C ATOM 446 CD GLU A 30 3.040 -19.031 -4.041 1.00 0.00 C ATOM 447 OE1 GLU A 30 2.788 -17.974 -3.426 1.00 0.00 O ATOM 448 OE2 GLU A 30 2.280 -20.022 -4.041 1.00 0.00 O ATOM 0 H GLU A 30 6.535 -18.087 -5.392 1.00 0.00 H new ATOM 0 HA GLU A 30 5.471 -19.739 -7.385 1.00 0.00 H new ATOM 0 HB2 GLU A 30 4.097 -17.378 -6.055 1.00 0.00 H new ATOM 0 HB3 GLU A 30 3.341 -18.821 -6.701 1.00 0.00 H new ATOM 0 HG2 GLU A 30 4.608 -20.162 -4.959 1.00 0.00 H new ATOM 0 HG3 GLU A 30 5.133 -18.644 -4.258 1.00 0.00 H new ATOM 455 N ASN A 31 6.033 -16.682 -8.310 1.00 0.00 N ATOM 456 CA ASN A 31 6.026 -15.764 -9.443 1.00 0.00 C ATOM 457 C ASN A 31 7.405 -15.690 -10.092 1.00 0.00 C ATOM 458 O ASN A 31 7.736 -14.710 -10.758 1.00 0.00 O ATOM 459 CB ASN A 31 5.585 -14.370 -8.994 1.00 0.00 C ATOM 460 CG ASN A 31 6.064 -14.035 -7.594 1.00 0.00 C ATOM 461 OD1 ASN A 31 7.101 -13.396 -7.417 1.00 0.00 O ATOM 462 ND2 ASN A 31 5.308 -14.467 -6.591 1.00 0.00 N ATOM 0 H ASN A 31 6.591 -16.368 -7.516 1.00 0.00 H new ATOM 0 HA ASN A 31 5.317 -16.141 -10.180 1.00 0.00 H new ATOM 0 HB2 ASN A 31 5.969 -13.628 -9.694 1.00 0.00 H new ATOM 0 HB3 ASN A 31 4.497 -14.308 -9.028 1.00 0.00 H new ATOM 0 HD21 ASN A 31 5.579 -14.272 -5.627 1.00 0.00 H new ATOM 0 HD22 ASN A 31 4.456 -14.993 -6.785 1.00 0.00 H new ATOM 469 N ALA A 32 8.204 -16.732 -9.891 1.00 0.00 N ATOM 470 CA ALA A 32 9.546 -16.786 -10.458 1.00 0.00 C ATOM 471 C ALA A 32 9.558 -17.571 -11.766 1.00 0.00 C ATOM 472 O ALA A 32 8.734 -18.457 -11.994 1.00 0.00 O ATOM 473 CB ALA A 32 10.516 -17.404 -9.462 1.00 0.00 C ATOM 0 H ALA A 32 7.946 -17.550 -9.340 1.00 0.00 H new ATOM 0 HA ALA A 32 9.864 -15.766 -10.673 1.00 0.00 H new ATOM 0 HB1 ALA A 32 11.514 -17.438 -9.899 1.00 0.00 H new ATOM 0 HB2 ALA A 32 10.538 -16.802 -8.554 1.00 0.00 H new ATOM 0 HB3 ALA A 32 10.192 -18.416 -9.219 1.00 0.00 H new ATOM 479 N PRO A 33 10.513 -17.239 -12.647 1.00 0.00 N ATOM 480 CA PRO A 33 10.655 -17.900 -13.948 1.00 0.00 C ATOM 481 C PRO A 33 11.140 -19.340 -13.816 1.00 0.00 C ATOM 482 O PRO A 33 11.591 -19.759 -12.750 1.00 0.00 O ATOM 483 CB PRO A 33 11.703 -17.047 -14.667 1.00 0.00 C ATOM 484 CG PRO A 33 12.493 -16.416 -13.574 1.00 0.00 C ATOM 485 CD PRO A 33 11.529 -16.193 -12.442 1.00 0.00 C ATOM 0 HA PRO A 33 9.704 -17.967 -14.477 1.00 0.00 H new ATOM 0 HB2 PRO A 33 12.336 -17.657 -15.311 1.00 0.00 H new ATOM 0 HB3 PRO A 33 11.234 -16.295 -15.301 1.00 0.00 H new ATOM 0 HG2 PRO A 33 13.316 -17.061 -13.265 1.00 0.00 H new ATOM 0 HG3 PRO A 33 12.932 -15.475 -13.904 1.00 0.00 H new ATOM 0 HD2 PRO A 33 12.018 -16.292 -11.473 1.00 0.00 H new ATOM 0 HD3 PRO A 33 11.091 -15.195 -12.478 1.00 0.00 H new ATOM 493 N LYS A 34 11.044 -20.094 -14.906 1.00 0.00 N ATOM 494 CA LYS A 34 11.474 -21.487 -14.914 1.00 0.00 C ATOM 495 C LYS A 34 12.401 -21.764 -16.093 1.00 0.00 C ATOM 496 O LYS A 34 12.055 -21.496 -17.244 1.00 0.00 O ATOM 497 CB LYS A 34 10.260 -22.417 -14.976 1.00 0.00 C ATOM 498 CG LYS A 34 9.822 -22.937 -13.618 1.00 0.00 C ATOM 499 CD LYS A 34 10.887 -23.819 -12.988 1.00 0.00 C ATOM 500 CE LYS A 34 10.272 -24.873 -12.080 1.00 0.00 C ATOM 501 NZ LYS A 34 9.819 -26.068 -12.845 1.00 0.00 N ATOM 0 H LYS A 34 10.672 -19.763 -15.796 1.00 0.00 H new ATOM 0 HA LYS A 34 12.022 -21.677 -13.991 1.00 0.00 H new ATOM 0 HB2 LYS A 34 9.428 -21.885 -15.437 1.00 0.00 H new ATOM 0 HB3 LYS A 34 10.494 -23.263 -15.622 1.00 0.00 H new ATOM 0 HG2 LYS A 34 9.607 -22.097 -12.958 1.00 0.00 H new ATOM 0 HG3 LYS A 34 8.897 -23.503 -13.725 1.00 0.00 H new ATOM 0 HD2 LYS A 34 11.468 -24.306 -13.771 1.00 0.00 H new ATOM 0 HD3 LYS A 34 11.579 -23.202 -12.415 1.00 0.00 H new ATOM 0 HE2 LYS A 34 11.002 -25.177 -11.330 1.00 0.00 H new ATOM 0 HE3 LYS A 34 9.426 -24.442 -11.545 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 9.406 -26.763 -12.191 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 9.104 -25.782 -13.544 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 10.631 -26.494 -13.336 1.00 0.00 H new ATOM 515 N LYS A 35 13.579 -22.303 -15.800 1.00 0.00 N ATOM 516 CA LYS A 35 14.555 -22.620 -16.836 1.00 0.00 C ATOM 517 C LYS A 35 14.017 -23.688 -17.783 1.00 0.00 C ATOM 518 O LYS A 35 13.081 -24.413 -17.448 1.00 0.00 O ATOM 519 CB LYS A 35 15.864 -23.097 -16.203 1.00 0.00 C ATOM 520 CG LYS A 35 15.852 -24.565 -15.814 1.00 0.00 C ATOM 521 CD LYS A 35 14.777 -24.860 -14.783 1.00 0.00 C ATOM 522 CE LYS A 35 14.905 -26.272 -14.231 1.00 0.00 C ATOM 523 NZ LYS A 35 15.886 -26.342 -13.113 1.00 0.00 N ATOM 0 H LYS A 35 13.882 -22.530 -14.853 1.00 0.00 H new ATOM 0 HA LYS A 35 14.745 -21.713 -17.410 1.00 0.00 H new ATOM 0 HB2 LYS A 35 16.681 -22.922 -16.903 1.00 0.00 H new ATOM 0 HB3 LYS A 35 16.069 -22.497 -15.317 1.00 0.00 H new ATOM 0 HG2 LYS A 35 15.684 -25.176 -16.701 1.00 0.00 H new ATOM 0 HG3 LYS A 35 16.827 -24.844 -15.414 1.00 0.00 H new ATOM 0 HD2 LYS A 35 14.848 -24.141 -13.966 1.00 0.00 H new ATOM 0 HD3 LYS A 35 13.793 -24.733 -15.235 1.00 0.00 H new ATOM 0 HE2 LYS A 35 13.931 -26.615 -13.882 1.00 0.00 H new ATOM 0 HE3 LYS A 35 15.214 -26.947 -15.029 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 15.945 -27.320 -12.764 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 16.821 -26.038 -13.452 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 15.578 -25.717 -12.341 1.00 0.00 H new ATOM 537 N GLY A 36 14.616 -23.780 -18.966 1.00 0.00 N ATOM 538 CA GLY A 36 14.184 -24.764 -19.942 1.00 0.00 C ATOM 539 C GLY A 36 12.694 -24.698 -20.210 1.00 0.00 C ATOM 540 O GLY A 36 11.982 -25.687 -20.044 1.00 0.00 O ATOM 0 H GLY A 36 15.393 -23.191 -19.266 1.00 0.00 H new ATOM 0 HA2 GLY A 36 14.725 -24.608 -20.875 1.00 0.00 H new ATOM 0 HA3 GLY A 36 14.442 -25.762 -19.587 1.00 0.00 H new ATOM 544 N ASN A 37 12.220 -23.527 -20.625 1.00 0.00 N ATOM 545 CA ASN A 37 10.804 -23.335 -20.915 1.00 0.00 C ATOM 546 C ASN A 37 10.569 -22.007 -21.628 1.00 0.00 C ATOM 547 O ASN A 37 11.245 -21.016 -21.353 1.00 0.00 O ATOM 548 CB ASN A 37 9.986 -23.384 -19.622 1.00 0.00 C ATOM 549 CG ASN A 37 9.435 -24.768 -19.338 1.00 0.00 C ATOM 550 OD1 ASN A 37 9.620 -25.310 -18.249 1.00 0.00 O ATOM 551 ND2 ASN A 37 8.754 -25.346 -20.320 1.00 0.00 N ATOM 0 H ASN A 37 12.796 -22.697 -20.768 1.00 0.00 H new ATOM 0 HA ASN A 37 10.481 -24.142 -21.573 1.00 0.00 H new ATOM 0 HB2 ASN A 37 10.611 -23.067 -18.788 1.00 0.00 H new ATOM 0 HB3 ASN A 37 9.161 -22.675 -19.690 1.00 0.00 H new ATOM 0 HD21 ASN A 37 8.359 -26.277 -20.188 1.00 0.00 H new ATOM 0 HD22 ASN A 37 8.625 -24.859 -21.207 1.00 0.00 H new ATOM 558 N GLU A 38 9.607 -21.996 -22.546 1.00 0.00 N ATOM 559 CA GLU A 38 9.285 -20.790 -23.299 1.00 0.00 C ATOM 560 C GLU A 38 8.720 -19.710 -22.380 1.00 0.00 C ATOM 561 O GLU A 38 7.596 -19.820 -21.892 1.00 0.00 O ATOM 562 CB GLU A 38 8.279 -21.108 -24.408 1.00 0.00 C ATOM 563 CG GLU A 38 8.605 -20.442 -25.734 1.00 0.00 C ATOM 564 CD GLU A 38 7.700 -20.906 -26.858 1.00 0.00 C ATOM 565 OE1 GLU A 38 6.876 -21.814 -26.619 1.00 0.00 O ATOM 566 OE2 GLU A 38 7.815 -20.363 -27.976 1.00 0.00 O ATOM 0 H GLU A 38 9.038 -22.808 -22.786 1.00 0.00 H new ATOM 0 HA GLU A 38 10.205 -20.416 -23.749 1.00 0.00 H new ATOM 0 HB2 GLU A 38 8.240 -22.188 -24.553 1.00 0.00 H new ATOM 0 HB3 GLU A 38 7.286 -20.793 -24.087 1.00 0.00 H new ATOM 0 HG2 GLU A 38 8.517 -19.361 -25.625 1.00 0.00 H new ATOM 0 HG3 GLU A 38 9.642 -20.653 -25.997 1.00 0.00 H new ATOM 573 N VAL A 39 9.510 -18.666 -22.149 1.00 0.00 N ATOM 574 CA VAL A 39 9.091 -17.566 -21.289 1.00 0.00 C ATOM 575 C VAL A 39 8.890 -16.286 -22.093 1.00 0.00 C ATOM 576 O VAL A 39 9.659 -15.986 -23.008 1.00 0.00 O ATOM 577 CB VAL A 39 10.119 -17.302 -20.173 1.00 0.00 C ATOM 578 CG1 VAL A 39 10.887 -18.572 -19.842 1.00 0.00 C ATOM 579 CG2 VAL A 39 11.070 -16.185 -20.579 1.00 0.00 C ATOM 0 H VAL A 39 10.444 -18.559 -22.546 1.00 0.00 H new ATOM 0 HA VAL A 39 8.144 -17.861 -20.837 1.00 0.00 H new ATOM 0 HB VAL A 39 9.584 -16.986 -19.277 1.00 0.00 H new ATOM 0 HG11 VAL A 39 11.608 -18.365 -19.051 1.00 0.00 H new ATOM 0 HG12 VAL A 39 10.191 -19.341 -19.506 1.00 0.00 H new ATOM 0 HG13 VAL A 39 11.413 -18.921 -20.731 1.00 0.00 H new ATOM 0 HG21 VAL A 39 11.790 -16.011 -19.779 1.00 0.00 H new ATOM 0 HG22 VAL A 39 11.599 -16.470 -21.488 1.00 0.00 H new ATOM 0 HG23 VAL A 39 10.503 -15.272 -20.761 1.00 0.00 H new ATOM 589 N THR A 40 7.851 -15.533 -21.747 1.00 0.00 N ATOM 590 CA THR A 40 7.548 -14.285 -22.437 1.00 0.00 C ATOM 591 C THR A 40 7.733 -13.087 -21.512 1.00 0.00 C ATOM 592 O THR A 40 7.139 -13.023 -20.436 1.00 0.00 O ATOM 593 CB THR A 40 6.108 -14.280 -22.982 1.00 0.00 C ATOM 594 OG1 THR A 40 5.865 -15.474 -23.735 1.00 0.00 O ATOM 595 CG2 THR A 40 5.866 -13.062 -23.861 1.00 0.00 C ATOM 0 H THR A 40 7.205 -15.766 -20.993 1.00 0.00 H new ATOM 0 HA THR A 40 8.245 -14.208 -23.272 1.00 0.00 H new ATOM 0 HB THR A 40 5.423 -14.239 -22.135 1.00 0.00 H new ATOM 0 HG1 THR A 40 4.947 -15.464 -24.077 1.00 0.00 H new ATOM 0 HG21 THR A 40 4.842 -13.080 -24.234 1.00 0.00 H new ATOM 0 HG22 THR A 40 6.023 -12.155 -23.277 1.00 0.00 H new ATOM 0 HG23 THR A 40 6.559 -13.077 -24.702 1.00 0.00 H new ATOM 603 N VAL A 41 8.561 -12.138 -21.939 1.00 0.00 N ATOM 604 CA VAL A 41 8.823 -10.941 -21.150 1.00 0.00 C ATOM 605 C VAL A 41 8.974 -9.715 -22.045 1.00 0.00 C ATOM 606 O VAL A 41 8.992 -9.827 -23.271 1.00 0.00 O ATOM 607 CB VAL A 41 10.095 -11.099 -20.296 1.00 0.00 C ATOM 608 CG1 VAL A 41 10.006 -12.347 -19.431 1.00 0.00 C ATOM 609 CG2 VAL A 41 11.330 -11.141 -21.183 1.00 0.00 C ATOM 0 H VAL A 41 9.061 -12.176 -22.827 1.00 0.00 H new ATOM 0 HA VAL A 41 7.966 -10.803 -20.490 1.00 0.00 H new ATOM 0 HB VAL A 41 10.179 -10.235 -19.637 1.00 0.00 H new ATOM 0 HG11 VAL A 41 10.914 -12.442 -18.835 1.00 0.00 H new ATOM 0 HG12 VAL A 41 9.143 -12.270 -18.769 1.00 0.00 H new ATOM 0 HG13 VAL A 41 9.897 -13.224 -20.068 1.00 0.00 H new ATOM 0 HG21 VAL A 41 12.220 -11.253 -20.563 1.00 0.00 H new ATOM 0 HG22 VAL A 41 11.257 -11.985 -21.869 1.00 0.00 H new ATOM 0 HG23 VAL A 41 11.400 -10.215 -21.754 1.00 0.00 H new ATOM 619 N HIS A 42 9.082 -8.545 -21.423 1.00 0.00 N ATOM 620 CA HIS A 42 9.232 -7.298 -22.163 1.00 0.00 C ATOM 621 C HIS A 42 10.365 -6.456 -21.584 1.00 0.00 C ATOM 622 O HIS A 42 10.511 -6.346 -20.366 1.00 0.00 O ATOM 623 CB HIS A 42 7.926 -6.503 -22.136 1.00 0.00 C ATOM 624 CG HIS A 42 8.083 -5.077 -22.563 1.00 0.00 C ATOM 625 ND1 HIS A 42 8.554 -4.087 -21.726 1.00 0.00 N ATOM 626 CD2 HIS A 42 7.831 -4.475 -23.749 1.00 0.00 C ATOM 627 CE1 HIS A 42 8.583 -2.939 -22.378 1.00 0.00 C ATOM 628 NE2 HIS A 42 8.149 -3.147 -23.608 1.00 0.00 N ATOM 0 H HIS A 42 9.068 -8.435 -20.409 1.00 0.00 H new ATOM 0 HA HIS A 42 9.477 -7.545 -23.196 1.00 0.00 H new ATOM 0 HB2 HIS A 42 7.200 -6.991 -22.787 1.00 0.00 H new ATOM 0 HB3 HIS A 42 7.516 -6.528 -21.126 1.00 0.00 H new ATOM 0 HD1 HIS A 42 8.836 -4.221 -20.755 1.00 0.00 H new ATOM 0 HD2 HIS A 42 7.450 -4.951 -24.641 1.00 0.00 H new ATOM 0 HE1 HIS A 42 8.907 -1.991 -21.974 1.00 0.00 H new ATOM 636 N TYR A 43 11.165 -5.864 -22.464 1.00 0.00 N ATOM 637 CA TYR A 43 12.287 -5.035 -22.041 1.00 0.00 C ATOM 638 C TYR A 43 12.713 -4.084 -23.155 1.00 0.00 C ATOM 639 O TYR A 43 12.479 -4.347 -24.335 1.00 0.00 O ATOM 640 CB TYR A 43 13.469 -5.913 -21.625 1.00 0.00 C ATOM 641 CG TYR A 43 13.981 -6.804 -22.733 1.00 0.00 C ATOM 642 CD1 TYR A 43 14.778 -6.293 -23.750 1.00 0.00 C ATOM 643 CD2 TYR A 43 13.666 -8.157 -22.766 1.00 0.00 C ATOM 644 CE1 TYR A 43 15.248 -7.104 -24.765 1.00 0.00 C ATOM 645 CE2 TYR A 43 14.132 -8.975 -23.776 1.00 0.00 C ATOM 646 CZ TYR A 43 14.923 -8.444 -24.774 1.00 0.00 C ATOM 647 OH TYR A 43 15.388 -9.255 -25.783 1.00 0.00 O ATOM 0 H TYR A 43 11.057 -5.943 -23.475 1.00 0.00 H new ATOM 0 HA TYR A 43 11.965 -4.442 -21.185 1.00 0.00 H new ATOM 0 HB2 TYR A 43 14.282 -5.274 -21.279 1.00 0.00 H new ATOM 0 HB3 TYR A 43 13.170 -6.533 -20.780 1.00 0.00 H new ATOM 0 HD1 TYR A 43 15.034 -5.244 -23.747 1.00 0.00 H new ATOM 0 HD2 TYR A 43 13.046 -8.576 -21.988 1.00 0.00 H new ATOM 0 HE1 TYR A 43 15.867 -6.690 -25.548 1.00 0.00 H new ATOM 0 HE2 TYR A 43 13.879 -10.025 -23.785 1.00 0.00 H new ATOM 0 HH TYR A 43 15.069 -10.171 -25.640 1.00 0.00 H new ATOM 657 N VAL A 44 13.342 -2.978 -22.772 1.00 0.00 N ATOM 658 CA VAL A 44 13.803 -1.987 -23.737 1.00 0.00 C ATOM 659 C VAL A 44 15.219 -1.523 -23.414 1.00 0.00 C ATOM 660 O VAL A 44 15.593 -1.401 -22.248 1.00 0.00 O ATOM 661 CB VAL A 44 12.870 -0.763 -23.774 1.00 0.00 C ATOM 662 CG1 VAL A 44 11.435 -1.193 -24.038 1.00 0.00 C ATOM 663 CG2 VAL A 44 12.969 0.023 -22.475 1.00 0.00 C ATOM 0 H VAL A 44 13.544 -2.745 -21.800 1.00 0.00 H new ATOM 0 HA VAL A 44 13.796 -2.470 -24.714 1.00 0.00 H new ATOM 0 HB VAL A 44 13.185 -0.113 -24.590 1.00 0.00 H new ATOM 0 HG11 VAL A 44 10.790 -0.314 -24.061 1.00 0.00 H new ATOM 0 HG12 VAL A 44 11.380 -1.708 -24.997 1.00 0.00 H new ATOM 0 HG13 VAL A 44 11.105 -1.865 -23.246 1.00 0.00 H new ATOM 0 HG21 VAL A 44 12.303 0.885 -22.519 1.00 0.00 H new ATOM 0 HG22 VAL A 44 12.681 -0.616 -21.640 1.00 0.00 H new ATOM 0 HG23 VAL A 44 13.994 0.364 -22.334 1.00 0.00 H new ATOM 673 N GLY A 45 16.004 -1.264 -24.456 1.00 0.00 N ATOM 674 CA GLY A 45 17.370 -0.816 -24.262 1.00 0.00 C ATOM 675 C GLY A 45 17.512 0.687 -24.398 1.00 0.00 C ATOM 676 O GLY A 45 16.886 1.302 -25.261 1.00 0.00 O ATOM 0 H GLY A 45 15.718 -1.357 -25.431 1.00 0.00 H new ATOM 0 HA2 GLY A 45 17.713 -1.122 -23.274 1.00 0.00 H new ATOM 0 HA3 GLY A 45 18.017 -1.306 -24.990 1.00 0.00 H new ATOM 680 N LYS A 46 18.336 1.281 -23.541 1.00 0.00 N ATOM 681 CA LYS A 46 18.559 2.722 -23.568 1.00 0.00 C ATOM 682 C LYS A 46 19.980 3.061 -23.129 1.00 0.00 C ATOM 683 O LYS A 46 20.516 2.453 -22.202 1.00 0.00 O ATOM 684 CB LYS A 46 17.551 3.431 -22.660 1.00 0.00 C ATOM 685 CG LYS A 46 17.862 3.292 -21.180 1.00 0.00 C ATOM 686 CD LYS A 46 18.518 4.546 -20.628 1.00 0.00 C ATOM 687 CE LYS A 46 17.991 4.888 -19.243 1.00 0.00 C ATOM 688 NZ LYS A 46 16.764 5.730 -19.309 1.00 0.00 N ATOM 0 H LYS A 46 18.860 0.787 -22.819 1.00 0.00 H new ATOM 0 HA LYS A 46 18.422 3.067 -24.593 1.00 0.00 H new ATOM 0 HB2 LYS A 46 17.523 4.489 -22.919 1.00 0.00 H new ATOM 0 HB3 LYS A 46 16.556 3.030 -22.853 1.00 0.00 H new ATOM 0 HG2 LYS A 46 16.942 3.090 -20.631 1.00 0.00 H new ATOM 0 HG3 LYS A 46 18.520 2.437 -21.024 1.00 0.00 H new ATOM 0 HD2 LYS A 46 19.598 4.403 -20.582 1.00 0.00 H new ATOM 0 HD3 LYS A 46 18.335 5.381 -21.304 1.00 0.00 H new ATOM 0 HE2 LYS A 46 17.772 3.968 -18.701 1.00 0.00 H new ATOM 0 HE3 LYS A 46 18.762 5.414 -18.680 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 16.436 5.942 -18.345 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 16.979 6.619 -19.804 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 16.019 5.218 -19.824 1.00 0.00 H new ATOM 702 N LEU A 47 20.584 4.036 -23.800 1.00 0.00 N ATOM 703 CA LEU A 47 21.943 4.457 -23.478 1.00 0.00 C ATOM 704 C LEU A 47 21.937 5.547 -22.411 1.00 0.00 C ATOM 705 O LEU A 47 21.024 6.369 -22.356 1.00 0.00 O ATOM 706 CB LEU A 47 22.653 4.963 -24.735 1.00 0.00 C ATOM 707 CG LEU A 47 23.529 3.946 -25.467 1.00 0.00 C ATOM 708 CD1 LEU A 47 23.575 4.254 -26.956 1.00 0.00 C ATOM 709 CD2 LEU A 47 24.932 3.931 -24.880 1.00 0.00 C ATOM 0 H LEU A 47 20.154 4.549 -24.570 1.00 0.00 H new ATOM 0 HA LEU A 47 22.481 3.594 -23.087 1.00 0.00 H new ATOM 0 HB2 LEU A 47 21.899 5.330 -25.431 1.00 0.00 H new ATOM 0 HB3 LEU A 47 23.274 5.815 -24.459 1.00 0.00 H new ATOM 0 HG LEU A 47 23.091 2.957 -25.335 1.00 0.00 H new ATOM 0 HD11 LEU A 47 24.203 3.520 -27.460 1.00 0.00 H new ATOM 0 HD12 LEU A 47 22.566 4.212 -27.367 1.00 0.00 H new ATOM 0 HD13 LEU A 47 23.988 5.251 -27.109 1.00 0.00 H new ATOM 0 HD21 LEU A 47 25.542 3.201 -25.413 1.00 0.00 H new ATOM 0 HD22 LEU A 47 25.379 4.920 -24.980 1.00 0.00 H new ATOM 0 HD23 LEU A 47 24.882 3.661 -23.825 1.00 0.00 H new ATOM 721 N GLU A 48 22.964 5.547 -21.566 1.00 0.00 N ATOM 722 CA GLU A 48 23.077 6.537 -20.502 1.00 0.00 C ATOM 723 C GLU A 48 23.901 7.737 -20.959 1.00 0.00 C ATOM 724 O GLU A 48 23.742 8.845 -20.448 1.00 0.00 O ATOM 725 CB GLU A 48 23.712 5.911 -19.258 1.00 0.00 C ATOM 726 CG GLU A 48 25.188 5.592 -19.425 1.00 0.00 C ATOM 727 CD GLU A 48 26.082 6.771 -19.090 1.00 0.00 C ATOM 728 OE1 GLU A 48 25.771 7.493 -18.119 1.00 0.00 O ATOM 729 OE2 GLU A 48 27.090 6.972 -19.798 1.00 0.00 O ATOM 0 H GLU A 48 23.729 4.873 -21.598 1.00 0.00 H new ATOM 0 HA GLU A 48 22.073 6.882 -20.254 1.00 0.00 H new ATOM 0 HB2 GLU A 48 23.589 6.592 -18.416 1.00 0.00 H new ATOM 0 HB3 GLU A 48 23.177 4.995 -19.009 1.00 0.00 H new ATOM 0 HG2 GLU A 48 25.449 4.750 -18.784 1.00 0.00 H new ATOM 0 HG3 GLU A 48 25.374 5.280 -20.453 1.00 0.00 H new ATOM 736 N SER A 49 24.784 7.506 -21.926 1.00 0.00 N ATOM 737 CA SER A 49 25.638 8.566 -22.450 1.00 0.00 C ATOM 738 C SER A 49 24.873 9.440 -23.440 1.00 0.00 C ATOM 739 O SER A 49 25.011 10.663 -23.440 1.00 0.00 O ATOM 740 CB SER A 49 26.871 7.968 -23.128 1.00 0.00 C ATOM 741 OG SER A 49 27.775 8.982 -23.530 1.00 0.00 O ATOM 0 H SER A 49 24.927 6.595 -22.362 1.00 0.00 H new ATOM 0 HA SER A 49 25.958 9.188 -21.614 1.00 0.00 H new ATOM 0 HB2 SER A 49 27.370 7.283 -22.443 1.00 0.00 H new ATOM 0 HB3 SER A 49 26.565 7.384 -23.996 1.00 0.00 H new ATOM 0 HG SER A 49 28.555 8.573 -23.959 1.00 0.00 H new ATOM 747 N SER A 50 24.066 8.802 -24.282 1.00 0.00 N ATOM 748 CA SER A 50 23.282 9.520 -25.281 1.00 0.00 C ATOM 749 C SER A 50 21.868 9.784 -24.773 1.00 0.00 C ATOM 750 O SER A 50 21.227 10.757 -25.167 1.00 0.00 O ATOM 751 CB SER A 50 23.227 8.723 -26.586 1.00 0.00 C ATOM 752 OG SER A 50 24.456 8.806 -27.286 1.00 0.00 O ATOM 0 H SER A 50 23.938 7.790 -24.292 1.00 0.00 H new ATOM 0 HA SER A 50 23.767 10.478 -25.469 1.00 0.00 H new ATOM 0 HB2 SER A 50 22.998 7.680 -26.369 1.00 0.00 H new ATOM 0 HB3 SER A 50 22.421 9.102 -27.214 1.00 0.00 H new ATOM 0 HG SER A 50 24.396 8.287 -28.115 1.00 0.00 H new ATOM 758 N GLY A 51 21.388 8.910 -23.894 1.00 0.00 N ATOM 759 CA GLY A 51 20.053 9.065 -23.346 1.00 0.00 C ATOM 760 C GLY A 51 18.971 8.708 -24.346 1.00 0.00 C ATOM 761 O GLY A 51 17.811 9.086 -24.178 1.00 0.00 O ATOM 0 H GLY A 51 21.900 8.097 -23.551 1.00 0.00 H new ATOM 0 HA2 GLY A 51 19.950 8.434 -22.463 1.00 0.00 H new ATOM 0 HA3 GLY A 51 19.915 10.096 -23.019 1.00 0.00 H new ATOM 765 N LYS A 52 19.349 7.979 -25.390 1.00 0.00 N ATOM 766 CA LYS A 52 18.403 7.570 -26.421 1.00 0.00 C ATOM 767 C LYS A 52 17.921 6.143 -26.183 1.00 0.00 C ATOM 768 O LYS A 52 18.596 5.350 -25.526 1.00 0.00 O ATOM 769 CB LYS A 52 19.048 7.678 -27.805 1.00 0.00 C ATOM 770 CG LYS A 52 19.572 9.067 -28.125 1.00 0.00 C ATOM 771 CD LYS A 52 18.472 10.111 -28.043 1.00 0.00 C ATOM 772 CE LYS A 52 18.789 11.324 -28.904 1.00 0.00 C ATOM 773 NZ LYS A 52 18.635 11.029 -30.356 1.00 0.00 N ATOM 0 H LYS A 52 20.305 7.659 -25.545 1.00 0.00 H new ATOM 0 HA LYS A 52 17.542 8.237 -26.374 1.00 0.00 H new ATOM 0 HB2 LYS A 52 19.870 6.965 -27.870 1.00 0.00 H new ATOM 0 HB3 LYS A 52 18.317 7.392 -28.561 1.00 0.00 H new ATOM 0 HG2 LYS A 52 20.371 9.324 -27.430 1.00 0.00 H new ATOM 0 HG3 LYS A 52 20.005 9.072 -29.125 1.00 0.00 H new ATOM 0 HD2 LYS A 52 17.528 9.672 -28.365 1.00 0.00 H new ATOM 0 HD3 LYS A 52 18.342 10.423 -27.007 1.00 0.00 H new ATOM 0 HE2 LYS A 52 18.130 12.147 -28.629 1.00 0.00 H new ATOM 0 HE3 LYS A 52 19.809 11.653 -28.706 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 18.591 11.921 -30.889 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 19.448 10.469 -30.685 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 17.759 10.490 -30.510 1.00 0.00 H new ATOM 787 N VAL A 53 16.750 5.820 -26.723 1.00 0.00 N ATOM 788 CA VAL A 53 16.179 4.487 -26.571 1.00 0.00 C ATOM 789 C VAL A 53 16.286 3.693 -27.868 1.00 0.00 C ATOM 790 O VAL A 53 16.003 4.209 -28.950 1.00 0.00 O ATOM 791 CB VAL A 53 14.701 4.555 -26.144 1.00 0.00 C ATOM 792 CG1 VAL A 53 14.115 3.157 -26.024 1.00 0.00 C ATOM 793 CG2 VAL A 53 14.561 5.315 -24.833 1.00 0.00 C ATOM 0 H VAL A 53 16.178 6.464 -27.270 1.00 0.00 H new ATOM 0 HA VAL A 53 16.752 3.984 -25.792 1.00 0.00 H new ATOM 0 HB VAL A 53 14.143 5.092 -26.911 1.00 0.00 H new ATOM 0 HG11 VAL A 53 13.070 3.225 -25.721 1.00 0.00 H new ATOM 0 HG12 VAL A 53 14.182 2.651 -26.987 1.00 0.00 H new ATOM 0 HG13 VAL A 53 14.673 2.592 -25.277 1.00 0.00 H new ATOM 0 HG21 VAL A 53 13.510 5.354 -24.545 1.00 0.00 H new ATOM 0 HG22 VAL A 53 15.132 4.807 -24.055 1.00 0.00 H new ATOM 0 HG23 VAL A 53 14.941 6.329 -24.958 1.00 0.00 H new ATOM 803 N PHE A 54 16.694 2.434 -27.753 1.00 0.00 N ATOM 804 CA PHE A 54 16.838 1.567 -28.917 1.00 0.00 C ATOM 805 C PHE A 54 16.491 0.123 -28.566 1.00 0.00 C ATOM 806 O PHE A 54 16.740 -0.333 -27.449 1.00 0.00 O ATOM 807 CB PHE A 54 18.266 1.642 -29.461 1.00 0.00 C ATOM 808 CG PHE A 54 19.266 0.895 -28.626 1.00 0.00 C ATOM 809 CD1 PHE A 54 19.532 -0.443 -28.872 1.00 0.00 C ATOM 810 CD2 PHE A 54 19.941 1.530 -27.596 1.00 0.00 C ATOM 811 CE1 PHE A 54 20.451 -1.132 -28.104 1.00 0.00 C ATOM 812 CE2 PHE A 54 20.862 0.846 -26.826 1.00 0.00 C ATOM 813 CZ PHE A 54 21.118 -0.487 -27.081 1.00 0.00 C ATOM 0 H PHE A 54 16.931 1.991 -26.865 1.00 0.00 H new ATOM 0 HA PHE A 54 16.145 1.912 -29.684 1.00 0.00 H new ATOM 0 HB2 PHE A 54 18.281 1.243 -30.475 1.00 0.00 H new ATOM 0 HB3 PHE A 54 18.567 2.688 -29.525 1.00 0.00 H new ATOM 0 HD1 PHE A 54 19.016 -0.952 -29.672 1.00 0.00 H new ATOM 0 HD2 PHE A 54 19.745 2.572 -27.393 1.00 0.00 H new ATOM 0 HE1 PHE A 54 20.648 -2.175 -28.304 1.00 0.00 H new ATOM 0 HE2 PHE A 54 21.381 1.353 -26.026 1.00 0.00 H new ATOM 0 HZ PHE A 54 21.838 -1.024 -26.482 1.00 0.00 H new ATOM 823 N ASP A 55 15.914 -0.590 -29.526 1.00 0.00 N ATOM 824 CA ASP A 55 15.533 -1.983 -29.320 1.00 0.00 C ATOM 825 C ASP A 55 14.462 -2.099 -28.240 1.00 0.00 C ATOM 826 O ASP A 55 14.536 -2.965 -27.368 1.00 0.00 O ATOM 827 CB ASP A 55 16.755 -2.817 -28.935 1.00 0.00 C ATOM 828 CG ASP A 55 16.653 -4.250 -29.420 1.00 0.00 C ATOM 829 OD1 ASP A 55 16.082 -4.470 -30.508 1.00 0.00 O ATOM 830 OD2 ASP A 55 17.146 -5.152 -28.710 1.00 0.00 O ATOM 0 H ASP A 55 15.700 -0.227 -30.455 1.00 0.00 H new ATOM 0 HA ASP A 55 15.123 -2.364 -30.256 1.00 0.00 H new ATOM 0 HB2 ASP A 55 17.651 -2.358 -29.353 1.00 0.00 H new ATOM 0 HB3 ASP A 55 16.869 -2.810 -27.851 1.00 0.00 H new ATOM 835 N SER A 56 13.467 -1.219 -28.303 1.00 0.00 N ATOM 836 CA SER A 56 12.383 -1.219 -27.327 1.00 0.00 C ATOM 837 C SER A 56 11.226 -2.092 -27.801 1.00 0.00 C ATOM 838 O SER A 56 10.642 -1.849 -28.858 1.00 0.00 O ATOM 839 CB SER A 56 11.892 0.208 -27.079 1.00 0.00 C ATOM 840 OG SER A 56 10.518 0.221 -26.733 1.00 0.00 O ATOM 0 H SER A 56 13.389 -0.497 -29.020 1.00 0.00 H new ATOM 0 HA SER A 56 12.767 -1.631 -26.394 1.00 0.00 H new ATOM 0 HB2 SER A 56 12.476 0.663 -26.279 1.00 0.00 H new ATOM 0 HB3 SER A 56 12.051 0.811 -27.973 1.00 0.00 H new ATOM 0 HG SER A 56 10.240 1.139 -26.531 1.00 0.00 H new ATOM 846 N SER A 57 10.899 -3.111 -27.012 1.00 0.00 N ATOM 847 CA SER A 57 9.813 -4.024 -27.352 1.00 0.00 C ATOM 848 C SER A 57 8.500 -3.266 -27.523 1.00 0.00 C ATOM 849 O SER A 57 7.689 -3.596 -28.388 1.00 0.00 O ATOM 850 CB SER A 57 9.661 -5.094 -26.269 1.00 0.00 C ATOM 851 OG SER A 57 10.475 -6.220 -26.548 1.00 0.00 O ATOM 0 H SER A 57 11.370 -3.325 -26.133 1.00 0.00 H new ATOM 0 HA SER A 57 10.059 -4.507 -28.298 1.00 0.00 H new ATOM 0 HB2 SER A 57 9.933 -4.676 -25.300 1.00 0.00 H new ATOM 0 HB3 SER A 57 8.618 -5.403 -26.202 1.00 0.00 H new ATOM 0 HG SER A 57 10.362 -6.889 -25.841 1.00 0.00 H new ATOM 857 N ARG A 58 8.298 -2.250 -26.690 1.00 0.00 N ATOM 858 CA ARG A 58 7.083 -1.446 -26.747 1.00 0.00 C ATOM 859 C ARG A 58 7.108 -0.508 -27.950 1.00 0.00 C ATOM 860 O ARG A 58 6.066 -0.187 -28.520 1.00 0.00 O ATOM 861 CB ARG A 58 6.920 -0.637 -25.459 1.00 0.00 C ATOM 862 CG ARG A 58 8.103 0.268 -25.155 1.00 0.00 C ATOM 863 CD ARG A 58 7.914 1.010 -23.841 1.00 0.00 C ATOM 864 NE ARG A 58 7.147 2.241 -24.013 1.00 0.00 N ATOM 865 CZ ARG A 58 7.665 3.370 -24.483 1.00 0.00 C ATOM 866 NH1 ARG A 58 8.945 3.424 -24.826 1.00 0.00 N ATOM 867 NH2 ARG A 58 6.903 4.449 -24.610 1.00 0.00 N ATOM 0 H ARG A 58 8.960 -1.964 -25.968 1.00 0.00 H new ATOM 0 HA ARG A 58 6.235 -2.122 -26.853 1.00 0.00 H new ATOM 0 HB2 ARG A 58 6.018 -0.029 -25.533 1.00 0.00 H new ATOM 0 HB3 ARG A 58 6.774 -1.323 -24.625 1.00 0.00 H new ATOM 0 HG2 ARG A 58 9.015 -0.327 -25.110 1.00 0.00 H new ATOM 0 HG3 ARG A 58 8.230 0.986 -25.965 1.00 0.00 H new ATOM 0 HD2 ARG A 58 7.404 0.362 -23.129 1.00 0.00 H new ATOM 0 HD3 ARG A 58 8.889 1.247 -23.415 1.00 0.00 H new ATOM 0 HE ARG A 58 6.159 2.233 -23.758 1.00 0.00 H new ATOM 0 HH11 ARG A 58 9.534 2.597 -24.729 1.00 0.00 H new ATOM 0 HH12 ARG A 58 9.340 4.292 -25.187 1.00 0.00 H new ATOM 0 HH21 ARG A 58 5.918 4.412 -24.347 1.00 0.00 H new ATOM 0 HH22 ARG A 58 7.302 5.316 -24.971 1.00 0.00 H new ATOM 881 N GLU A 59 8.305 -0.071 -28.329 1.00 0.00 N ATOM 882 CA GLU A 59 8.464 0.832 -29.463 1.00 0.00 C ATOM 883 C GLU A 59 7.868 0.225 -30.730 1.00 0.00 C ATOM 884 O GLU A 59 7.510 0.941 -31.665 1.00 0.00 O ATOM 885 CB GLU A 59 9.944 1.151 -29.685 1.00 0.00 C ATOM 886 CG GLU A 59 10.189 2.164 -30.791 1.00 0.00 C ATOM 887 CD GLU A 59 11.660 2.479 -30.978 1.00 0.00 C ATOM 888 OE1 GLU A 59 12.475 1.533 -30.980 1.00 0.00 O ATOM 889 OE2 GLU A 59 11.996 3.674 -31.123 1.00 0.00 O ATOM 0 H GLU A 59 9.178 -0.327 -27.868 1.00 0.00 H new ATOM 0 HA GLU A 59 7.930 1.755 -29.237 1.00 0.00 H new ATOM 0 HB2 GLU A 59 10.369 1.531 -28.756 1.00 0.00 H new ATOM 0 HB3 GLU A 59 10.474 0.229 -29.924 1.00 0.00 H new ATOM 0 HG2 GLU A 59 9.782 1.781 -31.726 1.00 0.00 H new ATOM 0 HG3 GLU A 59 9.651 3.084 -30.562 1.00 0.00 H new ATOM 896 N ARG A 60 7.765 -1.100 -30.752 1.00 0.00 N ATOM 897 CA ARG A 60 7.214 -1.804 -31.904 1.00 0.00 C ATOM 898 C ARG A 60 5.933 -2.542 -31.528 1.00 0.00 C ATOM 899 O ARG A 60 5.223 -3.053 -32.392 1.00 0.00 O ATOM 900 CB ARG A 60 8.240 -2.793 -32.462 1.00 0.00 C ATOM 901 CG ARG A 60 9.112 -3.433 -31.395 1.00 0.00 C ATOM 902 CD ARG A 60 10.110 -4.407 -32.002 1.00 0.00 C ATOM 903 NE ARG A 60 11.413 -3.787 -32.226 1.00 0.00 N ATOM 904 CZ ARG A 60 12.539 -4.476 -32.378 1.00 0.00 C ATOM 905 NH1 ARG A 60 12.520 -5.801 -32.331 1.00 0.00 N ATOM 906 NH2 ARG A 60 13.686 -3.840 -32.578 1.00 0.00 N ATOM 0 H ARG A 60 8.056 -1.707 -29.986 1.00 0.00 H new ATOM 0 HA ARG A 60 6.976 -1.066 -32.670 1.00 0.00 H new ATOM 0 HB2 ARG A 60 7.716 -3.577 -33.009 1.00 0.00 H new ATOM 0 HB3 ARG A 60 8.878 -2.276 -33.179 1.00 0.00 H new ATOM 0 HG2 ARG A 60 9.646 -2.657 -30.847 1.00 0.00 H new ATOM 0 HG3 ARG A 60 8.483 -3.956 -30.675 1.00 0.00 H new ATOM 0 HD2 ARG A 60 10.226 -5.266 -31.341 1.00 0.00 H new ATOM 0 HD3 ARG A 60 9.720 -4.783 -32.948 1.00 0.00 H new ATOM 0 HE ARG A 60 11.461 -2.769 -32.268 1.00 0.00 H new ATOM 0 HH11 ARG A 60 11.640 -6.293 -32.178 1.00 0.00 H new ATOM 0 HH12 ARG A 60 13.385 -6.328 -32.448 1.00 0.00 H new ATOM 0 HH21 ARG A 60 13.704 -2.821 -32.615 1.00 0.00 H new ATOM 0 HH22 ARG A 60 14.550 -4.370 -32.694 1.00 0.00 H new ATOM 920 N ASN A 61 5.645 -2.594 -30.231 1.00 0.00 N ATOM 921 CA ASN A 61 4.450 -3.271 -29.740 1.00 0.00 C ATOM 922 C ASN A 61 4.503 -4.763 -30.052 1.00 0.00 C ATOM 923 O ASN A 61 3.618 -5.301 -30.718 1.00 0.00 O ATOM 924 CB ASN A 61 3.196 -2.653 -30.363 1.00 0.00 C ATOM 925 CG ASN A 61 3.234 -1.137 -30.356 1.00 0.00 C ATOM 926 OD1 ASN A 61 3.383 -0.514 -29.305 1.00 0.00 O ATOM 927 ND2 ASN A 61 3.099 -0.536 -31.532 1.00 0.00 N ATOM 0 H ASN A 61 6.223 -2.176 -29.502 1.00 0.00 H new ATOM 0 HA ASN A 61 4.410 -3.145 -28.658 1.00 0.00 H new ATOM 0 HB2 ASN A 61 3.091 -3.006 -31.389 1.00 0.00 H new ATOM 0 HB3 ASN A 61 2.316 -2.994 -29.817 1.00 0.00 H new ATOM 0 HD21 ASN A 61 3.117 0.482 -31.589 1.00 0.00 H new ATOM 0 HD22 ASN A 61 2.978 -1.092 -32.378 1.00 0.00 H new ATOM 934 N VAL A 62 5.546 -5.427 -29.565 1.00 0.00 N ATOM 935 CA VAL A 62 5.714 -6.858 -29.789 1.00 0.00 C ATOM 936 C VAL A 62 6.536 -7.496 -28.674 1.00 0.00 C ATOM 937 O VAL A 62 7.715 -7.195 -28.488 1.00 0.00 O ATOM 938 CB VAL A 62 6.399 -7.138 -31.140 1.00 0.00 C ATOM 939 CG1 VAL A 62 7.710 -6.375 -31.243 1.00 0.00 C ATOM 940 CG2 VAL A 62 6.625 -8.631 -31.323 1.00 0.00 C ATOM 0 H VAL A 62 6.288 -4.997 -29.013 1.00 0.00 H new ATOM 0 HA VAL A 62 4.716 -7.296 -29.798 1.00 0.00 H new ATOM 0 HB VAL A 62 5.743 -6.793 -31.939 1.00 0.00 H new ATOM 0 HG11 VAL A 62 8.179 -6.586 -32.204 1.00 0.00 H new ATOM 0 HG12 VAL A 62 7.516 -5.306 -31.160 1.00 0.00 H new ATOM 0 HG13 VAL A 62 8.376 -6.686 -30.438 1.00 0.00 H new ATOM 0 HG21 VAL A 62 7.110 -8.811 -32.283 1.00 0.00 H new ATOM 0 HG22 VAL A 62 7.261 -9.004 -30.520 1.00 0.00 H new ATOM 0 HG23 VAL A 62 5.667 -9.150 -31.298 1.00 0.00 H new ATOM 950 N PRO A 63 5.900 -8.400 -27.914 1.00 0.00 N ATOM 951 CA PRO A 63 6.553 -9.101 -26.804 1.00 0.00 C ATOM 952 C PRO A 63 7.601 -10.098 -27.285 1.00 0.00 C ATOM 953 O PRO A 63 7.434 -10.736 -28.325 1.00 0.00 O ATOM 954 CB PRO A 63 5.396 -9.830 -26.116 1.00 0.00 C ATOM 955 CG PRO A 63 4.372 -10.009 -27.183 1.00 0.00 C ATOM 956 CD PRO A 63 4.494 -8.807 -28.079 1.00 0.00 C ATOM 0 HA PRO A 63 7.092 -8.416 -26.150 1.00 0.00 H new ATOM 0 HB2 PRO A 63 5.718 -10.790 -25.711 1.00 0.00 H new ATOM 0 HB3 PRO A 63 5.002 -9.249 -25.283 1.00 0.00 H new ATOM 0 HG2 PRO A 63 4.545 -10.930 -27.740 1.00 0.00 H new ATOM 0 HG3 PRO A 63 3.371 -10.078 -26.756 1.00 0.00 H new ATOM 0 HD2 PRO A 63 4.266 -9.054 -29.116 1.00 0.00 H new ATOM 0 HD3 PRO A 63 3.808 -8.013 -27.782 1.00 0.00 H new ATOM 964 N PHE A 64 8.681 -10.229 -26.522 1.00 0.00 N ATOM 965 CA PHE A 64 9.757 -11.149 -26.872 1.00 0.00 C ATOM 966 C PHE A 64 9.719 -12.392 -25.986 1.00 0.00 C ATOM 967 O PHE A 64 9.605 -12.294 -24.764 1.00 0.00 O ATOM 968 CB PHE A 64 11.114 -10.455 -26.738 1.00 0.00 C ATOM 969 CG PHE A 64 12.018 -10.674 -27.917 1.00 0.00 C ATOM 970 CD1 PHE A 64 11.801 -10.000 -29.108 1.00 0.00 C ATOM 971 CD2 PHE A 64 13.085 -11.554 -27.834 1.00 0.00 C ATOM 972 CE1 PHE A 64 12.631 -10.201 -30.195 1.00 0.00 C ATOM 973 CE2 PHE A 64 13.919 -11.758 -28.918 1.00 0.00 C ATOM 974 CZ PHE A 64 13.692 -11.080 -30.099 1.00 0.00 C ATOM 0 H PHE A 64 8.834 -9.710 -25.657 1.00 0.00 H new ATOM 0 HA PHE A 64 9.615 -11.458 -27.908 1.00 0.00 H new ATOM 0 HB2 PHE A 64 10.954 -9.385 -26.606 1.00 0.00 H new ATOM 0 HB3 PHE A 64 11.611 -10.816 -25.837 1.00 0.00 H new ATOM 0 HD1 PHE A 64 10.974 -9.310 -29.188 1.00 0.00 H new ATOM 0 HD2 PHE A 64 13.267 -12.087 -26.912 1.00 0.00 H new ATOM 0 HE1 PHE A 64 12.450 -9.671 -31.119 1.00 0.00 H new ATOM 0 HE2 PHE A 64 14.747 -12.447 -28.841 1.00 0.00 H new ATOM 0 HZ PHE A 64 14.343 -11.237 -30.946 1.00 0.00 H new ATOM 984 N LYS A 65 9.814 -13.560 -26.612 1.00 0.00 N ATOM 985 CA LYS A 65 9.792 -14.823 -25.884 1.00 0.00 C ATOM 986 C LYS A 65 11.117 -15.563 -26.037 1.00 0.00 C ATOM 987 O LYS A 65 11.720 -15.561 -27.110 1.00 0.00 O ATOM 988 CB LYS A 65 8.644 -15.703 -26.383 1.00 0.00 C ATOM 989 CG LYS A 65 8.549 -15.779 -27.897 1.00 0.00 C ATOM 990 CD LYS A 65 7.776 -17.007 -28.346 1.00 0.00 C ATOM 991 CE LYS A 65 6.335 -16.663 -28.692 1.00 0.00 C ATOM 992 NZ LYS A 65 5.651 -17.784 -29.394 1.00 0.00 N ATOM 0 H LYS A 65 9.907 -13.658 -27.623 1.00 0.00 H new ATOM 0 HA LYS A 65 9.640 -14.602 -24.828 1.00 0.00 H new ATOM 0 HB2 LYS A 65 8.769 -16.710 -25.984 1.00 0.00 H new ATOM 0 HB3 LYS A 65 7.704 -15.318 -25.987 1.00 0.00 H new ATOM 0 HG2 LYS A 65 8.061 -14.882 -28.277 1.00 0.00 H new ATOM 0 HG3 LYS A 65 9.551 -15.802 -28.325 1.00 0.00 H new ATOM 0 HD2 LYS A 65 8.265 -17.448 -29.215 1.00 0.00 H new ATOM 0 HD3 LYS A 65 7.792 -17.758 -27.556 1.00 0.00 H new ATOM 0 HE2 LYS A 65 5.791 -16.420 -27.780 1.00 0.00 H new ATOM 0 HE3 LYS A 65 6.315 -15.774 -29.322 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 4.672 -17.511 -29.613 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 6.156 -18.000 -30.277 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 5.647 -18.626 -28.783 1.00 0.00 H new ATOM 1006 N PHE A 66 11.564 -16.195 -24.957 1.00 0.00 N ATOM 1007 CA PHE A 66 12.818 -16.940 -24.972 1.00 0.00 C ATOM 1008 C PHE A 66 12.838 -17.994 -23.868 1.00 0.00 C ATOM 1009 O PHE A 66 11.994 -17.986 -22.972 1.00 0.00 O ATOM 1010 CB PHE A 66 14.004 -15.988 -24.805 1.00 0.00 C ATOM 1011 CG PHE A 66 14.171 -15.480 -23.401 1.00 0.00 C ATOM 1012 CD1 PHE A 66 13.220 -14.648 -22.833 1.00 0.00 C ATOM 1013 CD2 PHE A 66 15.281 -15.834 -22.651 1.00 0.00 C ATOM 1014 CE1 PHE A 66 13.371 -14.180 -21.541 1.00 0.00 C ATOM 1015 CE2 PHE A 66 15.437 -15.368 -21.359 1.00 0.00 C ATOM 1016 CZ PHE A 66 14.482 -14.539 -20.804 1.00 0.00 C ATOM 0 H PHE A 66 11.077 -16.206 -24.061 1.00 0.00 H new ATOM 0 HA PHE A 66 12.900 -17.445 -25.934 1.00 0.00 H new ATOM 0 HB2 PHE A 66 14.917 -16.501 -25.109 1.00 0.00 H new ATOM 0 HB3 PHE A 66 13.876 -15.140 -25.477 1.00 0.00 H new ATOM 0 HD1 PHE A 66 12.351 -14.362 -23.406 1.00 0.00 H new ATOM 0 HD2 PHE A 66 16.032 -16.481 -23.080 1.00 0.00 H new ATOM 0 HE1 PHE A 66 12.621 -13.534 -21.109 1.00 0.00 H new ATOM 0 HE2 PHE A 66 16.306 -15.652 -20.784 1.00 0.00 H new ATOM 0 HZ PHE A 66 14.604 -14.172 -19.796 1.00 0.00 H new ATOM 1026 N HIS A 67 13.807 -18.900 -23.941 1.00 0.00 N ATOM 1027 CA HIS A 67 13.938 -19.961 -22.949 1.00 0.00 C ATOM 1028 C HIS A 67 15.096 -19.674 -21.997 1.00 0.00 C ATOM 1029 O HIS A 67 16.225 -19.440 -22.429 1.00 0.00 O ATOM 1030 CB HIS A 67 14.151 -21.309 -23.637 1.00 0.00 C ATOM 1031 CG HIS A 67 13.176 -21.578 -24.742 1.00 0.00 C ATOM 1032 ND1 HIS A 67 12.138 -22.479 -24.628 1.00 0.00 N ATOM 1033 CD2 HIS A 67 13.084 -21.057 -25.988 1.00 0.00 C ATOM 1034 CE1 HIS A 67 11.451 -22.501 -25.756 1.00 0.00 C ATOM 1035 NE2 HIS A 67 12.005 -21.647 -26.598 1.00 0.00 N ATOM 0 H HIS A 67 14.513 -18.921 -24.677 1.00 0.00 H new ATOM 0 HA HIS A 67 13.015 -19.999 -22.370 1.00 0.00 H new ATOM 0 HB2 HIS A 67 15.163 -21.346 -24.040 1.00 0.00 H new ATOM 0 HB3 HIS A 67 14.074 -22.103 -22.894 1.00 0.00 H new ATOM 0 HD2 HIS A 67 13.738 -20.315 -26.422 1.00 0.00 H new ATOM 0 HE1 HIS A 67 10.584 -23.113 -25.956 1.00 0.00 H new ATOM 0 HE2 HIS A 67 11.683 -21.457 -27.547 1.00 0.00 H new ATOM 1043 N LEU A 68 14.807 -19.694 -20.700 1.00 0.00 N ATOM 1044 CA LEU A 68 15.824 -19.435 -19.686 1.00 0.00 C ATOM 1045 C LEU A 68 16.744 -20.640 -19.518 1.00 0.00 C ATOM 1046 O LEU A 68 16.438 -21.738 -19.982 1.00 0.00 O ATOM 1047 CB LEU A 68 15.164 -19.092 -18.350 1.00 0.00 C ATOM 1048 CG LEU A 68 15.461 -17.699 -17.793 1.00 0.00 C ATOM 1049 CD1 LEU A 68 14.493 -17.355 -16.671 1.00 0.00 C ATOM 1050 CD2 LEU A 68 16.899 -17.616 -17.303 1.00 0.00 C ATOM 0 H LEU A 68 13.878 -19.887 -20.326 1.00 0.00 H new ATOM 0 HA LEU A 68 16.424 -18.587 -20.016 1.00 0.00 H new ATOM 0 HB2 LEU A 68 14.085 -19.193 -18.464 1.00 0.00 H new ATOM 0 HB3 LEU A 68 15.477 -19.831 -17.612 1.00 0.00 H new ATOM 0 HG LEU A 68 15.329 -16.972 -18.595 1.00 0.00 H new ATOM 0 HD11 LEU A 68 14.720 -16.360 -16.287 1.00 0.00 H new ATOM 0 HD12 LEU A 68 13.472 -17.373 -17.053 1.00 0.00 H new ATOM 0 HD13 LEU A 68 14.593 -18.085 -15.868 1.00 0.00 H new ATOM 0 HD21 LEU A 68 17.092 -16.618 -16.910 1.00 0.00 H new ATOM 0 HD22 LEU A 68 17.058 -18.353 -16.516 1.00 0.00 H new ATOM 0 HD23 LEU A 68 17.578 -17.818 -18.132 1.00 0.00 H new ATOM 1062 N GLY A 69 17.872 -20.428 -18.847 1.00 0.00 N ATOM 1063 CA GLY A 69 18.818 -21.507 -18.626 1.00 0.00 C ATOM 1064 C GLY A 69 19.598 -21.858 -19.878 1.00 0.00 C ATOM 1065 O GLY A 69 20.175 -22.941 -19.973 1.00 0.00 O ATOM 0 H GLY A 69 18.148 -19.529 -18.452 1.00 0.00 H new ATOM 0 HA2 GLY A 69 19.513 -21.221 -17.837 1.00 0.00 H new ATOM 0 HA3 GLY A 69 18.283 -22.389 -18.275 1.00 0.00 H new ATOM 1069 N GLN A 70 19.615 -20.941 -20.840 1.00 0.00 N ATOM 1070 CA GLN A 70 20.329 -21.161 -22.092 1.00 0.00 C ATOM 1071 C GLN A 70 21.484 -20.176 -22.241 1.00 0.00 C ATOM 1072 O GLN A 70 21.536 -19.157 -21.554 1.00 0.00 O ATOM 1073 CB GLN A 70 19.373 -21.028 -23.279 1.00 0.00 C ATOM 1074 CG GLN A 70 18.352 -22.150 -23.367 1.00 0.00 C ATOM 1075 CD GLN A 70 18.846 -23.326 -24.186 1.00 0.00 C ATOM 1076 OE1 GLN A 70 18.979 -23.234 -25.407 1.00 0.00 O ATOM 1077 NE2 GLN A 70 19.121 -24.440 -23.518 1.00 0.00 N ATOM 0 H GLN A 70 19.143 -20.039 -20.776 1.00 0.00 H new ATOM 0 HA GLN A 70 20.738 -22.171 -22.075 1.00 0.00 H new ATOM 0 HB2 GLN A 70 18.848 -20.075 -23.207 1.00 0.00 H new ATOM 0 HB3 GLN A 70 19.954 -21.003 -24.201 1.00 0.00 H new ATOM 0 HG2 GLN A 70 18.105 -22.491 -22.362 1.00 0.00 H new ATOM 0 HG3 GLN A 70 17.433 -21.766 -23.808 1.00 0.00 H new ATOM 0 HE21 GLN A 70 18.996 -24.472 -22.506 1.00 0.00 H new ATOM 0 HE22 GLN A 70 19.457 -25.264 -24.017 1.00 0.00 H new ATOM 1086 N GLY A 71 22.410 -20.489 -23.142 1.00 0.00 N ATOM 1087 CA GLY A 71 23.552 -19.622 -23.364 1.00 0.00 C ATOM 1088 C GLY A 71 23.370 -18.722 -24.570 1.00 0.00 C ATOM 1089 O GLY A 71 24.320 -18.466 -25.310 1.00 0.00 O ATOM 0 H GLY A 71 22.390 -21.328 -23.722 1.00 0.00 H new ATOM 0 HA2 GLY A 71 23.716 -19.009 -22.478 1.00 0.00 H new ATOM 0 HA3 GLY A 71 24.446 -20.231 -23.500 1.00 0.00 H new ATOM 1093 N GLU A 72 22.147 -18.241 -24.769 1.00 0.00 N ATOM 1094 CA GLU A 72 21.845 -17.367 -25.896 1.00 0.00 C ATOM 1095 C GLU A 72 21.882 -15.901 -25.473 1.00 0.00 C ATOM 1096 O GLU A 72 22.079 -15.009 -26.298 1.00 0.00 O ATOM 1097 CB GLU A 72 20.471 -17.706 -26.480 1.00 0.00 C ATOM 1098 CG GLU A 72 20.475 -18.937 -27.370 1.00 0.00 C ATOM 1099 CD GLU A 72 19.221 -19.051 -28.214 1.00 0.00 C ATOM 1100 OE1 GLU A 72 18.545 -18.020 -28.415 1.00 0.00 O ATOM 1101 OE2 GLU A 72 18.916 -20.171 -28.675 1.00 0.00 O ATOM 0 H GLU A 72 21.350 -18.442 -24.165 1.00 0.00 H new ATOM 0 HA GLU A 72 22.606 -17.526 -26.660 1.00 0.00 H new ATOM 0 HB2 GLU A 72 19.766 -17.861 -25.663 1.00 0.00 H new ATOM 0 HB3 GLU A 72 20.110 -16.853 -27.055 1.00 0.00 H new ATOM 0 HG2 GLU A 72 21.347 -18.905 -28.024 1.00 0.00 H new ATOM 0 HG3 GLU A 72 20.574 -19.828 -26.750 1.00 0.00 H new ATOM 1108 N VAL A 73 21.690 -15.660 -24.180 1.00 0.00 N ATOM 1109 CA VAL A 73 21.702 -14.303 -23.645 1.00 0.00 C ATOM 1110 C VAL A 73 22.910 -14.079 -22.743 1.00 0.00 C ATOM 1111 O VAL A 73 23.459 -15.025 -22.176 1.00 0.00 O ATOM 1112 CB VAL A 73 20.418 -14.003 -22.849 1.00 0.00 C ATOM 1113 CG1 VAL A 73 19.248 -13.768 -23.792 1.00 0.00 C ATOM 1114 CG2 VAL A 73 20.114 -15.136 -21.881 1.00 0.00 C ATOM 0 H VAL A 73 21.524 -16.386 -23.483 1.00 0.00 H new ATOM 0 HA VAL A 73 21.759 -13.626 -24.498 1.00 0.00 H new ATOM 0 HB VAL A 73 20.575 -13.093 -22.269 1.00 0.00 H new ATOM 0 HG11 VAL A 73 18.350 -13.558 -23.212 1.00 0.00 H new ATOM 0 HG12 VAL A 73 19.468 -12.920 -24.441 1.00 0.00 H new ATOM 0 HG13 VAL A 73 19.087 -14.658 -24.401 1.00 0.00 H new ATOM 0 HG21 VAL A 73 19.204 -14.907 -21.327 1.00 0.00 H new ATOM 0 HG22 VAL A 73 19.977 -16.063 -22.438 1.00 0.00 H new ATOM 0 HG23 VAL A 73 20.944 -15.251 -21.184 1.00 0.00 H new ATOM 1124 N ILE A 74 23.320 -12.821 -22.614 1.00 0.00 N ATOM 1125 CA ILE A 74 24.462 -12.472 -21.779 1.00 0.00 C ATOM 1126 C ILE A 74 24.119 -12.596 -20.298 1.00 0.00 C ATOM 1127 O ILE A 74 22.952 -12.725 -19.928 1.00 0.00 O ATOM 1128 CB ILE A 74 24.951 -11.040 -22.063 1.00 0.00 C ATOM 1129 CG1 ILE A 74 23.842 -10.030 -21.759 1.00 0.00 C ATOM 1130 CG2 ILE A 74 25.408 -10.913 -23.509 1.00 0.00 C ATOM 1131 CD1 ILE A 74 24.325 -8.597 -21.717 1.00 0.00 C ATOM 0 H ILE A 74 22.878 -12.027 -23.077 1.00 0.00 H new ATOM 0 HA ILE A 74 25.258 -13.174 -22.025 1.00 0.00 H new ATOM 0 HB ILE A 74 25.800 -10.826 -21.414 1.00 0.00 H new ATOM 0 HG12 ILE A 74 23.062 -10.120 -22.515 1.00 0.00 H new ATOM 0 HG13 ILE A 74 23.387 -10.280 -20.801 1.00 0.00 H new ATOM 0 HG21 ILE A 74 25.751 -9.895 -23.694 1.00 0.00 H new ATOM 0 HG22 ILE A 74 26.225 -11.610 -23.695 1.00 0.00 H new ATOM 0 HG23 ILE A 74 24.576 -11.143 -24.175 1.00 0.00 H new ATOM 0 HD11 ILE A 74 23.486 -7.937 -21.497 1.00 0.00 H new ATOM 0 HD12 ILE A 74 25.083 -8.491 -20.941 1.00 0.00 H new ATOM 0 HD13 ILE A 74 24.754 -8.329 -22.683 1.00 0.00 H new ATOM 1143 N LYS A 75 25.144 -12.554 -19.453 1.00 0.00 N ATOM 1144 CA LYS A 75 24.953 -12.658 -18.012 1.00 0.00 C ATOM 1145 C LYS A 75 23.992 -11.584 -17.512 1.00 0.00 C ATOM 1146 O LYS A 75 23.288 -11.779 -16.522 1.00 0.00 O ATOM 1147 CB LYS A 75 26.295 -12.533 -17.288 1.00 0.00 C ATOM 1148 CG LYS A 75 26.519 -13.603 -16.233 1.00 0.00 C ATOM 1149 CD LYS A 75 27.177 -14.839 -16.823 1.00 0.00 C ATOM 1150 CE LYS A 75 26.722 -16.105 -16.113 1.00 0.00 C ATOM 1151 NZ LYS A 75 27.808 -17.122 -16.042 1.00 0.00 N ATOM 0 H LYS A 75 26.116 -12.449 -19.742 1.00 0.00 H new ATOM 0 HA LYS A 75 24.522 -13.636 -17.798 1.00 0.00 H new ATOM 0 HB2 LYS A 75 27.100 -12.583 -18.021 1.00 0.00 H new ATOM 0 HB3 LYS A 75 26.354 -11.552 -16.817 1.00 0.00 H new ATOM 0 HG2 LYS A 75 27.144 -13.203 -15.435 1.00 0.00 H new ATOM 0 HG3 LYS A 75 25.565 -13.877 -15.783 1.00 0.00 H new ATOM 0 HD2 LYS A 75 26.937 -14.909 -17.884 1.00 0.00 H new ATOM 0 HD3 LYS A 75 28.260 -14.747 -16.747 1.00 0.00 H new ATOM 0 HE2 LYS A 75 26.390 -15.857 -15.105 1.00 0.00 H new ATOM 0 HE3 LYS A 75 25.864 -16.526 -16.636 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 27.458 -17.970 -15.551 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 28.107 -17.378 -17.005 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 28.618 -16.729 -15.521 1.00 0.00 H new ATOM 1165 N GLY A 76 23.968 -10.449 -18.204 1.00 0.00 N ATOM 1166 CA GLY A 76 23.089 -9.361 -17.815 1.00 0.00 C ATOM 1167 C GLY A 76 21.630 -9.771 -17.805 1.00 0.00 C ATOM 1168 O GLY A 76 20.924 -9.554 -16.820 1.00 0.00 O ATOM 0 H GLY A 76 24.541 -10.263 -19.027 1.00 0.00 H new ATOM 0 HA2 GLY A 76 23.371 -9.007 -16.823 1.00 0.00 H new ATOM 0 HA3 GLY A 76 23.224 -8.525 -18.502 1.00 0.00 H new ATOM 1172 N TRP A 77 21.175 -10.363 -18.904 1.00 0.00 N ATOM 1173 CA TRP A 77 19.789 -10.802 -19.018 1.00 0.00 C ATOM 1174 C TRP A 77 19.542 -12.048 -18.175 1.00 0.00 C ATOM 1175 O TRP A 77 18.527 -12.150 -17.486 1.00 0.00 O ATOM 1176 CB TRP A 77 19.441 -11.083 -20.480 1.00 0.00 C ATOM 1177 CG TRP A 77 20.024 -10.084 -21.433 1.00 0.00 C ATOM 1178 CD1 TRP A 77 20.511 -10.332 -22.684 1.00 0.00 C ATOM 1179 CD2 TRP A 77 20.181 -8.678 -21.210 1.00 0.00 C ATOM 1180 NE1 TRP A 77 20.963 -9.165 -23.253 1.00 0.00 N ATOM 1181 CE2 TRP A 77 20.771 -8.136 -22.369 1.00 0.00 C ATOM 1182 CE3 TRP A 77 19.880 -7.825 -20.145 1.00 0.00 C ATOM 1183 CZ2 TRP A 77 21.065 -6.781 -22.490 1.00 0.00 C ATOM 1184 CZ3 TRP A 77 20.173 -6.480 -20.267 1.00 0.00 C ATOM 1185 CH2 TRP A 77 20.759 -5.968 -21.432 1.00 0.00 C ATOM 0 H TRP A 77 21.746 -10.550 -19.728 1.00 0.00 H new ATOM 0 HA TRP A 77 19.148 -10.002 -18.647 1.00 0.00 H new ATOM 0 HB2 TRP A 77 19.797 -12.078 -20.746 1.00 0.00 H new ATOM 0 HB3 TRP A 77 18.357 -11.092 -20.593 1.00 0.00 H new ATOM 0 HD1 TRP A 77 20.537 -11.302 -23.157 1.00 0.00 H new ATOM 0 HE1 TRP A 77 21.374 -9.079 -24.182 1.00 0.00 H new ATOM 0 HE3 TRP A 77 19.427 -8.210 -19.243 1.00 0.00 H new ATOM 0 HZ2 TRP A 77 21.518 -6.385 -23.387 1.00 0.00 H new ATOM 0 HZ3 TRP A 77 19.946 -5.812 -19.450 1.00 0.00 H new ATOM 0 HH2 TRP A 77 20.973 -4.911 -21.497 1.00 0.00 H new ATOM 1196 N ASP A 78 20.475 -12.991 -18.233 1.00 0.00 N ATOM 1197 CA ASP A 78 20.358 -14.230 -17.473 1.00 0.00 C ATOM 1198 C ASP A 78 20.228 -13.942 -15.981 1.00 0.00 C ATOM 1199 O ASP A 78 19.339 -14.471 -15.312 1.00 0.00 O ATOM 1200 CB ASP A 78 21.571 -15.127 -17.728 1.00 0.00 C ATOM 1201 CG ASP A 78 21.520 -16.412 -16.926 1.00 0.00 C ATOM 1202 OD1 ASP A 78 20.451 -17.058 -16.909 1.00 0.00 O ATOM 1203 OD2 ASP A 78 22.548 -16.772 -16.316 1.00 0.00 O ATOM 0 H ASP A 78 21.321 -12.921 -18.798 1.00 0.00 H new ATOM 0 HA ASP A 78 19.458 -14.747 -17.805 1.00 0.00 H new ATOM 0 HB2 ASP A 78 21.625 -15.367 -18.790 1.00 0.00 H new ATOM 0 HB3 ASP A 78 22.481 -14.582 -17.478 1.00 0.00 H new ATOM 1208 N ILE A 79 21.120 -13.103 -15.466 1.00 0.00 N ATOM 1209 CA ILE A 79 21.104 -12.745 -14.053 1.00 0.00 C ATOM 1210 C ILE A 79 19.856 -11.942 -13.703 1.00 0.00 C ATOM 1211 O ILE A 79 19.135 -12.275 -12.761 1.00 0.00 O ATOM 1212 CB ILE A 79 22.351 -11.929 -13.665 1.00 0.00 C ATOM 1213 CG1 ILE A 79 23.615 -12.774 -13.837 1.00 0.00 C ATOM 1214 CG2 ILE A 79 22.233 -11.429 -12.233 1.00 0.00 C ATOM 1215 CD1 ILE A 79 24.888 -11.958 -13.869 1.00 0.00 C ATOM 0 H ILE A 79 21.863 -12.658 -16.006 1.00 0.00 H new ATOM 0 HA ILE A 79 21.101 -13.679 -13.491 1.00 0.00 H new ATOM 0 HB ILE A 79 22.421 -11.065 -14.326 1.00 0.00 H new ATOM 0 HG12 ILE A 79 23.675 -13.494 -13.021 1.00 0.00 H new ATOM 0 HG13 ILE A 79 23.537 -13.346 -14.761 1.00 0.00 H new ATOM 0 HG21 ILE A 79 23.122 -10.854 -11.974 1.00 0.00 H new ATOM 0 HG22 ILE A 79 21.351 -10.795 -12.140 1.00 0.00 H new ATOM 0 HG23 ILE A 79 22.141 -12.279 -11.557 1.00 0.00 H new ATOM 0 HD11 ILE A 79 25.743 -12.622 -13.993 1.00 0.00 H new ATOM 0 HD12 ILE A 79 24.850 -11.256 -14.702 1.00 0.00 H new ATOM 0 HD13 ILE A 79 24.990 -11.406 -12.935 1.00 0.00 H new ATOM 1227 N CYS A 80 19.605 -10.885 -14.467 1.00 0.00 N ATOM 1228 CA CYS A 80 18.443 -10.034 -14.239 1.00 0.00 C ATOM 1229 C CYS A 80 17.158 -10.857 -14.241 1.00 0.00 C ATOM 1230 O CYS A 80 16.377 -10.809 -13.291 1.00 0.00 O ATOM 1231 CB CYS A 80 18.365 -8.943 -15.308 1.00 0.00 C ATOM 1232 SG CYS A 80 17.293 -7.555 -14.869 1.00 0.00 S ATOM 0 H CYS A 80 20.191 -10.597 -15.250 1.00 0.00 H new ATOM 0 HA CYS A 80 18.553 -9.566 -13.261 1.00 0.00 H new ATOM 0 HB2 CYS A 80 19.369 -8.566 -15.501 1.00 0.00 H new ATOM 0 HB3 CYS A 80 18.007 -9.385 -16.238 1.00 0.00 H new ATOM 0 HG CYS A 80 16.079 -7.803 -15.262 1.00 0.00 H new ATOM 1238 N VAL A 81 16.946 -11.610 -15.315 1.00 0.00 N ATOM 1239 CA VAL A 81 15.756 -12.443 -15.442 1.00 0.00 C ATOM 1240 C VAL A 81 15.691 -13.482 -14.328 1.00 0.00 C ATOM 1241 O VAL A 81 14.616 -13.796 -13.820 1.00 0.00 O ATOM 1242 CB VAL A 81 15.717 -13.163 -16.803 1.00 0.00 C ATOM 1243 CG1 VAL A 81 14.519 -14.098 -16.878 1.00 0.00 C ATOM 1244 CG2 VAL A 81 15.686 -12.152 -17.939 1.00 0.00 C ATOM 0 H VAL A 81 17.583 -11.661 -16.110 1.00 0.00 H new ATOM 0 HA VAL A 81 14.895 -11.778 -15.366 1.00 0.00 H new ATOM 0 HB VAL A 81 16.622 -13.762 -16.904 1.00 0.00 H new ATOM 0 HG11 VAL A 81 14.508 -14.598 -17.847 1.00 0.00 H new ATOM 0 HG12 VAL A 81 14.589 -14.843 -16.086 1.00 0.00 H new ATOM 0 HG13 VAL A 81 13.601 -13.523 -16.756 1.00 0.00 H new ATOM 0 HG21 VAL A 81 15.659 -12.678 -18.893 1.00 0.00 H new ATOM 0 HG22 VAL A 81 14.799 -11.525 -17.844 1.00 0.00 H new ATOM 0 HG23 VAL A 81 16.578 -11.527 -17.894 1.00 0.00 H new ATOM 1254 N ALA A 82 16.851 -14.012 -13.952 1.00 0.00 N ATOM 1255 CA ALA A 82 16.927 -15.014 -12.896 1.00 0.00 C ATOM 1256 C ALA A 82 16.898 -14.362 -11.518 1.00 0.00 C ATOM 1257 O ALA A 82 16.980 -15.044 -10.496 1.00 0.00 O ATOM 1258 CB ALA A 82 18.184 -15.856 -13.057 1.00 0.00 C ATOM 0 H ALA A 82 17.751 -13.764 -14.363 1.00 0.00 H new ATOM 0 HA ALA A 82 16.055 -15.663 -12.981 1.00 0.00 H new ATOM 0 HB1 ALA A 82 18.228 -16.600 -12.262 1.00 0.00 H new ATOM 0 HB2 ALA A 82 18.164 -16.359 -14.024 1.00 0.00 H new ATOM 0 HB3 ALA A 82 19.062 -15.213 -13.001 1.00 0.00 H new ATOM 1264 N SER A 83 16.780 -13.038 -11.497 1.00 0.00 N ATOM 1265 CA SER A 83 16.744 -12.294 -10.243 1.00 0.00 C ATOM 1266 C SER A 83 15.531 -11.370 -10.195 1.00 0.00 C ATOM 1267 O SER A 83 15.479 -10.437 -9.393 1.00 0.00 O ATOM 1268 CB SER A 83 18.027 -11.479 -10.073 1.00 0.00 C ATOM 1269 OG SER A 83 18.074 -10.861 -8.798 1.00 0.00 O ATOM 0 H SER A 83 16.708 -12.459 -12.333 1.00 0.00 H new ATOM 0 HA SER A 83 16.666 -13.011 -9.425 1.00 0.00 H new ATOM 0 HB2 SER A 83 18.893 -12.129 -10.198 1.00 0.00 H new ATOM 0 HB3 SER A 83 18.084 -10.718 -10.852 1.00 0.00 H new ATOM 0 HG SER A 83 17.197 -10.476 -8.588 1.00 0.00 H new ATOM 1275 N MET A 84 14.557 -11.636 -11.059 1.00 0.00 N ATOM 1276 CA MET A 84 13.343 -10.830 -11.114 1.00 0.00 C ATOM 1277 C MET A 84 12.107 -11.691 -10.876 1.00 0.00 C ATOM 1278 O MET A 84 12.170 -12.919 -10.947 1.00 0.00 O ATOM 1279 CB MET A 84 13.235 -10.125 -12.468 1.00 0.00 C ATOM 1280 CG MET A 84 12.723 -11.024 -13.582 1.00 0.00 C ATOM 1281 SD MET A 84 12.629 -10.177 -15.171 1.00 0.00 S ATOM 1282 CE MET A 84 11.647 -8.745 -14.733 1.00 0.00 C ATOM 0 H MET A 84 14.585 -12.403 -11.731 1.00 0.00 H new ATOM 0 HA MET A 84 13.398 -10.080 -10.325 1.00 0.00 H new ATOM 0 HB2 MET A 84 12.570 -9.267 -12.370 1.00 0.00 H new ATOM 0 HB3 MET A 84 14.215 -9.738 -12.746 1.00 0.00 H new ATOM 0 HG2 MET A 84 13.378 -11.890 -13.675 1.00 0.00 H new ATOM 0 HG3 MET A 84 11.735 -11.399 -13.316 1.00 0.00 H new ATOM 0 HE1 MET A 84 11.351 -8.216 -15.639 1.00 0.00 H new ATOM 0 HE2 MET A 84 10.756 -9.066 -14.193 1.00 0.00 H new ATOM 0 HE3 MET A 84 12.235 -8.080 -14.100 1.00 0.00 H new ATOM 1292 N THR A 85 10.983 -11.039 -10.592 1.00 0.00 N ATOM 1293 CA THR A 85 9.733 -11.746 -10.341 1.00 0.00 C ATOM 1294 C THR A 85 8.660 -11.335 -11.343 1.00 0.00 C ATOM 1295 O THR A 85 8.855 -10.415 -12.136 1.00 0.00 O ATOM 1296 CB THR A 85 9.216 -11.482 -8.914 1.00 0.00 C ATOM 1297 OG1 THR A 85 9.325 -10.089 -8.603 1.00 0.00 O ATOM 1298 CG2 THR A 85 9.998 -12.298 -7.896 1.00 0.00 C ATOM 0 H THR A 85 10.913 -10.023 -10.530 1.00 0.00 H new ATOM 0 HA THR A 85 9.942 -12.810 -10.452 1.00 0.00 H new ATOM 0 HB THR A 85 8.169 -11.782 -8.869 1.00 0.00 H new ATOM 0 HG1 THR A 85 8.429 -9.697 -8.541 1.00 0.00 H new ATOM 0 HG21 THR A 85 9.615 -12.095 -6.896 1.00 0.00 H new ATOM 0 HG22 THR A 85 9.888 -13.359 -8.118 1.00 0.00 H new ATOM 0 HG23 THR A 85 11.052 -12.025 -7.943 1.00 0.00 H new ATOM 1306 N LYS A 86 7.524 -12.023 -11.300 1.00 0.00 N ATOM 1307 CA LYS A 86 6.417 -11.730 -12.203 1.00 0.00 C ATOM 1308 C LYS A 86 5.872 -10.326 -11.957 1.00 0.00 C ATOM 1309 O LYS A 86 5.750 -9.890 -10.814 1.00 0.00 O ATOM 1310 CB LYS A 86 5.300 -12.760 -12.025 1.00 0.00 C ATOM 1311 CG LYS A 86 4.354 -12.843 -13.211 1.00 0.00 C ATOM 1312 CD LYS A 86 3.967 -14.280 -13.516 1.00 0.00 C ATOM 1313 CE LYS A 86 3.139 -14.376 -14.788 1.00 0.00 C ATOM 1314 NZ LYS A 86 1.682 -14.232 -14.514 1.00 0.00 N ATOM 0 H LYS A 86 7.346 -12.788 -10.649 1.00 0.00 H new ATOM 0 HA LYS A 86 6.791 -11.782 -13.225 1.00 0.00 H new ATOM 0 HB2 LYS A 86 5.745 -13.741 -11.857 1.00 0.00 H new ATOM 0 HB3 LYS A 86 4.728 -12.512 -11.131 1.00 0.00 H new ATOM 0 HG2 LYS A 86 3.457 -12.260 -13.003 1.00 0.00 H new ATOM 0 HG3 LYS A 86 4.827 -12.399 -14.087 1.00 0.00 H new ATOM 0 HD2 LYS A 86 4.867 -14.886 -13.620 1.00 0.00 H new ATOM 0 HD3 LYS A 86 3.401 -14.691 -12.680 1.00 0.00 H new ATOM 0 HE2 LYS A 86 3.455 -13.601 -15.487 1.00 0.00 H new ATOM 0 HE3 LYS A 86 3.325 -15.336 -15.271 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 1.152 -14.303 -15.406 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 1.374 -14.986 -13.867 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 1.501 -13.306 -14.077 1.00 0.00 H new ATOM 1328 N ASN A 87 5.545 -9.626 -13.038 1.00 0.00 N ATOM 1329 CA ASN A 87 5.012 -8.272 -12.939 1.00 0.00 C ATOM 1330 C ASN A 87 6.029 -7.333 -12.296 1.00 0.00 C ATOM 1331 O ASN A 87 5.673 -6.264 -11.800 1.00 0.00 O ATOM 1332 CB ASN A 87 3.715 -8.270 -12.128 1.00 0.00 C ATOM 1333 CG ASN A 87 2.482 -8.263 -13.011 1.00 0.00 C ATOM 1334 OD1 ASN A 87 2.145 -7.247 -13.618 1.00 0.00 O ATOM 1335 ND2 ASN A 87 1.801 -9.401 -13.084 1.00 0.00 N ATOM 0 H ASN A 87 5.640 -9.974 -13.992 1.00 0.00 H new ATOM 0 HA ASN A 87 4.802 -7.916 -13.948 1.00 0.00 H new ATOM 0 HB2 ASN A 87 3.692 -9.148 -11.483 1.00 0.00 H new ATOM 0 HB3 ASN A 87 3.698 -7.396 -11.477 1.00 0.00 H new ATOM 0 HD21 ASN A 87 0.962 -9.457 -13.661 1.00 0.00 H new ATOM 0 HD22 ASN A 87 2.117 -10.219 -12.563 1.00 0.00 H new ATOM 1342 N GLU A 88 7.294 -7.740 -12.309 1.00 0.00 N ATOM 1343 CA GLU A 88 8.361 -6.935 -11.726 1.00 0.00 C ATOM 1344 C GLU A 88 9.125 -6.179 -12.809 1.00 0.00 C ATOM 1345 O GLU A 88 9.834 -6.778 -13.619 1.00 0.00 O ATOM 1346 CB GLU A 88 9.323 -7.821 -10.932 1.00 0.00 C ATOM 1347 CG GLU A 88 10.311 -7.039 -10.083 1.00 0.00 C ATOM 1348 CD GLU A 88 9.796 -6.774 -8.682 1.00 0.00 C ATOM 1349 OE1 GLU A 88 8.905 -7.522 -8.228 1.00 0.00 O ATOM 1350 OE2 GLU A 88 10.283 -5.820 -8.041 1.00 0.00 O ATOM 0 H GLU A 88 7.605 -8.622 -12.717 1.00 0.00 H new ATOM 0 HA GLU A 88 7.907 -6.209 -11.052 1.00 0.00 H new ATOM 0 HB2 GLU A 88 8.745 -8.482 -10.286 1.00 0.00 H new ATOM 0 HB3 GLU A 88 9.875 -8.456 -11.625 1.00 0.00 H new ATOM 0 HG2 GLU A 88 11.249 -7.591 -10.023 1.00 0.00 H new ATOM 0 HG3 GLU A 88 10.531 -6.089 -10.571 1.00 0.00 H new ATOM 1357 N LYS A 89 8.976 -4.859 -12.818 1.00 0.00 N ATOM 1358 CA LYS A 89 9.651 -4.019 -13.800 1.00 0.00 C ATOM 1359 C LYS A 89 10.773 -3.216 -13.149 1.00 0.00 C ATOM 1360 O LYS A 89 10.523 -2.356 -12.303 1.00 0.00 O ATOM 1361 CB LYS A 89 8.650 -3.071 -14.465 1.00 0.00 C ATOM 1362 CG LYS A 89 9.291 -2.091 -15.432 1.00 0.00 C ATOM 1363 CD LYS A 89 8.325 -1.680 -16.531 1.00 0.00 C ATOM 1364 CE LYS A 89 8.933 -0.623 -17.441 1.00 0.00 C ATOM 1365 NZ LYS A 89 7.912 -0.003 -18.330 1.00 0.00 N ATOM 0 H LYS A 89 8.393 -4.347 -12.156 1.00 0.00 H new ATOM 0 HA LYS A 89 10.086 -4.669 -14.559 1.00 0.00 H new ATOM 0 HB2 LYS A 89 7.904 -3.660 -14.999 1.00 0.00 H new ATOM 0 HB3 LYS A 89 8.122 -2.513 -13.692 1.00 0.00 H new ATOM 0 HG2 LYS A 89 9.623 -1.206 -14.888 1.00 0.00 H new ATOM 0 HG3 LYS A 89 10.178 -2.544 -15.876 1.00 0.00 H new ATOM 0 HD2 LYS A 89 8.050 -2.554 -17.121 1.00 0.00 H new ATOM 0 HD3 LYS A 89 7.408 -1.294 -16.085 1.00 0.00 H new ATOM 0 HE2 LYS A 89 9.405 0.150 -16.835 1.00 0.00 H new ATOM 0 HE3 LYS A 89 9.717 -1.074 -18.048 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 8.366 0.712 -18.934 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 7.480 -0.737 -18.927 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 7.176 0.450 -17.751 1.00 0.00 H new ATOM 1379 N CYS A 90 12.007 -3.500 -13.550 1.00 0.00 N ATOM 1380 CA CYS A 90 13.167 -2.803 -13.006 1.00 0.00 C ATOM 1381 C CYS A 90 14.175 -2.485 -14.105 1.00 0.00 C ATOM 1382 O CYS A 90 14.071 -2.991 -15.222 1.00 0.00 O ATOM 1383 CB CYS A 90 13.831 -3.646 -11.917 1.00 0.00 C ATOM 1384 SG CYS A 90 12.678 -4.309 -10.691 1.00 0.00 S ATOM 0 H CYS A 90 12.230 -4.208 -14.250 1.00 0.00 H new ATOM 0 HA CYS A 90 12.824 -1.865 -12.570 1.00 0.00 H new ATOM 0 HB2 CYS A 90 14.361 -4.474 -12.387 1.00 0.00 H new ATOM 0 HB3 CYS A 90 14.578 -3.038 -11.406 1.00 0.00 H new ATOM 0 HG CYS A 90 13.017 -5.528 -10.391 1.00 0.00 H new ATOM 1390 N SER A 91 15.151 -1.642 -13.781 1.00 0.00 N ATOM 1391 CA SER A 91 16.175 -1.252 -14.743 1.00 0.00 C ATOM 1392 C SER A 91 17.550 -1.743 -14.300 1.00 0.00 C ATOM 1393 O SER A 91 18.001 -1.448 -13.193 1.00 0.00 O ATOM 1394 CB SER A 91 16.194 0.268 -14.912 1.00 0.00 C ATOM 1395 OG SER A 91 17.224 0.670 -15.798 1.00 0.00 O ATOM 0 H SER A 91 15.254 -1.216 -12.860 1.00 0.00 H new ATOM 0 HA SER A 91 15.934 -1.713 -15.701 1.00 0.00 H new ATOM 0 HB2 SER A 91 15.230 0.607 -15.292 1.00 0.00 H new ATOM 0 HB3 SER A 91 16.339 0.743 -13.942 1.00 0.00 H new ATOM 0 HG SER A 91 17.214 1.646 -15.890 1.00 0.00 H new ATOM 1401 N VAL A 92 18.213 -2.494 -15.174 1.00 0.00 N ATOM 1402 CA VAL A 92 19.537 -3.026 -14.875 1.00 0.00 C ATOM 1403 C VAL A 92 20.612 -2.314 -15.690 1.00 0.00 C ATOM 1404 O VAL A 92 20.457 -2.107 -16.894 1.00 0.00 O ATOM 1405 CB VAL A 92 19.612 -4.538 -15.158 1.00 0.00 C ATOM 1406 CG1 VAL A 92 19.465 -4.811 -16.647 1.00 0.00 C ATOM 1407 CG2 VAL A 92 20.915 -5.115 -14.627 1.00 0.00 C ATOM 0 H VAL A 92 17.855 -2.748 -16.095 1.00 0.00 H new ATOM 0 HA VAL A 92 19.715 -2.853 -13.814 1.00 0.00 H new ATOM 0 HB VAL A 92 18.787 -5.028 -14.641 1.00 0.00 H new ATOM 0 HG11 VAL A 92 19.521 -5.885 -16.827 1.00 0.00 H new ATOM 0 HG12 VAL A 92 18.502 -4.434 -16.993 1.00 0.00 H new ATOM 0 HG13 VAL A 92 20.267 -4.310 -17.190 1.00 0.00 H new ATOM 0 HG21 VAL A 92 20.951 -6.184 -14.836 1.00 0.00 H new ATOM 0 HG22 VAL A 92 21.756 -4.622 -15.114 1.00 0.00 H new ATOM 0 HG23 VAL A 92 20.973 -4.953 -13.551 1.00 0.00 H new ATOM 1417 N ARG A 93 21.701 -1.943 -15.026 1.00 0.00 N ATOM 1418 CA ARG A 93 22.802 -1.254 -15.689 1.00 0.00 C ATOM 1419 C ARG A 93 23.950 -2.216 -15.979 1.00 0.00 C ATOM 1420 O ARG A 93 24.557 -2.770 -15.061 1.00 0.00 O ATOM 1421 CB ARG A 93 23.300 -0.094 -14.824 1.00 0.00 C ATOM 1422 CG ARG A 93 24.123 0.928 -15.591 1.00 0.00 C ATOM 1423 CD ARG A 93 24.143 2.273 -14.881 1.00 0.00 C ATOM 1424 NE ARG A 93 22.800 2.813 -14.693 1.00 0.00 N ATOM 1425 CZ ARG A 93 22.548 3.952 -14.057 1.00 0.00 C ATOM 1426 NH1 ARG A 93 23.544 4.667 -13.553 1.00 0.00 N ATOM 1427 NH2 ARG A 93 21.299 4.378 -13.927 1.00 0.00 N ATOM 0 H ARG A 93 21.845 -2.108 -14.030 1.00 0.00 H new ATOM 0 HA ARG A 93 22.433 -0.860 -16.636 1.00 0.00 H new ATOM 0 HB2 ARG A 93 22.443 0.406 -14.374 1.00 0.00 H new ATOM 0 HB3 ARG A 93 23.901 -0.493 -14.007 1.00 0.00 H new ATOM 0 HG2 ARG A 93 25.143 0.562 -15.708 1.00 0.00 H new ATOM 0 HG3 ARG A 93 23.712 1.050 -16.593 1.00 0.00 H new ATOM 0 HD2 ARG A 93 24.629 2.164 -13.911 1.00 0.00 H new ATOM 0 HD3 ARG A 93 24.740 2.979 -15.459 1.00 0.00 H new ATOM 0 HE ARG A 93 22.012 2.287 -15.071 1.00 0.00 H new ATOM 0 HH11 ARG A 93 24.506 4.343 -13.653 1.00 0.00 H new ATOM 0 HH12 ARG A 93 23.348 5.541 -13.065 1.00 0.00 H new ATOM 0 HH21 ARG A 93 20.531 3.831 -14.315 1.00 0.00 H new ATOM 0 HH22 ARG A 93 21.107 5.253 -13.439 1.00 0.00 H new ATOM 1441 N LEU A 94 24.243 -2.411 -17.260 1.00 0.00 N ATOM 1442 CA LEU A 94 25.318 -3.307 -17.671 1.00 0.00 C ATOM 1443 C LEU A 94 26.565 -2.518 -18.060 1.00 0.00 C ATOM 1444 O LEU A 94 26.517 -1.654 -18.935 1.00 0.00 O ATOM 1445 CB LEU A 94 24.863 -4.175 -18.845 1.00 0.00 C ATOM 1446 CG LEU A 94 23.794 -5.222 -18.531 1.00 0.00 C ATOM 1447 CD1 LEU A 94 23.482 -6.054 -19.765 1.00 0.00 C ATOM 1448 CD2 LEU A 94 24.243 -6.115 -17.383 1.00 0.00 C ATOM 0 H LEU A 94 23.751 -1.961 -18.032 1.00 0.00 H new ATOM 0 HA LEU A 94 25.566 -3.950 -16.826 1.00 0.00 H new ATOM 0 HB2 LEU A 94 24.482 -3.520 -19.629 1.00 0.00 H new ATOM 0 HB3 LEU A 94 25.735 -4.686 -19.252 1.00 0.00 H new ATOM 0 HG LEU A 94 22.884 -4.704 -18.228 1.00 0.00 H new ATOM 0 HD11 LEU A 94 22.719 -6.794 -19.522 1.00 0.00 H new ATOM 0 HD12 LEU A 94 23.117 -5.403 -20.560 1.00 0.00 H new ATOM 0 HD13 LEU A 94 24.386 -6.562 -20.099 1.00 0.00 H new ATOM 0 HD21 LEU A 94 23.470 -6.854 -17.173 1.00 0.00 H new ATOM 0 HD22 LEU A 94 25.167 -6.624 -17.658 1.00 0.00 H new ATOM 0 HD23 LEU A 94 24.414 -5.507 -16.495 1.00 0.00 H new ATOM 1460 N ASP A 95 27.679 -2.824 -17.405 1.00 0.00 N ATOM 1461 CA ASP A 95 28.940 -2.146 -17.684 1.00 0.00 C ATOM 1462 C ASP A 95 29.565 -2.671 -18.973 1.00 0.00 C ATOM 1463 O ASP A 95 28.929 -3.406 -19.729 1.00 0.00 O ATOM 1464 CB ASP A 95 29.913 -2.333 -16.519 1.00 0.00 C ATOM 1465 CG ASP A 95 30.761 -1.101 -16.270 1.00 0.00 C ATOM 1466 OD1 ASP A 95 30.210 -0.089 -15.789 1.00 0.00 O ATOM 1467 OD2 ASP A 95 31.976 -1.149 -16.557 1.00 0.00 O ATOM 0 H ASP A 95 27.735 -3.537 -16.677 1.00 0.00 H new ATOM 0 HA ASP A 95 28.733 -1.083 -17.807 1.00 0.00 H new ATOM 0 HB2 ASP A 95 29.352 -2.573 -15.616 1.00 0.00 H new ATOM 0 HB3 ASP A 95 30.564 -3.183 -16.726 1.00 0.00 H new ATOM 1472 N SER A 96 30.814 -2.287 -19.219 1.00 0.00 N ATOM 1473 CA SER A 96 31.523 -2.715 -20.419 1.00 0.00 C ATOM 1474 C SER A 96 32.279 -4.016 -20.168 1.00 0.00 C ATOM 1475 O SER A 96 33.491 -4.093 -20.375 1.00 0.00 O ATOM 1476 CB SER A 96 32.495 -1.626 -20.877 1.00 0.00 C ATOM 1477 OG SER A 96 33.509 -1.408 -19.911 1.00 0.00 O ATOM 0 H SER A 96 31.355 -1.680 -18.603 1.00 0.00 H new ATOM 0 HA SER A 96 30.787 -2.889 -21.204 1.00 0.00 H new ATOM 0 HB2 SER A 96 32.948 -1.914 -21.826 1.00 0.00 H new ATOM 0 HB3 SER A 96 31.950 -0.698 -21.053 1.00 0.00 H new ATOM 0 HG SER A 96 34.028 -2.231 -19.790 1.00 0.00 H new ATOM 1483 N LYS A 97 31.556 -5.037 -19.721 1.00 0.00 N ATOM 1484 CA LYS A 97 32.156 -6.336 -19.443 1.00 0.00 C ATOM 1485 C LYS A 97 31.150 -7.460 -19.669 1.00 0.00 C ATOM 1486 O LYS A 97 31.330 -8.299 -20.552 1.00 0.00 O ATOM 1487 CB LYS A 97 32.674 -6.384 -18.004 1.00 0.00 C ATOM 1488 CG LYS A 97 33.279 -7.723 -17.619 1.00 0.00 C ATOM 1489 CD LYS A 97 33.641 -7.768 -16.144 1.00 0.00 C ATOM 1490 CE LYS A 97 35.071 -7.308 -15.907 1.00 0.00 C ATOM 1491 NZ LYS A 97 36.037 -8.439 -15.980 1.00 0.00 N ATOM 0 H LYS A 97 30.553 -4.990 -19.543 1.00 0.00 H new ATOM 0 HA LYS A 97 32.991 -6.476 -20.129 1.00 0.00 H new ATOM 0 HB2 LYS A 97 33.424 -5.604 -17.871 1.00 0.00 H new ATOM 0 HB3 LYS A 97 31.853 -6.157 -17.324 1.00 0.00 H new ATOM 0 HG2 LYS A 97 32.572 -8.521 -17.846 1.00 0.00 H new ATOM 0 HG3 LYS A 97 34.170 -7.907 -18.219 1.00 0.00 H new ATOM 0 HD2 LYS A 97 32.956 -7.135 -15.581 1.00 0.00 H new ATOM 0 HD3 LYS A 97 33.518 -8.784 -15.769 1.00 0.00 H new ATOM 0 HE2 LYS A 97 35.338 -6.554 -16.648 1.00 0.00 H new ATOM 0 HE3 LYS A 97 35.142 -6.832 -14.929 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 37.000 -8.084 -15.813 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 35.798 -9.147 -15.256 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 35.988 -8.877 -16.922 1.00 0.00 H new ATOM 1505 N TYR A 98 30.090 -7.469 -18.868 1.00 0.00 N ATOM 1506 CA TYR A 98 29.056 -8.490 -18.981 1.00 0.00 C ATOM 1507 C TYR A 98 28.178 -8.244 -20.205 1.00 0.00 C ATOM 1508 O TYR A 98 27.516 -9.154 -20.701 1.00 0.00 O ATOM 1509 CB TYR A 98 28.193 -8.514 -17.718 1.00 0.00 C ATOM 1510 CG TYR A 98 28.960 -8.884 -16.469 1.00 0.00 C ATOM 1511 CD1 TYR A 98 29.765 -7.954 -15.823 1.00 0.00 C ATOM 1512 CD2 TYR A 98 28.880 -10.164 -15.934 1.00 0.00 C ATOM 1513 CE1 TYR A 98 30.467 -8.288 -14.681 1.00 0.00 C ATOM 1514 CE2 TYR A 98 29.578 -10.507 -14.792 1.00 0.00 C ATOM 1515 CZ TYR A 98 30.370 -9.565 -14.170 1.00 0.00 C ATOM 1516 OH TYR A 98 31.069 -9.902 -13.033 1.00 0.00 O ATOM 0 H TYR A 98 29.925 -6.781 -18.134 1.00 0.00 H new ATOM 0 HA TYR A 98 29.547 -9.456 -19.097 1.00 0.00 H new ATOM 0 HB2 TYR A 98 27.740 -7.533 -17.579 1.00 0.00 H new ATOM 0 HB3 TYR A 98 27.378 -9.224 -17.858 1.00 0.00 H new ATOM 0 HD1 TYR A 98 29.843 -6.953 -16.220 1.00 0.00 H new ATOM 0 HD2 TYR A 98 28.261 -10.904 -16.420 1.00 0.00 H new ATOM 0 HE1 TYR A 98 31.088 -7.553 -14.191 1.00 0.00 H new ATOM 0 HE2 TYR A 98 29.504 -11.506 -14.389 1.00 0.00 H new ATOM 0 HH TYR A 98 30.891 -10.838 -12.805 1.00 0.00 H new ATOM 1526 N GLY A 99 28.180 -7.005 -20.687 1.00 0.00 N ATOM 1527 CA GLY A 99 27.382 -6.659 -21.849 1.00 0.00 C ATOM 1528 C GLY A 99 27.916 -7.280 -23.124 1.00 0.00 C ATOM 1529 O GLY A 99 27.798 -8.488 -23.332 1.00 0.00 O ATOM 0 H GLY A 99 28.720 -6.234 -20.293 1.00 0.00 H new ATOM 0 HA2 GLY A 99 26.355 -6.987 -21.691 1.00 0.00 H new ATOM 0 HA3 GLY A 99 27.357 -5.575 -21.959 1.00 0.00 H new ATOM 1533 N TYR A 100 28.504 -6.453 -23.982 1.00 0.00 N ATOM 1534 CA TYR A 100 29.054 -6.928 -25.246 1.00 0.00 C ATOM 1535 C TYR A 100 30.575 -7.022 -25.177 1.00 0.00 C ATOM 1536 O TYR A 100 31.261 -6.942 -26.195 1.00 0.00 O ATOM 1537 CB TYR A 100 28.641 -5.996 -26.387 1.00 0.00 C ATOM 1538 CG TYR A 100 27.171 -6.074 -26.730 1.00 0.00 C ATOM 1539 CD1 TYR A 100 26.534 -7.300 -26.872 1.00 0.00 C ATOM 1540 CD2 TYR A 100 26.418 -4.920 -26.911 1.00 0.00 C ATOM 1541 CE1 TYR A 100 25.190 -7.375 -27.186 1.00 0.00 C ATOM 1542 CE2 TYR A 100 25.074 -4.985 -27.224 1.00 0.00 C ATOM 1543 CZ TYR A 100 24.465 -6.215 -27.361 1.00 0.00 C ATOM 1544 OH TYR A 100 23.126 -6.286 -27.672 1.00 0.00 O ATOM 0 H TYR A 100 28.612 -5.451 -23.825 1.00 0.00 H new ATOM 0 HA TYR A 100 28.655 -7.924 -25.436 1.00 0.00 H new ATOM 0 HB2 TYR A 100 28.888 -4.970 -26.114 1.00 0.00 H new ATOM 0 HB3 TYR A 100 29.226 -6.240 -27.274 1.00 0.00 H new ATOM 0 HD1 TYR A 100 27.099 -8.210 -26.735 1.00 0.00 H new ATOM 0 HD2 TYR A 100 26.892 -3.955 -26.805 1.00 0.00 H new ATOM 0 HE1 TYR A 100 24.710 -8.337 -27.294 1.00 0.00 H new ATOM 0 HE2 TYR A 100 24.504 -4.078 -27.361 1.00 0.00 H new ATOM 0 HH TYR A 100 22.762 -5.380 -27.760 1.00 0.00 H new ATOM 1554 N GLY A 101 31.096 -7.195 -23.966 1.00 0.00 N ATOM 1555 CA GLY A 101 32.532 -7.298 -23.784 1.00 0.00 C ATOM 1556 C GLY A 101 33.263 -6.039 -24.207 1.00 0.00 C ATOM 1557 O GLY A 101 33.025 -4.963 -23.659 1.00 0.00 O ATOM 0 H GLY A 101 30.549 -7.266 -23.108 1.00 0.00 H new ATOM 0 HA2 GLY A 101 32.748 -7.505 -22.736 1.00 0.00 H new ATOM 0 HA3 GLY A 101 32.908 -8.143 -24.360 1.00 0.00 H new ATOM 1561 N GLU A 102 34.156 -6.174 -25.182 1.00 0.00 N ATOM 1562 CA GLU A 102 34.925 -5.037 -25.675 1.00 0.00 C ATOM 1563 C GLU A 102 34.427 -4.598 -27.049 1.00 0.00 C ATOM 1564 O GLU A 102 34.678 -3.473 -27.480 1.00 0.00 O ATOM 1565 CB GLU A 102 36.411 -5.393 -25.750 1.00 0.00 C ATOM 1566 CG GLU A 102 36.686 -6.721 -26.434 1.00 0.00 C ATOM 1567 CD GLU A 102 36.682 -7.888 -25.465 1.00 0.00 C ATOM 1568 OE1 GLU A 102 37.546 -7.914 -24.564 1.00 0.00 O ATOM 1569 OE2 GLU A 102 35.814 -8.775 -25.608 1.00 0.00 O ATOM 0 H GLU A 102 34.365 -7.058 -25.646 1.00 0.00 H new ATOM 0 HA GLU A 102 34.791 -4.210 -24.977 1.00 0.00 H new ATOM 0 HB2 GLU A 102 36.938 -4.603 -26.284 1.00 0.00 H new ATOM 0 HB3 GLU A 102 36.820 -5.423 -24.740 1.00 0.00 H new ATOM 0 HG2 GLU A 102 35.934 -6.891 -27.205 1.00 0.00 H new ATOM 0 HG3 GLU A 102 37.652 -6.674 -26.936 1.00 0.00 H new ATOM 1576 N GLU A 103 33.719 -5.494 -27.730 1.00 0.00 N ATOM 1577 CA GLU A 103 33.187 -5.199 -29.055 1.00 0.00 C ATOM 1578 C GLU A 103 31.671 -5.036 -29.008 1.00 0.00 C ATOM 1579 O GLU A 103 30.927 -6.012 -29.091 1.00 0.00 O ATOM 1580 CB GLU A 103 33.561 -6.310 -30.039 1.00 0.00 C ATOM 1581 CG GLU A 103 33.371 -7.709 -29.478 1.00 0.00 C ATOM 1582 CD GLU A 103 33.417 -8.779 -30.551 1.00 0.00 C ATOM 1583 OE1 GLU A 103 32.406 -8.951 -31.263 1.00 0.00 O ATOM 1584 OE2 GLU A 103 34.466 -9.445 -30.679 1.00 0.00 O ATOM 0 H GLU A 103 33.501 -6.429 -27.386 1.00 0.00 H new ATOM 0 HA GLU A 103 33.626 -4.261 -29.394 1.00 0.00 H new ATOM 0 HB2 GLU A 103 32.957 -6.204 -30.940 1.00 0.00 H new ATOM 0 HB3 GLU A 103 34.602 -6.185 -30.336 1.00 0.00 H new ATOM 0 HG2 GLU A 103 34.146 -7.908 -28.738 1.00 0.00 H new ATOM 0 HG3 GLU A 103 32.414 -7.761 -28.959 1.00 0.00 H new ATOM 1591 N GLY A 104 31.219 -3.792 -28.874 1.00 0.00 N ATOM 1592 CA GLY A 104 29.794 -3.523 -28.817 1.00 0.00 C ATOM 1593 C GLY A 104 29.087 -3.867 -30.113 1.00 0.00 C ATOM 1594 O GLY A 104 29.553 -4.714 -30.877 1.00 0.00 O ATOM 0 H GLY A 104 31.814 -2.967 -28.804 1.00 0.00 H new ATOM 0 HA2 GLY A 104 29.352 -4.096 -28.002 1.00 0.00 H new ATOM 0 HA3 GLY A 104 29.635 -2.469 -28.589 1.00 0.00 H new ATOM 1598 N CYS A 105 27.958 -3.212 -30.361 1.00 0.00 N ATOM 1599 CA CYS A 105 27.183 -3.456 -31.573 1.00 0.00 C ATOM 1600 C CYS A 105 27.227 -2.245 -32.499 1.00 0.00 C ATOM 1601 O CYS A 105 26.718 -1.176 -32.164 1.00 0.00 O ATOM 1602 CB CYS A 105 25.734 -3.790 -31.218 1.00 0.00 C ATOM 1603 SG CYS A 105 24.803 -4.559 -32.564 1.00 0.00 S ATOM 0 H CYS A 105 27.559 -2.508 -29.740 1.00 0.00 H new ATOM 0 HA CYS A 105 27.626 -4.305 -32.094 1.00 0.00 H new ATOM 0 HB2 CYS A 105 25.727 -4.459 -30.357 1.00 0.00 H new ATOM 0 HB3 CYS A 105 25.225 -2.875 -30.915 1.00 0.00 H new ATOM 0 HG CYS A 105 23.590 -4.806 -32.167 1.00 0.00 H new ATOM 1609 N GLY A 106 27.840 -2.420 -33.666 1.00 0.00 N ATOM 1610 CA GLY A 106 27.941 -1.332 -34.621 1.00 0.00 C ATOM 1611 C GLY A 106 28.511 -0.070 -34.005 1.00 0.00 C ATOM 1612 O GLY A 106 29.267 -0.132 -33.037 1.00 0.00 O ATOM 0 H GLY A 106 28.268 -3.296 -33.967 1.00 0.00 H new ATOM 0 HA2 GLY A 106 28.571 -1.642 -35.455 1.00 0.00 H new ATOM 0 HA3 GLY A 106 26.953 -1.119 -35.030 1.00 0.00 H new ATOM 1616 N GLU A 107 28.148 1.078 -34.569 1.00 0.00 N ATOM 1617 CA GLU A 107 28.631 2.360 -34.070 1.00 0.00 C ATOM 1618 C GLU A 107 27.613 2.995 -33.127 1.00 0.00 C ATOM 1619 O GLU A 107 27.630 4.205 -32.902 1.00 0.00 O ATOM 1620 CB GLU A 107 28.925 3.308 -35.234 1.00 0.00 C ATOM 1621 CG GLU A 107 29.720 2.664 -36.358 1.00 0.00 C ATOM 1622 CD GLU A 107 28.834 2.003 -37.395 1.00 0.00 C ATOM 1623 OE1 GLU A 107 27.751 2.552 -37.688 1.00 0.00 O ATOM 1624 OE2 GLU A 107 29.224 0.937 -37.915 1.00 0.00 O ATOM 0 H GLU A 107 27.522 1.146 -35.371 1.00 0.00 H new ATOM 0 HA GLU A 107 29.552 2.181 -33.516 1.00 0.00 H new ATOM 0 HB2 GLU A 107 27.982 3.681 -35.635 1.00 0.00 H new ATOM 0 HB3 GLU A 107 29.476 4.171 -34.859 1.00 0.00 H new ATOM 0 HG2 GLU A 107 30.336 3.421 -36.842 1.00 0.00 H new ATOM 0 HG3 GLU A 107 30.398 1.921 -35.939 1.00 0.00 H new ATOM 1631 N SER A 108 26.728 2.169 -32.578 1.00 0.00 N ATOM 1632 CA SER A 108 25.699 2.650 -31.663 1.00 0.00 C ATOM 1633 C SER A 108 26.144 2.488 -30.213 1.00 0.00 C ATOM 1634 O SER A 108 25.719 3.239 -29.334 1.00 0.00 O ATOM 1635 CB SER A 108 24.389 1.895 -31.893 1.00 0.00 C ATOM 1636 OG SER A 108 24.630 0.525 -32.165 1.00 0.00 O ATOM 0 H SER A 108 26.703 1.164 -32.751 1.00 0.00 H new ATOM 0 HA SER A 108 25.539 3.710 -31.860 1.00 0.00 H new ATOM 0 HB2 SER A 108 23.753 1.988 -31.013 1.00 0.00 H new ATOM 0 HB3 SER A 108 23.848 2.345 -32.726 1.00 0.00 H new ATOM 0 HG SER A 108 25.427 0.230 -31.677 1.00 0.00 H new ATOM 1642 N ILE A 109 27.003 1.504 -29.970 1.00 0.00 N ATOM 1643 CA ILE A 109 27.508 1.244 -28.627 1.00 0.00 C ATOM 1644 C ILE A 109 29.013 1.001 -28.643 1.00 0.00 C ATOM 1645 O ILE A 109 29.483 -0.128 -28.789 1.00 0.00 O ATOM 1646 CB ILE A 109 26.809 0.029 -27.989 1.00 0.00 C ATOM 1647 CG1 ILE A 109 25.296 0.250 -27.941 1.00 0.00 C ATOM 1648 CG2 ILE A 109 27.357 -0.224 -26.593 1.00 0.00 C ATOM 1649 CD1 ILE A 109 24.508 -1.014 -27.678 1.00 0.00 C ATOM 0 H ILE A 109 27.364 0.873 -30.686 1.00 0.00 H new ATOM 0 HA ILE A 109 27.293 2.131 -28.031 1.00 0.00 H new ATOM 0 HB ILE A 109 27.009 -0.850 -28.602 1.00 0.00 H new ATOM 0 HG12 ILE A 109 25.068 0.979 -27.163 1.00 0.00 H new ATOM 0 HG13 ILE A 109 24.970 0.681 -28.887 1.00 0.00 H new ATOM 0 HG21 ILE A 109 26.853 -1.086 -26.155 1.00 0.00 H new ATOM 0 HG22 ILE A 109 28.427 -0.421 -26.652 1.00 0.00 H new ATOM 0 HG23 ILE A 109 27.184 0.653 -25.970 1.00 0.00 H new ATOM 0 HD11 ILE A 109 23.443 -0.781 -27.658 1.00 0.00 H new ATOM 0 HD12 ILE A 109 24.706 -1.737 -28.469 1.00 0.00 H new ATOM 0 HD13 ILE A 109 24.806 -1.435 -26.718 1.00 0.00 H new ATOM 1661 N PRO A 110 29.789 2.084 -28.488 1.00 0.00 N ATOM 1662 CA PRO A 110 31.253 2.014 -28.478 1.00 0.00 C ATOM 1663 C PRO A 110 31.792 1.327 -27.227 1.00 0.00 C ATOM 1664 O PRO A 110 31.218 1.445 -26.146 1.00 0.00 O ATOM 1665 CB PRO A 110 31.679 3.484 -28.506 1.00 0.00 C ATOM 1666 CG PRO A 110 30.530 4.222 -27.911 1.00 0.00 C ATOM 1667 CD PRO A 110 29.297 3.460 -28.309 1.00 0.00 C ATOM 0 HA PRO A 110 31.639 1.428 -29.313 1.00 0.00 H new ATOM 0 HB2 PRO A 110 32.592 3.643 -27.932 1.00 0.00 H new ATOM 0 HB3 PRO A 110 31.880 3.819 -29.524 1.00 0.00 H new ATOM 0 HG2 PRO A 110 30.621 4.277 -26.826 1.00 0.00 H new ATOM 0 HG3 PRO A 110 30.491 5.247 -28.280 1.00 0.00 H new ATOM 0 HD2 PRO A 110 28.526 3.514 -27.541 1.00 0.00 H new ATOM 0 HD3 PRO A 110 28.860 3.853 -29.227 1.00 0.00 H new ATOM 1675 N GLY A 111 32.901 0.609 -27.383 1.00 0.00 N ATOM 1676 CA GLY A 111 33.499 -0.085 -26.258 1.00 0.00 C ATOM 1677 C GLY A 111 33.723 0.825 -25.067 1.00 0.00 C ATOM 1678 O GLY A 111 33.859 2.038 -25.222 1.00 0.00 O ATOM 0 H GLY A 111 33.395 0.496 -28.268 1.00 0.00 H new ATOM 0 HA2 GLY A 111 32.855 -0.913 -25.962 1.00 0.00 H new ATOM 0 HA3 GLY A 111 34.452 -0.516 -26.566 1.00 0.00 H new ATOM 1682 N ASN A 112 33.761 0.240 -23.875 1.00 0.00 N ATOM 1683 CA ASN A 112 33.968 1.007 -22.652 1.00 0.00 C ATOM 1684 C ASN A 112 32.863 2.043 -22.467 1.00 0.00 C ATOM 1685 O ASN A 112 33.133 3.238 -22.347 1.00 0.00 O ATOM 1686 CB ASN A 112 35.332 1.700 -22.685 1.00 0.00 C ATOM 1687 CG ASN A 112 35.875 1.973 -21.296 1.00 0.00 C ATOM 1688 OD1 ASN A 112 35.597 3.016 -20.703 1.00 0.00 O ATOM 1689 ND2 ASN A 112 36.654 1.035 -20.771 1.00 0.00 N ATOM 0 H ASN A 112 33.651 -0.764 -23.729 1.00 0.00 H new ATOM 0 HA ASN A 112 33.939 0.316 -21.809 1.00 0.00 H new ATOM 0 HB2 ASN A 112 36.040 1.078 -23.233 1.00 0.00 H new ATOM 0 HB3 ASN A 112 35.246 2.640 -23.230 1.00 0.00 H new ATOM 0 HD21 ASN A 112 37.049 1.163 -19.839 1.00 0.00 H new ATOM 0 HD22 ASN A 112 36.857 0.186 -21.299 1.00 0.00 H new ATOM 1696 N SER A 113 31.619 1.576 -22.444 1.00 0.00 N ATOM 1697 CA SER A 113 30.473 2.462 -22.276 1.00 0.00 C ATOM 1698 C SER A 113 29.337 1.749 -21.550 1.00 0.00 C ATOM 1699 O SER A 113 28.891 0.680 -21.968 1.00 0.00 O ATOM 1700 CB SER A 113 29.987 2.965 -23.637 1.00 0.00 C ATOM 1701 OG SER A 113 31.017 3.654 -24.324 1.00 0.00 O ATOM 0 H SER A 113 31.379 0.589 -22.540 1.00 0.00 H new ATOM 0 HA SER A 113 30.789 3.313 -21.673 1.00 0.00 H new ATOM 0 HB2 SER A 113 29.645 2.123 -24.238 1.00 0.00 H new ATOM 0 HB3 SER A 113 29.132 3.627 -23.499 1.00 0.00 H new ATOM 0 HG SER A 113 31.331 3.108 -25.075 1.00 0.00 H new ATOM 1707 N VAL A 114 28.873 2.349 -20.458 1.00 0.00 N ATOM 1708 CA VAL A 114 27.788 1.773 -19.672 1.00 0.00 C ATOM 1709 C VAL A 114 26.455 1.896 -20.402 1.00 0.00 C ATOM 1710 O VAL A 114 26.187 2.900 -21.062 1.00 0.00 O ATOM 1711 CB VAL A 114 27.671 2.452 -18.294 1.00 0.00 C ATOM 1712 CG1 VAL A 114 26.571 1.802 -17.470 1.00 0.00 C ATOM 1713 CG2 VAL A 114 29.002 2.397 -17.559 1.00 0.00 C ATOM 0 H VAL A 114 29.231 3.233 -20.098 1.00 0.00 H new ATOM 0 HA VAL A 114 28.025 0.719 -19.530 1.00 0.00 H new ATOM 0 HB VAL A 114 27.408 3.499 -18.445 1.00 0.00 H new ATOM 0 HG11 VAL A 114 26.503 2.295 -16.500 1.00 0.00 H new ATOM 0 HG12 VAL A 114 25.620 1.898 -17.993 1.00 0.00 H new ATOM 0 HG13 VAL A 114 26.800 0.746 -17.325 1.00 0.00 H new ATOM 0 HG21 VAL A 114 28.901 2.881 -16.588 1.00 0.00 H new ATOM 0 HG22 VAL A 114 29.297 1.357 -17.418 1.00 0.00 H new ATOM 0 HG23 VAL A 114 29.763 2.913 -18.145 1.00 0.00 H new ATOM 1723 N LEU A 115 25.623 0.868 -20.278 1.00 0.00 N ATOM 1724 CA LEU A 115 24.315 0.860 -20.926 1.00 0.00 C ATOM 1725 C LEU A 115 23.216 0.507 -19.929 1.00 0.00 C ATOM 1726 O LEU A 115 23.442 -0.249 -18.984 1.00 0.00 O ATOM 1727 CB LEU A 115 24.306 -0.135 -22.088 1.00 0.00 C ATOM 1728 CG LEU A 115 25.593 -0.221 -22.909 1.00 0.00 C ATOM 1729 CD1 LEU A 115 25.555 -1.425 -23.837 1.00 0.00 C ATOM 1730 CD2 LEU A 115 25.806 1.060 -23.702 1.00 0.00 C ATOM 0 H LEU A 115 25.830 0.030 -19.735 1.00 0.00 H new ATOM 0 HA LEU A 115 24.121 1.861 -21.312 1.00 0.00 H new ATOM 0 HB2 LEU A 115 24.086 -1.126 -21.690 1.00 0.00 H new ATOM 0 HB3 LEU A 115 23.488 0.128 -22.759 1.00 0.00 H new ATOM 0 HG LEU A 115 26.431 -0.344 -22.223 1.00 0.00 H new ATOM 0 HD11 LEU A 115 26.479 -1.470 -24.413 1.00 0.00 H new ATOM 0 HD12 LEU A 115 25.451 -2.336 -23.247 1.00 0.00 H new ATOM 0 HD13 LEU A 115 24.708 -1.334 -24.517 1.00 0.00 H new ATOM 0 HD21 LEU A 115 26.727 0.981 -24.280 1.00 0.00 H new ATOM 0 HD22 LEU A 115 24.965 1.214 -24.378 1.00 0.00 H new ATOM 0 HD23 LEU A 115 25.879 1.904 -23.017 1.00 0.00 H new ATOM 1742 N ILE A 116 22.026 1.056 -20.150 1.00 0.00 N ATOM 1743 CA ILE A 116 20.891 0.795 -19.273 1.00 0.00 C ATOM 1744 C ILE A 116 19.792 0.036 -20.007 1.00 0.00 C ATOM 1745 O ILE A 116 19.450 0.362 -21.144 1.00 0.00 O ATOM 1746 CB ILE A 116 20.306 2.102 -18.706 1.00 0.00 C ATOM 1747 CG1 ILE A 116 21.373 2.865 -17.918 1.00 0.00 C ATOM 1748 CG2 ILE A 116 19.101 1.805 -17.826 1.00 0.00 C ATOM 1749 CD1 ILE A 116 20.918 4.229 -17.449 1.00 0.00 C ATOM 0 H ILE A 116 21.823 1.684 -20.928 1.00 0.00 H new ATOM 0 HA ILE A 116 21.262 0.185 -18.450 1.00 0.00 H new ATOM 0 HB ILE A 116 19.979 2.727 -19.537 1.00 0.00 H new ATOM 0 HG12 ILE A 116 21.667 2.272 -17.052 1.00 0.00 H new ATOM 0 HG13 ILE A 116 22.260 2.981 -18.541 1.00 0.00 H new ATOM 0 HG21 ILE A 116 18.699 2.739 -17.433 1.00 0.00 H new ATOM 0 HG22 ILE A 116 18.336 1.300 -18.415 1.00 0.00 H new ATOM 0 HG23 ILE A 116 19.404 1.163 -16.999 1.00 0.00 H new ATOM 0 HD11 ILE A 116 21.725 4.712 -16.898 1.00 0.00 H new ATOM 0 HD12 ILE A 116 20.651 4.840 -18.311 1.00 0.00 H new ATOM 0 HD13 ILE A 116 20.050 4.119 -16.799 1.00 0.00 H new ATOM 1761 N PHE A 117 19.240 -0.978 -19.349 1.00 0.00 N ATOM 1762 CA PHE A 117 18.177 -1.784 -19.939 1.00 0.00 C ATOM 1763 C PHE A 117 17.089 -2.084 -18.913 1.00 0.00 C ATOM 1764 O PHE A 117 17.375 -2.522 -17.799 1.00 0.00 O ATOM 1765 CB PHE A 117 18.747 -3.092 -20.492 1.00 0.00 C ATOM 1766 CG PHE A 117 19.323 -2.960 -21.873 1.00 0.00 C ATOM 1767 CD1 PHE A 117 20.488 -2.240 -22.086 1.00 0.00 C ATOM 1768 CD2 PHE A 117 18.699 -3.555 -22.958 1.00 0.00 C ATOM 1769 CE1 PHE A 117 21.018 -2.116 -23.356 1.00 0.00 C ATOM 1770 CE2 PHE A 117 19.225 -3.434 -24.230 1.00 0.00 C ATOM 1771 CZ PHE A 117 20.387 -2.715 -24.429 1.00 0.00 C ATOM 0 H PHE A 117 19.511 -1.261 -18.407 1.00 0.00 H new ATOM 0 HA PHE A 117 17.734 -1.214 -20.756 1.00 0.00 H new ATOM 0 HB2 PHE A 117 19.522 -3.455 -19.817 1.00 0.00 H new ATOM 0 HB3 PHE A 117 17.959 -3.845 -20.506 1.00 0.00 H new ATOM 0 HD1 PHE A 117 20.987 -1.771 -21.251 1.00 0.00 H new ATOM 0 HD2 PHE A 117 17.791 -4.120 -22.808 1.00 0.00 H new ATOM 0 HE1 PHE A 117 21.925 -1.551 -23.510 1.00 0.00 H new ATOM 0 HE2 PHE A 117 18.728 -3.901 -25.067 1.00 0.00 H new ATOM 0 HZ PHE A 117 20.802 -2.621 -25.422 1.00 0.00 H new ATOM 1781 N GLU A 118 15.839 -1.844 -19.298 1.00 0.00 N ATOM 1782 CA GLU A 118 14.707 -2.087 -18.411 1.00 0.00 C ATOM 1783 C GLU A 118 14.031 -3.414 -18.743 1.00 0.00 C ATOM 1784 O GLU A 118 13.572 -3.626 -19.866 1.00 0.00 O ATOM 1785 CB GLU A 118 13.694 -0.946 -18.516 1.00 0.00 C ATOM 1786 CG GLU A 118 12.952 -0.669 -17.219 1.00 0.00 C ATOM 1787 CD GLU A 118 12.625 0.801 -17.037 1.00 0.00 C ATOM 1788 OE1 GLU A 118 11.562 1.236 -17.525 1.00 0.00 O ATOM 1789 OE2 GLU A 118 13.432 1.515 -16.406 1.00 0.00 O ATOM 0 H GLU A 118 15.585 -1.482 -20.217 1.00 0.00 H new ATOM 0 HA GLU A 118 15.083 -2.136 -17.389 1.00 0.00 H new ATOM 0 HB2 GLU A 118 14.212 -0.039 -18.829 1.00 0.00 H new ATOM 0 HB3 GLU A 118 12.970 -1.185 -19.295 1.00 0.00 H new ATOM 0 HG2 GLU A 118 12.028 -1.248 -17.202 1.00 0.00 H new ATOM 0 HG3 GLU A 118 13.557 -1.010 -16.379 1.00 0.00 H new ATOM 1796 N ILE A 119 13.974 -4.305 -17.758 1.00 0.00 N ATOM 1797 CA ILE A 119 13.354 -5.611 -17.945 1.00 0.00 C ATOM 1798 C ILE A 119 12.090 -5.745 -17.102 1.00 0.00 C ATOM 1799 O ILE A 119 12.023 -5.239 -15.982 1.00 0.00 O ATOM 1800 CB ILE A 119 14.323 -6.751 -17.582 1.00 0.00 C ATOM 1801 CG1 ILE A 119 15.582 -6.674 -18.448 1.00 0.00 C ATOM 1802 CG2 ILE A 119 13.640 -8.100 -17.750 1.00 0.00 C ATOM 1803 CD1 ILE A 119 16.579 -7.777 -18.165 1.00 0.00 C ATOM 0 H ILE A 119 14.350 -4.146 -16.823 1.00 0.00 H new ATOM 0 HA ILE A 119 13.094 -5.689 -19.001 1.00 0.00 H new ATOM 0 HB ILE A 119 14.615 -6.641 -16.538 1.00 0.00 H new ATOM 0 HG12 ILE A 119 15.294 -6.717 -19.498 1.00 0.00 H new ATOM 0 HG13 ILE A 119 16.064 -5.710 -18.289 1.00 0.00 H new ATOM 0 HG21 ILE A 119 14.338 -8.896 -17.490 1.00 0.00 H new ATOM 0 HG22 ILE A 119 12.770 -8.151 -17.095 1.00 0.00 H new ATOM 0 HG23 ILE A 119 13.322 -8.220 -18.786 1.00 0.00 H new ATOM 0 HD11 ILE A 119 17.446 -7.659 -18.815 1.00 0.00 H new ATOM 0 HD12 ILE A 119 16.896 -7.722 -17.124 1.00 0.00 H new ATOM 0 HD13 ILE A 119 16.114 -8.745 -18.352 1.00 0.00 H new ATOM 1815 N GLU A 120 11.091 -6.432 -17.647 1.00 0.00 N ATOM 1816 CA GLU A 120 9.830 -6.634 -16.944 1.00 0.00 C ATOM 1817 C GLU A 120 9.246 -8.008 -17.258 1.00 0.00 C ATOM 1818 O GLU A 120 9.034 -8.354 -18.421 1.00 0.00 O ATOM 1819 CB GLU A 120 8.828 -5.542 -17.325 1.00 0.00 C ATOM 1820 CG GLU A 120 7.437 -5.768 -16.757 1.00 0.00 C ATOM 1821 CD GLU A 120 6.455 -4.689 -17.172 1.00 0.00 C ATOM 1822 OE1 GLU A 120 6.689 -4.042 -18.214 1.00 0.00 O ATOM 1823 OE2 GLU A 120 5.453 -4.491 -16.453 1.00 0.00 O ATOM 0 H GLU A 120 11.131 -6.858 -18.573 1.00 0.00 H new ATOM 0 HA GLU A 120 10.027 -6.579 -15.873 1.00 0.00 H new ATOM 0 HB2 GLU A 120 9.202 -4.580 -16.976 1.00 0.00 H new ATOM 0 HB3 GLU A 120 8.763 -5.483 -18.411 1.00 0.00 H new ATOM 0 HG2 GLU A 120 7.067 -6.738 -17.088 1.00 0.00 H new ATOM 0 HG3 GLU A 120 7.494 -5.803 -15.669 1.00 0.00 H new ATOM 1830 N LEU A 121 8.988 -8.787 -16.213 1.00 0.00 N ATOM 1831 CA LEU A 121 8.428 -10.124 -16.376 1.00 0.00 C ATOM 1832 C LEU A 121 6.928 -10.058 -16.645 1.00 0.00 C ATOM 1833 O LEU A 121 6.159 -9.575 -15.813 1.00 0.00 O ATOM 1834 CB LEU A 121 8.697 -10.967 -15.128 1.00 0.00 C ATOM 1835 CG LEU A 121 8.349 -12.452 -15.233 1.00 0.00 C ATOM 1836 CD1 LEU A 121 8.976 -13.061 -16.477 1.00 0.00 C ATOM 1837 CD2 LEU A 121 8.804 -13.195 -13.985 1.00 0.00 C ATOM 0 H LEU A 121 9.158 -8.516 -15.244 1.00 0.00 H new ATOM 0 HA LEU A 121 8.912 -10.591 -17.234 1.00 0.00 H new ATOM 0 HB2 LEU A 121 9.754 -10.879 -14.876 1.00 0.00 H new ATOM 0 HB3 LEU A 121 8.134 -10.540 -14.298 1.00 0.00 H new ATOM 0 HG LEU A 121 7.266 -12.547 -15.314 1.00 0.00 H new ATOM 0 HD11 LEU A 121 8.717 -14.118 -16.535 1.00 0.00 H new ATOM 0 HD12 LEU A 121 8.601 -12.547 -17.362 1.00 0.00 H new ATOM 0 HD13 LEU A 121 10.060 -12.955 -16.427 1.00 0.00 H new ATOM 0 HD21 LEU A 121 8.548 -14.251 -14.077 1.00 0.00 H new ATOM 0 HD22 LEU A 121 9.883 -13.091 -13.873 1.00 0.00 H new ATOM 0 HD23 LEU A 121 8.307 -12.776 -13.110 1.00 0.00 H new ATOM 1849 N ILE A 122 6.519 -10.547 -17.811 1.00 0.00 N ATOM 1850 CA ILE A 122 5.111 -10.546 -18.187 1.00 0.00 C ATOM 1851 C ILE A 122 4.441 -11.864 -17.813 1.00 0.00 C ATOM 1852 O ILE A 122 3.472 -11.886 -17.053 1.00 0.00 O ATOM 1853 CB ILE A 122 4.932 -10.303 -19.697 1.00 0.00 C ATOM 1854 CG1 ILE A 122 5.734 -9.076 -20.137 1.00 0.00 C ATOM 1855 CG2 ILE A 122 3.459 -10.128 -20.035 1.00 0.00 C ATOM 1856 CD1 ILE A 122 5.640 -8.792 -21.620 1.00 0.00 C ATOM 0 H ILE A 122 7.143 -10.949 -18.511 1.00 0.00 H new ATOM 0 HA ILE A 122 4.638 -9.732 -17.637 1.00 0.00 H new ATOM 0 HB ILE A 122 5.308 -11.172 -20.237 1.00 0.00 H new ATOM 0 HG12 ILE A 122 5.381 -8.205 -19.585 1.00 0.00 H new ATOM 0 HG13 ILE A 122 6.781 -9.221 -19.869 1.00 0.00 H new ATOM 0 HG21 ILE A 122 3.349 -9.957 -21.106 1.00 0.00 H new ATOM 0 HG22 ILE A 122 2.912 -11.027 -19.753 1.00 0.00 H new ATOM 0 HG23 ILE A 122 3.059 -9.274 -19.488 1.00 0.00 H new ATOM 0 HD11 ILE A 122 6.233 -7.909 -21.860 1.00 0.00 H new ATOM 0 HD12 ILE A 122 6.020 -9.647 -22.179 1.00 0.00 H new ATOM 0 HD13 ILE A 122 4.599 -8.615 -21.891 1.00 0.00 H new ATOM 1868 N SER A 123 4.964 -12.961 -18.350 1.00 0.00 N ATOM 1869 CA SER A 123 4.416 -14.284 -18.075 1.00 0.00 C ATOM 1870 C SER A 123 5.207 -15.363 -18.807 1.00 0.00 C ATOM 1871 O SER A 123 5.726 -15.135 -19.900 1.00 0.00 O ATOM 1872 CB SER A 123 2.944 -14.345 -18.489 1.00 0.00 C ATOM 1873 OG SER A 123 2.754 -13.789 -19.779 1.00 0.00 O ATOM 0 H SER A 123 5.767 -12.960 -18.979 1.00 0.00 H new ATOM 0 HA SER A 123 4.493 -14.467 -17.003 1.00 0.00 H new ATOM 0 HB2 SER A 123 2.604 -15.380 -18.482 1.00 0.00 H new ATOM 0 HB3 SER A 123 2.336 -13.805 -17.763 1.00 0.00 H new ATOM 0 HG SER A 123 1.806 -13.841 -20.021 1.00 0.00 H new ATOM 1879 N PHE A 124 5.295 -16.540 -18.196 1.00 0.00 N ATOM 1880 CA PHE A 124 6.024 -17.656 -18.787 1.00 0.00 C ATOM 1881 C PHE A 124 5.138 -18.894 -18.885 1.00 0.00 C ATOM 1882 O PHE A 124 4.160 -19.030 -18.149 1.00 0.00 O ATOM 1883 CB PHE A 124 7.272 -17.973 -17.961 1.00 0.00 C ATOM 1884 CG PHE A 124 6.991 -18.160 -16.497 1.00 0.00 C ATOM 1885 CD1 PHE A 124 7.004 -17.078 -15.632 1.00 0.00 C ATOM 1886 CD2 PHE A 124 6.714 -19.418 -15.987 1.00 0.00 C ATOM 1887 CE1 PHE A 124 6.745 -17.247 -14.285 1.00 0.00 C ATOM 1888 CE2 PHE A 124 6.453 -19.593 -14.641 1.00 0.00 C ATOM 1889 CZ PHE A 124 6.471 -18.506 -13.789 1.00 0.00 C ATOM 0 H PHE A 124 4.870 -16.746 -17.292 1.00 0.00 H new ATOM 0 HA PHE A 124 6.327 -17.367 -19.793 1.00 0.00 H new ATOM 0 HB2 PHE A 124 7.736 -18.878 -18.352 1.00 0.00 H new ATOM 0 HB3 PHE A 124 7.994 -17.166 -18.084 1.00 0.00 H new ATOM 0 HD1 PHE A 124 7.219 -16.091 -16.015 1.00 0.00 H new ATOM 0 HD2 PHE A 124 6.702 -20.272 -16.649 1.00 0.00 H new ATOM 0 HE1 PHE A 124 6.757 -16.395 -13.621 1.00 0.00 H new ATOM 0 HE2 PHE A 124 6.235 -20.578 -14.256 1.00 0.00 H new ATOM 0 HZ PHE A 124 6.271 -18.641 -12.736 1.00 0.00 H new ATOM 1899 N ARG A 125 5.486 -19.793 -19.799 1.00 0.00 N ATOM 1900 CA ARG A 125 4.722 -21.019 -19.995 1.00 0.00 C ATOM 1901 C ARG A 125 5.614 -22.137 -20.529 1.00 0.00 C ATOM 1902 O ARG A 125 6.829 -21.975 -20.637 1.00 0.00 O ATOM 1903 CB ARG A 125 3.562 -20.773 -20.961 1.00 0.00 C ATOM 1904 CG ARG A 125 3.999 -20.234 -22.313 1.00 0.00 C ATOM 1905 CD ARG A 125 4.285 -21.359 -23.295 1.00 0.00 C ATOM 1906 NE ARG A 125 3.813 -21.044 -24.641 1.00 0.00 N ATOM 1907 CZ ARG A 125 4.351 -20.101 -25.407 1.00 0.00 C ATOM 1908 NH1 ARG A 125 5.374 -19.385 -24.962 1.00 0.00 N ATOM 1909 NH2 ARG A 125 3.865 -19.874 -26.621 1.00 0.00 N ATOM 0 H ARG A 125 6.292 -19.696 -20.416 1.00 0.00 H new ATOM 0 HA ARG A 125 4.323 -21.327 -19.029 1.00 0.00 H new ATOM 0 HB2 ARG A 125 3.020 -21.707 -21.110 1.00 0.00 H new ATOM 0 HB3 ARG A 125 2.865 -20.069 -20.507 1.00 0.00 H new ATOM 0 HG2 ARG A 125 3.221 -19.586 -22.717 1.00 0.00 H new ATOM 0 HG3 ARG A 125 4.892 -19.621 -22.190 1.00 0.00 H new ATOM 0 HD2 ARG A 125 5.357 -21.552 -23.323 1.00 0.00 H new ATOM 0 HD3 ARG A 125 3.805 -22.274 -22.948 1.00 0.00 H new ATOM 0 HE ARG A 125 3.027 -21.577 -25.013 1.00 0.00 H new ATOM 0 HH11 ARG A 125 5.750 -19.557 -24.030 1.00 0.00 H new ATOM 0 HH12 ARG A 125 5.785 -18.662 -25.552 1.00 0.00 H new ATOM 0 HH21 ARG A 125 3.078 -20.424 -26.966 1.00 0.00 H new ATOM 0 HH22 ARG A 125 4.278 -19.150 -27.209 1.00 0.00 H new ATOM 1923 N GLU A 126 5.001 -23.269 -20.860 1.00 0.00 N ATOM 1924 CA GLU A 126 5.741 -24.413 -21.381 1.00 0.00 C ATOM 1925 C GLU A 126 5.271 -24.769 -22.789 1.00 0.00 C ATOM 1926 O GLU A 126 4.098 -24.606 -23.122 1.00 0.00 O ATOM 1927 CB GLU A 126 5.574 -25.620 -20.455 1.00 0.00 C ATOM 1928 CG GLU A 126 4.130 -25.905 -20.081 1.00 0.00 C ATOM 1929 CD GLU A 126 3.955 -27.260 -19.422 1.00 0.00 C ATOM 1930 OE1 GLU A 126 4.311 -27.392 -18.233 1.00 0.00 O ATOM 1931 OE2 GLU A 126 3.461 -28.188 -20.097 1.00 0.00 O ATOM 0 H GLU A 126 3.995 -23.419 -20.777 1.00 0.00 H new ATOM 0 HA GLU A 126 6.796 -24.142 -21.426 1.00 0.00 H new ATOM 0 HB2 GLU A 126 5.995 -26.500 -20.940 1.00 0.00 H new ATOM 0 HB3 GLU A 126 6.150 -25.451 -19.545 1.00 0.00 H new ATOM 0 HG2 GLU A 126 3.773 -25.128 -19.405 1.00 0.00 H new ATOM 0 HG3 GLU A 126 3.510 -25.858 -20.977 1.00 0.00 H new TER 1938 GLU A 126