USER MOD reduce.3.24.130724 H: found=0, std=0, add=709, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 709 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 54 TYR OH : rot 180:sc= 0.519 USER MOD Set 1.2: A 76 LYS NZ :NH3+ 175:sc= 1.03 (180deg=0.234) USER MOD Set 2.1: A 27 THR OG1 : rot 137:sc= 1.15 USER MOD Set 2.2: A 29 THR OG1 : rot 180:sc= 0.965 USER MOD Single : A 1 MET CE :methyl -128:sc= 0 (180deg=-0.0365) USER MOD Single : A 1 MET N :NH3+ -103:sc= 0.0833 (180deg=0) USER MOD Single : A 4 ASN : amide:sc= -0.124 K(o=-0.12,f=-2.3!) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 ASN : amide:sc= -0.0666 K(o=-0.067,f=-1.3) USER MOD Single : A 8 TYR OH : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 MET CE :methyl -150:sc= 0 (180deg=-0.249) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 ASN : amide:sc= 0.547 K(o=0.55,f=0) USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 19 CYS SG : rot 37:sc= 0.138 USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 THR OG1 : rot 180:sc= 0.0218 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 SER OG : rot 180:sc= -0.79 USER MOD Single : A 28 TYR OH : rot 70:sc= 0.522 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 CYS SG : rot 80:sc= 0.319 USER MOD Single : A 33 ASN : amide:sc=-0.00874 K(o=-0.0087,f=-0.97) USER MOD Single : A 35 SER OG : rot -37:sc= 0.561 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 39 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 40 SER OG : rot 180:sc= 0.0172 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0246) USER MOD Single : A 53 GLN : amide:sc= 0 X(o=0,f=-0.19) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 CYS SG : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 GLN : amide:sc= 0 K(o=0,f=-0.79) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 THR OG1 : rot 39:sc= 0.314 USER MOD Single : A 68 TYR OH : rot -15:sc= -2.56 USER MOD Single : A 70 THR OG1 : rot -73:sc= 0.955 USER MOD Single : A 72 ASN : amide:sc= -0.0483 X(o=-0.048,f=-0.25) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 SER OG : rot -50:sc= 1.05 USER MOD Single : A 81 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 18.293 29.619 22.231 1.00 0.00 N1+ ATOM 2 CA MET A 1 19.505 29.503 23.074 1.00 0.00 C ATOM 3 C MET A 1 19.168 28.833 24.403 1.00 0.00 C ATOM 4 O MET A 1 18.027 28.919 24.848 1.00 0.00 O ATOM 5 CB MET A 1 20.209 30.862 23.247 1.00 0.00 C ATOM 6 CG MET A 1 19.376 31.949 23.945 1.00 0.00 C ATOM 7 SD MET A 1 20.329 33.341 24.618 1.00 0.00 S ATOM 8 CE MET A 1 20.965 32.559 26.127 1.00 0.00 C ATOM 0 H1 MET A 1 18.313 28.888 21.491 1.00 0.00 H new ATOM 0 H2 MET A 1 17.446 29.491 22.821 1.00 0.00 H new ATOM 0 H3 MET A 1 18.267 30.559 21.788 1.00 0.00 H new ATOM 0 HA MET A 1 20.222 28.860 22.564 1.00 0.00 H new ATOM 0 HB2 MET A 1 21.125 30.708 23.817 1.00 0.00 H new ATOM 0 HB3 MET A 1 20.503 31.228 22.263 1.00 0.00 H new ATOM 0 HG2 MET A 1 18.647 32.338 23.234 1.00 0.00 H new ATOM 0 HG3 MET A 1 18.814 31.488 24.757 1.00 0.00 H new ATOM 0 HE1 MET A 1 20.739 33.190 26.987 1.00 0.00 H new ATOM 0 HE2 MET A 1 20.495 31.584 26.258 1.00 0.00 H new ATOM 0 HE3 MET A 1 22.044 32.433 26.044 1.00 0.00 H new ATOM 20 N ALA A 2 20.129 28.111 24.967 1.00 0.00 N ATOM 21 CA ALA A 2 19.932 27.405 26.224 1.00 0.00 C ATOM 22 C ALA A 2 21.206 27.452 27.052 1.00 0.00 C ATOM 23 O ALA A 2 22.294 27.668 26.517 1.00 0.00 O ATOM 24 CB ALA A 2 19.522 25.964 25.964 1.00 0.00 C ATOM 0 H ALA A 2 21.061 28.000 24.568 1.00 0.00 H new ATOM 0 HA ALA A 2 19.133 27.895 26.780 1.00 0.00 H new ATOM 0 HB1 ALA A 2 19.379 25.449 26.914 1.00 0.00 H new ATOM 0 HB2 ALA A 2 18.591 25.947 25.398 1.00 0.00 H new ATOM 0 HB3 ALA A 2 20.303 25.461 25.393 1.00 0.00 H new ATOM 30 N VAL A 3 21.077 27.217 28.352 1.00 0.00 N ATOM 31 CA VAL A 3 22.230 27.254 29.240 1.00 0.00 C ATOM 32 C VAL A 3 22.315 25.992 30.088 1.00 0.00 C ATOM 33 O VAL A 3 22.012 26.009 31.282 1.00 0.00 O ATOM 34 CB VAL A 3 22.177 28.477 30.174 1.00 0.00 C ATOM 35 CG1 VAL A 3 22.284 29.764 29.371 1.00 0.00 C ATOM 36 CG2 VAL A 3 20.901 28.459 31.002 1.00 0.00 C ATOM 0 H VAL A 3 20.192 27.000 28.811 1.00 0.00 H new ATOM 0 HA VAL A 3 23.114 27.323 28.605 1.00 0.00 H new ATOM 0 HB VAL A 3 23.026 28.431 30.856 1.00 0.00 H new ATOM 0 HG11 VAL A 3 22.245 30.619 30.046 1.00 0.00 H new ATOM 0 HG12 VAL A 3 23.228 29.775 28.826 1.00 0.00 H new ATOM 0 HG13 VAL A 3 21.456 29.822 28.664 1.00 0.00 H new ATOM 0 HG21 VAL A 3 20.880 29.330 31.657 1.00 0.00 H new ATOM 0 HG22 VAL A 3 20.036 28.482 30.339 1.00 0.00 H new ATOM 0 HG23 VAL A 3 20.871 27.551 31.605 1.00 0.00 H new ATOM 46 N ASN A 4 22.731 24.896 29.461 1.00 0.00 N ATOM 47 CA ASN A 4 22.876 23.626 30.157 1.00 0.00 C ATOM 48 C ASN A 4 23.994 23.728 31.192 1.00 0.00 C ATOM 49 O ASN A 4 25.052 24.293 30.910 1.00 0.00 O ATOM 50 CB ASN A 4 23.232 22.513 29.172 1.00 0.00 C ATOM 51 CG ASN A 4 22.179 22.327 28.097 1.00 0.00 C ATOM 52 OD1 ASN A 4 21.194 23.064 28.043 1.00 0.00 O ATOM 53 ND2 ASN A 4 22.382 21.338 27.235 1.00 0.00 N ATOM 0 H ASN A 4 22.973 24.864 28.471 1.00 0.00 H new ATOM 0 HA ASN A 4 21.929 23.395 30.644 1.00 0.00 H new ATOM 0 HB2 ASN A 4 24.189 22.741 28.702 1.00 0.00 H new ATOM 0 HB3 ASN A 4 23.359 21.578 29.717 1.00 0.00 H new ATOM 0 HD21 ASN A 4 21.707 21.164 26.490 1.00 0.00 H new ATOM 0 HD22 ASN A 4 23.213 20.752 27.318 1.00 0.00 H new ATOM 60 N LYS A 5 23.778 23.179 32.384 1.00 0.00 N ATOM 61 CA LYS A 5 24.785 23.258 33.431 1.00 0.00 C ATOM 62 C LYS A 5 26.131 22.673 33.016 1.00 0.00 C ATOM 63 O LYS A 5 27.177 23.255 33.303 1.00 0.00 O ATOM 64 CB LYS A 5 24.286 22.563 34.699 1.00 0.00 C ATOM 65 CG LYS A 5 23.000 23.149 35.258 1.00 0.00 C ATOM 66 CD LYS A 5 22.685 22.588 36.635 1.00 0.00 C ATOM 67 CE LYS A 5 22.551 21.075 36.606 1.00 0.00 C ATOM 68 NZ LYS A 5 22.295 20.512 37.960 1.00 0.00 N1+ ATOM 0 H LYS A 5 22.926 22.682 32.644 1.00 0.00 H new ATOM 0 HA LYS A 5 24.947 24.318 33.625 1.00 0.00 H new ATOM 0 HB2 LYS A 5 24.129 21.506 34.484 1.00 0.00 H new ATOM 0 HB3 LYS A 5 25.062 22.621 35.462 1.00 0.00 H new ATOM 0 HG2 LYS A 5 23.089 24.234 35.317 1.00 0.00 H new ATOM 0 HG3 LYS A 5 22.175 22.934 34.579 1.00 0.00 H new ATOM 0 HD2 LYS A 5 23.473 22.871 37.333 1.00 0.00 H new ATOM 0 HD3 LYS A 5 21.759 23.029 37.005 1.00 0.00 H new ATOM 0 HE2 LYS A 5 21.737 20.796 35.937 1.00 0.00 H new ATOM 0 HE3 LYS A 5 23.462 20.638 36.198 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 22.210 19.477 37.895 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 23.084 20.756 38.592 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 21.412 20.909 38.340 1.00 0.00 H new ATOM 82 N ASN A 6 26.110 21.527 32.343 1.00 0.00 N ATOM 83 CA ASN A 6 27.361 20.896 31.917 1.00 0.00 C ATOM 84 C ASN A 6 28.126 21.577 30.769 1.00 0.00 C ATOM 85 O ASN A 6 29.331 21.802 30.884 1.00 0.00 O ATOM 86 CB ASN A 6 27.088 19.439 31.533 1.00 0.00 C ATOM 87 CG ASN A 6 26.432 18.654 32.653 1.00 0.00 C ATOM 88 OD1 ASN A 6 26.349 19.123 33.788 1.00 0.00 O ATOM 89 ND2 ASN A 6 25.962 17.453 32.338 1.00 0.00 N ATOM 0 H ASN A 6 25.262 21.023 32.084 1.00 0.00 H new ATOM 0 HA ASN A 6 28.017 20.992 32.782 1.00 0.00 H new ATOM 0 HB2 ASN A 6 26.447 19.413 30.652 1.00 0.00 H new ATOM 0 HB3 ASN A 6 28.026 18.958 31.258 1.00 0.00 H new ATOM 0 HD21 ASN A 6 25.510 16.879 33.050 1.00 0.00 H new ATOM 0 HD22 ASN A 6 26.053 17.104 31.384 1.00 0.00 H new ATOM 96 N GLU A 7 27.444 21.906 29.672 1.00 0.00 N ATOM 97 CA GLU A 7 28.105 22.576 28.548 1.00 0.00 C ATOM 98 C GLU A 7 28.474 24.009 28.904 1.00 0.00 C ATOM 99 O GLU A 7 29.576 24.491 28.639 1.00 0.00 O ATOM 100 CB GLU A 7 27.200 22.565 27.314 1.00 0.00 C ATOM 101 CG GLU A 7 26.962 21.181 26.730 1.00 0.00 C ATOM 102 CD GLU A 7 26.005 21.199 25.555 1.00 0.00 C ATOM 103 OE1 GLU A 7 25.380 22.252 25.312 1.00 0.00 O ATOM 104 OE2 GLU A 7 25.876 20.160 24.874 1.00 0.00 O ATOM 0 H GLU A 7 26.450 21.724 29.536 1.00 0.00 H new ATOM 0 HA GLU A 7 29.021 22.029 28.325 1.00 0.00 H new ATOM 0 HB2 GLU A 7 26.239 23.006 27.578 1.00 0.00 H new ATOM 0 HB3 GLU A 7 27.643 23.200 26.547 1.00 0.00 H new ATOM 0 HG2 GLU A 7 27.914 20.757 26.411 1.00 0.00 H new ATOM 0 HG3 GLU A 7 26.565 20.527 27.506 1.00 0.00 H new ATOM 111 N TYR A 8 27.498 24.663 29.516 1.00 0.00 N ATOM 112 CA TYR A 8 27.599 26.053 29.974 1.00 0.00 C ATOM 113 C TYR A 8 28.450 26.174 31.243 1.00 0.00 C ATOM 114 O TYR A 8 28.888 27.282 31.544 1.00 0.00 O ATOM 115 CB TYR A 8 26.190 26.655 30.138 1.00 0.00 C ATOM 116 CG TYR A 8 26.081 28.112 29.719 1.00 0.00 C ATOM 117 CD1 TYR A 8 25.769 28.428 28.383 1.00 0.00 C ATOM 118 CD2 TYR A 8 26.281 29.150 30.650 1.00 0.00 C ATOM 119 CE1 TYR A 8 25.666 29.772 27.976 1.00 0.00 C ATOM 120 CE2 TYR A 8 26.189 30.497 30.248 1.00 0.00 C ATOM 121 CZ TYR A 8 25.881 30.809 28.908 1.00 0.00 C ATOM 122 OH TYR A 8 25.794 32.105 28.507 1.00 0.00 O ATOM 0 H TYR A 8 26.592 24.239 29.715 1.00 0.00 H new ATOM 0 HA TYR A 8 28.121 26.636 29.215 1.00 0.00 H new ATOM 0 HB2 TYR A 8 25.485 26.066 29.551 1.00 0.00 H new ATOM 0 HB3 TYR A 8 25.888 26.565 31.182 1.00 0.00 H new ATOM 0 HD1 TYR A 8 25.608 27.636 27.667 1.00 0.00 H new ATOM 0 HD2 TYR A 8 26.506 28.912 31.679 1.00 0.00 H new ATOM 0 HE1 TYR A 8 25.423 30.009 26.951 1.00 0.00 H new ATOM 0 HE2 TYR A 8 26.354 31.288 30.964 1.00 0.00 H new ATOM 0 HH TYR A 8 25.968 32.696 29.269 1.00 0.00 H new ATOM 132 N LYS A 9 28.798 25.059 31.919 1.00 0.00 N ATOM 133 CA LYS A 9 29.794 25.025 32.995 1.00 0.00 C ATOM 134 C LYS A 9 31.030 25.843 32.629 1.00 0.00 C ATOM 135 O LYS A 9 31.466 26.669 33.417 1.00 0.00 O ATOM 136 CB LYS A 9 30.248 23.579 33.277 1.00 0.00 C ATOM 137 CG LYS A 9 31.432 23.540 34.252 1.00 0.00 C ATOM 138 CD LYS A 9 31.762 22.143 34.774 1.00 0.00 C ATOM 139 CE LYS A 9 30.768 21.704 35.849 1.00 0.00 C ATOM 140 NZ LYS A 9 31.332 20.584 36.633 1.00 0.00 N1+ ATOM 0 H LYS A 9 28.385 24.147 31.725 1.00 0.00 H new ATOM 0 HA LYS A 9 29.319 25.449 33.879 1.00 0.00 H new ATOM 0 HB2 LYS A 9 29.416 23.010 33.691 1.00 0.00 H new ATOM 0 HB3 LYS A 9 30.530 23.096 32.341 1.00 0.00 H new ATOM 0 HG2 LYS A 9 32.312 23.948 33.755 1.00 0.00 H new ATOM 0 HG3 LYS A 9 31.214 24.191 35.099 1.00 0.00 H new ATOM 0 HD2 LYS A 9 31.747 21.431 33.949 1.00 0.00 H new ATOM 0 HD3 LYS A 9 32.772 22.135 35.184 1.00 0.00 H new ATOM 0 HE2 LYS A 9 30.540 22.541 36.508 1.00 0.00 H new ATOM 0 HE3 LYS A 9 29.830 21.398 35.385 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 30.650 20.292 37.361 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 31.528 19.782 36.001 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 32.215 20.890 37.089 1.00 0.00 H new ATOM 154 N ILE A 10 31.567 25.648 31.422 1.00 0.00 N ATOM 155 CA ILE A 10 32.790 26.315 30.955 1.00 0.00 C ATOM 156 C ILE A 10 32.665 27.839 31.070 1.00 0.00 C ATOM 157 O ILE A 10 33.533 28.492 31.641 1.00 0.00 O ATOM 158 CB ILE A 10 33.090 25.889 29.506 1.00 0.00 C ATOM 159 CG1 ILE A 10 33.580 24.428 29.476 1.00 0.00 C ATOM 160 CG2 ILE A 10 34.129 26.831 28.871 1.00 0.00 C ATOM 161 CD1 ILE A 10 33.433 23.773 28.103 1.00 0.00 C ATOM 0 H ILE A 10 31.162 25.016 30.732 1.00 0.00 H new ATOM 0 HA ILE A 10 33.622 26.010 31.589 1.00 0.00 H new ATOM 0 HB ILE A 10 32.173 25.957 28.921 1.00 0.00 H new ATOM 0 HG12 ILE A 10 34.627 24.396 29.776 1.00 0.00 H new ATOM 0 HG13 ILE A 10 33.020 23.848 30.210 1.00 0.00 H new ATOM 0 HG21 ILE A 10 34.329 26.515 27.847 1.00 0.00 H new ATOM 0 HG22 ILE A 10 33.742 27.850 28.867 1.00 0.00 H new ATOM 0 HG23 ILE A 10 35.053 26.796 29.448 1.00 0.00 H new ATOM 0 HD11 ILE A 10 33.796 22.746 28.149 1.00 0.00 H new ATOM 0 HD12 ILE A 10 32.383 23.774 27.810 1.00 0.00 H new ATOM 0 HD13 ILE A 10 34.015 24.331 27.370 1.00 0.00 H new ATOM 173 N LEU A 11 31.558 28.390 30.565 1.00 0.00 N ATOM 174 CA LEU A 11 31.239 29.818 30.605 1.00 0.00 C ATOM 175 C LEU A 11 30.996 30.326 32.046 1.00 0.00 C ATOM 176 O LEU A 11 31.165 31.512 32.328 1.00 0.00 O ATOM 177 CB LEU A 11 30.028 30.043 29.666 1.00 0.00 C ATOM 178 CG LEU A 11 30.352 29.924 28.157 1.00 0.00 C ATOM 179 CD1 LEU A 11 29.068 29.989 27.336 1.00 0.00 C ATOM 180 CD2 LEU A 11 31.277 31.040 27.661 1.00 0.00 C ATOM 0 H LEU A 11 30.837 27.836 30.103 1.00 0.00 H new ATOM 0 HA LEU A 11 32.086 30.408 30.255 1.00 0.00 H new ATOM 0 HB2 LEU A 11 29.252 29.319 29.916 1.00 0.00 H new ATOM 0 HB3 LEU A 11 29.615 31.033 29.859 1.00 0.00 H new ATOM 0 HG LEU A 11 30.857 28.967 28.030 1.00 0.00 H new ATOM 0 HD11 LEU A 11 29.309 29.904 26.276 1.00 0.00 H new ATOM 0 HD12 LEU A 11 28.409 29.170 27.625 1.00 0.00 H new ATOM 0 HD13 LEU A 11 28.567 30.939 27.519 1.00 0.00 H new ATOM 0 HD21 LEU A 11 31.470 30.906 26.597 1.00 0.00 H new ATOM 0 HD22 LEU A 11 30.801 32.007 27.825 1.00 0.00 H new ATOM 0 HD23 LEU A 11 32.219 31.002 28.208 1.00 0.00 H new ATOM 192 N ILE A 12 30.665 29.425 32.976 1.00 0.00 N ATOM 193 CA ILE A 12 30.407 29.715 34.399 1.00 0.00 C ATOM 194 C ILE A 12 31.694 29.621 35.247 1.00 0.00 C ATOM 195 O ILE A 12 31.891 30.408 36.170 1.00 0.00 O ATOM 196 CB ILE A 12 29.272 28.808 34.940 1.00 0.00 C ATOM 197 CG1 ILE A 12 27.970 28.976 34.117 1.00 0.00 C ATOM 198 CG2 ILE A 12 28.971 29.118 36.418 1.00 0.00 C ATOM 199 CD1 ILE A 12 26.979 27.818 34.294 1.00 0.00 C ATOM 0 H ILE A 12 30.564 28.434 32.755 1.00 0.00 H new ATOM 0 HA ILE A 12 30.068 30.748 34.481 1.00 0.00 H new ATOM 0 HB ILE A 12 29.621 27.779 34.848 1.00 0.00 H new ATOM 0 HG12 ILE A 12 27.484 29.907 34.408 1.00 0.00 H new ATOM 0 HG13 ILE A 12 28.226 29.066 33.061 1.00 0.00 H new ATOM 0 HG21 ILE A 12 28.171 28.467 36.771 1.00 0.00 H new ATOM 0 HG22 ILE A 12 29.867 28.948 37.015 1.00 0.00 H new ATOM 0 HG23 ILE A 12 28.662 30.159 36.516 1.00 0.00 H new ATOM 0 HD11 ILE A 12 26.091 28.003 33.689 1.00 0.00 H new ATOM 0 HD12 ILE A 12 27.447 26.887 33.976 1.00 0.00 H new ATOM 0 HD13 ILE A 12 26.693 27.741 35.343 1.00 0.00 H new ATOM 211 N MET A 13 32.634 28.741 34.892 1.00 0.00 N ATOM 212 CA MET A 13 33.952 28.633 35.536 1.00 0.00 C ATOM 213 C MET A 13 34.734 29.955 35.487 1.00 0.00 C ATOM 214 O MET A 13 35.387 30.337 36.461 1.00 0.00 O ATOM 215 CB MET A 13 34.772 27.531 34.846 1.00 0.00 C ATOM 216 CG MET A 13 34.273 26.108 35.115 1.00 0.00 C ATOM 217 SD MET A 13 34.531 25.539 36.817 1.00 0.00 S ATOM 218 CE MET A 13 32.867 25.746 37.512 1.00 0.00 C ATOM 0 H MET A 13 32.501 28.070 34.135 1.00 0.00 H new ATOM 0 HA MET A 13 33.785 28.386 36.584 1.00 0.00 H new ATOM 0 HB2 MET A 13 34.764 27.709 33.771 1.00 0.00 H new ATOM 0 HB3 MET A 13 35.809 27.607 35.174 1.00 0.00 H new ATOM 0 HG2 MET A 13 33.209 26.059 34.885 1.00 0.00 H new ATOM 0 HG3 MET A 13 34.778 25.423 34.434 1.00 0.00 H new ATOM 0 HE1 MET A 13 32.942 25.962 38.578 1.00 0.00 H new ATOM 0 HE2 MET A 13 32.363 26.571 37.009 1.00 0.00 H new ATOM 0 HE3 MET A 13 32.296 24.829 37.367 1.00 0.00 H new ATOM 228 N LEU A 14 34.631 30.677 34.367 1.00 0.00 N ATOM 229 CA LEU A 14 35.172 32.031 34.206 1.00 0.00 C ATOM 230 C LEU A 14 34.299 33.136 34.829 1.00 0.00 C ATOM 231 O LEU A 14 34.857 34.142 35.259 1.00 0.00 O ATOM 232 CB LEU A 14 35.556 32.367 32.749 1.00 0.00 C ATOM 233 CG LEU A 14 34.962 31.551 31.575 1.00 0.00 C ATOM 234 CD1 LEU A 14 34.186 32.446 30.614 1.00 0.00 C ATOM 235 CD2 LEU A 14 36.055 30.819 30.807 1.00 0.00 C ATOM 0 H LEU A 14 34.161 30.331 33.531 1.00 0.00 H new ATOM 0 HA LEU A 14 36.096 32.015 34.784 1.00 0.00 H new ATOM 0 HB2 LEU A 14 35.295 33.412 32.580 1.00 0.00 H new ATOM 0 HB3 LEU A 14 36.641 32.293 32.676 1.00 0.00 H new ATOM 0 HG LEU A 14 34.279 30.821 32.009 1.00 0.00 H new ATOM 0 HD11 LEU A 14 33.782 31.843 29.801 1.00 0.00 H new ATOM 0 HD12 LEU A 14 33.368 32.930 31.148 1.00 0.00 H new ATOM 0 HD13 LEU A 14 34.853 33.205 30.205 1.00 0.00 H new ATOM 0 HD21 LEU A 14 35.609 30.254 29.988 1.00 0.00 H new ATOM 0 HD22 LEU A 14 36.764 31.543 30.405 1.00 0.00 H new ATOM 0 HD23 LEU A 14 36.576 30.136 31.478 1.00 0.00 H new ATOM 247 N LYS A 15 32.975 32.957 34.946 1.00 0.00 N ATOM 248 CA LYS A 15 32.093 33.839 35.747 1.00 0.00 C ATOM 249 C LYS A 15 32.559 33.895 37.205 1.00 0.00 C ATOM 250 O LYS A 15 32.685 34.979 37.770 1.00 0.00 O ATOM 251 CB LYS A 15 30.627 33.360 35.620 1.00 0.00 C ATOM 252 CG LYS A 15 29.543 34.201 36.307 1.00 0.00 C ATOM 253 CD LYS A 15 29.426 33.909 37.809 1.00 0.00 C ATOM 254 CE LYS A 15 28.334 34.766 38.443 1.00 0.00 C ATOM 255 NZ LYS A 15 28.250 34.601 39.914 1.00 0.00 N1+ ATOM 0 H LYS A 15 32.477 32.194 34.488 1.00 0.00 H new ATOM 0 HA LYS A 15 32.149 34.857 35.361 1.00 0.00 H new ATOM 0 HB2 LYS A 15 30.384 33.300 34.559 1.00 0.00 H new ATOM 0 HB3 LYS A 15 30.569 32.347 36.018 1.00 0.00 H new ATOM 0 HG2 LYS A 15 29.765 35.259 36.163 1.00 0.00 H new ATOM 0 HG3 LYS A 15 28.583 34.009 35.828 1.00 0.00 H new ATOM 0 HD2 LYS A 15 29.202 32.853 37.963 1.00 0.00 H new ATOM 0 HD3 LYS A 15 30.380 34.107 38.298 1.00 0.00 H new ATOM 0 HE2 LYS A 15 28.521 35.814 38.210 1.00 0.00 H new ATOM 0 HE3 LYS A 15 27.373 34.508 37.998 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 27.492 35.207 40.289 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 28.043 33.607 40.141 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 29.156 34.873 40.346 1.00 0.00 H new ATOM 269 N GLU A 16 32.833 32.733 37.796 1.00 0.00 N ATOM 270 CA GLU A 16 33.344 32.604 39.166 1.00 0.00 C ATOM 271 C GLU A 16 34.787 33.112 39.307 1.00 0.00 C ATOM 272 O GLU A 16 35.066 33.940 40.172 1.00 0.00 O ATOM 273 CB GLU A 16 33.242 31.131 39.602 1.00 0.00 C ATOM 274 CG GLU A 16 31.823 30.755 40.051 1.00 0.00 C ATOM 275 CD GLU A 16 31.608 31.081 41.535 1.00 0.00 C ATOM 276 OE1 GLU A 16 30.997 32.127 41.858 1.00 0.00 O ATOM 277 OE2 GLU A 16 32.077 30.292 42.388 1.00 0.00 O ATOM 0 H GLU A 16 32.705 31.835 37.329 1.00 0.00 H new ATOM 0 HA GLU A 16 32.733 33.230 39.816 1.00 0.00 H new ATOM 0 HB2 GLU A 16 33.542 30.488 38.775 1.00 0.00 H new ATOM 0 HB3 GLU A 16 33.940 30.947 40.418 1.00 0.00 H new ATOM 0 HG2 GLU A 16 31.093 31.294 39.448 1.00 0.00 H new ATOM 0 HG3 GLU A 16 31.654 29.692 39.881 1.00 0.00 H new ATOM 284 N ASN A 17 35.718 32.647 38.466 1.00 0.00 N ATOM 285 CA ASN A 17 37.141 32.990 38.599 1.00 0.00 C ATOM 286 C ASN A 17 37.574 34.299 37.917 1.00 0.00 C ATOM 287 O ASN A 17 38.749 34.671 37.980 1.00 0.00 O ATOM 288 CB ASN A 17 37.999 31.821 38.126 1.00 0.00 C ATOM 289 CG ASN A 17 37.908 30.640 39.066 1.00 0.00 C ATOM 290 OD1 ASN A 17 38.526 30.628 40.118 1.00 0.00 O ATOM 291 ND2 ASN A 17 37.151 29.623 38.727 1.00 0.00 N ATOM 0 H ASN A 17 35.511 32.029 37.682 1.00 0.00 H new ATOM 0 HA ASN A 17 37.297 33.177 39.661 1.00 0.00 H new ATOM 0 HB2 ASN A 17 37.681 31.517 37.129 1.00 0.00 H new ATOM 0 HB3 ASN A 17 39.038 32.142 38.045 1.00 0.00 H new ATOM 0 HD21 ASN A 17 37.076 28.815 39.345 1.00 0.00 H new ATOM 0 HD22 ASN A 17 36.638 29.641 37.846 1.00 0.00 H new ATOM 298 N GLN A 18 36.641 35.017 37.290 1.00 0.00 N ATOM 299 CA GLN A 18 36.861 36.301 36.606 1.00 0.00 C ATOM 300 C GLN A 18 37.744 36.203 35.346 1.00 0.00 C ATOM 301 O GLN A 18 38.172 37.221 34.800 1.00 0.00 O ATOM 302 CB GLN A 18 37.342 37.385 37.597 1.00 0.00 C ATOM 303 CG GLN A 18 36.745 37.222 39.006 1.00 0.00 C ATOM 304 CD GLN A 18 37.030 38.421 39.892 1.00 0.00 C ATOM 305 OE1 GLN A 18 36.428 39.479 39.753 1.00 0.00 O ATOM 306 NE2 GLN A 18 37.942 38.290 40.827 1.00 0.00 N ATOM 0 H GLN A 18 35.669 34.711 37.240 1.00 0.00 H new ATOM 0 HA GLN A 18 35.889 36.612 36.224 1.00 0.00 H new ATOM 0 HB2 GLN A 18 38.429 37.351 37.663 1.00 0.00 H new ATOM 0 HB3 GLN A 18 37.077 38.368 37.208 1.00 0.00 H new ATOM 0 HG2 GLN A 18 35.667 37.078 38.928 1.00 0.00 H new ATOM 0 HG3 GLN A 18 37.153 36.324 39.470 1.00 0.00 H new ATOM 0 HE21 GLN A 18 38.438 37.405 40.935 1.00 0.00 H new ATOM 0 HE22 GLN A 18 38.155 39.073 41.445 1.00 0.00 H new ATOM 315 N CYS A 19 38.012 34.990 34.855 1.00 0.00 N ATOM 316 CA CYS A 19 38.844 34.704 33.680 1.00 0.00 C ATOM 317 C CYS A 19 38.111 34.985 32.349 1.00 0.00 C ATOM 318 O CYS A 19 38.037 34.121 31.480 1.00 0.00 O ATOM 319 CB CYS A 19 39.390 33.267 33.774 1.00 0.00 C ATOM 320 SG CYS A 19 40.292 32.994 35.330 1.00 0.00 S ATOM 0 H CYS A 19 37.639 34.143 35.283 1.00 0.00 H new ATOM 0 HA CYS A 19 39.691 35.390 33.680 1.00 0.00 H new ATOM 0 HB2 CYS A 19 38.565 32.558 33.702 1.00 0.00 H new ATOM 0 HB3 CYS A 19 40.052 33.073 32.930 1.00 0.00 H new ATOM 0 HG CYS A 19 39.696 33.631 36.294 1.00 0.00 H new ATOM 326 N THR A 20 37.515 36.172 32.206 1.00 0.00 N ATOM 327 CA THR A 20 36.681 36.564 31.061 1.00 0.00 C ATOM 328 C THR A 20 36.813 38.060 30.762 1.00 0.00 C ATOM 329 O THR A 20 36.496 38.905 31.598 1.00 0.00 O ATOM 330 CB THR A 20 35.220 36.134 31.277 1.00 0.00 C ATOM 331 OG1 THR A 20 34.413 36.608 30.231 1.00 0.00 O ATOM 332 CG2 THR A 20 34.570 36.564 32.598 1.00 0.00 C ATOM 0 H THR A 20 37.601 36.911 32.904 1.00 0.00 H new ATOM 0 HA THR A 20 37.042 36.038 30.177 1.00 0.00 H new ATOM 0 HB THR A 20 35.279 35.046 31.307 1.00 0.00 H new ATOM 0 HG1 THR A 20 33.486 36.326 30.379 1.00 0.00 H new ATOM 0 HG21 THR A 20 33.542 36.202 32.633 1.00 0.00 H new ATOM 0 HG22 THR A 20 35.131 36.144 33.433 1.00 0.00 H new ATOM 0 HG23 THR A 20 34.574 37.652 32.668 1.00 0.00 H new ATOM 340 N THR A 21 37.375 38.366 29.600 1.00 0.00 N ATOM 341 CA THR A 21 37.544 39.702 28.999 1.00 0.00 C ATOM 342 C THR A 21 38.257 39.556 27.651 1.00 0.00 C ATOM 343 O THR A 21 38.863 38.524 27.374 1.00 0.00 O ATOM 344 CB THR A 21 38.328 40.651 29.941 1.00 0.00 C ATOM 345 OG1 THR A 21 38.507 41.942 29.407 1.00 0.00 O ATOM 346 CG2 THR A 21 39.725 40.147 30.294 1.00 0.00 C ATOM 0 H THR A 21 37.758 37.636 28.999 1.00 0.00 H new ATOM 0 HA THR A 21 36.562 40.148 28.844 1.00 0.00 H new ATOM 0 HB THR A 21 37.697 40.681 30.829 1.00 0.00 H new ATOM 0 HG1 THR A 21 39.005 42.494 30.045 1.00 0.00 H new ATOM 0 HG21 THR A 21 40.213 40.862 30.956 1.00 0.00 H new ATOM 0 HG22 THR A 21 39.648 39.182 30.796 1.00 0.00 H new ATOM 0 HG23 THR A 21 40.313 40.036 29.383 1.00 0.00 H new ATOM 354 N GLU A 22 38.237 40.599 26.802 1.00 0.00 N ATOM 355 CA GLU A 22 39.093 40.680 25.608 1.00 0.00 C ATOM 356 C GLU A 22 40.582 40.880 25.943 1.00 0.00 C ATOM 357 O GLU A 22 41.449 40.612 25.117 1.00 0.00 O ATOM 358 CB GLU A 22 38.617 41.822 24.701 1.00 0.00 C ATOM 359 CG GLU A 22 37.169 41.671 24.217 1.00 0.00 C ATOM 360 CD GLU A 22 36.987 42.452 22.914 1.00 0.00 C ATOM 361 OE1 GLU A 22 36.886 41.814 21.841 1.00 0.00 O ATOM 362 OE2 GLU A 22 37.017 43.703 22.962 1.00 0.00 O ATOM 0 H GLU A 22 37.628 41.408 26.925 1.00 0.00 H new ATOM 0 HA GLU A 22 39.005 39.722 25.096 1.00 0.00 H new ATOM 0 HB2 GLU A 22 38.713 42.765 25.240 1.00 0.00 H new ATOM 0 HB3 GLU A 22 39.275 41.882 23.834 1.00 0.00 H new ATOM 0 HG2 GLU A 22 36.934 40.618 24.059 1.00 0.00 H new ATOM 0 HG3 GLU A 22 36.479 42.041 24.976 1.00 0.00 H new ATOM 369 N LEU A 23 40.892 41.349 27.157 1.00 0.00 N ATOM 370 CA LEU A 23 42.253 41.681 27.593 1.00 0.00 C ATOM 371 C LEU A 23 43.075 40.474 28.096 1.00 0.00 C ATOM 372 O LEU A 23 44.226 40.668 28.500 1.00 0.00 O ATOM 373 CB LEU A 23 42.165 42.787 28.667 1.00 0.00 C ATOM 374 CG LEU A 23 41.468 44.090 28.221 1.00 0.00 C ATOM 375 CD1 LEU A 23 41.454 45.078 29.385 1.00 0.00 C ATOM 376 CD2 LEU A 23 42.176 44.763 27.043 1.00 0.00 C ATOM 0 H LEU A 23 40.189 41.512 27.878 1.00 0.00 H new ATOM 0 HA LEU A 23 42.800 42.033 26.718 1.00 0.00 H new ATOM 0 HB2 LEU A 23 41.634 42.389 29.532 1.00 0.00 H new ATOM 0 HB3 LEU A 23 43.175 43.030 28.997 1.00 0.00 H new ATOM 0 HG LEU A 23 40.460 43.820 27.907 1.00 0.00 H new ATOM 0 HD11 LEU A 23 40.962 46.000 29.074 1.00 0.00 H new ATOM 0 HD12 LEU A 23 40.912 44.643 30.225 1.00 0.00 H new ATOM 0 HD13 LEU A 23 42.478 45.297 29.688 1.00 0.00 H new ATOM 0 HD21 LEU A 23 41.644 45.674 26.771 1.00 0.00 H new ATOM 0 HD22 LEU A 23 43.199 45.011 27.327 1.00 0.00 H new ATOM 0 HD23 LEU A 23 42.191 44.083 26.191 1.00 0.00 H new ATOM 388 N LYS A 24 42.486 39.266 28.143 1.00 0.00 N ATOM 389 CA LYS A 24 43.035 38.050 28.782 1.00 0.00 C ATOM 390 C LYS A 24 42.506 36.785 28.090 1.00 0.00 C ATOM 391 O LYS A 24 41.294 36.578 28.059 1.00 0.00 O ATOM 392 CB LYS A 24 42.642 37.995 30.279 1.00 0.00 C ATOM 393 CG LYS A 24 43.054 39.224 31.112 1.00 0.00 C ATOM 394 CD LYS A 24 42.466 39.191 32.529 1.00 0.00 C ATOM 395 CE LYS A 24 42.567 40.582 33.167 1.00 0.00 C ATOM 396 NZ LYS A 24 43.933 40.864 33.661 1.00 0.00 N1+ ATOM 0 H LYS A 24 41.573 39.100 27.719 1.00 0.00 H new ATOM 0 HA LYS A 24 44.120 38.092 28.688 1.00 0.00 H new ATOM 0 HB2 LYS A 24 41.561 37.874 30.350 1.00 0.00 H new ATOM 0 HB3 LYS A 24 43.092 37.107 30.724 1.00 0.00 H new ATOM 0 HG2 LYS A 24 44.141 39.271 31.173 1.00 0.00 H new ATOM 0 HG3 LYS A 24 42.724 40.131 30.605 1.00 0.00 H new ATOM 0 HD2 LYS A 24 41.424 38.872 32.493 1.00 0.00 H new ATOM 0 HD3 LYS A 24 43.001 38.462 33.138 1.00 0.00 H new ATOM 0 HE2 LYS A 24 42.282 41.338 32.436 1.00 0.00 H new ATOM 0 HE3 LYS A 24 41.860 40.655 33.993 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 43.960 41.813 34.085 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 44.196 40.157 34.377 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 44.605 40.820 32.868 1.00 0.00 H new ATOM 410 N SER A 25 43.387 35.912 27.599 1.00 0.00 N ATOM 411 CA SER A 25 43.002 34.644 26.946 1.00 0.00 C ATOM 412 C SER A 25 43.274 33.456 27.880 1.00 0.00 C ATOM 413 O SER A 25 44.375 33.329 28.420 1.00 0.00 O ATOM 414 CB SER A 25 43.698 34.471 25.582 1.00 0.00 C ATOM 415 OG SER A 25 43.277 35.457 24.650 1.00 0.00 O ATOM 0 H SER A 25 44.396 36.059 27.640 1.00 0.00 H new ATOM 0 HA SER A 25 41.931 34.677 26.747 1.00 0.00 H new ATOM 0 HB2 SER A 25 44.778 34.532 25.714 1.00 0.00 H new ATOM 0 HB3 SER A 25 43.481 33.479 25.186 1.00 0.00 H new ATOM 0 HG SER A 25 43.739 35.319 23.797 1.00 0.00 H new ATOM 421 N PHE A 26 42.263 32.625 28.118 1.00 0.00 N ATOM 422 CA PHE A 26 42.403 31.464 29.005 1.00 0.00 C ATOM 423 C PHE A 26 43.112 30.258 28.376 1.00 0.00 C ATOM 424 O PHE A 26 43.081 30.076 27.159 1.00 0.00 O ATOM 425 CB PHE A 26 41.024 31.031 29.510 1.00 0.00 C ATOM 426 CG PHE A 26 41.026 30.535 30.927 1.00 0.00 C ATOM 427 CD1 PHE A 26 42.206 30.455 31.647 1.00 0.00 C ATOM 428 CD2 PHE A 26 39.846 30.149 31.541 1.00 0.00 C ATOM 429 CE1 PHE A 26 42.210 29.999 32.952 1.00 0.00 C ATOM 430 CE2 PHE A 26 39.843 29.691 32.845 1.00 0.00 C ATOM 431 CZ PHE A 26 41.027 29.616 33.551 1.00 0.00 C ATOM 0 H PHE A 26 41.334 32.731 27.710 1.00 0.00 H new ATOM 0 HA PHE A 26 43.041 31.796 29.824 1.00 0.00 H new ATOM 0 HB2 PHE A 26 40.337 31.874 29.431 1.00 0.00 H new ATOM 0 HB3 PHE A 26 40.640 30.245 28.860 1.00 0.00 H new ATOM 0 HD1 PHE A 26 43.135 30.753 31.183 1.00 0.00 H new ATOM 0 HD2 PHE A 26 38.917 30.207 30.994 1.00 0.00 H new ATOM 0 HE1 PHE A 26 43.138 29.943 33.502 1.00 0.00 H new ATOM 0 HE2 PHE A 26 38.916 29.392 33.311 1.00 0.00 H new ATOM 0 HZ PHE A 26 41.028 29.258 34.570 1.00 0.00 H new ATOM 441 N THR A 27 43.748 29.438 29.215 1.00 0.00 N ATOM 442 CA THR A 27 44.414 28.222 28.727 1.00 0.00 C ATOM 443 C THR A 27 43.494 27.002 28.789 1.00 0.00 C ATOM 444 O THR A 27 42.691 26.844 29.713 1.00 0.00 O ATOM 445 CB THR A 27 45.713 27.923 29.492 1.00 0.00 C ATOM 446 OG1 THR A 27 45.449 27.640 30.845 1.00 0.00 O ATOM 447 CG2 THR A 27 46.721 29.072 29.441 1.00 0.00 C ATOM 0 H THR A 27 43.818 29.587 30.222 1.00 0.00 H new ATOM 0 HA THR A 27 44.665 28.420 27.685 1.00 0.00 H new ATOM 0 HB THR A 27 46.147 27.057 28.992 1.00 0.00 H new ATOM 0 HG1 THR A 27 45.988 26.873 31.130 1.00 0.00 H new ATOM 0 HG21 THR A 27 47.615 28.797 30.000 1.00 0.00 H new ATOM 0 HG22 THR A 27 46.989 29.275 28.404 1.00 0.00 H new ATOM 0 HG23 THR A 27 46.278 29.965 29.882 1.00 0.00 H new ATOM 455 N TYR A 28 43.658 26.075 27.839 1.00 0.00 N ATOM 456 CA TYR A 28 43.035 24.749 27.915 1.00 0.00 C ATOM 457 C TYR A 28 43.523 23.955 29.140 1.00 0.00 C ATOM 458 O TYR A 28 42.735 23.190 29.689 1.00 0.00 O ATOM 459 CB TYR A 28 43.294 23.958 26.618 1.00 0.00 C ATOM 460 CG TYR A 28 42.309 24.109 25.461 1.00 0.00 C ATOM 461 CD1 TYR A 28 41.290 25.088 25.509 1.00 0.00 C ATOM 462 CD2 TYR A 28 42.366 23.231 24.357 1.00 0.00 C ATOM 463 CE1 TYR A 28 40.323 25.153 24.486 1.00 0.00 C ATOM 464 CE2 TYR A 28 41.413 23.306 23.325 1.00 0.00 C ATOM 465 CZ TYR A 28 40.377 24.261 23.396 1.00 0.00 C ATOM 466 OH TYR A 28 39.434 24.321 22.420 1.00 0.00 O ATOM 0 H TYR A 28 44.222 26.221 27.002 1.00 0.00 H new ATOM 0 HA TYR A 28 41.961 24.897 28.030 1.00 0.00 H new ATOM 0 HB2 TYR A 28 44.281 24.238 26.251 1.00 0.00 H new ATOM 0 HB3 TYR A 28 43.339 22.901 26.879 1.00 0.00 H new ATOM 0 HD1 TYR A 28 41.253 25.787 26.331 1.00 0.00 H new ATOM 0 HD2 TYR A 28 43.152 22.492 24.304 1.00 0.00 H new ATOM 0 HE1 TYR A 28 39.536 25.891 24.537 1.00 0.00 H new ATOM 0 HE2 TYR A 28 41.474 22.635 22.481 1.00 0.00 H new ATOM 0 HH TYR A 28 39.560 25.138 21.893 1.00 0.00 H new ATOM 476 N THR A 29 44.763 24.155 29.610 1.00 0.00 N ATOM 477 CA THR A 29 45.299 23.487 30.816 1.00 0.00 C ATOM 478 C THR A 29 44.424 23.759 32.042 1.00 0.00 C ATOM 479 O THR A 29 43.873 22.830 32.635 1.00 0.00 O ATOM 480 CB THR A 29 46.757 23.904 31.114 1.00 0.00 C ATOM 481 OG1 THR A 29 46.896 25.310 31.202 1.00 0.00 O ATOM 482 CG2 THR A 29 47.727 23.424 30.037 1.00 0.00 C ATOM 0 H THR A 29 45.429 24.787 29.166 1.00 0.00 H new ATOM 0 HA THR A 29 45.288 22.418 30.604 1.00 0.00 H new ATOM 0 HB THR A 29 46.997 23.437 32.069 1.00 0.00 H new ATOM 0 HG1 THR A 29 47.831 25.535 31.393 1.00 0.00 H new ATOM 0 HG21 THR A 29 48.738 23.741 30.291 1.00 0.00 H new ATOM 0 HG22 THR A 29 47.693 22.336 29.975 1.00 0.00 H new ATOM 0 HG23 THR A 29 47.443 23.851 29.075 1.00 0.00 H new ATOM 490 N LYS A 30 44.217 25.036 32.379 1.00 0.00 N ATOM 491 CA LYS A 30 43.413 25.441 33.533 1.00 0.00 C ATOM 492 C LYS A 30 41.932 25.122 33.326 1.00 0.00 C ATOM 493 O LYS A 30 41.298 24.621 34.254 1.00 0.00 O ATOM 494 CB LYS A 30 43.663 26.930 33.812 1.00 0.00 C ATOM 495 CG LYS A 30 43.088 27.418 35.149 1.00 0.00 C ATOM 496 CD LYS A 30 43.766 26.818 36.390 1.00 0.00 C ATOM 497 CE LYS A 30 43.264 27.602 37.605 1.00 0.00 C ATOM 498 NZ LYS A 30 44.092 27.394 38.818 1.00 0.00 N1+ ATOM 0 H LYS A 30 44.605 25.821 31.855 1.00 0.00 H new ATOM 0 HA LYS A 30 43.716 24.869 34.410 1.00 0.00 H new ATOM 0 HB2 LYS A 30 44.737 27.116 33.800 1.00 0.00 H new ATOM 0 HB3 LYS A 30 43.228 27.519 33.004 1.00 0.00 H new ATOM 0 HG2 LYS A 30 43.174 28.504 35.193 1.00 0.00 H new ATOM 0 HG3 LYS A 30 42.025 27.181 35.181 1.00 0.00 H new ATOM 0 HD2 LYS A 30 43.522 25.760 36.488 1.00 0.00 H new ATOM 0 HD3 LYS A 30 44.851 26.889 36.308 1.00 0.00 H new ATOM 0 HE2 LYS A 30 43.248 28.664 37.362 1.00 0.00 H new ATOM 0 HE3 LYS A 30 42.237 27.308 37.820 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 43.701 27.951 39.605 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 44.088 26.386 39.072 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 45.068 27.700 38.629 1.00 0.00 H new ATOM 512 N LEU A 31 41.392 25.350 32.121 1.00 0.00 N ATOM 513 CA LEU A 31 39.989 25.050 31.816 1.00 0.00 C ATOM 514 C LEU A 31 39.650 23.557 31.959 1.00 0.00 C ATOM 515 O LEU A 31 38.599 23.256 32.520 1.00 0.00 O ATOM 516 CB LEU A 31 39.609 25.562 30.410 1.00 0.00 C ATOM 517 CG LEU A 31 39.073 27.009 30.368 1.00 0.00 C ATOM 518 CD1 LEU A 31 38.929 27.457 28.913 1.00 0.00 C ATOM 519 CD2 LEU A 31 37.693 27.099 31.029 1.00 0.00 C ATOM 0 H LEU A 31 41.912 25.744 31.337 1.00 0.00 H new ATOM 0 HA LEU A 31 39.392 25.580 32.559 1.00 0.00 H new ATOM 0 HB2 LEU A 31 40.486 25.496 29.766 1.00 0.00 H new ATOM 0 HB3 LEU A 31 38.854 24.898 29.989 1.00 0.00 H new ATOM 0 HG LEU A 31 39.777 27.646 30.904 1.00 0.00 H new ATOM 0 HD11 LEU A 31 38.551 28.479 28.883 1.00 0.00 H new ATOM 0 HD12 LEU A 31 39.901 27.415 28.422 1.00 0.00 H new ATOM 0 HD13 LEU A 31 38.233 26.797 28.396 1.00 0.00 H new ATOM 0 HD21 LEU A 31 37.336 28.128 30.987 1.00 0.00 H new ATOM 0 HD22 LEU A 31 36.994 26.451 30.501 1.00 0.00 H new ATOM 0 HD23 LEU A 31 37.767 26.782 32.069 1.00 0.00 H new ATOM 531 N CYS A 32 40.507 22.626 31.520 1.00 0.00 N ATOM 532 CA CYS A 32 40.245 21.188 31.683 1.00 0.00 C ATOM 533 C CYS A 32 40.202 20.776 33.165 1.00 0.00 C ATOM 534 O CYS A 32 39.264 20.090 33.575 1.00 0.00 O ATOM 535 CB CYS A 32 41.280 20.361 30.904 1.00 0.00 C ATOM 536 SG CYS A 32 41.082 20.613 29.117 1.00 0.00 S ATOM 0 H CYS A 32 41.386 22.841 31.050 1.00 0.00 H new ATOM 0 HA CYS A 32 39.258 20.982 31.269 1.00 0.00 H new ATOM 0 HB2 CYS A 32 42.287 20.648 31.208 1.00 0.00 H new ATOM 0 HB3 CYS A 32 41.164 19.304 31.143 1.00 0.00 H new ATOM 0 HG CYS A 32 41.653 21.728 28.770 1.00 0.00 H new ATOM 542 N ASN A 33 41.151 21.263 33.979 1.00 0.00 N ATOM 543 CA ASN A 33 41.178 21.035 35.429 1.00 0.00 C ATOM 544 C ASN A 33 39.895 21.554 36.112 1.00 0.00 C ATOM 545 O ASN A 33 39.166 20.777 36.735 1.00 0.00 O ATOM 546 CB ASN A 33 42.448 21.679 36.033 1.00 0.00 C ATOM 547 CG ASN A 33 43.720 20.936 35.658 1.00 0.00 C ATOM 548 OD1 ASN A 33 43.716 19.760 35.323 1.00 0.00 O ATOM 549 ND2 ASN A 33 44.845 21.615 35.686 1.00 0.00 N ATOM 0 H ASN A 33 41.929 21.832 33.644 1.00 0.00 H new ATOM 0 HA ASN A 33 41.212 19.961 35.612 1.00 0.00 H new ATOM 0 HB2 ASN A 33 42.523 22.712 35.694 1.00 0.00 H new ATOM 0 HB3 ASN A 33 42.355 21.706 37.119 1.00 0.00 H new ATOM 0 HD21 ASN A 33 45.721 21.161 35.427 1.00 0.00 H new ATOM 0 HD22 ASN A 33 44.842 22.596 35.966 1.00 0.00 H new ATOM 556 N ILE A 34 39.585 22.852 35.987 1.00 0.00 N ATOM 557 CA ILE A 34 38.443 23.455 36.703 1.00 0.00 C ATOM 558 C ILE A 34 37.091 22.972 36.154 1.00 0.00 C ATOM 559 O ILE A 34 36.172 22.714 36.927 1.00 0.00 O ATOM 560 CB ILE A 34 38.540 25.000 36.759 1.00 0.00 C ATOM 561 CG1 ILE A 34 38.235 25.665 35.398 1.00 0.00 C ATOM 562 CG2 ILE A 34 39.901 25.436 37.334 1.00 0.00 C ATOM 563 CD1 ILE A 34 38.515 27.170 35.345 1.00 0.00 C ATOM 0 H ILE A 34 40.104 23.505 35.400 1.00 0.00 H new ATOM 0 HA ILE A 34 38.499 23.104 37.733 1.00 0.00 H new ATOM 0 HB ILE A 34 37.763 25.354 37.437 1.00 0.00 H new ATOM 0 HG12 ILE A 34 38.827 25.172 34.627 1.00 0.00 H new ATOM 0 HG13 ILE A 34 37.187 25.495 35.153 1.00 0.00 H new ATOM 0 HG21 ILE A 34 39.951 26.524 37.366 1.00 0.00 H new ATOM 0 HG22 ILE A 34 40.014 25.038 38.342 1.00 0.00 H new ATOM 0 HG23 ILE A 34 40.702 25.054 36.701 1.00 0.00 H new ATOM 0 HD11 ILE A 34 38.272 27.551 34.353 1.00 0.00 H new ATOM 0 HD12 ILE A 34 37.903 27.680 36.089 1.00 0.00 H new ATOM 0 HD13 ILE A 34 39.569 27.352 35.555 1.00 0.00 H new ATOM 575 N SER A 35 36.964 22.777 34.835 1.00 0.00 N ATOM 576 CA SER A 35 35.725 22.291 34.211 1.00 0.00 C ATOM 577 C SER A 35 35.554 20.762 34.271 1.00 0.00 C ATOM 578 O SER A 35 34.523 20.262 33.814 1.00 0.00 O ATOM 579 CB SER A 35 35.605 22.802 32.772 1.00 0.00 C ATOM 580 OG SER A 35 34.287 22.600 32.307 1.00 0.00 O ATOM 0 H SER A 35 37.717 22.952 34.170 1.00 0.00 H new ATOM 0 HA SER A 35 34.909 22.702 34.805 1.00 0.00 H new ATOM 0 HB2 SER A 35 35.858 23.861 32.729 1.00 0.00 H new ATOM 0 HB3 SER A 35 36.313 22.279 32.129 1.00 0.00 H new ATOM 0 HG SER A 35 33.942 21.753 32.659 1.00 0.00 H new ATOM 586 N LYS A 36 36.529 20.031 34.838 1.00 0.00 N ATOM 587 CA LYS A 36 36.475 18.602 35.155 1.00 0.00 C ATOM 588 C LYS A 36 36.279 17.674 33.937 1.00 0.00 C ATOM 589 O LYS A 36 35.476 16.744 33.987 1.00 0.00 O ATOM 590 CB LYS A 36 35.439 18.415 36.278 1.00 0.00 C ATOM 591 CG LYS A 36 35.781 17.239 37.189 1.00 0.00 C ATOM 592 CD LYS A 36 34.553 16.883 38.037 1.00 0.00 C ATOM 593 CE LYS A 36 34.902 15.983 39.223 1.00 0.00 C ATOM 594 NZ LYS A 36 33.661 15.490 39.864 1.00 0.00 N1+ ATOM 0 H LYS A 36 37.422 20.448 35.100 1.00 0.00 H new ATOM 0 HA LYS A 36 37.454 18.278 35.509 1.00 0.00 H new ATOM 0 HB2 LYS A 36 35.381 19.327 36.872 1.00 0.00 H new ATOM 0 HB3 LYS A 36 34.454 18.257 35.839 1.00 0.00 H new ATOM 0 HG2 LYS A 36 36.088 16.379 36.593 1.00 0.00 H new ATOM 0 HG3 LYS A 36 36.621 17.496 37.834 1.00 0.00 H new ATOM 0 HD2 LYS A 36 34.091 17.799 38.404 1.00 0.00 H new ATOM 0 HD3 LYS A 36 33.815 16.383 37.410 1.00 0.00 H new ATOM 0 HE2 LYS A 36 35.507 15.141 38.886 1.00 0.00 H new ATOM 0 HE3 LYS A 36 35.501 16.536 39.947 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 33.905 14.879 40.669 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 33.099 16.298 40.200 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 33.106 14.946 39.173 1.00 0.00 H new ATOM 608 N LEU A 37 36.981 17.938 32.829 1.00 0.00 N ATOM 609 CA LEU A 37 36.774 17.261 31.546 1.00 0.00 C ATOM 610 C LEU A 37 38.049 17.115 30.691 1.00 0.00 C ATOM 611 O LEU A 37 39.043 17.804 30.907 1.00 0.00 O ATOM 612 CB LEU A 37 35.621 17.971 30.812 1.00 0.00 C ATOM 613 CG LEU A 37 35.776 19.470 30.479 1.00 0.00 C ATOM 614 CD1 LEU A 37 36.705 19.751 29.305 1.00 0.00 C ATOM 615 CD2 LEU A 37 34.409 20.050 30.108 1.00 0.00 C ATOM 0 H LEU A 37 37.721 18.640 32.799 1.00 0.00 H new ATOM 0 HA LEU A 37 36.499 16.224 31.741 1.00 0.00 H new ATOM 0 HB2 LEU A 37 35.446 17.439 29.877 1.00 0.00 H new ATOM 0 HB3 LEU A 37 34.722 17.857 31.417 1.00 0.00 H new ATOM 0 HG LEU A 37 36.205 19.926 31.371 1.00 0.00 H new ATOM 0 HD11 LEU A 37 36.761 20.826 29.134 1.00 0.00 H new ATOM 0 HD12 LEU A 37 37.700 19.367 29.529 1.00 0.00 H new ATOM 0 HD13 LEU A 37 36.320 19.261 28.411 1.00 0.00 H new ATOM 0 HD21 LEU A 37 34.515 21.109 29.872 1.00 0.00 H new ATOM 0 HD22 LEU A 37 34.013 19.523 29.240 1.00 0.00 H new ATOM 0 HD23 LEU A 37 33.724 19.932 30.947 1.00 0.00 H new ATOM 627 N SER A 38 38.012 16.203 29.711 1.00 0.00 N ATOM 628 CA SER A 38 39.123 15.919 28.786 1.00 0.00 C ATOM 629 C SER A 38 39.295 17.007 27.715 1.00 0.00 C ATOM 630 O SER A 38 38.344 17.703 27.357 1.00 0.00 O ATOM 631 CB SER A 38 38.909 14.563 28.095 1.00 0.00 C ATOM 632 OG SER A 38 38.832 13.517 29.043 1.00 0.00 O ATOM 0 H SER A 38 37.190 15.627 29.533 1.00 0.00 H new ATOM 0 HA SER A 38 40.031 15.897 29.389 1.00 0.00 H new ATOM 0 HB2 SER A 38 37.993 14.592 27.505 1.00 0.00 H new ATOM 0 HB3 SER A 38 39.728 14.371 27.402 1.00 0.00 H new ATOM 0 HG SER A 38 38.694 12.665 28.579 1.00 0.00 H new ATOM 638 N MET A 39 40.492 17.114 27.117 1.00 0.00 N ATOM 639 CA MET A 39 40.746 18.095 26.044 1.00 0.00 C ATOM 640 C MET A 39 39.903 17.848 24.775 1.00 0.00 C ATOM 641 O MET A 39 39.555 18.794 24.072 1.00 0.00 O ATOM 642 CB MET A 39 42.250 18.183 25.726 1.00 0.00 C ATOM 643 CG MET A 39 42.813 17.002 24.922 1.00 0.00 C ATOM 644 SD MET A 39 44.556 17.181 24.446 1.00 0.00 S ATOM 645 CE MET A 39 45.382 16.750 26.004 1.00 0.00 C ATOM 0 H MET A 39 41.298 16.537 27.356 1.00 0.00 H new ATOM 0 HA MET A 39 40.420 19.063 26.425 1.00 0.00 H new ATOM 0 HB2 MET A 39 42.436 19.102 25.171 1.00 0.00 H new ATOM 0 HB3 MET A 39 42.800 18.260 26.664 1.00 0.00 H new ATOM 0 HG2 MET A 39 42.702 16.092 25.511 1.00 0.00 H new ATOM 0 HG3 MET A 39 42.214 16.874 24.020 1.00 0.00 H new ATOM 0 HE1 MET A 39 46.462 16.814 25.873 1.00 0.00 H new ATOM 0 HE2 MET A 39 45.070 17.443 26.785 1.00 0.00 H new ATOM 0 HE3 MET A 39 45.111 15.734 26.291 1.00 0.00 H new ATOM 655 N SER A 40 39.510 16.600 24.508 1.00 0.00 N ATOM 656 CA SER A 40 38.514 16.235 23.488 1.00 0.00 C ATOM 657 C SER A 40 37.139 16.851 23.791 1.00 0.00 C ATOM 658 O SER A 40 36.521 17.474 22.926 1.00 0.00 O ATOM 659 CB SER A 40 38.424 14.701 23.435 1.00 0.00 C ATOM 660 OG SER A 40 38.273 14.170 24.745 1.00 0.00 O ATOM 0 H SER A 40 39.883 15.792 25.006 1.00 0.00 H new ATOM 0 HA SER A 40 38.826 16.629 22.521 1.00 0.00 H new ATOM 0 HB2 SER A 40 37.580 14.401 22.814 1.00 0.00 H new ATOM 0 HB3 SER A 40 39.322 14.293 22.971 1.00 0.00 H new ATOM 0 HG SER A 40 38.215 13.193 24.697 1.00 0.00 H new ATOM 666 N THR A 41 36.690 16.767 25.045 1.00 0.00 N ATOM 667 CA THR A 41 35.448 17.384 25.525 1.00 0.00 C ATOM 668 C THR A 41 35.509 18.913 25.443 1.00 0.00 C ATOM 669 O THR A 41 34.559 19.536 24.966 1.00 0.00 O ATOM 670 CB THR A 41 35.156 16.977 26.979 1.00 0.00 C ATOM 671 OG1 THR A 41 35.208 15.579 27.162 1.00 0.00 O ATOM 672 CG2 THR A 41 33.777 17.443 27.441 1.00 0.00 C ATOM 0 H THR A 41 37.190 16.257 25.773 1.00 0.00 H new ATOM 0 HA THR A 41 34.649 17.025 24.877 1.00 0.00 H new ATOM 0 HB THR A 41 35.934 17.461 27.569 1.00 0.00 H new ATOM 0 HG1 THR A 41 35.018 15.364 28.099 1.00 0.00 H new ATOM 0 HG21 THR A 41 33.615 17.133 28.473 1.00 0.00 H new ATOM 0 HG22 THR A 41 33.719 18.529 27.375 1.00 0.00 H new ATOM 0 HG23 THR A 41 33.011 17.000 26.805 1.00 0.00 H new ATOM 680 N VAL A 42 36.623 19.539 25.858 1.00 0.00 N ATOM 681 CA VAL A 42 36.752 21.006 25.790 1.00 0.00 C ATOM 682 C VAL A 42 36.785 21.499 24.342 1.00 0.00 C ATOM 683 O VAL A 42 36.146 22.506 24.052 1.00 0.00 O ATOM 684 CB VAL A 42 37.917 21.561 26.645 1.00 0.00 C ATOM 685 CG1 VAL A 42 39.315 21.403 26.041 1.00 0.00 C ATOM 686 CG2 VAL A 42 37.711 23.062 26.895 1.00 0.00 C ATOM 0 H VAL A 42 37.439 19.060 26.240 1.00 0.00 H new ATOM 0 HA VAL A 42 35.852 21.418 26.246 1.00 0.00 H new ATOM 0 HB VAL A 42 37.886 20.962 27.555 1.00 0.00 H new ATOM 0 HG11 VAL A 42 40.055 21.825 26.721 1.00 0.00 H new ATOM 0 HG12 VAL A 42 39.527 20.345 25.885 1.00 0.00 H new ATOM 0 HG13 VAL A 42 39.360 21.926 25.086 1.00 0.00 H new ATOM 0 HG21 VAL A 42 38.534 23.447 27.497 1.00 0.00 H new ATOM 0 HG22 VAL A 42 37.682 23.589 25.941 1.00 0.00 H new ATOM 0 HG23 VAL A 42 36.771 23.217 27.424 1.00 0.00 H new ATOM 696 N ARG A 43 37.431 20.766 23.418 1.00 0.00 N ATOM 697 CA ARG A 43 37.427 21.067 21.973 1.00 0.00 C ATOM 698 C ARG A 43 36.010 21.106 21.399 1.00 0.00 C ATOM 699 O ARG A 43 35.664 22.093 20.752 1.00 0.00 O ATOM 700 CB ARG A 43 38.303 20.050 21.214 1.00 0.00 C ATOM 701 CG ARG A 43 39.806 20.322 21.380 1.00 0.00 C ATOM 702 CD ARG A 43 40.666 19.329 20.577 1.00 0.00 C ATOM 703 NE ARG A 43 42.112 19.536 20.785 1.00 0.00 N ATOM 704 CZ ARG A 43 43.106 18.787 20.331 1.00 0.00 C ATOM 705 NH1 ARG A 43 42.856 17.718 19.631 1.00 0.00 N ATOM 706 NH2 ARG A 43 44.338 19.126 20.559 1.00 0.00 N ATOM 0 H ARG A 43 37.977 19.938 23.655 1.00 0.00 H new ATOM 0 HA ARG A 43 37.850 22.063 21.841 1.00 0.00 H new ATOM 0 HB2 ARG A 43 38.078 19.045 21.571 1.00 0.00 H new ATOM 0 HB3 ARG A 43 38.048 20.076 20.155 1.00 0.00 H new ATOM 0 HG2 ARG A 43 40.028 21.339 21.055 1.00 0.00 H new ATOM 0 HG3 ARG A 43 40.071 20.260 22.435 1.00 0.00 H new ATOM 0 HD2 ARG A 43 40.403 18.311 20.864 1.00 0.00 H new ATOM 0 HD3 ARG A 43 40.437 19.430 19.516 1.00 0.00 H new ATOM 0 HE ARG A 43 42.377 20.349 21.342 1.00 0.00 H new ATOM 0 HH11 ARG A 43 41.891 17.454 19.430 1.00 0.00 H new ATOM 0 HH12 ARG A 43 43.625 17.145 19.284 1.00 0.00 H new ATOM 0 HH21 ARG A 43 44.544 19.972 21.090 1.00 0.00 H new ATOM 0 HH22 ARG A 43 45.100 18.546 20.207 1.00 0.00 H new ATOM 720 N ARG A 44 35.171 20.100 21.686 1.00 0.00 N ATOM 721 CA ARG A 44 33.746 20.080 21.288 1.00 0.00 C ATOM 722 C ARG A 44 33.001 21.325 21.782 1.00 0.00 C ATOM 723 O ARG A 44 32.405 22.041 20.976 1.00 0.00 O ATOM 724 CB ARG A 44 33.074 18.785 21.796 1.00 0.00 C ATOM 725 CG ARG A 44 33.280 17.579 20.860 1.00 0.00 C ATOM 726 CD ARG A 44 32.222 17.509 19.741 1.00 0.00 C ATOM 727 NE ARG A 44 30.907 17.035 20.232 1.00 0.00 N ATOM 728 CZ ARG A 44 30.504 15.784 20.373 1.00 0.00 C ATOM 729 NH1 ARG A 44 31.300 14.800 20.073 1.00 0.00 N ATOM 730 NH2 ARG A 44 29.311 15.525 20.825 1.00 0.00 N ATOM 0 H ARG A 44 35.459 19.270 22.204 1.00 0.00 H new ATOM 0 HA ARG A 44 33.696 20.095 20.199 1.00 0.00 H new ATOM 0 HB2 ARG A 44 33.470 18.542 22.782 1.00 0.00 H new ATOM 0 HB3 ARG A 44 32.005 18.963 21.917 1.00 0.00 H new ATOM 0 HG2 ARG A 44 34.273 17.636 20.413 1.00 0.00 H new ATOM 0 HG3 ARG A 44 33.246 16.660 21.445 1.00 0.00 H new ATOM 0 HD2 ARG A 44 32.105 18.496 19.294 1.00 0.00 H new ATOM 0 HD3 ARG A 44 32.574 16.842 18.954 1.00 0.00 H new ATOM 0 HE ARG A 44 30.235 17.757 20.491 1.00 0.00 H new ATOM 0 HH11 ARG A 44 32.240 14.992 19.727 1.00 0.00 H new ATOM 0 HH12 ARG A 44 30.984 13.837 20.184 1.00 0.00 H new ATOM 0 HH21 ARG A 44 28.682 16.289 21.072 1.00 0.00 H new ATOM 0 HH22 ARG A 44 29.005 14.558 20.932 1.00 0.00 H new ATOM 744 N SER A 45 33.058 21.610 23.083 1.00 0.00 N ATOM 745 CA SER A 45 32.258 22.687 23.681 1.00 0.00 C ATOM 746 C SER A 45 32.780 24.096 23.356 1.00 0.00 C ATOM 747 O SER A 45 31.981 24.949 22.979 1.00 0.00 O ATOM 748 CB SER A 45 32.112 22.471 25.190 1.00 0.00 C ATOM 749 OG SER A 45 31.593 21.178 25.435 1.00 0.00 O ATOM 0 H SER A 45 33.650 21.111 23.747 1.00 0.00 H new ATOM 0 HA SER A 45 31.271 22.634 23.222 1.00 0.00 H new ATOM 0 HB2 SER A 45 33.079 22.585 25.679 1.00 0.00 H new ATOM 0 HB3 SER A 45 31.450 23.226 25.614 1.00 0.00 H new ATOM 0 HG SER A 45 31.501 21.040 26.401 1.00 0.00 H new ATOM 755 N ILE A 46 34.094 24.363 23.410 1.00 0.00 N ATOM 756 CA ILE A 46 34.660 25.661 22.982 1.00 0.00 C ATOM 757 C ILE A 46 34.425 25.915 21.486 1.00 0.00 C ATOM 758 O ILE A 46 34.149 27.061 21.134 1.00 0.00 O ATOM 759 CB ILE A 46 36.151 25.800 23.400 1.00 0.00 C ATOM 760 CG1 ILE A 46 36.305 25.942 24.937 1.00 0.00 C ATOM 761 CG2 ILE A 46 36.922 26.933 22.706 1.00 0.00 C ATOM 762 CD1 ILE A 46 35.914 27.279 25.568 1.00 0.00 C ATOM 0 H ILE A 46 34.790 23.698 23.746 1.00 0.00 H new ATOM 0 HA ILE A 46 34.124 26.450 23.509 1.00 0.00 H new ATOM 0 HB ILE A 46 36.602 24.868 23.060 1.00 0.00 H new ATOM 0 HG12 ILE A 46 35.708 25.161 25.408 1.00 0.00 H new ATOM 0 HG13 ILE A 46 37.346 25.743 25.190 1.00 0.00 H new ATOM 0 HG21 ILE A 46 37.951 26.946 23.065 1.00 0.00 H new ATOM 0 HG22 ILE A 46 36.916 26.770 21.628 1.00 0.00 H new ATOM 0 HG23 ILE A 46 36.447 27.888 22.931 1.00 0.00 H new ATOM 0 HD11 ILE A 46 36.073 27.233 26.645 1.00 0.00 H new ATOM 0 HD12 ILE A 46 36.527 28.075 25.144 1.00 0.00 H new ATOM 0 HD13 ILE A 46 34.863 27.483 25.365 1.00 0.00 H new ATOM 774 N LYS A 47 34.432 24.893 20.610 1.00 0.00 N ATOM 775 CA LYS A 47 34.107 25.090 19.184 1.00 0.00 C ATOM 776 C LYS A 47 32.657 25.542 19.017 1.00 0.00 C ATOM 777 O LYS A 47 32.403 26.547 18.358 1.00 0.00 O ATOM 778 CB LYS A 47 34.404 23.822 18.360 1.00 0.00 C ATOM 779 CG LYS A 47 34.147 24.087 16.867 1.00 0.00 C ATOM 780 CD LYS A 47 34.437 22.875 15.980 1.00 0.00 C ATOM 781 CE LYS A 47 34.142 23.285 14.534 1.00 0.00 C ATOM 782 NZ LYS A 47 34.354 22.177 13.580 1.00 0.00 N1+ ATOM 0 H LYS A 47 34.657 23.930 20.861 1.00 0.00 H new ATOM 0 HA LYS A 47 34.749 25.881 18.798 1.00 0.00 H new ATOM 0 HB2 LYS A 47 35.440 23.516 18.510 1.00 0.00 H new ATOM 0 HB3 LYS A 47 33.776 23.000 18.704 1.00 0.00 H new ATOM 0 HG2 LYS A 47 33.108 24.387 16.732 1.00 0.00 H new ATOM 0 HG3 LYS A 47 34.766 24.923 16.542 1.00 0.00 H new ATOM 0 HD2 LYS A 47 35.476 22.562 16.086 1.00 0.00 H new ATOM 0 HD3 LYS A 47 33.817 22.028 16.273 1.00 0.00 H new ATOM 0 HE2 LYS A 47 33.111 23.632 14.461 1.00 0.00 H new ATOM 0 HE3 LYS A 47 34.781 24.124 14.260 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 34.142 22.504 12.616 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 35.344 21.862 13.629 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 33.726 21.385 13.823 1.00 0.00 H new ATOM 796 N LYS A 48 31.720 24.870 19.688 1.00 0.00 N ATOM 797 CA LYS A 48 30.315 25.295 19.739 1.00 0.00 C ATOM 798 C LYS A 48 30.137 26.685 20.364 1.00 0.00 C ATOM 799 O LYS A 48 29.262 27.429 19.931 1.00 0.00 O ATOM 800 CB LYS A 48 29.497 24.205 20.445 1.00 0.00 C ATOM 801 CG LYS A 48 29.146 23.090 19.451 1.00 0.00 C ATOM 802 CD LYS A 48 28.187 22.069 20.074 1.00 0.00 C ATOM 803 CE LYS A 48 27.788 20.995 19.059 1.00 0.00 C ATOM 804 NZ LYS A 48 26.889 21.512 18.000 1.00 0.00 N1+ ATOM 0 H LYS A 48 31.911 24.016 20.212 1.00 0.00 H new ATOM 0 HA LYS A 48 29.939 25.409 18.722 1.00 0.00 H new ATOM 0 HB2 LYS A 48 30.065 23.795 21.280 1.00 0.00 H new ATOM 0 HB3 LYS A 48 28.585 24.634 20.861 1.00 0.00 H new ATOM 0 HG2 LYS A 48 28.690 23.524 18.561 1.00 0.00 H new ATOM 0 HG3 LYS A 48 30.058 22.587 19.129 1.00 0.00 H new ATOM 0 HD2 LYS A 48 28.661 21.600 20.937 1.00 0.00 H new ATOM 0 HD3 LYS A 48 27.295 22.579 20.438 1.00 0.00 H new ATOM 0 HE2 LYS A 48 28.687 20.585 18.598 1.00 0.00 H new ATOM 0 HE3 LYS A 48 27.294 20.175 19.580 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 26.570 20.724 17.401 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 26.065 21.970 18.438 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 27.401 22.205 17.417 1.00 0.00 H new ATOM 818 N PHE A 49 30.992 27.099 21.301 1.00 0.00 N ATOM 819 CA PHE A 49 31.019 28.478 21.807 1.00 0.00 C ATOM 820 C PHE A 49 31.661 29.524 20.866 1.00 0.00 C ATOM 821 O PHE A 49 31.441 30.713 21.099 1.00 0.00 O ATOM 822 CB PHE A 49 31.561 28.533 23.246 1.00 0.00 C ATOM 823 CG PHE A 49 30.760 27.757 24.290 1.00 0.00 C ATOM 824 CD1 PHE A 49 29.348 27.809 24.308 1.00 0.00 C ATOM 825 CD2 PHE A 49 31.429 27.014 25.284 1.00 0.00 C ATOM 826 CE1 PHE A 49 28.621 27.077 25.262 1.00 0.00 C ATOM 827 CE2 PHE A 49 30.700 26.284 26.241 1.00 0.00 C ATOM 828 CZ PHE A 49 29.295 26.287 26.208 1.00 0.00 C ATOM 0 H PHE A 49 31.687 26.489 21.732 1.00 0.00 H new ATOM 0 HA PHE A 49 29.976 28.793 21.832 1.00 0.00 H new ATOM 0 HB2 PHE A 49 32.583 28.153 23.244 1.00 0.00 H new ATOM 0 HB3 PHE A 49 31.610 29.577 23.556 1.00 0.00 H new ATOM 0 HD1 PHE A 49 28.824 28.415 23.584 1.00 0.00 H new ATOM 0 HD2 PHE A 49 32.509 27.005 25.311 1.00 0.00 H new ATOM 0 HE1 PHE A 49 27.542 27.122 25.268 1.00 0.00 H new ATOM 0 HE2 PHE A 49 31.221 25.721 27.001 1.00 0.00 H new ATOM 0 HZ PHE A 49 28.735 25.684 26.908 1.00 0.00 H new ATOM 838 N LEU A 50 32.364 29.128 19.790 1.00 0.00 N ATOM 839 CA LEU A 50 32.668 30.017 18.652 1.00 0.00 C ATOM 840 C LEU A 50 31.404 30.293 17.821 1.00 0.00 C ATOM 841 O LEU A 50 31.147 31.433 17.440 1.00 0.00 O ATOM 842 CB LEU A 50 33.742 29.431 17.716 1.00 0.00 C ATOM 843 CG LEU A 50 35.107 29.107 18.344 1.00 0.00 C ATOM 844 CD1 LEU A 50 36.012 28.522 17.267 1.00 0.00 C ATOM 845 CD2 LEU A 50 35.813 30.342 18.897 1.00 0.00 C ATOM 0 H LEU A 50 32.737 28.185 19.684 1.00 0.00 H new ATOM 0 HA LEU A 50 33.049 30.942 19.086 1.00 0.00 H new ATOM 0 HB2 LEU A 50 33.346 28.517 17.275 1.00 0.00 H new ATOM 0 HB3 LEU A 50 33.902 30.135 16.900 1.00 0.00 H new ATOM 0 HG LEU A 50 34.923 28.414 19.165 1.00 0.00 H new ATOM 0 HD11 LEU A 50 36.985 28.287 17.698 1.00 0.00 H new ATOM 0 HD12 LEU A 50 35.562 27.613 16.868 1.00 0.00 H new ATOM 0 HD13 LEU A 50 36.137 29.247 16.463 1.00 0.00 H new ATOM 0 HD21 LEU A 50 36.771 30.051 19.328 1.00 0.00 H new ATOM 0 HD22 LEU A 50 35.979 31.057 18.092 1.00 0.00 H new ATOM 0 HD23 LEU A 50 35.193 30.801 19.667 1.00 0.00 H new ATOM 857 N GLU A 51 30.598 29.260 17.552 1.00 0.00 N ATOM 858 CA GLU A 51 29.330 29.384 16.813 1.00 0.00 C ATOM 859 C GLU A 51 28.301 30.209 17.608 1.00 0.00 C ATOM 860 O GLU A 51 27.712 31.150 17.069 1.00 0.00 O ATOM 861 CB GLU A 51 28.777 27.990 16.463 1.00 0.00 C ATOM 862 CG GLU A 51 29.660 27.241 15.450 1.00 0.00 C ATOM 863 CD GLU A 51 29.257 25.766 15.307 1.00 0.00 C ATOM 864 OE1 GLU A 51 28.955 25.316 14.175 1.00 0.00 O ATOM 865 OE2 GLU A 51 29.275 25.036 16.320 1.00 0.00 O ATOM 0 H GLU A 51 30.806 28.305 17.842 1.00 0.00 H new ATOM 0 HA GLU A 51 29.526 29.918 15.883 1.00 0.00 H new ATOM 0 HB2 GLU A 51 28.693 27.397 17.374 1.00 0.00 H new ATOM 0 HB3 GLU A 51 27.771 28.094 16.056 1.00 0.00 H new ATOM 0 HG2 GLU A 51 29.591 27.730 14.479 1.00 0.00 H new ATOM 0 HG3 GLU A 51 30.702 27.302 15.764 1.00 0.00 H new ATOM 872 N LEU A 52 28.187 29.936 18.916 1.00 0.00 N ATOM 873 CA LEU A 52 27.484 30.744 19.930 1.00 0.00 C ATOM 874 C LEU A 52 28.166 32.102 20.228 1.00 0.00 C ATOM 875 O LEU A 52 27.720 32.825 21.114 1.00 0.00 O ATOM 876 CB LEU A 52 27.302 29.906 21.213 1.00 0.00 C ATOM 877 CG LEU A 52 25.978 29.134 21.284 1.00 0.00 C ATOM 878 CD1 LEU A 52 25.770 28.140 20.140 1.00 0.00 C ATOM 879 CD2 LEU A 52 25.927 28.349 22.591 1.00 0.00 C ATOM 0 H LEU A 52 28.606 29.098 19.320 1.00 0.00 H new ATOM 0 HA LEU A 52 26.509 31.005 19.519 1.00 0.00 H new ATOM 0 HB2 LEU A 52 28.126 29.197 21.289 1.00 0.00 H new ATOM 0 HB3 LEU A 52 27.370 30.567 22.077 1.00 0.00 H new ATOM 0 HG LEU A 52 25.191 29.885 21.213 1.00 0.00 H new ATOM 0 HD11 LEU A 52 24.811 27.637 20.265 1.00 0.00 H new ATOM 0 HD12 LEU A 52 25.779 28.673 19.189 1.00 0.00 H new ATOM 0 HD13 LEU A 52 26.572 27.401 20.150 1.00 0.00 H new ATOM 0 HD21 LEU A 52 24.988 27.798 22.648 1.00 0.00 H new ATOM 0 HD22 LEU A 52 26.762 27.649 22.628 1.00 0.00 H new ATOM 0 HD23 LEU A 52 25.995 29.039 23.432 1.00 0.00 H new ATOM 891 N GLN A 53 29.220 32.473 19.493 1.00 0.00 N ATOM 892 CA GLN A 53 29.907 33.775 19.493 1.00 0.00 C ATOM 893 C GLN A 53 30.671 34.179 20.773 1.00 0.00 C ATOM 894 O GLN A 53 31.532 35.060 20.686 1.00 0.00 O ATOM 895 CB GLN A 53 28.933 34.905 19.089 1.00 0.00 C ATOM 896 CG GLN A 53 27.965 34.590 17.933 1.00 0.00 C ATOM 897 CD GLN A 53 27.056 35.777 17.635 1.00 0.00 C ATOM 898 OE1 GLN A 53 27.490 36.920 17.563 1.00 0.00 O ATOM 899 NE2 GLN A 53 25.772 35.578 17.447 1.00 0.00 N ATOM 0 H GLN A 53 29.649 31.825 18.833 1.00 0.00 H new ATOM 0 HA GLN A 53 30.694 33.634 18.752 1.00 0.00 H new ATOM 0 HB2 GLN A 53 28.343 35.178 19.964 1.00 0.00 H new ATOM 0 HB3 GLN A 53 29.520 35.781 18.814 1.00 0.00 H new ATOM 0 HG2 GLN A 53 28.533 34.331 17.040 1.00 0.00 H new ATOM 0 HG3 GLN A 53 27.360 33.720 18.189 1.00 0.00 H new ATOM 0 HE21 GLN A 53 25.389 34.634 17.502 1.00 0.00 H new ATOM 0 HE22 GLN A 53 25.158 36.367 17.246 1.00 0.00 H new ATOM 908 N TYR A 54 30.360 33.602 21.940 1.00 0.00 N ATOM 909 CA TYR A 54 30.808 34.087 23.254 1.00 0.00 C ATOM 910 C TYR A 54 32.328 34.041 23.471 1.00 0.00 C ATOM 911 O TYR A 54 32.890 35.016 23.981 1.00 0.00 O ATOM 912 CB TYR A 54 30.119 33.290 24.373 1.00 0.00 C ATOM 913 CG TYR A 54 28.605 33.342 24.341 1.00 0.00 C ATOM 914 CD1 TYR A 54 27.946 34.585 24.373 1.00 0.00 C ATOM 915 CD2 TYR A 54 27.856 32.151 24.259 1.00 0.00 C ATOM 916 CE1 TYR A 54 26.543 34.648 24.293 1.00 0.00 C ATOM 917 CE2 TYR A 54 26.455 32.209 24.136 1.00 0.00 C ATOM 918 CZ TYR A 54 25.803 33.458 24.126 1.00 0.00 C ATOM 919 OH TYR A 54 24.460 33.517 23.947 1.00 0.00 O ATOM 0 H TYR A 54 29.777 32.767 22.000 1.00 0.00 H new ATOM 0 HA TYR A 54 30.525 35.139 23.283 1.00 0.00 H new ATOM 0 HB2 TYR A 54 30.436 32.249 24.308 1.00 0.00 H new ATOM 0 HB3 TYR A 54 30.463 33.668 25.336 1.00 0.00 H new ATOM 0 HD1 TYR A 54 28.520 35.495 24.459 1.00 0.00 H new ATOM 0 HD2 TYR A 54 28.357 31.195 24.291 1.00 0.00 H new ATOM 0 HE1 TYR A 54 26.036 35.599 24.359 1.00 0.00 H new ATOM 0 HE2 TYR A 54 25.881 31.298 24.049 1.00 0.00 H new ATOM 0 HH TYR A 54 24.103 32.610 23.847 1.00 0.00 H new ATOM 929 N VAL A 55 32.979 32.928 23.113 1.00 0.00 N ATOM 930 CA VAL A 55 34.446 32.762 23.180 1.00 0.00 C ATOM 931 C VAL A 55 35.043 33.042 21.797 1.00 0.00 C ATOM 932 O VAL A 55 34.387 32.767 20.796 1.00 0.00 O ATOM 933 CB VAL A 55 34.877 31.374 23.729 1.00 0.00 C ATOM 934 CG1 VAL A 55 34.433 31.175 25.185 1.00 0.00 C ATOM 935 CG2 VAL A 55 34.373 30.212 22.868 1.00 0.00 C ATOM 0 H VAL A 55 32.498 32.100 22.762 1.00 0.00 H new ATOM 0 HA VAL A 55 34.838 33.483 23.897 1.00 0.00 H new ATOM 0 HB VAL A 55 35.966 31.368 23.689 1.00 0.00 H new ATOM 0 HG11 VAL A 55 34.753 30.193 25.532 1.00 0.00 H new ATOM 0 HG12 VAL A 55 34.883 31.945 25.811 1.00 0.00 H new ATOM 0 HG13 VAL A 55 33.347 31.245 25.247 1.00 0.00 H new ATOM 0 HG21 VAL A 55 34.705 29.268 23.300 1.00 0.00 H new ATOM 0 HG22 VAL A 55 33.284 30.232 22.832 1.00 0.00 H new ATOM 0 HG23 VAL A 55 34.771 30.308 21.858 1.00 0.00 H new ATOM 945 N LYS A 56 36.280 33.547 21.722 1.00 0.00 N ATOM 946 CA LYS A 56 37.041 33.720 20.468 1.00 0.00 C ATOM 947 C LYS A 56 38.405 33.047 20.560 1.00 0.00 C ATOM 948 O LYS A 56 39.064 33.077 21.594 1.00 0.00 O ATOM 949 CB LYS A 56 37.194 35.209 20.091 1.00 0.00 C ATOM 950 CG LYS A 56 36.046 35.783 19.244 1.00 0.00 C ATOM 951 CD LYS A 56 36.257 37.264 18.933 1.00 0.00 C ATOM 952 CE LYS A 56 35.213 37.809 17.964 1.00 0.00 C ATOM 953 NZ LYS A 56 35.442 39.246 17.712 1.00 0.00 N1+ ATOM 0 H LYS A 56 36.796 33.855 22.546 1.00 0.00 H new ATOM 0 HA LYS A 56 36.470 33.236 19.675 1.00 0.00 H new ATOM 0 HB2 LYS A 56 37.278 35.794 21.007 1.00 0.00 H new ATOM 0 HB3 LYS A 56 38.128 35.336 19.544 1.00 0.00 H new ATOM 0 HG2 LYS A 56 35.967 35.223 18.312 1.00 0.00 H new ATOM 0 HG3 LYS A 56 35.103 35.654 19.775 1.00 0.00 H new ATOM 0 HD2 LYS A 56 36.222 37.836 19.860 1.00 0.00 H new ATOM 0 HD3 LYS A 56 37.251 37.405 18.509 1.00 0.00 H new ATOM 0 HE2 LYS A 56 35.257 37.257 17.025 1.00 0.00 H new ATOM 0 HE3 LYS A 56 34.214 37.660 18.375 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 34.723 39.601 17.050 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 35.377 39.770 18.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 36.387 39.380 17.300 1.00 0.00 H new ATOM 967 N GLU A 57 38.807 32.435 19.454 1.00 0.00 N ATOM 968 CA GLU A 57 40.075 31.711 19.292 1.00 0.00 C ATOM 969 C GLU A 57 41.288 32.621 19.043 1.00 0.00 C ATOM 970 O GLU A 57 41.169 33.722 18.504 1.00 0.00 O ATOM 971 CB GLU A 57 39.942 30.669 18.163 1.00 0.00 C ATOM 972 CG GLU A 57 39.379 31.239 16.853 1.00 0.00 C ATOM 973 CD GLU A 57 39.445 30.269 15.661 1.00 0.00 C ATOM 974 OE1 GLU A 57 40.064 29.190 15.756 1.00 0.00 O ATOM 975 OE2 GLU A 57 38.876 30.613 14.597 1.00 0.00 O ATOM 0 H GLU A 57 38.240 32.425 18.606 1.00 0.00 H new ATOM 0 HA GLU A 57 40.269 31.215 20.243 1.00 0.00 H new ATOM 0 HB2 GLU A 57 40.922 30.233 17.967 1.00 0.00 H new ATOM 0 HB3 GLU A 57 39.296 29.860 18.503 1.00 0.00 H new ATOM 0 HG2 GLU A 57 38.341 31.529 17.013 1.00 0.00 H new ATOM 0 HG3 GLU A 57 39.928 32.146 16.599 1.00 0.00 H new ATOM 982 N GLY A 58 42.468 32.106 19.375 1.00 0.00 N ATOM 983 CA GLY A 58 43.707 32.840 19.194 1.00 0.00 C ATOM 984 C GLY A 58 44.688 32.053 18.338 1.00 0.00 C ATOM 985 O GLY A 58 44.684 30.822 18.362 1.00 0.00 O ATOM 0 H GLY A 58 42.588 31.175 19.774 1.00 0.00 H new ATOM 0 HA2 GLY A 58 43.499 33.801 18.724 1.00 0.00 H new ATOM 0 HA3 GLY A 58 44.154 33.050 20.165 1.00 0.00 H new ATOM 989 N CYS A 59 45.531 32.754 17.582 1.00 0.00 N ATOM 990 CA CYS A 59 46.503 32.104 16.709 1.00 0.00 C ATOM 991 C CYS A 59 47.527 31.313 17.525 1.00 0.00 C ATOM 992 O CYS A 59 47.883 31.714 18.633 1.00 0.00 O ATOM 993 CB CYS A 59 47.221 33.143 15.846 1.00 0.00 C ATOM 994 SG CYS A 59 46.126 34.101 14.773 1.00 0.00 S ATOM 0 H CYS A 59 45.559 33.773 17.557 1.00 0.00 H new ATOM 0 HA CYS A 59 45.964 31.412 16.062 1.00 0.00 H new ATOM 0 HB2 CYS A 59 47.763 33.828 16.498 1.00 0.00 H new ATOM 0 HB3 CYS A 59 47.963 32.636 15.229 1.00 0.00 H new ATOM 0 HG CYS A 59 46.828 34.953 14.086 1.00 0.00 H new ATOM 1000 N LYS A 60 47.999 30.191 16.983 1.00 0.00 N ATOM 1001 CA LYS A 60 48.963 29.358 17.689 1.00 0.00 C ATOM 1002 C LYS A 60 50.355 29.417 17.035 1.00 0.00 C ATOM 1003 O LYS A 60 50.484 29.156 15.839 1.00 0.00 O ATOM 1004 CB LYS A 60 48.476 27.908 17.703 1.00 0.00 C ATOM 1005 CG LYS A 60 49.510 26.909 18.196 1.00 0.00 C ATOM 1006 CD LYS A 60 48.993 25.482 18.106 1.00 0.00 C ATOM 1007 CE LYS A 60 48.690 25.089 16.670 1.00 0.00 C ATOM 1008 NZ LYS A 60 48.146 23.706 16.571 1.00 0.00 N1+ ATOM 0 H LYS A 60 47.730 29.842 16.063 1.00 0.00 H new ATOM 0 HA LYS A 60 49.049 29.740 18.706 1.00 0.00 H new ATOM 0 HB2 LYS A 60 47.591 27.840 18.335 1.00 0.00 H new ATOM 0 HB3 LYS A 60 48.170 27.629 16.695 1.00 0.00 H new ATOM 0 HG2 LYS A 60 50.421 27.005 17.605 1.00 0.00 H new ATOM 0 HG3 LYS A 60 49.774 27.137 19.229 1.00 0.00 H new ATOM 0 HD2 LYS A 60 49.733 24.799 18.523 1.00 0.00 H new ATOM 0 HD3 LYS A 60 48.091 25.382 18.710 1.00 0.00 H new ATOM 0 HE2 LYS A 60 47.973 25.792 16.246 1.00 0.00 H new ATOM 0 HE3 LYS A 60 49.600 25.164 16.074 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 47.953 23.479 15.574 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 48.840 23.032 16.952 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 47.264 23.640 17.118 1.00 0.00 H new ATOM 1022 N GLN A 61 51.389 29.755 17.807 1.00 0.00 N ATOM 1023 CA GLN A 61 52.752 29.824 17.295 1.00 0.00 C ATOM 1024 C GLN A 61 53.656 29.062 18.256 1.00 0.00 C ATOM 1025 O GLN A 61 54.343 29.665 19.080 1.00 0.00 O ATOM 1026 CB GLN A 61 53.211 31.276 17.170 1.00 0.00 C ATOM 1027 CG GLN A 61 54.601 31.434 16.574 1.00 0.00 C ATOM 1028 CD GLN A 61 54.996 32.886 16.391 1.00 0.00 C ATOM 1029 OE1 GLN A 61 54.311 33.793 16.864 1.00 0.00 O ATOM 1030 NE2 GLN A 61 56.107 33.113 15.700 1.00 0.00 N ATOM 0 H GLN A 61 51.303 29.986 18.797 1.00 0.00 H new ATOM 0 HA GLN A 61 52.798 29.379 16.301 1.00 0.00 H new ATOM 0 HB2 GLN A 61 52.497 31.820 16.552 1.00 0.00 H new ATOM 0 HB3 GLN A 61 53.195 31.738 18.157 1.00 0.00 H new ATOM 0 HG2 GLN A 61 55.328 30.943 17.221 1.00 0.00 H new ATOM 0 HG3 GLN A 61 54.639 30.927 15.610 1.00 0.00 H new ATOM 0 HE21 GLN A 61 56.644 32.330 15.326 1.00 0.00 H new ATOM 0 HE22 GLN A 61 56.424 34.070 15.543 1.00 0.00 H new ATOM 1039 N GLY A 62 53.656 27.736 18.151 1.00 0.00 N ATOM 1040 CA GLY A 62 54.427 26.869 19.033 1.00 0.00 C ATOM 1041 C GLY A 62 53.753 26.575 20.370 1.00 0.00 C ATOM 1042 O GLY A 62 53.497 25.410 20.672 1.00 0.00 O ATOM 0 H GLY A 62 53.117 27.231 17.447 1.00 0.00 H new ATOM 0 HA2 GLY A 62 54.618 25.926 18.520 1.00 0.00 H new ATOM 0 HA3 GLY A 62 55.396 27.331 19.222 1.00 0.00 H new ATOM 1046 N ILE A 63 53.459 27.597 21.175 1.00 0.00 N ATOM 1047 CA ILE A 63 52.757 27.401 22.439 1.00 0.00 C ATOM 1048 C ILE A 63 51.302 27.030 22.157 1.00 0.00 C ATOM 1049 O ILE A 63 50.743 27.409 21.127 1.00 0.00 O ATOM 1050 CB ILE A 63 52.796 28.668 23.312 1.00 0.00 C ATOM 1051 CG1 ILE A 63 52.087 29.824 22.604 1.00 0.00 C ATOM 1052 CG2 ILE A 63 54.234 29.046 23.634 1.00 0.00 C ATOM 1053 CD1 ILE A 63 52.049 31.101 23.415 1.00 0.00 C ATOM 0 H ILE A 63 53.697 28.568 20.972 1.00 0.00 H new ATOM 0 HA ILE A 63 53.257 26.599 22.982 1.00 0.00 H new ATOM 0 HB ILE A 63 52.275 28.461 24.247 1.00 0.00 H new ATOM 0 HG12 ILE A 63 52.588 30.020 21.656 1.00 0.00 H new ATOM 0 HG13 ILE A 63 51.066 29.523 22.368 1.00 0.00 H new ATOM 0 HG21 ILE A 63 54.245 29.944 24.252 1.00 0.00 H new ATOM 0 HG22 ILE A 63 54.713 28.229 24.173 1.00 0.00 H new ATOM 0 HG23 ILE A 63 54.776 29.237 22.708 1.00 0.00 H new ATOM 0 HD11 ILE A 63 51.531 31.876 22.850 1.00 0.00 H new ATOM 0 HD12 ILE A 63 51.521 30.922 24.352 1.00 0.00 H new ATOM 0 HD13 ILE A 63 53.067 31.427 23.629 1.00 0.00 H new ATOM 1065 N SER A 64 50.672 26.323 23.088 1.00 0.00 N ATOM 1066 CA SER A 64 49.294 25.889 22.889 1.00 0.00 C ATOM 1067 C SER A 64 48.352 27.055 22.556 1.00 0.00 C ATOM 1068 O SER A 64 48.562 28.183 23.004 1.00 0.00 O ATOM 1069 CB SER A 64 48.788 25.161 24.136 1.00 0.00 C ATOM 1070 OG SER A 64 48.809 26.012 25.268 1.00 0.00 O ATOM 0 H SER A 64 51.086 26.041 23.976 1.00 0.00 H new ATOM 0 HA SER A 64 49.293 25.213 22.034 1.00 0.00 H new ATOM 0 HB2 SER A 64 47.773 24.803 23.965 1.00 0.00 H new ATOM 0 HB3 SER A 64 49.407 24.284 24.325 1.00 0.00 H new ATOM 0 HG SER A 64 48.479 25.523 26.051 1.00 0.00 H new ATOM 1076 N LYS A 65 47.308 26.770 21.773 1.00 0.00 N ATOM 1077 CA LYS A 65 46.325 27.773 21.355 1.00 0.00 C ATOM 1078 C LYS A 65 45.505 28.262 22.544 1.00 0.00 C ATOM 1079 O LYS A 65 45.331 27.540 23.529 1.00 0.00 O ATOM 1080 CB LYS A 65 45.390 27.185 20.296 1.00 0.00 C ATOM 1081 CG LYS A 65 44.572 26.002 20.784 1.00 0.00 C ATOM 1082 CD LYS A 65 43.662 25.458 19.694 1.00 0.00 C ATOM 1083 CE LYS A 65 44.452 24.808 18.568 1.00 0.00 C ATOM 1084 NZ LYS A 65 43.579 24.269 17.489 1.00 0.00 N1+ ATOM 0 H LYS A 65 47.120 25.835 21.410 1.00 0.00 H new ATOM 0 HA LYS A 65 46.866 28.620 20.933 1.00 0.00 H new ATOM 0 HB2 LYS A 65 44.712 27.965 19.951 1.00 0.00 H new ATOM 0 HB3 LYS A 65 45.982 26.874 19.435 1.00 0.00 H new ATOM 0 HG2 LYS A 65 45.242 25.213 21.126 1.00 0.00 H new ATOM 0 HG3 LYS A 65 43.971 26.304 21.642 1.00 0.00 H new ATOM 0 HD2 LYS A 65 42.976 24.728 20.124 1.00 0.00 H new ATOM 0 HD3 LYS A 65 43.054 26.268 19.291 1.00 0.00 H new ATOM 0 HE2 LYS A 65 45.139 25.540 18.142 1.00 0.00 H new ATOM 0 HE3 LYS A 65 45.060 24.000 18.976 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 44.168 23.838 16.748 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 42.941 23.550 17.886 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 43.017 25.042 17.078 1.00 0.00 H new ATOM 1098 N THR A 66 44.956 29.469 22.449 1.00 0.00 N ATOM 1099 CA THR A 66 44.219 29.996 23.608 1.00 0.00 C ATOM 1100 C THR A 66 42.905 30.636 23.155 1.00 0.00 C ATOM 1101 O THR A 66 42.736 30.895 21.963 1.00 0.00 O ATOM 1102 CB THR A 66 45.130 30.952 24.387 1.00 0.00 C ATOM 1103 OG1 THR A 66 44.466 31.496 25.499 1.00 0.00 O ATOM 1104 CG2 THR A 66 45.625 32.146 23.566 1.00 0.00 C ATOM 0 H THR A 66 44.998 30.078 21.632 1.00 0.00 H new ATOM 0 HA THR A 66 43.940 29.190 24.287 1.00 0.00 H new ATOM 0 HB THR A 66 45.979 30.332 24.675 1.00 0.00 H new ATOM 0 HG1 THR A 66 43.903 30.809 25.912 1.00 0.00 H new ATOM 0 HG21 THR A 66 46.263 32.775 24.187 1.00 0.00 H new ATOM 0 HG22 THR A 66 46.194 31.787 22.708 1.00 0.00 H new ATOM 0 HG23 THR A 66 44.771 32.727 23.218 1.00 0.00 H new ATOM 1112 N PHE A 67 41.959 30.849 24.076 1.00 0.00 N ATOM 1113 CA PHE A 67 40.646 31.425 23.778 1.00 0.00 C ATOM 1114 C PHE A 67 40.289 32.490 24.826 1.00 0.00 C ATOM 1115 O PHE A 67 40.365 32.226 26.028 1.00 0.00 O ATOM 1116 CB PHE A 67 39.561 30.326 23.665 1.00 0.00 C ATOM 1117 CG PHE A 67 39.810 29.242 22.625 1.00 0.00 C ATOM 1118 CD1 PHE A 67 40.747 28.222 22.890 1.00 0.00 C ATOM 1119 CD2 PHE A 67 39.084 29.209 21.414 1.00 0.00 C ATOM 1120 CE1 PHE A 67 40.990 27.211 21.947 1.00 0.00 C ATOM 1121 CE2 PHE A 67 39.284 28.156 20.501 1.00 0.00 C ATOM 1122 CZ PHE A 67 40.244 27.165 20.759 1.00 0.00 C ATOM 0 H PHE A 67 42.087 30.623 25.062 1.00 0.00 H new ATOM 0 HA PHE A 67 40.690 31.915 22.806 1.00 0.00 H new ATOM 0 HB2 PHE A 67 39.454 29.849 24.639 1.00 0.00 H new ATOM 0 HB3 PHE A 67 38.609 30.806 23.439 1.00 0.00 H new ATOM 0 HD1 PHE A 67 41.283 28.219 23.828 1.00 0.00 H new ATOM 0 HD2 PHE A 67 38.375 29.992 21.188 1.00 0.00 H new ATOM 0 HE1 PHE A 67 41.751 26.468 22.136 1.00 0.00 H new ATOM 0 HE2 PHE A 67 38.695 28.111 19.597 1.00 0.00 H new ATOM 0 HZ PHE A 67 40.408 26.370 20.046 1.00 0.00 H new ATOM 1132 N TYR A 68 39.918 33.693 24.385 1.00 0.00 N ATOM 1133 CA TYR A 68 39.376 34.748 25.257 1.00 0.00 C ATOM 1134 C TYR A 68 37.845 34.774 25.176 1.00 0.00 C ATOM 1135 O TYR A 68 37.241 34.072 24.362 1.00 0.00 O ATOM 1136 CB TYR A 68 39.998 36.111 24.931 1.00 0.00 C ATOM 1137 CG TYR A 68 39.493 36.766 23.664 1.00 0.00 C ATOM 1138 CD1 TYR A 68 40.150 36.494 22.452 1.00 0.00 C ATOM 1139 CD2 TYR A 68 38.392 37.650 23.700 1.00 0.00 C ATOM 1140 CE1 TYR A 68 39.718 37.116 21.266 1.00 0.00 C ATOM 1141 CE2 TYR A 68 37.953 38.268 22.511 1.00 0.00 C ATOM 1142 CZ TYR A 68 38.618 38.007 21.295 1.00 0.00 C ATOM 1143 OH TYR A 68 38.243 38.654 20.158 1.00 0.00 O ATOM 0 H TYR A 68 39.984 33.969 23.405 1.00 0.00 H new ATOM 0 HA TYR A 68 39.646 34.520 26.288 1.00 0.00 H new ATOM 0 HB2 TYR A 68 39.814 36.785 25.767 1.00 0.00 H new ATOM 0 HB3 TYR A 68 41.078 35.989 24.852 1.00 0.00 H new ATOM 0 HD1 TYR A 68 40.985 35.809 22.431 1.00 0.00 H new ATOM 0 HD2 TYR A 68 37.889 37.852 24.634 1.00 0.00 H new ATOM 0 HE1 TYR A 68 40.225 36.914 20.334 1.00 0.00 H new ATOM 0 HE2 TYR A 68 37.108 38.941 22.532 1.00 0.00 H new ATOM 0 HH TYR A 68 38.959 38.586 19.492 1.00 0.00 H new ATOM 1153 N ILE A 69 37.201 35.569 26.036 1.00 0.00 N ATOM 1154 CA ILE A 69 35.741 35.599 26.166 1.00 0.00 C ATOM 1155 C ILE A 69 35.236 37.041 26.113 1.00 0.00 C ATOM 1156 O ILE A 69 35.759 37.934 26.775 1.00 0.00 O ATOM 1157 CB ILE A 69 35.274 34.813 27.413 1.00 0.00 C ATOM 1158 CG1 ILE A 69 35.779 33.346 27.401 1.00 0.00 C ATOM 1159 CG2 ILE A 69 33.734 34.809 27.496 1.00 0.00 C ATOM 1160 CD1 ILE A 69 37.094 33.136 28.162 1.00 0.00 C ATOM 0 H ILE A 69 37.680 36.213 26.665 1.00 0.00 H new ATOM 0 HA ILE A 69 35.290 35.084 25.318 1.00 0.00 H new ATOM 0 HB ILE A 69 35.698 35.316 28.282 1.00 0.00 H new ATOM 0 HG12 ILE A 69 35.012 32.704 27.836 1.00 0.00 H new ATOM 0 HG13 ILE A 69 35.913 33.027 26.368 1.00 0.00 H new ATOM 0 HG21 ILE A 69 33.419 34.252 28.378 1.00 0.00 H new ATOM 0 HG22 ILE A 69 33.371 35.834 27.565 1.00 0.00 H new ATOM 0 HG23 ILE A 69 33.323 34.338 26.603 1.00 0.00 H new ATOM 0 HD11 ILE A 69 37.382 32.086 28.108 1.00 0.00 H new ATOM 0 HD12 ILE A 69 37.876 33.750 27.714 1.00 0.00 H new ATOM 0 HD13 ILE A 69 36.960 33.423 29.205 1.00 0.00 H new ATOM 1172 N THR A 70 34.239 37.270 25.263 1.00 0.00 N ATOM 1173 CA THR A 70 33.686 38.585 24.945 1.00 0.00 C ATOM 1174 C THR A 70 32.775 39.128 26.061 1.00 0.00 C ATOM 1175 O THR A 70 32.125 38.347 26.769 1.00 0.00 O ATOM 1176 CB THR A 70 32.886 38.492 23.636 1.00 0.00 C ATOM 1177 OG1 THR A 70 31.790 37.614 23.762 1.00 0.00 O ATOM 1178 CG2 THR A 70 33.714 38.033 22.437 1.00 0.00 C ATOM 0 H THR A 70 33.775 36.516 24.757 1.00 0.00 H new ATOM 0 HA THR A 70 34.522 39.277 24.842 1.00 0.00 H new ATOM 0 HB THR A 70 32.549 39.512 23.451 1.00 0.00 H new ATOM 0 HG1 THR A 70 32.112 36.689 23.776 1.00 0.00 H new ATOM 0 HG21 THR A 70 33.080 37.992 21.551 1.00 0.00 H new ATOM 0 HG22 THR A 70 34.530 38.736 22.267 1.00 0.00 H new ATOM 0 HG23 THR A 70 34.124 37.043 22.636 1.00 0.00 H new ATOM 1186 N PRO A 71 32.608 40.465 26.174 1.00 0.00 N ATOM 1187 CA PRO A 71 31.591 41.056 27.052 1.00 0.00 C ATOM 1188 C PRO A 71 30.175 40.573 26.702 1.00 0.00 C ATOM 1189 O PRO A 71 29.336 40.436 27.586 1.00 0.00 O ATOM 1190 CB PRO A 71 31.722 42.573 26.871 1.00 0.00 C ATOM 1191 CG PRO A 71 32.294 42.706 25.461 1.00 0.00 C ATOM 1192 CD PRO A 71 33.245 41.514 25.386 1.00 0.00 C ATOM 0 HA PRO A 71 31.748 40.757 28.088 1.00 0.00 H new ATOM 0 HB2 PRO A 71 30.759 43.075 26.964 1.00 0.00 H new ATOM 0 HB3 PRO A 71 32.384 43.012 27.617 1.00 0.00 H new ATOM 0 HG2 PRO A 71 31.516 42.655 24.699 1.00 0.00 H new ATOM 0 HG3 PRO A 71 32.816 43.653 25.321 1.00 0.00 H new ATOM 0 HD2 PRO A 71 33.396 41.195 24.355 1.00 0.00 H new ATOM 0 HD3 PRO A 71 34.226 41.767 25.788 1.00 0.00 H new ATOM 1200 N ASN A 72 29.931 40.216 25.437 1.00 0.00 N ATOM 1201 CA ASN A 72 28.643 39.724 24.946 1.00 0.00 C ATOM 1202 C ASN A 72 28.192 38.406 25.613 1.00 0.00 C ATOM 1203 O ASN A 72 26.995 38.122 25.644 1.00 0.00 O ATOM 1204 CB ASN A 72 28.730 39.594 23.413 1.00 0.00 C ATOM 1205 CG ASN A 72 29.149 40.889 22.735 1.00 0.00 C ATOM 1206 OD1 ASN A 72 28.822 41.980 23.179 1.00 0.00 O ATOM 1207 ND2 ASN A 72 29.903 40.830 21.666 1.00 0.00 N ATOM 0 H ASN A 72 30.643 40.263 24.709 1.00 0.00 H new ATOM 0 HA ASN A 72 27.871 40.444 25.218 1.00 0.00 H new ATOM 0 HB2 ASN A 72 29.443 38.809 23.159 1.00 0.00 H new ATOM 0 HB3 ASN A 72 27.761 39.282 23.024 1.00 0.00 H new ATOM 0 HD21 ASN A 72 30.212 41.689 21.212 1.00 0.00 H new ATOM 0 HD22 ASN A 72 30.181 39.925 21.288 1.00 0.00 H new ATOM 1214 N GLY A 73 29.118 37.624 26.183 1.00 0.00 N ATOM 1215 CA GLY A 73 28.783 36.515 27.084 1.00 0.00 C ATOM 1216 C GLY A 73 28.455 36.987 28.504 1.00 0.00 C ATOM 1217 O GLY A 73 27.442 36.572 29.066 1.00 0.00 O ATOM 0 H GLY A 73 30.120 37.743 26.032 1.00 0.00 H new ATOM 0 HA2 GLY A 73 27.930 35.969 26.681 1.00 0.00 H new ATOM 0 HA3 GLY A 73 29.619 35.817 27.121 1.00 0.00 H new ATOM 1221 N ILE A 74 29.270 37.895 29.063 1.00 0.00 N ATOM 1222 CA ILE A 74 29.069 38.490 30.396 1.00 0.00 C ATOM 1223 C ILE A 74 27.690 39.147 30.534 1.00 0.00 C ATOM 1224 O ILE A 74 27.051 38.970 31.570 1.00 0.00 O ATOM 1225 CB ILE A 74 30.201 39.485 30.743 1.00 0.00 C ATOM 1226 CG1 ILE A 74 31.499 38.696 31.014 1.00 0.00 C ATOM 1227 CG2 ILE A 74 29.869 40.361 31.967 1.00 0.00 C ATOM 1228 CD1 ILE A 74 32.746 39.554 30.795 1.00 0.00 C ATOM 0 H ILE A 74 30.105 38.244 28.592 1.00 0.00 H new ATOM 0 HA ILE A 74 29.107 37.674 31.117 1.00 0.00 H new ATOM 0 HB ILE A 74 30.322 40.155 29.892 1.00 0.00 H new ATOM 0 HG12 ILE A 74 31.490 38.324 32.038 1.00 0.00 H new ATOM 0 HG13 ILE A 74 31.538 37.826 30.359 1.00 0.00 H new ATOM 0 HG21 ILE A 74 30.699 41.040 32.164 1.00 0.00 H new ATOM 0 HG22 ILE A 74 28.967 40.939 31.767 1.00 0.00 H new ATOM 0 HG23 ILE A 74 29.706 39.724 32.837 1.00 0.00 H new ATOM 0 HD11 ILE A 74 33.637 38.959 30.997 1.00 0.00 H new ATOM 0 HD12 ILE A 74 32.770 39.905 29.763 1.00 0.00 H new ATOM 0 HD13 ILE A 74 32.721 40.410 31.469 1.00 0.00 H new ATOM 1240 N GLU A 75 27.196 39.835 29.495 1.00 0.00 N ATOM 1241 CA GLU A 75 25.848 40.430 29.476 1.00 0.00 C ATOM 1242 C GLU A 75 24.764 39.413 29.870 1.00 0.00 C ATOM 1243 O GLU A 75 23.895 39.708 30.692 1.00 0.00 O ATOM 1244 CB GLU A 75 25.513 40.993 28.079 1.00 0.00 C ATOM 1245 CG GLU A 75 26.362 42.203 27.652 1.00 0.00 C ATOM 1246 CD GLU A 75 25.756 42.988 26.477 1.00 0.00 C ATOM 1247 OE1 GLU A 75 26.495 43.570 25.647 1.00 0.00 O ATOM 1248 OE2 GLU A 75 24.513 43.134 26.408 1.00 0.00 O ATOM 0 H GLU A 75 27.723 39.997 28.637 1.00 0.00 H new ATOM 0 HA GLU A 75 25.856 41.237 30.209 1.00 0.00 H new ATOM 0 HB2 GLU A 75 25.640 40.199 27.343 1.00 0.00 H new ATOM 0 HB3 GLU A 75 24.462 41.280 28.061 1.00 0.00 H new ATOM 0 HG2 GLU A 75 26.482 42.873 28.504 1.00 0.00 H new ATOM 0 HG3 GLU A 75 27.358 41.859 27.374 1.00 0.00 H new ATOM 1255 N LYS A 76 24.843 38.186 29.336 1.00 0.00 N ATOM 1256 CA LYS A 76 23.860 37.123 29.594 1.00 0.00 C ATOM 1257 C LYS A 76 24.021 36.489 30.985 1.00 0.00 C ATOM 1258 O LYS A 76 23.033 36.043 31.567 1.00 0.00 O ATOM 1259 CB LYS A 76 23.885 36.086 28.452 1.00 0.00 C ATOM 1260 CG LYS A 76 23.776 36.742 27.057 1.00 0.00 C ATOM 1261 CD LYS A 76 23.271 35.777 25.979 1.00 0.00 C ATOM 1262 CE LYS A 76 23.197 36.495 24.617 1.00 0.00 C ATOM 1263 NZ LYS A 76 22.557 35.663 23.566 1.00 0.00 N1+ ATOM 0 H LYS A 76 25.595 37.901 28.709 1.00 0.00 H new ATOM 0 HA LYS A 76 22.869 37.577 29.607 1.00 0.00 H new ATOM 0 HB2 LYS A 76 24.809 35.510 28.508 1.00 0.00 H new ATOM 0 HB3 LYS A 76 23.062 35.383 28.585 1.00 0.00 H new ATOM 0 HG2 LYS A 76 23.103 37.597 27.115 1.00 0.00 H new ATOM 0 HG3 LYS A 76 24.754 37.125 26.765 1.00 0.00 H new ATOM 0 HD2 LYS A 76 23.937 34.917 25.909 1.00 0.00 H new ATOM 0 HD3 LYS A 76 22.287 35.397 26.252 1.00 0.00 H new ATOM 0 HE2 LYS A 76 22.638 37.424 24.730 1.00 0.00 H new ATOM 0 HE3 LYS A 76 24.204 36.766 24.298 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 22.456 36.222 22.695 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 23.148 34.829 23.376 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 21.618 35.355 23.891 1.00 0.00 H new ATOM 1277 N LEU A 77 25.220 36.527 31.584 1.00 0.00 N ATOM 1278 CA LEU A 77 25.448 36.073 32.971 1.00 0.00 C ATOM 1279 C LEU A 77 24.623 36.873 33.997 1.00 0.00 C ATOM 1280 O LEU A 77 24.285 36.357 35.066 1.00 0.00 O ATOM 1281 CB LEU A 77 26.937 36.156 33.365 1.00 0.00 C ATOM 1282 CG LEU A 77 27.949 35.522 32.399 1.00 0.00 C ATOM 1283 CD1 LEU A 77 29.365 35.744 32.935 1.00 0.00 C ATOM 1284 CD2 LEU A 77 27.743 34.027 32.166 1.00 0.00 C ATOM 0 H LEU A 77 26.062 36.873 31.124 1.00 0.00 H new ATOM 0 HA LEU A 77 25.123 35.033 32.992 1.00 0.00 H new ATOM 0 HB2 LEU A 77 27.197 37.207 33.487 1.00 0.00 H new ATOM 0 HB3 LEU A 77 27.057 35.683 34.340 1.00 0.00 H new ATOM 0 HG LEU A 77 27.796 36.012 31.437 1.00 0.00 H new ATOM 0 HD11 LEU A 77 30.087 35.296 32.252 1.00 0.00 H new ATOM 0 HD12 LEU A 77 29.559 36.813 33.017 1.00 0.00 H new ATOM 0 HD13 LEU A 77 29.459 35.281 33.918 1.00 0.00 H new ATOM 0 HD21 LEU A 77 28.499 33.659 31.472 1.00 0.00 H new ATOM 0 HD22 LEU A 77 27.831 33.496 33.114 1.00 0.00 H new ATOM 0 HD23 LEU A 77 26.752 33.857 31.746 1.00 0.00 H new ATOM 1296 N LYS A 78 24.266 38.121 33.666 1.00 0.00 N ATOM 1297 CA LYS A 78 23.512 39.045 34.531 1.00 0.00 C ATOM 1298 C LYS A 78 22.028 38.649 34.704 1.00 0.00 C ATOM 1299 O LYS A 78 21.296 39.312 35.442 1.00 0.00 O ATOM 1300 CB LYS A 78 23.653 40.501 34.031 1.00 0.00 C ATOM 1301 CG LYS A 78 25.106 40.978 33.824 1.00 0.00 C ATOM 1302 CD LYS A 78 25.987 40.911 35.087 1.00 0.00 C ATOM 1303 CE LYS A 78 27.464 40.824 34.700 1.00 0.00 C ATOM 1304 NZ LYS A 78 28.184 42.118 34.832 1.00 0.00 N1+ ATOM 0 H LYS A 78 24.500 38.530 32.762 1.00 0.00 H new ATOM 0 HA LYS A 78 23.956 38.972 35.524 1.00 0.00 H new ATOM 0 HB2 LYS A 78 23.116 40.600 33.088 1.00 0.00 H new ATOM 0 HB3 LYS A 78 23.166 41.164 34.746 1.00 0.00 H new ATOM 0 HG2 LYS A 78 25.566 40.372 33.043 1.00 0.00 H new ATOM 0 HG3 LYS A 78 25.089 42.006 33.462 1.00 0.00 H new ATOM 0 HD2 LYS A 78 25.817 41.793 35.704 1.00 0.00 H new ATOM 0 HD3 LYS A 78 25.710 40.044 35.687 1.00 0.00 H new ATOM 0 HE2 LYS A 78 27.953 40.078 35.327 1.00 0.00 H new ATOM 0 HE3 LYS A 78 27.543 40.476 33.670 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 29.178 41.992 34.555 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 27.740 42.827 34.214 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 28.138 42.442 35.819 1.00 0.00 H new ATOM 1318 N SER A 79 21.611 37.583 34.029 1.00 0.00 N ATOM 1319 CA SER A 79 20.233 37.115 34.112 1.00 0.00 C ATOM 1320 C SER A 79 20.161 35.741 34.768 1.00 0.00 C ATOM 1321 O SER A 79 19.364 34.892 34.365 1.00 0.00 O ATOM 1322 CB SER A 79 19.607 37.060 32.717 1.00 0.00 C ATOM 1323 OG SER A 79 18.266 36.605 32.778 1.00 0.00 O ATOM 0 H SER A 79 22.209 37.027 33.418 1.00 0.00 H new ATOM 0 HA SER A 79 19.674 37.820 34.728 1.00 0.00 H new ATOM 0 HB2 SER A 79 19.638 38.050 32.262 1.00 0.00 H new ATOM 0 HB3 SER A 79 20.191 36.397 32.079 1.00 0.00 H new ATOM 0 HG SER A 79 18.224 35.782 33.309 1.00 0.00 H new ATOM 1329 N ILE A 80 20.998 35.526 35.778 1.00 0.00 N ATOM 1330 CA ILE A 80 21.027 34.257 36.492 1.00 0.00 C ATOM 1331 C ILE A 80 20.655 34.479 37.963 1.00 0.00 C ATOM 1332 O ILE A 80 21.203 35.375 38.605 1.00 0.00 O ATOM 1333 CB ILE A 80 22.421 33.609 36.426 1.00 0.00 C ATOM 1334 CG1 ILE A 80 22.825 33.361 34.972 1.00 0.00 C ATOM 1335 CG2 ILE A 80 22.438 32.304 37.206 1.00 0.00 C ATOM 1336 CD1 ILE A 80 24.167 32.679 34.821 1.00 0.00 C ATOM 0 H ILE A 80 21.666 36.217 36.120 1.00 0.00 H new ATOM 0 HA ILE A 80 20.307 33.592 36.015 1.00 0.00 H new ATOM 0 HB ILE A 80 23.140 34.293 36.876 1.00 0.00 H new ATOM 0 HG12 ILE A 80 22.061 32.750 34.491 1.00 0.00 H new ATOM 0 HG13 ILE A 80 22.850 34.314 34.444 1.00 0.00 H new ATOM 0 HG21 ILE A 80 23.431 31.859 37.149 1.00 0.00 H new ATOM 0 HG22 ILE A 80 22.188 32.500 38.249 1.00 0.00 H new ATOM 0 HG23 ILE A 80 21.707 31.616 36.780 1.00 0.00 H new ATOM 0 HD11 ILE A 80 24.386 32.537 33.763 1.00 0.00 H new ATOM 0 HD12 ILE A 80 24.943 33.298 35.272 1.00 0.00 H new ATOM 0 HD13 ILE A 80 24.141 31.710 35.320 1.00 0.00 H new ATOM 1348 N MET A 81 19.736 33.678 38.502 1.00 0.00 N ATOM 1349 CA MET A 81 19.326 33.829 39.892 1.00 0.00 C ATOM 1350 C MET A 81 18.710 32.536 40.415 1.00 0.00 C ATOM 1351 O MET A 81 17.557 32.219 40.123 1.00 0.00 O ATOM 1352 CB MET A 81 18.319 34.973 40.025 1.00 0.00 C ATOM 1353 CG MET A 81 17.816 35.195 41.442 1.00 0.00 C ATOM 1354 SD MET A 81 16.627 36.546 41.552 1.00 0.00 S ATOM 1355 CE MET A 81 16.292 36.562 43.311 1.00 0.00 C ATOM 1356 OXT MET A 81 19.351 31.777 41.142 1.00 0.00 O ATOM 0 H MET A 81 19.266 32.925 38.000 1.00 0.00 H new ATOM 0 HA MET A 81 20.211 34.060 40.486 1.00 0.00 H new ATOM 0 HB2 MET A 81 18.781 35.893 39.667 1.00 0.00 H new ATOM 0 HB3 MET A 81 17.467 34.770 39.376 1.00 0.00 H new ATOM 0 HG2 MET A 81 17.353 34.278 41.807 1.00 0.00 H new ATOM 0 HG3 MET A 81 18.663 35.407 42.095 1.00 0.00 H new ATOM 0 HE1 MET A 81 15.571 37.348 43.537 1.00 0.00 H new ATOM 0 HE2 MET A 81 15.884 35.597 43.612 1.00 0.00 H new ATOM 0 HE3 MET A 81 17.217 36.751 43.856 1.00 0.00 H new TER 1366 MET A 81