USER MOD reduce.3.24.130724 H: found=0, std=0, add=1038, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 1029 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 64 SER OG : rot -140:sc= 0 USER MOD Set 1.2: A 95 LYS NZ :NH3+ -145:sc= -0.275 (180deg=-1.43) USER MOD Set 2.1: A 7 HIS : no HD1:sc= -0.0185 X(o=-0.3,f=-0.41) USER MOD Set 2.2: A 41 LYS NZ :NH3+ 157:sc= -0.282 (180deg=-0.479) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 148:sc= 0.00461 (180deg=0) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 HIS : no HD1:sc= 0 X(o=0,f=-0.061) USER MOD Single : A 9 HIS : no HD1:sc= -0.0207 X(o=-0.021,f=0) USER MOD Single : A 10 HIS : no HD1:sc= -0.0608 X(o=-0.061,f=-0.13) USER MOD Single : A 11 HIS : no HE2:sc= 0.134 K(o=0.13,f=-0.84) USER MOD Single : A 12 HIS : no HD1:sc= -0.0245 X(o=-0.024,f=-0.024) USER MOD Single : A 13 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 16 TYR OH : rot -17:sc= 1.27 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 MET CE :methyl -178:sc= 0 (180deg=-0.00545) USER MOD Single : A 28 ASN : amide:sc= -0.441 X(o=-0.44,f=-0.41) USER MOD Single : A 29 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0345) USER MOD Single : A 32 ASN : amide:sc= 1.01 K(o=1,f=-5.5!) USER MOD Single : A 35 ASN : amide:sc= -0.177 X(o=-0.18,f=-0.39) USER MOD Single : A 37 HIS : no HD1:sc= -0.278 X(o=-0.28,f=-0.0023) USER MOD Single : A 40 LYS NZ :NH3+ 161:sc= -0.0935 (180deg=-0.424) USER MOD Single : A 49 ASN : amide:sc= 0.601 K(o=0.6,f=-0.0022) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 ASN : amide:sc= -0.0685 X(o=-0.068,f=0) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot 180:sc= 0.015 USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 75 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 SER OG : rot -153:sc= 0.107 USER MOD Single : A 81 SER OG : rot -50:sc= 1.23 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 93 ASN : amide:sc= 0.143 K(o=0.14,f=-3.4!) USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 103 THR OG1 : rot -45:sc= 0 USER MOD Single : A 104 ASN : amide:sc= 0 X(o=0,f=-0.41) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot -82:sc= 1.3 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 119 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 0.745 -9.949 12.262 1.00 0.00 N ATOM 2 CA MET A 1 -0.698 -9.968 12.543 1.00 0.00 C ATOM 3 C MET A 1 -1.015 -8.867 13.545 1.00 0.00 C ATOM 4 O MET A 1 -0.371 -8.798 14.590 1.00 0.00 O ATOM 5 CB MET A 1 -1.124 -11.338 13.089 1.00 0.00 C ATOM 6 CG MET A 1 -2.636 -11.572 13.071 1.00 0.00 C ATOM 7 SD MET A 1 -3.236 -12.326 11.535 1.00 0.00 S ATOM 8 CE MET A 1 -3.966 -13.838 12.220 1.00 0.00 C ATOM 0 H1 MET A 1 1.073 -10.916 12.063 1.00 0.00 H new ATOM 0 H2 MET A 1 0.930 -9.344 11.437 1.00 0.00 H new ATOM 0 H3 MET A 1 1.255 -9.574 13.088 1.00 0.00 H new ATOM 0 HA MET A 1 -1.253 -9.793 11.621 1.00 0.00 H new ATOM 0 HB2 MET A 1 -0.639 -12.118 12.503 1.00 0.00 H new ATOM 0 HB3 MET A 1 -0.763 -11.438 14.113 1.00 0.00 H new ATOM 0 HG2 MET A 1 -2.906 -12.213 13.910 1.00 0.00 H new ATOM 0 HG3 MET A 1 -3.144 -10.620 13.221 1.00 0.00 H new ATOM 0 HE1 MET A 1 -4.390 -14.435 11.413 1.00 0.00 H new ATOM 0 HE2 MET A 1 -3.195 -14.414 12.732 1.00 0.00 H new ATOM 0 HE3 MET A 1 -4.752 -13.574 12.928 1.00 0.00 H new ATOM 18 N GLY A 2 -1.996 -8.015 13.250 1.00 0.00 N ATOM 19 CA GLY A 2 -2.523 -7.025 14.177 1.00 0.00 C ATOM 20 C GLY A 2 -2.919 -5.746 13.455 1.00 0.00 C ATOM 21 O GLY A 2 -2.394 -5.457 12.376 1.00 0.00 O ATOM 0 H GLY A 2 -2.454 -7.997 12.339 1.00 0.00 H new ATOM 0 HA2 GLY A 2 -3.389 -7.435 14.696 1.00 0.00 H new ATOM 0 HA3 GLY A 2 -1.774 -6.799 14.936 1.00 0.00 H new ATOM 25 N SER A 3 -3.801 -4.979 14.095 1.00 0.00 N ATOM 26 CA SER A 3 -4.592 -3.892 13.532 1.00 0.00 C ATOM 27 C SER A 3 -5.510 -4.373 12.405 1.00 0.00 C ATOM 28 O SER A 3 -5.229 -5.331 11.674 1.00 0.00 O ATOM 29 CB SER A 3 -3.730 -2.694 13.120 1.00 0.00 C ATOM 30 OG SER A 3 -2.901 -2.268 14.194 1.00 0.00 O ATOM 0 H SER A 3 -3.993 -5.112 15.088 1.00 0.00 H new ATOM 0 HA SER A 3 -5.243 -3.534 14.329 1.00 0.00 H new ATOM 0 HB2 SER A 3 -3.112 -2.964 12.264 1.00 0.00 H new ATOM 0 HB3 SER A 3 -4.372 -1.872 12.803 1.00 0.00 H new ATOM 0 HG SER A 3 -2.359 -1.504 13.906 1.00 0.00 H new ATOM 36 N ASP A 4 -6.656 -3.707 12.287 1.00 0.00 N ATOM 37 CA ASP A 4 -7.693 -4.110 11.355 1.00 0.00 C ATOM 38 C ASP A 4 -7.365 -3.617 9.946 1.00 0.00 C ATOM 39 O ASP A 4 -6.929 -2.475 9.747 1.00 0.00 O ATOM 40 CB ASP A 4 -9.072 -3.675 11.846 1.00 0.00 C ATOM 41 CG ASP A 4 -9.448 -2.239 11.518 1.00 0.00 C ATOM 42 OD1 ASP A 4 -8.832 -1.302 12.072 1.00 0.00 O ATOM 43 OD2 ASP A 4 -10.481 -2.068 10.834 1.00 0.00 O ATOM 0 H ASP A 4 -6.886 -2.878 12.834 1.00 0.00 H new ATOM 0 HA ASP A 4 -7.725 -5.198 11.304 1.00 0.00 H new ATOM 0 HB2 ASP A 4 -9.821 -4.338 11.413 1.00 0.00 H new ATOM 0 HB3 ASP A 4 -9.115 -3.808 12.927 1.00 0.00 H new ATOM 48 N LYS A 5 -7.538 -4.505 8.962 1.00 0.00 N ATOM 49 CA LYS A 5 -7.383 -4.175 7.552 1.00 0.00 C ATOM 50 C LYS A 5 -8.612 -3.409 7.076 1.00 0.00 C ATOM 51 O LYS A 5 -9.657 -4.009 6.812 1.00 0.00 O ATOM 52 CB LYS A 5 -7.057 -5.403 6.685 1.00 0.00 C ATOM 53 CG LYS A 5 -7.885 -6.671 6.952 1.00 0.00 C ATOM 54 CD LYS A 5 -8.207 -7.439 5.665 1.00 0.00 C ATOM 55 CE LYS A 5 -9.354 -6.742 4.912 1.00 0.00 C ATOM 56 NZ LYS A 5 -10.417 -7.695 4.540 1.00 0.00 N ATOM 0 H LYS A 5 -7.791 -5.479 9.129 1.00 0.00 H new ATOM 0 HA LYS A 5 -6.514 -3.527 7.438 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -7.186 -5.126 5.639 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -6.004 -5.648 6.823 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -7.338 -7.322 7.634 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -8.815 -6.397 7.451 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -7.322 -7.490 5.031 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -8.488 -8.465 5.904 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -9.774 -5.953 5.536 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -8.963 -6.264 4.014 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -11.173 -7.191 4.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -10.021 -8.434 3.924 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -10.807 -8.133 5.399 1.00 0.00 H new ATOM 70 N ILE A 6 -8.487 -2.089 6.975 1.00 0.00 N ATOM 71 CA ILE A 6 -9.538 -1.193 6.519 1.00 0.00 C ATOM 72 C ILE A 6 -8.891 -0.169 5.584 1.00 0.00 C ATOM 73 O ILE A 6 -8.188 0.739 6.029 1.00 0.00 O ATOM 74 CB ILE A 6 -10.326 -0.640 7.734 1.00 0.00 C ATOM 75 CG1 ILE A 6 -11.536 0.219 7.325 1.00 0.00 C ATOM 76 CG2 ILE A 6 -9.474 0.146 8.750 1.00 0.00 C ATOM 77 CD1 ILE A 6 -12.568 -0.528 6.471 1.00 0.00 C ATOM 0 H ILE A 6 -7.624 -1.601 7.216 1.00 0.00 H new ATOM 0 HA ILE A 6 -10.309 -1.689 5.930 1.00 0.00 H new ATOM 0 HB ILE A 6 -10.676 -1.545 8.231 1.00 0.00 H new ATOM 0 HG12 ILE A 6 -12.025 0.592 8.225 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -11.181 1.088 6.771 1.00 0.00 H new ATOM 0 HG21 ILE A 6 -10.109 0.494 9.565 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -8.694 -0.502 9.149 1.00 0.00 H new ATOM 0 HG23 ILE A 6 -9.016 1.003 8.255 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -13.390 0.144 6.223 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -12.096 -0.878 5.553 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -12.953 -1.382 7.029 1.00 0.00 H new ATOM 89 N HIS A 7 -8.999 -0.386 4.272 1.00 0.00 N ATOM 90 CA HIS A 7 -8.358 0.438 3.256 1.00 0.00 C ATOM 91 C HIS A 7 -9.185 0.342 1.975 1.00 0.00 C ATOM 92 O HIS A 7 -9.046 -0.625 1.217 1.00 0.00 O ATOM 93 CB HIS A 7 -6.902 -0.029 3.060 1.00 0.00 C ATOM 94 CG HIS A 7 -6.108 0.745 2.033 1.00 0.00 C ATOM 95 ND1 HIS A 7 -5.637 0.243 0.840 1.00 0.00 N ATOM 96 CD2 HIS A 7 -5.656 2.034 2.144 1.00 0.00 C ATOM 97 CE1 HIS A 7 -4.918 1.205 0.239 1.00 0.00 C ATOM 98 NE2 HIS A 7 -4.911 2.322 0.991 1.00 0.00 N ATOM 0 H HIS A 7 -9.545 -1.154 3.883 1.00 0.00 H new ATOM 0 HA HIS A 7 -8.317 1.485 3.557 1.00 0.00 H new ATOM 0 HB2 HIS A 7 -6.385 0.035 4.018 1.00 0.00 H new ATOM 0 HB3 HIS A 7 -6.911 -1.080 2.772 1.00 0.00 H new ATOM 0 HD2 HIS A 7 -5.840 2.706 2.969 1.00 0.00 H new ATOM 0 HE1 HIS A 7 -4.417 1.098 -0.712 1.00 0.00 H new ATOM 0 HE2 HIS A 7 -4.453 3.205 0.766 1.00 0.00 H new ATOM 106 N HIS A 8 -10.077 1.308 1.756 1.00 0.00 N ATOM 107 CA HIS A 8 -10.842 1.442 0.518 1.00 0.00 C ATOM 108 C HIS A 8 -9.927 1.664 -0.689 1.00 0.00 C ATOM 109 O HIS A 8 -8.715 1.856 -0.552 1.00 0.00 O ATOM 110 CB HIS A 8 -11.877 2.561 0.647 1.00 0.00 C ATOM 111 CG HIS A 8 -12.973 2.255 1.630 1.00 0.00 C ATOM 112 ND1 HIS A 8 -13.538 1.018 1.888 1.00 0.00 N ATOM 113 CD2 HIS A 8 -13.565 3.173 2.450 1.00 0.00 C ATOM 114 CE1 HIS A 8 -14.448 1.191 2.864 1.00 0.00 C ATOM 115 NE2 HIS A 8 -14.493 2.482 3.230 1.00 0.00 N ATOM 0 H HIS A 8 -10.291 2.030 2.444 1.00 0.00 H new ATOM 0 HA HIS A 8 -11.373 0.505 0.347 1.00 0.00 H new ATOM 0 HB2 HIS A 8 -11.373 3.478 0.951 1.00 0.00 H new ATOM 0 HB3 HIS A 8 -12.320 2.750 -0.331 1.00 0.00 H new ATOM 0 HD2 HIS A 8 -13.355 4.232 2.488 1.00 0.00 H new ATOM 0 HE1 HIS A 8 -15.054 0.406 3.291 1.00 0.00 H new ATOM 0 HE2 HIS A 8 -15.096 2.884 3.948 1.00 0.00 H new ATOM 123 N HIS A 9 -10.492 1.592 -1.890 1.00 0.00 N ATOM 124 CA HIS A 9 -9.738 1.507 -3.123 1.00 0.00 C ATOM 125 C HIS A 9 -9.540 2.919 -3.675 1.00 0.00 C ATOM 126 O HIS A 9 -10.409 3.448 -4.365 1.00 0.00 O ATOM 127 CB HIS A 9 -10.485 0.566 -4.076 1.00 0.00 C ATOM 128 CG HIS A 9 -9.664 0.202 -5.276 1.00 0.00 C ATOM 129 ND1 HIS A 9 -8.947 -0.961 -5.452 1.00 0.00 N ATOM 130 CD2 HIS A 9 -9.512 0.968 -6.396 1.00 0.00 C ATOM 131 CE1 HIS A 9 -8.392 -0.907 -6.673 1.00 0.00 C ATOM 132 NE2 HIS A 9 -8.702 0.251 -7.275 1.00 0.00 N ATOM 0 H HIS A 9 -11.502 1.591 -2.030 1.00 0.00 H new ATOM 0 HA HIS A 9 -8.742 1.089 -2.975 1.00 0.00 H new ATOM 0 HB2 HIS A 9 -10.765 -0.342 -3.541 1.00 0.00 H new ATOM 0 HB3 HIS A 9 -11.410 1.042 -4.402 1.00 0.00 H new ATOM 0 HD2 HIS A 9 -9.939 1.945 -6.568 1.00 0.00 H new ATOM 0 HE1 HIS A 9 -7.783 -1.685 -7.109 1.00 0.00 H new ATOM 0 HE2 HIS A 9 -8.401 0.551 -8.202 1.00 0.00 H new ATOM 140 N HIS A 10 -8.424 3.565 -3.335 1.00 0.00 N ATOM 141 CA HIS A 10 -8.118 4.930 -3.753 1.00 0.00 C ATOM 142 C HIS A 10 -6.599 5.100 -3.912 1.00 0.00 C ATOM 143 O HIS A 10 -6.006 6.083 -3.460 1.00 0.00 O ATOM 144 CB HIS A 10 -8.748 5.914 -2.753 1.00 0.00 C ATOM 145 CG HIS A 10 -8.717 7.340 -3.235 1.00 0.00 C ATOM 146 ND1 HIS A 10 -9.127 7.790 -4.472 1.00 0.00 N ATOM 147 CD2 HIS A 10 -8.241 8.414 -2.533 1.00 0.00 C ATOM 148 CE1 HIS A 10 -8.890 9.107 -4.522 1.00 0.00 C ATOM 149 NE2 HIS A 10 -8.381 9.537 -3.354 1.00 0.00 N ATOM 0 H HIS A 10 -7.698 3.147 -2.753 1.00 0.00 H new ATOM 0 HA HIS A 10 -8.551 5.146 -4.730 1.00 0.00 H new ATOM 0 HB2 HIS A 10 -9.781 5.622 -2.565 1.00 0.00 H new ATOM 0 HB3 HIS A 10 -8.220 5.846 -1.802 1.00 0.00 H new ATOM 0 HD2 HIS A 10 -7.834 8.397 -1.533 1.00 0.00 H new ATOM 0 HE1 HIS A 10 -9.081 9.735 -5.380 1.00 0.00 H new ATOM 0 HE2 HIS A 10 -8.143 10.499 -3.113 1.00 0.00 H new ATOM 157 N HIS A 11 -5.946 4.112 -4.533 1.00 0.00 N ATOM 158 CA HIS A 11 -4.535 4.225 -4.888 1.00 0.00 C ATOM 159 C HIS A 11 -4.367 5.367 -5.899 1.00 0.00 C ATOM 160 O HIS A 11 -5.267 5.591 -6.718 1.00 0.00 O ATOM 161 CB HIS A 11 -4.018 2.884 -5.433 1.00 0.00 C ATOM 162 CG HIS A 11 -4.498 2.519 -6.822 1.00 0.00 C ATOM 163 ND1 HIS A 11 -3.975 2.987 -8.009 1.00 0.00 N ATOM 164 CD2 HIS A 11 -5.519 1.661 -7.134 1.00 0.00 C ATOM 165 CE1 HIS A 11 -4.674 2.432 -9.010 1.00 0.00 C ATOM 166 NE2 HIS A 11 -5.636 1.625 -8.529 1.00 0.00 N ATOM 0 H HIS A 11 -6.376 3.226 -4.799 1.00 0.00 H new ATOM 0 HA HIS A 11 -3.939 4.460 -4.006 1.00 0.00 H new ATOM 0 HB2 HIS A 11 -2.928 2.909 -5.439 1.00 0.00 H new ATOM 0 HB3 HIS A 11 -4.315 2.093 -4.745 1.00 0.00 H new ATOM 0 HD1 HIS A 11 -3.196 3.638 -8.108 1.00 0.00 H new ATOM 0 HD2 HIS A 11 -6.125 1.111 -6.430 1.00 0.00 H new ATOM 0 HE1 HIS A 11 -4.489 2.609 -10.059 1.00 0.00 H new ATOM 174 N HIS A 12 -3.232 6.071 -5.873 1.00 0.00 N ATOM 175 CA HIS A 12 -2.903 7.014 -6.933 1.00 0.00 C ATOM 176 C HIS A 12 -2.151 6.253 -8.021 1.00 0.00 C ATOM 177 O HIS A 12 -2.783 5.647 -8.886 1.00 0.00 O ATOM 178 CB HIS A 12 -2.155 8.250 -6.406 1.00 0.00 C ATOM 179 CG HIS A 12 -1.823 9.226 -7.511 1.00 0.00 C ATOM 180 ND1 HIS A 12 -2.731 9.900 -8.297 1.00 0.00 N ATOM 181 CD2 HIS A 12 -0.571 9.542 -7.970 1.00 0.00 C ATOM 182 CE1 HIS A 12 -2.041 10.603 -9.207 1.00 0.00 C ATOM 183 NE2 HIS A 12 -0.720 10.400 -9.067 1.00 0.00 N ATOM 0 H HIS A 12 -2.533 6.003 -5.133 1.00 0.00 H new ATOM 0 HA HIS A 12 -3.814 7.428 -7.365 1.00 0.00 H new ATOM 0 HB2 HIS A 12 -2.765 8.749 -5.653 1.00 0.00 H new ATOM 0 HB3 HIS A 12 -1.236 7.934 -5.913 1.00 0.00 H new ATOM 0 HD2 HIS A 12 0.364 9.192 -7.559 1.00 0.00 H new ATOM 0 HE1 HIS A 12 -2.487 11.246 -9.952 1.00 0.00 H new ATOM 0 HE2 HIS A 12 0.024 10.792 -9.644 1.00 0.00 H new ATOM 191 N MET A 13 -0.821 6.278 -8.003 1.00 0.00 N ATOM 192 CA MET A 13 0.034 5.832 -9.088 1.00 0.00 C ATOM 193 C MET A 13 1.374 5.499 -8.435 1.00 0.00 C ATOM 194 O MET A 13 2.138 6.406 -8.117 1.00 0.00 O ATOM 195 CB MET A 13 0.106 6.976 -10.122 1.00 0.00 C ATOM 196 CG MET A 13 0.521 6.534 -11.521 1.00 0.00 C ATOM 197 SD MET A 13 0.281 7.859 -12.742 1.00 0.00 S ATOM 198 CE MET A 13 0.493 6.934 -14.281 1.00 0.00 C ATOM 0 H MET A 13 -0.294 6.623 -7.201 1.00 0.00 H new ATOM 0 HA MET A 13 -0.321 4.952 -9.624 1.00 0.00 H new ATOM 0 HB2 MET A 13 -0.870 7.458 -10.181 1.00 0.00 H new ATOM 0 HB3 MET A 13 0.812 7.727 -9.767 1.00 0.00 H new ATOM 0 HG2 MET A 13 1.568 6.233 -11.512 1.00 0.00 H new ATOM 0 HG3 MET A 13 -0.060 5.659 -11.814 1.00 0.00 H new ATOM 0 HE1 MET A 13 0.375 7.608 -15.130 1.00 0.00 H new ATOM 0 HE2 MET A 13 1.489 6.491 -14.305 1.00 0.00 H new ATOM 0 HE3 MET A 13 -0.257 6.145 -14.337 1.00 0.00 H new ATOM 208 N PHE A 14 1.625 4.232 -8.104 1.00 0.00 N ATOM 209 CA PHE A 14 2.781 3.825 -7.326 1.00 0.00 C ATOM 210 C PHE A 14 4.064 4.004 -8.160 1.00 0.00 C ATOM 211 O PHE A 14 4.169 3.369 -9.219 1.00 0.00 O ATOM 212 CB PHE A 14 2.637 2.344 -6.965 1.00 0.00 C ATOM 213 CG PHE A 14 1.388 1.854 -6.262 1.00 0.00 C ATOM 214 CD1 PHE A 14 1.050 2.320 -4.979 1.00 0.00 C ATOM 215 CD2 PHE A 14 0.601 0.852 -6.864 1.00 0.00 C ATOM 216 CE1 PHE A 14 -0.087 1.813 -4.323 1.00 0.00 C ATOM 217 CE2 PHE A 14 -0.530 0.343 -6.204 1.00 0.00 C ATOM 218 CZ PHE A 14 -0.878 0.826 -4.935 1.00 0.00 C ATOM 0 H PHE A 14 1.021 3.456 -8.375 1.00 0.00 H new ATOM 0 HA PHE A 14 2.843 4.436 -6.425 1.00 0.00 H new ATOM 0 HB2 PHE A 14 2.734 1.774 -7.889 1.00 0.00 H new ATOM 0 HB3 PHE A 14 3.488 2.079 -6.337 1.00 0.00 H new ATOM 0 HD1 PHE A 14 1.663 3.067 -4.497 1.00 0.00 H new ATOM 0 HD2 PHE A 14 0.869 0.473 -7.839 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -0.353 2.184 -3.344 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -1.131 -0.421 -6.675 1.00 0.00 H new ATOM 0 HZ PHE A 14 -1.751 0.441 -4.429 1.00 0.00 H new ATOM 228 N PRO A 15 5.064 4.789 -7.725 1.00 0.00 N ATOM 229 CA PRO A 15 6.354 4.856 -8.396 1.00 0.00 C ATOM 230 C PRO A 15 7.209 3.627 -8.022 1.00 0.00 C ATOM 231 O PRO A 15 7.754 3.540 -6.914 1.00 0.00 O ATOM 232 CB PRO A 15 6.945 6.196 -7.963 1.00 0.00 C ATOM 233 CG PRO A 15 6.396 6.405 -6.557 1.00 0.00 C ATOM 234 CD PRO A 15 5.029 5.715 -6.600 1.00 0.00 C ATOM 0 HA PRO A 15 6.294 4.817 -9.484 1.00 0.00 H new ATOM 0 HB2 PRO A 15 8.035 6.171 -7.966 1.00 0.00 H new ATOM 0 HB3 PRO A 15 6.643 7.001 -8.633 1.00 0.00 H new ATOM 0 HG2 PRO A 15 7.046 5.962 -5.802 1.00 0.00 H new ATOM 0 HG3 PRO A 15 6.304 7.464 -6.316 1.00 0.00 H new ATOM 0 HD2 PRO A 15 4.833 5.185 -5.668 1.00 0.00 H new ATOM 0 HD3 PRO A 15 4.230 6.446 -6.725 1.00 0.00 H new ATOM 242 N TYR A 16 7.274 2.640 -8.918 1.00 0.00 N ATOM 243 CA TYR A 16 8.166 1.483 -8.873 1.00 0.00 C ATOM 244 C TYR A 16 8.240 0.831 -10.261 1.00 0.00 C ATOM 245 O TYR A 16 7.484 1.214 -11.162 1.00 0.00 O ATOM 246 CB TYR A 16 7.680 0.452 -7.840 1.00 0.00 C ATOM 247 CG TYR A 16 6.434 -0.328 -8.215 1.00 0.00 C ATOM 248 CD1 TYR A 16 5.164 0.164 -7.878 1.00 0.00 C ATOM 249 CD2 TYR A 16 6.545 -1.578 -8.849 1.00 0.00 C ATOM 250 CE1 TYR A 16 4.015 -0.614 -8.120 1.00 0.00 C ATOM 251 CE2 TYR A 16 5.394 -2.314 -9.177 1.00 0.00 C ATOM 252 CZ TYR A 16 4.123 -1.848 -8.788 1.00 0.00 C ATOM 253 OH TYR A 16 3.015 -2.605 -9.013 1.00 0.00 O ATOM 0 H TYR A 16 6.671 2.628 -9.740 1.00 0.00 H new ATOM 0 HA TYR A 16 9.157 1.825 -8.576 1.00 0.00 H new ATOM 0 HB2 TYR A 16 8.487 -0.257 -7.656 1.00 0.00 H new ATOM 0 HB3 TYR A 16 7.491 0.970 -6.900 1.00 0.00 H new ATOM 0 HD1 TYR A 16 5.067 1.143 -7.432 1.00 0.00 H new ATOM 0 HD2 TYR A 16 7.521 -1.975 -9.085 1.00 0.00 H new ATOM 0 HE1 TYR A 16 3.048 -0.262 -7.792 1.00 0.00 H new ATOM 0 HE2 TYR A 16 5.484 -3.238 -9.728 1.00 0.00 H new ATOM 0 HH TYR A 16 2.288 -2.302 -8.430 1.00 0.00 H new ATOM 263 N LYS A 17 9.093 -0.190 -10.414 1.00 0.00 N ATOM 264 CA LYS A 17 9.091 -1.116 -11.546 1.00 0.00 C ATOM 265 C LYS A 17 9.351 -2.553 -11.095 1.00 0.00 C ATOM 266 O LYS A 17 9.713 -2.782 -9.938 1.00 0.00 O ATOM 267 CB LYS A 17 10.115 -0.662 -12.595 1.00 0.00 C ATOM 268 CG LYS A 17 11.603 -0.883 -12.273 1.00 0.00 C ATOM 269 CD LYS A 17 12.377 -1.506 -13.442 1.00 0.00 C ATOM 270 CE LYS A 17 13.782 -0.938 -13.647 1.00 0.00 C ATOM 271 NZ LYS A 17 14.474 -1.583 -14.791 1.00 0.00 N ATOM 0 H LYS A 17 9.823 -0.398 -9.732 1.00 0.00 H new ATOM 0 HA LYS A 17 8.101 -1.103 -12.001 1.00 0.00 H new ATOM 0 HB2 LYS A 17 9.892 -1.178 -13.529 1.00 0.00 H new ATOM 0 HB3 LYS A 17 9.964 0.402 -12.775 1.00 0.00 H new ATOM 0 HG2 LYS A 17 12.059 0.071 -12.009 1.00 0.00 H new ATOM 0 HG3 LYS A 17 11.689 -1.530 -11.400 1.00 0.00 H new ATOM 0 HD2 LYS A 17 12.454 -2.581 -13.279 1.00 0.00 H new ATOM 0 HD3 LYS A 17 11.804 -1.363 -14.358 1.00 0.00 H new ATOM 0 HE2 LYS A 17 13.718 0.136 -13.819 1.00 0.00 H new ATOM 0 HE3 LYS A 17 14.368 -1.081 -12.739 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 15.423 -1.172 -14.899 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 14.557 -2.605 -14.615 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 13.927 -1.425 -15.661 1.00 0.00 H new ATOM 285 N ILE A 18 9.238 -3.511 -12.012 1.00 0.00 N ATOM 286 CA ILE A 18 9.548 -4.921 -11.795 1.00 0.00 C ATOM 287 C ILE A 18 10.664 -5.279 -12.766 1.00 0.00 C ATOM 288 O ILE A 18 10.773 -4.736 -13.864 1.00 0.00 O ATOM 289 CB ILE A 18 8.265 -5.769 -11.981 1.00 0.00 C ATOM 290 CG1 ILE A 18 7.249 -5.524 -10.840 1.00 0.00 C ATOM 291 CG2 ILE A 18 8.503 -7.287 -12.072 1.00 0.00 C ATOM 292 CD1 ILE A 18 5.856 -5.278 -11.417 1.00 0.00 C ATOM 0 H ILE A 18 8.916 -3.319 -12.961 1.00 0.00 H new ATOM 0 HA ILE A 18 9.892 -5.126 -10.781 1.00 0.00 H new ATOM 0 HB ILE A 18 7.873 -5.432 -12.941 1.00 0.00 H new ATOM 0 HG12 ILE A 18 7.227 -6.385 -10.172 1.00 0.00 H new ATOM 0 HG13 ILE A 18 7.560 -4.666 -10.244 1.00 0.00 H new ATOM 0 HG21 ILE A 18 7.549 -7.798 -12.201 1.00 0.00 H new ATOM 0 HG22 ILE A 18 9.149 -7.504 -12.923 1.00 0.00 H new ATOM 0 HG23 ILE A 18 8.980 -7.636 -11.156 1.00 0.00 H new ATOM 0 HD11 ILE A 18 5.150 -5.107 -10.604 1.00 0.00 H new ATOM 0 HD12 ILE A 18 5.880 -4.403 -12.066 1.00 0.00 H new ATOM 0 HD13 ILE A 18 5.542 -6.148 -11.993 1.00 0.00 H new ATOM 304 N VAL A 19 11.509 -6.192 -12.322 1.00 0.00 N ATOM 305 CA VAL A 19 12.679 -6.757 -12.958 1.00 0.00 C ATOM 306 C VAL A 19 12.446 -8.273 -12.934 1.00 0.00 C ATOM 307 O VAL A 19 11.338 -8.722 -12.623 1.00 0.00 O ATOM 308 CB VAL A 19 13.900 -6.198 -12.189 1.00 0.00 C ATOM 309 CG1 VAL A 19 15.254 -6.839 -12.461 1.00 0.00 C ATOM 310 CG2 VAL A 19 14.015 -4.711 -12.535 1.00 0.00 C ATOM 0 H VAL A 19 11.372 -6.601 -11.398 1.00 0.00 H new ATOM 0 HA VAL A 19 12.867 -6.498 -14.000 1.00 0.00 H new ATOM 0 HB VAL A 19 13.696 -6.418 -11.141 1.00 0.00 H new ATOM 0 HG11 VAL A 19 16.017 -6.349 -11.855 1.00 0.00 H new ATOM 0 HG12 VAL A 19 15.213 -7.898 -12.206 1.00 0.00 H new ATOM 0 HG13 VAL A 19 15.503 -6.729 -13.516 1.00 0.00 H new ATOM 0 HG21 VAL A 19 14.867 -4.280 -12.010 1.00 0.00 H new ATOM 0 HG22 VAL A 19 14.156 -4.597 -13.610 1.00 0.00 H new ATOM 0 HG23 VAL A 19 13.104 -4.195 -12.232 1.00 0.00 H new ATOM 320 N ASP A 20 13.419 -9.068 -13.364 1.00 0.00 N ATOM 321 CA ASP A 20 13.226 -10.460 -13.724 1.00 0.00 C ATOM 322 C ASP A 20 12.519 -11.269 -12.645 1.00 0.00 C ATOM 323 O ASP A 20 11.443 -11.804 -12.901 1.00 0.00 O ATOM 324 CB ASP A 20 14.553 -11.081 -14.158 1.00 0.00 C ATOM 325 CG ASP A 20 14.678 -10.948 -15.671 1.00 0.00 C ATOM 326 OD1 ASP A 20 13.811 -11.496 -16.393 1.00 0.00 O ATOM 327 OD2 ASP A 20 15.556 -10.191 -16.131 1.00 0.00 O ATOM 0 H ASP A 20 14.383 -8.752 -13.473 1.00 0.00 H new ATOM 0 HA ASP A 20 12.546 -10.488 -14.576 1.00 0.00 H new ATOM 0 HB2 ASP A 20 15.385 -10.580 -13.664 1.00 0.00 H new ATOM 0 HB3 ASP A 20 14.594 -12.130 -13.865 1.00 0.00 H new ATOM 332 N ASP A 21 13.044 -11.253 -11.419 1.00 0.00 N ATOM 333 CA ASP A 21 12.302 -11.681 -10.228 1.00 0.00 C ATOM 334 C ASP A 21 12.349 -10.597 -9.155 1.00 0.00 C ATOM 335 O ASP A 21 12.066 -10.878 -7.991 1.00 0.00 O ATOM 336 CB ASP A 21 12.848 -12.975 -9.599 1.00 0.00 C ATOM 337 CG ASP A 21 13.075 -14.150 -10.532 1.00 0.00 C ATOM 338 OD1 ASP A 21 12.229 -14.445 -11.402 1.00 0.00 O ATOM 339 OD2 ASP A 21 14.110 -14.836 -10.364 1.00 0.00 O ATOM 0 H ASP A 21 13.996 -10.943 -11.222 1.00 0.00 H new ATOM 0 HA ASP A 21 11.284 -11.865 -10.571 1.00 0.00 H new ATOM 0 HB2 ASP A 21 13.794 -12.742 -9.111 1.00 0.00 H new ATOM 0 HB3 ASP A 21 12.156 -13.291 -8.818 1.00 0.00 H new ATOM 344 N VAL A 22 12.788 -9.382 -9.483 1.00 0.00 N ATOM 345 CA VAL A 22 13.150 -8.367 -8.497 1.00 0.00 C ATOM 346 C VAL A 22 12.246 -7.150 -8.696 1.00 0.00 C ATOM 347 O VAL A 22 11.573 -7.040 -9.717 1.00 0.00 O ATOM 348 CB VAL A 22 14.683 -8.125 -8.512 1.00 0.00 C ATOM 349 CG1 VAL A 22 15.084 -7.207 -7.357 1.00 0.00 C ATOM 350 CG2 VAL A 22 15.420 -9.474 -8.336 1.00 0.00 C ATOM 0 H VAL A 22 12.903 -9.073 -10.448 1.00 0.00 H new ATOM 0 HA VAL A 22 12.963 -8.690 -7.473 1.00 0.00 H new ATOM 0 HB VAL A 22 14.952 -7.663 -9.462 1.00 0.00 H new ATOM 0 HG11 VAL A 22 16.162 -7.045 -7.378 1.00 0.00 H new ATOM 0 HG12 VAL A 22 14.571 -6.250 -7.458 1.00 0.00 H new ATOM 0 HG13 VAL A 22 14.806 -7.670 -6.410 1.00 0.00 H new ATOM 0 HG21 VAL A 22 16.497 -9.304 -8.347 1.00 0.00 H new ATOM 0 HG22 VAL A 22 15.133 -9.924 -7.386 1.00 0.00 H new ATOM 0 HG23 VAL A 22 15.150 -10.145 -9.152 1.00 0.00 H new ATOM 360 N VAL A 23 12.178 -6.256 -7.716 1.00 0.00 N ATOM 361 CA VAL A 23 11.229 -5.156 -7.674 1.00 0.00 C ATOM 362 C VAL A 23 12.042 -3.917 -7.327 1.00 0.00 C ATOM 363 O VAL A 23 12.782 -3.943 -6.341 1.00 0.00 O ATOM 364 CB VAL A 23 10.139 -5.471 -6.632 1.00 0.00 C ATOM 365 CG1 VAL A 23 9.126 -4.330 -6.580 1.00 0.00 C ATOM 366 CG2 VAL A 23 9.393 -6.785 -6.920 1.00 0.00 C ATOM 0 H VAL A 23 12.800 -6.279 -6.908 1.00 0.00 H new ATOM 0 HA VAL A 23 10.711 -4.997 -8.620 1.00 0.00 H new ATOM 0 HB VAL A 23 10.648 -5.584 -5.675 1.00 0.00 H new ATOM 0 HG11 VAL A 23 8.358 -4.559 -5.841 1.00 0.00 H new ATOM 0 HG12 VAL A 23 9.633 -3.406 -6.302 1.00 0.00 H new ATOM 0 HG13 VAL A 23 8.663 -4.210 -7.559 1.00 0.00 H new ATOM 0 HG21 VAL A 23 8.638 -6.951 -6.151 1.00 0.00 H new ATOM 0 HG22 VAL A 23 8.910 -6.723 -7.895 1.00 0.00 H new ATOM 0 HG23 VAL A 23 10.101 -7.613 -6.918 1.00 0.00 H new ATOM 376 N ILE A 24 11.955 -2.862 -8.144 1.00 0.00 N ATOM 377 CA ILE A 24 12.734 -1.648 -7.954 1.00 0.00 C ATOM 378 C ILE A 24 11.764 -0.584 -7.469 1.00 0.00 C ATOM 379 O ILE A 24 10.947 -0.078 -8.239 1.00 0.00 O ATOM 380 CB ILE A 24 13.526 -1.204 -9.207 1.00 0.00 C ATOM 381 CG1 ILE A 24 14.257 -2.289 -10.043 1.00 0.00 C ATOM 382 CG2 ILE A 24 14.572 -0.204 -8.700 1.00 0.00 C ATOM 383 CD1 ILE A 24 14.600 -3.636 -9.392 1.00 0.00 C ATOM 0 H ILE A 24 11.339 -2.832 -8.956 1.00 0.00 H new ATOM 0 HA ILE A 24 13.518 -1.829 -7.219 1.00 0.00 H new ATOM 0 HB ILE A 24 12.783 -0.817 -9.905 1.00 0.00 H new ATOM 0 HG12 ILE A 24 13.643 -2.496 -10.919 1.00 0.00 H new ATOM 0 HG13 ILE A 24 15.189 -1.853 -10.403 1.00 0.00 H new ATOM 0 HG21 ILE A 24 15.171 0.153 -9.538 1.00 0.00 H new ATOM 0 HG22 ILE A 24 14.069 0.640 -8.228 1.00 0.00 H new ATOM 0 HG23 ILE A 24 15.220 -0.693 -7.973 1.00 0.00 H new ATOM 0 HD11 ILE A 24 15.107 -4.272 -10.117 1.00 0.00 H new ATOM 0 HD12 ILE A 24 15.253 -3.470 -8.535 1.00 0.00 H new ATOM 0 HD13 ILE A 24 13.683 -4.124 -9.060 1.00 0.00 H new ATOM 395 N LEU A 25 11.799 -0.288 -6.174 1.00 0.00 N ATOM 396 CA LEU A 25 10.928 0.684 -5.540 1.00 0.00 C ATOM 397 C LEU A 25 11.686 2.002 -5.624 1.00 0.00 C ATOM 398 O LEU A 25 12.693 2.177 -4.938 1.00 0.00 O ATOM 399 CB LEU A 25 10.613 0.241 -4.097 1.00 0.00 C ATOM 400 CG LEU A 25 10.040 -1.191 -4.023 1.00 0.00 C ATOM 401 CD1 LEU A 25 9.737 -1.614 -2.592 1.00 0.00 C ATOM 402 CD2 LEU A 25 8.756 -1.350 -4.829 1.00 0.00 C ATOM 0 H LEU A 25 12.450 -0.730 -5.525 1.00 0.00 H new ATOM 0 HA LEU A 25 9.956 0.784 -6.023 1.00 0.00 H new ATOM 0 HB2 LEU A 25 11.522 0.295 -3.498 1.00 0.00 H new ATOM 0 HB3 LEU A 25 9.899 0.937 -3.656 1.00 0.00 H new ATOM 0 HG LEU A 25 10.820 -1.825 -4.445 1.00 0.00 H new ATOM 0 HD11 LEU A 25 9.336 -2.628 -2.589 1.00 0.00 H new ATOM 0 HD12 LEU A 25 10.653 -1.585 -2.002 1.00 0.00 H new ATOM 0 HD13 LEU A 25 9.004 -0.933 -2.159 1.00 0.00 H new ATOM 0 HD21 LEU A 25 8.397 -2.375 -4.742 1.00 0.00 H new ATOM 0 HD22 LEU A 25 7.999 -0.666 -4.446 1.00 0.00 H new ATOM 0 HD23 LEU A 25 8.953 -1.122 -5.877 1.00 0.00 H new ATOM 414 N MET A 26 11.269 2.887 -6.528 1.00 0.00 N ATOM 415 CA MET A 26 11.982 4.116 -6.861 1.00 0.00 C ATOM 416 C MET A 26 11.130 5.295 -6.392 1.00 0.00 C ATOM 417 O MET A 26 10.325 5.801 -7.173 1.00 0.00 O ATOM 418 CB MET A 26 12.282 4.179 -8.368 1.00 0.00 C ATOM 419 CG MET A 26 13.187 3.032 -8.818 1.00 0.00 C ATOM 420 SD MET A 26 14.018 3.246 -10.417 1.00 0.00 S ATOM 421 CE MET A 26 12.583 3.431 -11.506 1.00 0.00 C ATOM 0 H MET A 26 10.407 2.766 -7.060 1.00 0.00 H new ATOM 0 HA MET A 26 12.947 4.150 -6.356 1.00 0.00 H new ATOM 0 HB2 MET A 26 11.346 4.143 -8.926 1.00 0.00 H new ATOM 0 HB3 MET A 26 12.758 5.131 -8.604 1.00 0.00 H new ATOM 0 HG2 MET A 26 13.949 2.877 -8.054 1.00 0.00 H new ATOM 0 HG3 MET A 26 12.590 2.121 -8.862 1.00 0.00 H new ATOM 0 HE1 MET A 26 12.920 3.537 -12.537 1.00 0.00 H new ATOM 0 HE2 MET A 26 11.946 2.551 -11.421 1.00 0.00 H new ATOM 0 HE3 MET A 26 12.018 4.317 -11.216 1.00 0.00 H new ATOM 431 N PRO A 27 11.225 5.710 -5.116 1.00 0.00 N ATOM 432 CA PRO A 27 10.491 6.864 -4.629 1.00 0.00 C ATOM 433 C PRO A 27 11.075 8.142 -5.229 1.00 0.00 C ATOM 434 O PRO A 27 12.255 8.200 -5.584 1.00 0.00 O ATOM 435 CB PRO A 27 10.669 6.840 -3.113 1.00 0.00 C ATOM 436 CG PRO A 27 12.054 6.226 -2.938 1.00 0.00 C ATOM 437 CD PRO A 27 12.143 5.232 -4.094 1.00 0.00 C ATOM 0 HA PRO A 27 9.437 6.837 -4.907 1.00 0.00 H new ATOM 0 HB2 PRO A 27 10.615 7.841 -2.685 1.00 0.00 H new ATOM 0 HB3 PRO A 27 9.898 6.242 -2.626 1.00 0.00 H new ATOM 0 HG2 PRO A 27 12.839 6.980 -2.994 1.00 0.00 H new ATOM 0 HG3 PRO A 27 12.156 5.731 -1.972 1.00 0.00 H new ATOM 0 HD2 PRO A 27 13.160 5.176 -4.481 1.00 0.00 H new ATOM 0 HD3 PRO A 27 11.871 4.229 -3.766 1.00 0.00 H new ATOM 445 N ASN A 28 10.238 9.177 -5.264 1.00 0.00 N ATOM 446 CA ASN A 28 10.553 10.491 -5.807 1.00 0.00 C ATOM 447 C ASN A 28 10.326 11.508 -4.687 1.00 0.00 C ATOM 448 O ASN A 28 11.231 11.668 -3.873 1.00 0.00 O ATOM 449 CB ASN A 28 9.849 10.761 -7.162 1.00 0.00 C ATOM 450 CG ASN A 28 8.744 9.779 -7.537 1.00 0.00 C ATOM 451 OD1 ASN A 28 8.884 8.974 -8.448 1.00 0.00 O ATOM 452 ND2 ASN A 28 7.615 9.807 -6.860 1.00 0.00 N ATOM 0 H ASN A 28 9.287 9.118 -4.901 1.00 0.00 H new ATOM 0 HA ASN A 28 11.599 10.572 -6.102 1.00 0.00 H new ATOM 0 HB2 ASN A 28 9.425 11.765 -7.137 1.00 0.00 H new ATOM 0 HB3 ASN A 28 10.602 10.752 -7.950 1.00 0.00 H new ATOM 0 HD21 ASN A 28 6.863 9.160 -7.096 1.00 0.00 H new ATOM 0 HD22 ASN A 28 7.493 10.476 -6.100 1.00 0.00 H new ATOM 459 N LYS A 29 9.152 12.138 -4.532 1.00 0.00 N ATOM 460 CA LYS A 29 8.950 13.181 -3.515 1.00 0.00 C ATOM 461 C LYS A 29 7.589 13.042 -2.825 1.00 0.00 C ATOM 462 O LYS A 29 6.752 13.948 -2.891 1.00 0.00 O ATOM 463 CB LYS A 29 9.229 14.585 -4.092 1.00 0.00 C ATOM 464 CG LYS A 29 8.448 14.936 -5.371 1.00 0.00 C ATOM 465 CD LYS A 29 9.253 14.670 -6.653 1.00 0.00 C ATOM 466 CE LYS A 29 8.336 14.399 -7.848 1.00 0.00 C ATOM 467 NZ LYS A 29 7.433 15.536 -8.116 1.00 0.00 N ATOM 0 H LYS A 29 8.327 11.943 -5.099 1.00 0.00 H new ATOM 0 HA LYS A 29 9.685 13.040 -2.722 1.00 0.00 H new ATOM 0 HB2 LYS A 29 8.996 15.327 -3.328 1.00 0.00 H new ATOM 0 HB3 LYS A 29 10.295 14.668 -4.302 1.00 0.00 H new ATOM 0 HG2 LYS A 29 7.526 14.355 -5.399 1.00 0.00 H new ATOM 0 HG3 LYS A 29 8.161 15.987 -5.339 1.00 0.00 H new ATOM 0 HD2 LYS A 29 9.889 15.529 -6.869 1.00 0.00 H new ATOM 0 HD3 LYS A 29 9.912 13.816 -6.499 1.00 0.00 H new ATOM 0 HE2 LYS A 29 8.941 14.199 -8.732 1.00 0.00 H new ATOM 0 HE3 LYS A 29 7.745 13.503 -7.657 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 6.888 15.350 -8.982 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 6.780 15.657 -7.315 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 7.994 16.403 -8.240 1.00 0.00 H new ATOM 481 N GLU A 30 7.350 11.893 -2.186 1.00 0.00 N ATOM 482 CA GLU A 30 6.066 11.575 -1.559 1.00 0.00 C ATOM 483 C GLU A 30 6.159 10.756 -0.272 1.00 0.00 C ATOM 484 O GLU A 30 5.125 10.271 0.196 1.00 0.00 O ATOM 485 CB GLU A 30 5.178 10.860 -2.581 1.00 0.00 C ATOM 486 CG GLU A 30 5.633 9.440 -2.945 1.00 0.00 C ATOM 487 CD GLU A 30 4.957 8.976 -4.238 1.00 0.00 C ATOM 488 OE1 GLU A 30 5.218 9.623 -5.275 1.00 0.00 O ATOM 489 OE2 GLU A 30 4.176 7.990 -4.210 1.00 0.00 O ATOM 0 H GLU A 30 8.046 11.154 -2.089 1.00 0.00 H new ATOM 0 HA GLU A 30 5.632 12.527 -1.252 1.00 0.00 H new ATOM 0 HB2 GLU A 30 4.162 10.812 -2.188 1.00 0.00 H new ATOM 0 HB3 GLU A 30 5.140 11.459 -3.491 1.00 0.00 H new ATOM 0 HG2 GLU A 30 6.716 9.418 -3.066 1.00 0.00 H new ATOM 0 HG3 GLU A 30 5.389 8.754 -2.134 1.00 0.00 H new ATOM 496 N LEU A 31 7.353 10.557 0.295 1.00 0.00 N ATOM 497 CA LEU A 31 7.558 9.727 1.487 1.00 0.00 C ATOM 498 C LEU A 31 7.173 10.488 2.757 1.00 0.00 C ATOM 499 O LEU A 31 7.953 10.614 3.702 1.00 0.00 O ATOM 500 CB LEU A 31 8.996 9.195 1.545 1.00 0.00 C ATOM 501 CG LEU A 31 9.423 8.387 0.310 1.00 0.00 C ATOM 502 CD1 LEU A 31 10.742 7.693 0.638 1.00 0.00 C ATOM 503 CD2 LEU A 31 8.366 7.378 -0.152 1.00 0.00 C ATOM 0 H LEU A 31 8.213 10.972 -0.064 1.00 0.00 H new ATOM 0 HA LEU A 31 6.899 8.862 1.420 1.00 0.00 H new ATOM 0 HB2 LEU A 31 9.677 10.037 1.667 1.00 0.00 H new ATOM 0 HB3 LEU A 31 9.103 8.567 2.430 1.00 0.00 H new ATOM 0 HG LEU A 31 9.544 9.073 -0.528 1.00 0.00 H new ATOM 0 HD11 LEU A 31 11.070 7.110 -0.223 1.00 0.00 H new ATOM 0 HD12 LEU A 31 11.497 8.441 0.879 1.00 0.00 H new ATOM 0 HD13 LEU A 31 10.602 7.031 1.492 1.00 0.00 H new ATOM 0 HD21 LEU A 31 8.733 6.842 -1.028 1.00 0.00 H new ATOM 0 HD22 LEU A 31 8.166 6.668 0.650 1.00 0.00 H new ATOM 0 HD23 LEU A 31 7.447 7.905 -0.408 1.00 0.00 H new ATOM 515 N ASN A 32 5.957 11.016 2.751 1.00 0.00 N ATOM 516 CA ASN A 32 5.279 11.632 3.870 1.00 0.00 C ATOM 517 C ASN A 32 4.577 10.543 4.694 1.00 0.00 C ATOM 518 O ASN A 32 4.453 9.395 4.264 1.00 0.00 O ATOM 519 CB ASN A 32 4.284 12.671 3.331 1.00 0.00 C ATOM 520 CG ASN A 32 2.972 12.045 2.876 1.00 0.00 C ATOM 521 OD1 ASN A 32 2.030 12.005 3.650 1.00 0.00 O ATOM 522 ND2 ASN A 32 2.878 11.500 1.671 1.00 0.00 N ATOM 0 H ASN A 32 5.385 11.023 1.906 1.00 0.00 H new ATOM 0 HA ASN A 32 5.986 12.142 4.524 1.00 0.00 H new ATOM 0 HB2 ASN A 32 4.080 13.410 4.106 1.00 0.00 H new ATOM 0 HB3 ASN A 32 4.738 13.203 2.495 1.00 0.00 H new ATOM 0 HD21 ASN A 32 2.013 11.042 1.384 1.00 0.00 H new ATOM 0 HD22 ASN A 32 3.671 11.538 1.031 1.00 0.00 H new ATOM 529 N ILE A 33 4.082 10.905 5.877 1.00 0.00 N ATOM 530 CA ILE A 33 3.495 9.977 6.843 1.00 0.00 C ATOM 531 C ILE A 33 2.321 9.192 6.248 1.00 0.00 C ATOM 532 O ILE A 33 2.121 8.020 6.590 1.00 0.00 O ATOM 533 CB ILE A 33 3.096 10.773 8.108 1.00 0.00 C ATOM 534 CG1 ILE A 33 4.395 11.201 8.829 1.00 0.00 C ATOM 535 CG2 ILE A 33 2.135 9.989 9.024 1.00 0.00 C ATOM 536 CD1 ILE A 33 4.202 11.792 10.225 1.00 0.00 C ATOM 0 H ILE A 33 4.078 11.873 6.198 1.00 0.00 H new ATOM 0 HA ILE A 33 4.233 9.223 7.117 1.00 0.00 H new ATOM 0 HB ILE A 33 2.532 11.660 7.820 1.00 0.00 H new ATOM 0 HG12 ILE A 33 5.051 10.334 8.907 1.00 0.00 H new ATOM 0 HG13 ILE A 33 4.910 11.935 8.209 1.00 0.00 H new ATOM 0 HG21 ILE A 33 1.888 10.595 9.896 1.00 0.00 H new ATOM 0 HG22 ILE A 33 1.223 9.752 8.477 1.00 0.00 H new ATOM 0 HG23 ILE A 33 2.614 9.065 9.348 1.00 0.00 H new ATOM 0 HD11 ILE A 33 5.172 12.060 10.644 1.00 0.00 H new ATOM 0 HD12 ILE A 33 3.577 12.682 10.160 1.00 0.00 H new ATOM 0 HD13 ILE A 33 3.719 11.056 10.868 1.00 0.00 H new ATOM 548 N GLU A 34 1.519 9.797 5.376 1.00 0.00 N ATOM 549 CA GLU A 34 0.336 9.150 4.829 1.00 0.00 C ATOM 550 C GLU A 34 0.714 8.051 3.847 1.00 0.00 C ATOM 551 O GLU A 34 -0.093 7.151 3.621 1.00 0.00 O ATOM 552 CB GLU A 34 -0.596 10.161 4.167 1.00 0.00 C ATOM 553 CG GLU A 34 -0.882 11.287 5.161 1.00 0.00 C ATOM 554 CD GLU A 34 -2.171 12.041 4.859 1.00 0.00 C ATOM 555 OE1 GLU A 34 -2.531 12.250 3.676 1.00 0.00 O ATOM 556 OE2 GLU A 34 -2.820 12.438 5.855 1.00 0.00 O ATOM 0 H GLU A 34 1.672 10.745 5.032 1.00 0.00 H new ATOM 0 HA GLU A 34 -0.198 8.694 5.663 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -0.138 10.562 3.263 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -1.525 9.678 3.866 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -0.940 10.870 6.166 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -0.048 11.989 5.155 1.00 0.00 H new ATOM 563 N ASN A 35 1.957 8.036 3.369 1.00 0.00 N ATOM 564 CA ASN A 35 2.510 7.011 2.502 1.00 0.00 C ATOM 565 C ASN A 35 3.714 6.372 3.199 1.00 0.00 C ATOM 566 O ASN A 35 4.830 6.366 2.684 1.00 0.00 O ATOM 567 CB ASN A 35 2.814 7.621 1.132 1.00 0.00 C ATOM 568 CG ASN A 35 3.318 6.569 0.157 1.00 0.00 C ATOM 569 OD1 ASN A 35 2.695 5.524 -0.012 1.00 0.00 O ATOM 570 ND2 ASN A 35 4.420 6.850 -0.512 1.00 0.00 N ATOM 0 H ASN A 35 2.630 8.771 3.588 1.00 0.00 H new ATOM 0 HA ASN A 35 1.801 6.204 2.318 1.00 0.00 H new ATOM 0 HB2 ASN A 35 1.914 8.089 0.732 1.00 0.00 H new ATOM 0 HB3 ASN A 35 3.561 8.407 1.240 1.00 0.00 H new ATOM 0 HD21 ASN A 35 4.783 6.188 -1.198 1.00 0.00 H new ATOM 0 HD22 ASN A 35 4.909 7.729 -0.343 1.00 0.00 H new ATOM 577 N ALA A 36 3.478 5.851 4.411 1.00 0.00 N ATOM 578 CA ALA A 36 4.497 5.245 5.260 1.00 0.00 C ATOM 579 C ALA A 36 3.943 4.002 5.963 1.00 0.00 C ATOM 580 O ALA A 36 4.382 2.895 5.664 1.00 0.00 O ATOM 581 CB ALA A 36 5.047 6.280 6.236 1.00 0.00 C ATOM 0 H ALA A 36 2.549 5.842 4.833 1.00 0.00 H new ATOM 0 HA ALA A 36 5.331 4.908 4.644 1.00 0.00 H new ATOM 0 HB1 ALA A 36 5.807 5.818 6.866 1.00 0.00 H new ATOM 0 HB2 ALA A 36 5.490 7.106 5.679 1.00 0.00 H new ATOM 0 HB3 ALA A 36 4.238 6.657 6.861 1.00 0.00 H new ATOM 587 N HIS A 37 2.939 4.121 6.843 1.00 0.00 N ATOM 588 CA HIS A 37 2.251 2.926 7.336 1.00 0.00 C ATOM 589 C HIS A 37 1.657 2.158 6.153 1.00 0.00 C ATOM 590 O HIS A 37 1.843 0.938 6.075 1.00 0.00 O ATOM 591 CB HIS A 37 1.172 3.232 8.387 1.00 0.00 C ATOM 592 CG HIS A 37 0.618 1.968 9.012 1.00 0.00 C ATOM 593 ND1 HIS A 37 1.037 1.411 10.199 1.00 0.00 N ATOM 594 CD2 HIS A 37 -0.326 1.126 8.477 1.00 0.00 C ATOM 595 CE1 HIS A 37 0.368 0.261 10.371 1.00 0.00 C ATOM 596 NE2 HIS A 37 -0.457 0.027 9.338 1.00 0.00 N ATOM 0 H HIS A 37 2.595 5.005 7.217 1.00 0.00 H new ATOM 0 HA HIS A 37 2.993 2.312 7.846 1.00 0.00 H new ATOM 0 HB2 HIS A 37 1.594 3.867 9.166 1.00 0.00 H new ATOM 0 HB3 HIS A 37 0.361 3.793 7.922 1.00 0.00 H new ATOM 0 HD2 HIS A 37 -0.870 1.282 7.557 1.00 0.00 H new ATOM 0 HE1 HIS A 37 0.478 -0.390 11.226 1.00 0.00 H new ATOM 0 HE2 HIS A 37 -1.058 -0.786 9.206 1.00 0.00 H new ATOM 604 N LEU A 38 0.984 2.857 5.224 1.00 0.00 N ATOM 605 CA LEU A 38 0.410 2.224 4.051 1.00 0.00 C ATOM 606 C LEU A 38 1.523 1.672 3.165 1.00 0.00 C ATOM 607 O LEU A 38 1.292 0.669 2.518 1.00 0.00 O ATOM 608 CB LEU A 38 -0.583 3.147 3.305 1.00 0.00 C ATOM 609 CG LEU A 38 -0.070 3.875 2.040 1.00 0.00 C ATOM 610 CD1 LEU A 38 0.195 2.934 0.862 1.00 0.00 C ATOM 611 CD2 LEU A 38 -1.088 4.910 1.562 1.00 0.00 C ATOM 0 H LEU A 38 0.830 3.864 5.274 1.00 0.00 H new ATOM 0 HA LEU A 38 -0.199 1.379 4.372 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -1.449 2.549 3.021 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -0.934 3.902 4.009 1.00 0.00 H new ATOM 0 HG LEU A 38 0.869 4.340 2.341 1.00 0.00 H new ATOM 0 HD11 LEU A 38 0.552 3.511 0.009 1.00 0.00 H new ATOM 0 HD12 LEU A 38 0.949 2.200 1.145 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -0.728 2.420 0.592 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -0.707 5.410 0.672 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -2.029 4.413 1.325 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -1.255 5.646 2.348 1.00 0.00 H new ATOM 623 N PHE A 39 2.720 2.272 3.146 1.00 0.00 N ATOM 624 CA PHE A 39 3.826 1.907 2.256 1.00 0.00 C ATOM 625 C PHE A 39 4.117 0.414 2.370 1.00 0.00 C ATOM 626 O PHE A 39 4.058 -0.330 1.397 1.00 0.00 O ATOM 627 CB PHE A 39 5.056 2.732 2.651 1.00 0.00 C ATOM 628 CG PHE A 39 6.139 2.937 1.622 1.00 0.00 C ATOM 629 CD1 PHE A 39 5.929 3.801 0.532 1.00 0.00 C ATOM 630 CD2 PHE A 39 7.422 2.417 1.869 1.00 0.00 C ATOM 631 CE1 PHE A 39 7.012 4.205 -0.262 1.00 0.00 C ATOM 632 CE2 PHE A 39 8.506 2.835 1.079 1.00 0.00 C ATOM 633 CZ PHE A 39 8.303 3.739 0.023 1.00 0.00 C ATOM 0 H PHE A 39 2.951 3.047 3.768 1.00 0.00 H new ATOM 0 HA PHE A 39 3.563 2.118 1.220 1.00 0.00 H new ATOM 0 HB2 PHE A 39 4.709 3.715 2.969 1.00 0.00 H new ATOM 0 HB3 PHE A 39 5.509 2.257 3.521 1.00 0.00 H new ATOM 0 HD1 PHE A 39 4.933 4.153 0.307 1.00 0.00 H new ATOM 0 HD2 PHE A 39 7.573 1.700 2.662 1.00 0.00 H new ATOM 0 HE1 PHE A 39 6.851 4.875 -1.093 1.00 0.00 H new ATOM 0 HE2 PHE A 39 9.498 2.460 1.284 1.00 0.00 H new ATOM 0 HZ PHE A 39 9.141 4.075 -0.569 1.00 0.00 H new ATOM 643 N LYS A 40 4.344 -0.036 3.604 1.00 0.00 N ATOM 644 CA LYS A 40 4.496 -1.439 3.958 1.00 0.00 C ATOM 645 C LYS A 40 3.263 -2.242 3.543 1.00 0.00 C ATOM 646 O LYS A 40 3.409 -3.331 3.015 1.00 0.00 O ATOM 647 CB LYS A 40 4.793 -1.480 5.462 1.00 0.00 C ATOM 648 CG LYS A 40 4.894 -2.858 6.126 1.00 0.00 C ATOM 649 CD LYS A 40 3.529 -3.463 6.516 1.00 0.00 C ATOM 650 CE LYS A 40 3.634 -4.567 7.575 1.00 0.00 C ATOM 651 NZ LYS A 40 4.229 -4.090 8.841 1.00 0.00 N ATOM 0 H LYS A 40 4.429 0.588 4.406 1.00 0.00 H new ATOM 0 HA LYS A 40 5.319 -1.912 3.423 1.00 0.00 H new ATOM 0 HB2 LYS A 40 5.732 -0.954 5.634 1.00 0.00 H new ATOM 0 HB3 LYS A 40 4.014 -0.916 5.974 1.00 0.00 H new ATOM 0 HG2 LYS A 40 5.403 -3.542 5.447 1.00 0.00 H new ATOM 0 HG3 LYS A 40 5.513 -2.776 7.019 1.00 0.00 H new ATOM 0 HD2 LYS A 40 2.882 -2.670 6.891 1.00 0.00 H new ATOM 0 HD3 LYS A 40 3.051 -3.869 5.624 1.00 0.00 H new ATOM 0 HE2 LYS A 40 2.641 -4.969 7.774 1.00 0.00 H new ATOM 0 HE3 LYS A 40 4.236 -5.386 7.181 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 3.990 -4.751 9.607 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 5.263 -4.035 8.740 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 3.853 -3.147 9.068 1.00 0.00 H new ATOM 665 N LYS A 41 2.054 -1.748 3.796 1.00 0.00 N ATOM 666 CA LYS A 41 0.779 -2.400 3.469 1.00 0.00 C ATOM 667 C LYS A 41 0.589 -2.587 1.956 1.00 0.00 C ATOM 668 O LYS A 41 -0.050 -3.556 1.545 1.00 0.00 O ATOM 669 CB LYS A 41 -0.355 -1.529 4.066 1.00 0.00 C ATOM 670 CG LYS A 41 -1.208 -2.227 5.135 1.00 0.00 C ATOM 671 CD LYS A 41 -2.268 -3.155 4.529 1.00 0.00 C ATOM 672 CE LYS A 41 -3.661 -2.534 4.327 1.00 0.00 C ATOM 673 NZ LYS A 41 -3.660 -1.333 3.462 1.00 0.00 N ATOM 0 H LYS A 41 1.925 -0.845 4.253 1.00 0.00 H new ATOM 0 HA LYS A 41 0.765 -3.403 3.896 1.00 0.00 H new ATOM 0 HB2 LYS A 41 0.086 -0.632 4.501 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -1.008 -1.203 3.256 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -0.559 -2.804 5.793 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -1.699 -1.474 5.752 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -1.905 -3.510 3.564 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -2.370 -4.029 5.172 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -4.323 -3.283 3.892 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -4.075 -2.269 5.300 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -4.607 -1.198 3.055 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -3.404 -0.498 4.027 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -2.968 -1.458 2.696 1.00 0.00 H new ATOM 687 N TRP A 42 1.075 -1.663 1.131 1.00 0.00 N ATOM 688 CA TRP A 42 1.132 -1.782 -0.317 1.00 0.00 C ATOM 689 C TRP A 42 2.177 -2.848 -0.623 1.00 0.00 C ATOM 690 O TRP A 42 1.804 -3.912 -1.101 1.00 0.00 O ATOM 691 CB TRP A 42 1.399 -0.404 -0.952 1.00 0.00 C ATOM 692 CG TRP A 42 2.183 -0.366 -2.232 1.00 0.00 C ATOM 693 CD1 TRP A 42 1.834 -0.917 -3.416 1.00 0.00 C ATOM 694 CD2 TRP A 42 3.479 0.259 -2.462 1.00 0.00 C ATOM 695 NE1 TRP A 42 2.844 -0.712 -4.337 1.00 0.00 N ATOM 696 CE2 TRP A 42 3.914 -0.040 -3.784 1.00 0.00 C ATOM 697 CE3 TRP A 42 4.344 1.029 -1.664 1.00 0.00 C ATOM 698 CZ2 TRP A 42 5.187 0.335 -4.252 1.00 0.00 C ATOM 699 CZ3 TRP A 42 5.618 1.408 -2.114 1.00 0.00 C ATOM 700 CH2 TRP A 42 6.053 1.042 -3.398 1.00 0.00 C ATOM 0 H TRP A 42 1.454 -0.778 1.469 1.00 0.00 H new ATOM 0 HA TRP A 42 0.188 -2.101 -0.758 1.00 0.00 H new ATOM 0 HB2 TRP A 42 0.436 0.074 -1.134 1.00 0.00 H new ATOM 0 HB3 TRP A 42 1.925 0.207 -0.218 1.00 0.00 H new ATOM 0 HD1 TRP A 42 0.908 -1.437 -3.612 1.00 0.00 H new ATOM 0 HE1 TRP A 42 2.803 -1.020 -5.308 1.00 0.00 H new ATOM 0 HE3 TRP A 42 4.020 1.336 -0.681 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 5.496 0.083 -5.256 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 6.267 1.984 -1.470 1.00 0.00 H new ATOM 0 HH2 TRP A 42 7.048 1.302 -3.728 1.00 0.00 H new ATOM 711 N VAL A 43 3.445 -2.635 -0.254 1.00 0.00 N ATOM 712 CA VAL A 43 4.539 -3.573 -0.511 1.00 0.00 C ATOM 713 C VAL A 43 4.184 -5.022 -0.128 1.00 0.00 C ATOM 714 O VAL A 43 4.513 -5.947 -0.876 1.00 0.00 O ATOM 715 CB VAL A 43 5.821 -3.045 0.180 1.00 0.00 C ATOM 716 CG1 VAL A 43 6.954 -4.075 0.315 1.00 0.00 C ATOM 717 CG2 VAL A 43 6.370 -1.820 -0.567 1.00 0.00 C ATOM 0 H VAL A 43 3.742 -1.793 0.239 1.00 0.00 H new ATOM 0 HA VAL A 43 4.724 -3.623 -1.584 1.00 0.00 H new ATOM 0 HB VAL A 43 5.502 -2.790 1.190 1.00 0.00 H new ATOM 0 HG11 VAL A 43 7.808 -3.613 0.810 1.00 0.00 H new ATOM 0 HG12 VAL A 43 6.607 -4.923 0.906 1.00 0.00 H new ATOM 0 HG13 VAL A 43 7.252 -4.420 -0.675 1.00 0.00 H new ATOM 0 HG21 VAL A 43 7.270 -1.463 -0.067 1.00 0.00 H new ATOM 0 HG22 VAL A 43 6.610 -2.097 -1.593 1.00 0.00 H new ATOM 0 HG23 VAL A 43 5.619 -1.030 -0.571 1.00 0.00 H new ATOM 727 N PHE A 44 3.505 -5.237 1.002 1.00 0.00 N ATOM 728 CA PHE A 44 3.134 -6.558 1.487 1.00 0.00 C ATOM 729 C PHE A 44 2.216 -7.290 0.514 1.00 0.00 C ATOM 730 O PHE A 44 2.289 -8.508 0.430 1.00 0.00 O ATOM 731 CB PHE A 44 2.448 -6.464 2.859 1.00 0.00 C ATOM 732 CG PHE A 44 3.333 -6.846 4.031 1.00 0.00 C ATOM 733 CD1 PHE A 44 4.506 -6.120 4.320 1.00 0.00 C ATOM 734 CD2 PHE A 44 2.991 -7.958 4.825 1.00 0.00 C ATOM 735 CE1 PHE A 44 5.327 -6.492 5.401 1.00 0.00 C ATOM 736 CE2 PHE A 44 3.813 -8.331 5.902 1.00 0.00 C ATOM 737 CZ PHE A 44 4.974 -7.597 6.194 1.00 0.00 C ATOM 0 H PHE A 44 3.195 -4.481 1.612 1.00 0.00 H new ATOM 0 HA PHE A 44 4.059 -7.128 1.579 1.00 0.00 H new ATOM 0 HB2 PHE A 44 2.093 -5.444 3.005 1.00 0.00 H new ATOM 0 HB3 PHE A 44 1.570 -7.110 2.857 1.00 0.00 H new ATOM 0 HD1 PHE A 44 4.777 -5.272 3.708 1.00 0.00 H new ATOM 0 HD2 PHE A 44 2.097 -8.524 4.606 1.00 0.00 H new ATOM 0 HE1 PHE A 44 6.224 -5.931 5.620 1.00 0.00 H new ATOM 0 HE2 PHE A 44 3.551 -9.186 6.508 1.00 0.00 H new ATOM 0 HZ PHE A 44 5.596 -7.882 7.029 1.00 0.00 H new ATOM 747 N ASP A 45 1.333 -6.585 -0.180 1.00 0.00 N ATOM 748 CA ASP A 45 0.255 -7.170 -0.987 1.00 0.00 C ATOM 749 C ASP A 45 0.449 -6.941 -2.486 1.00 0.00 C ATOM 750 O ASP A 45 -0.205 -7.570 -3.316 1.00 0.00 O ATOM 751 CB ASP A 45 -1.074 -6.591 -0.505 1.00 0.00 C ATOM 752 CG ASP A 45 -2.291 -7.282 -1.121 1.00 0.00 C ATOM 753 OD1 ASP A 45 -2.308 -8.519 -1.283 1.00 0.00 O ATOM 754 OD2 ASP A 45 -3.331 -6.612 -1.313 1.00 0.00 O ATOM 0 H ASP A 45 1.341 -5.565 -0.202 1.00 0.00 H new ATOM 0 HA ASP A 45 0.265 -8.252 -0.852 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -1.127 -6.675 0.580 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -1.108 -5.528 -0.744 1.00 0.00 H new ATOM 759 N GLU A 46 1.377 -6.066 -2.843 1.00 0.00 N ATOM 760 CA GLU A 46 1.838 -5.828 -4.200 1.00 0.00 C ATOM 761 C GLU A 46 2.994 -6.780 -4.533 1.00 0.00 C ATOM 762 O GLU A 46 3.098 -7.228 -5.677 1.00 0.00 O ATOM 763 CB GLU A 46 2.286 -4.362 -4.271 1.00 0.00 C ATOM 764 CG GLU A 46 2.412 -3.822 -5.698 1.00 0.00 C ATOM 765 CD GLU A 46 1.102 -3.293 -6.281 1.00 0.00 C ATOM 766 OE1 GLU A 46 0.003 -3.764 -5.906 1.00 0.00 O ATOM 767 OE2 GLU A 46 1.193 -2.419 -7.174 1.00 0.00 O ATOM 0 H GLU A 46 1.851 -5.475 -2.160 1.00 0.00 H new ATOM 0 HA GLU A 46 1.048 -6.013 -4.928 1.00 0.00 H new ATOM 0 HB2 GLU A 46 1.573 -3.747 -3.722 1.00 0.00 H new ATOM 0 HB3 GLU A 46 3.248 -4.261 -3.768 1.00 0.00 H new ATOM 0 HG2 GLU A 46 3.152 -3.022 -5.708 1.00 0.00 H new ATOM 0 HG3 GLU A 46 2.791 -4.615 -6.343 1.00 0.00 H new ATOM 774 N PHE A 47 3.850 -7.107 -3.549 1.00 0.00 N ATOM 775 CA PHE A 47 5.099 -7.822 -3.785 1.00 0.00 C ATOM 776 C PHE A 47 5.256 -9.011 -2.847 1.00 0.00 C ATOM 777 O PHE A 47 5.380 -10.145 -3.301 1.00 0.00 O ATOM 778 CB PHE A 47 6.316 -6.887 -3.673 1.00 0.00 C ATOM 779 CG PHE A 47 6.169 -5.584 -4.420 1.00 0.00 C ATOM 780 CD1 PHE A 47 5.983 -5.584 -5.811 1.00 0.00 C ATOM 781 CD2 PHE A 47 6.165 -4.371 -3.714 1.00 0.00 C ATOM 782 CE1 PHE A 47 5.771 -4.373 -6.487 1.00 0.00 C ATOM 783 CE2 PHE A 47 5.930 -3.162 -4.384 1.00 0.00 C ATOM 784 CZ PHE A 47 5.749 -3.162 -5.776 1.00 0.00 C ATOM 0 H PHE A 47 3.687 -6.879 -2.568 1.00 0.00 H new ATOM 0 HA PHE A 47 5.054 -8.202 -4.806 1.00 0.00 H new ATOM 0 HB2 PHE A 47 6.497 -6.670 -2.620 1.00 0.00 H new ATOM 0 HB3 PHE A 47 7.196 -7.409 -4.047 1.00 0.00 H new ATOM 0 HD1 PHE A 47 6.003 -6.514 -6.360 1.00 0.00 H new ATOM 0 HD2 PHE A 47 6.344 -4.369 -2.649 1.00 0.00 H new ATOM 0 HE1 PHE A 47 5.624 -4.372 -7.557 1.00 0.00 H new ATOM 0 HE2 PHE A 47 5.888 -2.235 -3.832 1.00 0.00 H new ATOM 0 HZ PHE A 47 5.593 -2.231 -6.300 1.00 0.00 H new ATOM 794 N LEU A 48 5.324 -8.748 -1.541 1.00 0.00 N ATOM 795 CA LEU A 48 5.839 -9.724 -0.590 1.00 0.00 C ATOM 796 C LEU A 48 4.981 -10.983 -0.564 1.00 0.00 C ATOM 797 O LEU A 48 5.501 -12.071 -0.816 1.00 0.00 O ATOM 798 CB LEU A 48 6.011 -9.118 0.809 1.00 0.00 C ATOM 799 CG LEU A 48 6.919 -7.883 0.895 1.00 0.00 C ATOM 800 CD1 LEU A 48 7.281 -7.574 2.352 1.00 0.00 C ATOM 801 CD2 LEU A 48 8.210 -8.047 0.091 1.00 0.00 C ATOM 0 H LEU A 48 5.028 -7.867 -1.122 1.00 0.00 H new ATOM 0 HA LEU A 48 6.832 -10.019 -0.931 1.00 0.00 H new ATOM 0 HB2 LEU A 48 5.026 -8.849 1.191 1.00 0.00 H new ATOM 0 HB3 LEU A 48 6.411 -9.886 1.471 1.00 0.00 H new ATOM 0 HG LEU A 48 6.351 -7.058 0.466 1.00 0.00 H new ATOM 0 HD11 LEU A 48 7.925 -6.695 2.388 1.00 0.00 H new ATOM 0 HD12 LEU A 48 6.371 -7.381 2.920 1.00 0.00 H new ATOM 0 HD13 LEU A 48 7.805 -8.426 2.785 1.00 0.00 H new ATOM 0 HD21 LEU A 48 8.815 -7.145 0.186 1.00 0.00 H new ATOM 0 HD22 LEU A 48 8.770 -8.901 0.472 1.00 0.00 H new ATOM 0 HD23 LEU A 48 7.967 -8.211 -0.959 1.00 0.00 H new ATOM 813 N ASN A 49 3.680 -10.847 -0.307 1.00 0.00 N ATOM 814 CA ASN A 49 2.752 -11.974 -0.350 1.00 0.00 C ATOM 815 C ASN A 49 2.727 -12.584 -1.745 1.00 0.00 C ATOM 816 O ASN A 49 2.652 -13.805 -1.853 1.00 0.00 O ATOM 817 CB ASN A 49 1.333 -11.559 0.057 1.00 0.00 C ATOM 818 CG ASN A 49 1.163 -11.507 1.567 1.00 0.00 C ATOM 819 OD1 ASN A 49 1.162 -12.535 2.239 1.00 0.00 O ATOM 820 ND2 ASN A 49 1.003 -10.322 2.131 1.00 0.00 N ATOM 0 H ASN A 49 3.243 -9.958 -0.065 1.00 0.00 H new ATOM 0 HA ASN A 49 3.106 -12.715 0.367 1.00 0.00 H new ATOM 0 HB2 ASN A 49 1.106 -10.581 -0.367 1.00 0.00 H new ATOM 0 HB3 ASN A 49 0.615 -12.263 -0.364 1.00 0.00 H new ATOM 0 HD21 ASN A 49 0.876 -10.251 3.141 1.00 0.00 H new ATOM 0 HD22 ASN A 49 1.007 -9.479 1.557 1.00 0.00 H new ATOM 827 N LYS A 50 2.858 -11.764 -2.793 1.00 0.00 N ATOM 828 CA LYS A 50 2.866 -12.133 -4.210 1.00 0.00 C ATOM 829 C LYS A 50 3.969 -13.134 -4.560 1.00 0.00 C ATOM 830 O LYS A 50 3.902 -13.731 -5.633 1.00 0.00 O ATOM 831 CB LYS A 50 3.036 -10.851 -5.061 1.00 0.00 C ATOM 832 CG LYS A 50 1.911 -10.575 -6.066 1.00 0.00 C ATOM 833 CD LYS A 50 2.445 -10.379 -7.485 1.00 0.00 C ATOM 834 CE LYS A 50 1.360 -9.846 -8.425 1.00 0.00 C ATOM 835 NZ LYS A 50 0.240 -10.788 -8.603 1.00 0.00 N ATOM 0 H LYS A 50 2.969 -10.758 -2.664 1.00 0.00 H new ATOM 0 HA LYS A 50 1.917 -12.623 -4.428 1.00 0.00 H new ATOM 0 HB2 LYS A 50 3.117 -9.997 -4.389 1.00 0.00 H new ATOM 0 HB3 LYS A 50 3.978 -10.919 -5.605 1.00 0.00 H new ATOM 0 HG2 LYS A 50 1.205 -11.405 -6.056 1.00 0.00 H new ATOM 0 HG3 LYS A 50 1.361 -9.685 -5.759 1.00 0.00 H new ATOM 0 HD2 LYS A 50 3.285 -9.684 -7.466 1.00 0.00 H new ATOM 0 HD3 LYS A 50 2.824 -11.327 -7.866 1.00 0.00 H new ATOM 0 HE2 LYS A 50 0.977 -8.904 -8.032 1.00 0.00 H new ATOM 0 HE3 LYS A 50 1.803 -9.629 -9.397 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -0.463 -10.374 -9.248 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 0.596 -11.679 -9.004 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -0.205 -10.977 -7.682 1.00 0.00 H new ATOM 849 N GLY A 51 4.966 -13.300 -3.688 1.00 0.00 N ATOM 850 CA GLY A 51 6.068 -14.240 -3.817 1.00 0.00 C ATOM 851 C GLY A 51 7.420 -13.531 -3.883 1.00 0.00 C ATOM 852 O GLY A 51 8.458 -14.189 -3.798 1.00 0.00 O ATOM 0 H GLY A 51 5.024 -12.751 -2.830 1.00 0.00 H new ATOM 0 HA2 GLY A 51 6.060 -14.927 -2.971 1.00 0.00 H new ATOM 0 HA3 GLY A 51 5.929 -14.840 -4.716 1.00 0.00 H new ATOM 856 N TYR A 52 7.444 -12.205 -4.026 1.00 0.00 N ATOM 857 CA TYR A 52 8.675 -11.469 -4.266 1.00 0.00 C ATOM 858 C TYR A 52 9.523 -11.396 -2.993 1.00 0.00 C ATOM 859 O TYR A 52 9.112 -10.857 -1.962 1.00 0.00 O ATOM 860 CB TYR A 52 8.354 -10.090 -4.844 1.00 0.00 C ATOM 861 CG TYR A 52 7.931 -10.116 -6.304 1.00 0.00 C ATOM 862 CD1 TYR A 52 8.865 -10.475 -7.289 1.00 0.00 C ATOM 863 CD2 TYR A 52 6.628 -9.766 -6.696 1.00 0.00 C ATOM 864 CE1 TYR A 52 8.555 -10.373 -8.650 1.00 0.00 C ATOM 865 CE2 TYR A 52 6.291 -9.666 -8.057 1.00 0.00 C ATOM 866 CZ TYR A 52 7.270 -9.946 -9.040 1.00 0.00 C ATOM 867 OH TYR A 52 6.996 -9.862 -10.365 1.00 0.00 O ATOM 0 H TYR A 52 6.611 -11.618 -3.978 1.00 0.00 H new ATOM 0 HA TYR A 52 9.276 -11.999 -5.005 1.00 0.00 H new ATOM 0 HB2 TYR A 52 7.558 -9.636 -4.254 1.00 0.00 H new ATOM 0 HB3 TYR A 52 9.231 -9.451 -4.742 1.00 0.00 H new ATOM 0 HD1 TYR A 52 9.839 -10.836 -6.992 1.00 0.00 H new ATOM 0 HD2 TYR A 52 5.878 -9.572 -5.944 1.00 0.00 H new ATOM 0 HE1 TYR A 52 9.296 -10.620 -9.396 1.00 0.00 H new ATOM 0 HE2 TYR A 52 5.292 -9.378 -8.350 1.00 0.00 H new ATOM 0 HH TYR A 52 6.073 -9.556 -10.489 1.00 0.00 H new ATOM 877 N ASN A 53 10.739 -11.936 -3.083 1.00 0.00 N ATOM 878 CA ASN A 53 11.720 -12.071 -2.007 1.00 0.00 C ATOM 879 C ASN A 53 12.921 -11.136 -2.201 1.00 0.00 C ATOM 880 O ASN A 53 13.947 -11.308 -1.547 1.00 0.00 O ATOM 881 CB ASN A 53 12.157 -13.548 -1.876 1.00 0.00 C ATOM 882 CG ASN A 53 11.113 -14.500 -1.290 1.00 0.00 C ATOM 883 OD1 ASN A 53 10.915 -15.592 -1.810 1.00 0.00 O ATOM 884 ND2 ASN A 53 10.430 -14.154 -0.211 1.00 0.00 N ATOM 0 H ASN A 53 11.086 -12.314 -3.964 1.00 0.00 H new ATOM 0 HA ASN A 53 11.246 -11.766 -1.074 1.00 0.00 H new ATOM 0 HB2 ASN A 53 12.440 -13.913 -2.863 1.00 0.00 H new ATOM 0 HB3 ASN A 53 13.050 -13.589 -1.252 1.00 0.00 H new ATOM 0 HD21 ASN A 53 9.742 -14.795 0.185 1.00 0.00 H new ATOM 0 HD22 ASN A 53 10.591 -13.246 0.225 1.00 0.00 H new ATOM 891 N LYS A 54 12.856 -10.157 -3.103 1.00 0.00 N ATOM 892 CA LYS A 54 13.970 -9.287 -3.466 1.00 0.00 C ATOM 893 C LYS A 54 13.398 -7.950 -3.901 1.00 0.00 C ATOM 894 O LYS A 54 12.750 -7.843 -4.945 1.00 0.00 O ATOM 895 CB LYS A 54 14.855 -9.928 -4.547 1.00 0.00 C ATOM 896 CG LYS A 54 16.133 -10.549 -3.950 1.00 0.00 C ATOM 897 CD LYS A 54 16.434 -11.925 -4.539 1.00 0.00 C ATOM 898 CE LYS A 54 15.397 -12.919 -4.014 1.00 0.00 C ATOM 899 NZ LYS A 54 15.925 -14.299 -3.942 1.00 0.00 N ATOM 0 H LYS A 54 12.001 -9.943 -3.615 1.00 0.00 H new ATOM 0 HA LYS A 54 14.624 -9.134 -2.607 1.00 0.00 H new ATOM 0 HB2 LYS A 54 14.288 -10.698 -5.071 1.00 0.00 H new ATOM 0 HB3 LYS A 54 15.128 -9.175 -5.286 1.00 0.00 H new ATOM 0 HG2 LYS A 54 16.978 -9.885 -4.133 1.00 0.00 H new ATOM 0 HG3 LYS A 54 16.023 -10.634 -2.869 1.00 0.00 H new ATOM 0 HD2 LYS A 54 16.402 -11.885 -5.628 1.00 0.00 H new ATOM 0 HD3 LYS A 54 17.438 -12.244 -4.261 1.00 0.00 H new ATOM 0 HE2 LYS A 54 15.067 -12.607 -3.023 1.00 0.00 H new ATOM 0 HE3 LYS A 54 14.520 -12.902 -4.662 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 15.186 -14.935 -3.581 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 16.216 -14.609 -4.891 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 16.745 -14.324 -3.303 1.00 0.00 H new ATOM 913 N ILE A 55 13.563 -6.944 -3.058 1.00 0.00 N ATOM 914 CA ILE A 55 13.171 -5.562 -3.293 1.00 0.00 C ATOM 915 C ILE A 55 14.492 -4.796 -3.402 1.00 0.00 C ATOM 916 O ILE A 55 15.462 -5.198 -2.754 1.00 0.00 O ATOM 917 CB ILE A 55 12.275 -5.132 -2.110 1.00 0.00 C ATOM 918 CG1 ILE A 55 10.809 -5.596 -2.300 1.00 0.00 C ATOM 919 CG2 ILE A 55 12.249 -3.611 -1.924 1.00 0.00 C ATOM 920 CD1 ILE A 55 10.548 -7.101 -2.282 1.00 0.00 C ATOM 0 H ILE A 55 13.996 -7.075 -2.144 1.00 0.00 H new ATOM 0 HA ILE A 55 12.588 -5.382 -4.196 1.00 0.00 H new ATOM 0 HB ILE A 55 12.714 -5.607 -1.232 1.00 0.00 H new ATOM 0 HG12 ILE A 55 10.205 -5.138 -1.516 1.00 0.00 H new ATOM 0 HG13 ILE A 55 10.450 -5.202 -3.251 1.00 0.00 H new ATOM 0 HG21 ILE A 55 11.606 -3.358 -1.081 1.00 0.00 H new ATOM 0 HG22 ILE A 55 13.259 -3.251 -1.731 1.00 0.00 H new ATOM 0 HG23 ILE A 55 11.863 -3.140 -2.828 1.00 0.00 H new ATOM 0 HD11 ILE A 55 9.484 -7.287 -2.425 1.00 0.00 H new ATOM 0 HD12 ILE A 55 11.111 -7.578 -3.084 1.00 0.00 H new ATOM 0 HD13 ILE A 55 10.863 -7.513 -1.323 1.00 0.00 H new ATOM 932 N PHE A 56 14.538 -3.686 -4.141 1.00 0.00 N ATOM 933 CA PHE A 56 15.624 -2.710 -4.105 1.00 0.00 C ATOM 934 C PHE A 56 15.044 -1.309 -3.935 1.00 0.00 C ATOM 935 O PHE A 56 13.935 -1.049 -4.409 1.00 0.00 O ATOM 936 CB PHE A 56 16.485 -2.775 -5.378 1.00 0.00 C ATOM 937 CG PHE A 56 17.212 -4.087 -5.619 1.00 0.00 C ATOM 938 CD1 PHE A 56 17.769 -4.808 -4.544 1.00 0.00 C ATOM 939 CD2 PHE A 56 17.294 -4.617 -6.924 1.00 0.00 C ATOM 940 CE1 PHE A 56 18.360 -6.056 -4.789 1.00 0.00 C ATOM 941 CE2 PHE A 56 17.879 -5.869 -7.164 1.00 0.00 C ATOM 942 CZ PHE A 56 18.398 -6.600 -6.083 1.00 0.00 C ATOM 0 H PHE A 56 13.799 -3.436 -4.799 1.00 0.00 H new ATOM 0 HA PHE A 56 16.268 -2.947 -3.259 1.00 0.00 H new ATOM 0 HB2 PHE A 56 15.845 -2.573 -6.237 1.00 0.00 H new ATOM 0 HB3 PHE A 56 17.224 -1.975 -5.335 1.00 0.00 H new ATOM 0 HD1 PHE A 56 17.741 -4.404 -3.543 1.00 0.00 H new ATOM 0 HD2 PHE A 56 16.899 -4.048 -7.753 1.00 0.00 H new ATOM 0 HE1 PHE A 56 18.793 -6.608 -3.968 1.00 0.00 H new ATOM 0 HE2 PHE A 56 17.930 -6.266 -8.167 1.00 0.00 H new ATOM 0 HZ PHE A 56 18.825 -7.578 -6.247 1.00 0.00 H new ATOM 952 N LEU A 57 15.793 -0.399 -3.299 1.00 0.00 N ATOM 953 CA LEU A 57 15.406 1.001 -3.113 1.00 0.00 C ATOM 954 C LEU A 57 16.452 1.886 -3.782 1.00 0.00 C ATOM 955 O LEU A 57 17.586 1.929 -3.323 1.00 0.00 O ATOM 956 CB LEU A 57 15.261 1.309 -1.611 1.00 0.00 C ATOM 957 CG LEU A 57 15.250 2.800 -1.231 1.00 0.00 C ATOM 958 CD1 LEU A 57 14.164 3.578 -1.971 1.00 0.00 C ATOM 959 CD2 LEU A 57 15.033 2.931 0.281 1.00 0.00 C ATOM 0 H LEU A 57 16.702 -0.622 -2.893 1.00 0.00 H new ATOM 0 HA LEU A 57 14.439 1.199 -3.575 1.00 0.00 H new ATOM 0 HB2 LEU A 57 14.336 0.856 -1.254 1.00 0.00 H new ATOM 0 HB3 LEU A 57 16.080 0.824 -1.079 1.00 0.00 H new ATOM 0 HG LEU A 57 16.211 3.225 -1.521 1.00 0.00 H new ATOM 0 HD11 LEU A 57 14.197 4.625 -1.669 1.00 0.00 H new ATOM 0 HD12 LEU A 57 14.332 3.505 -3.045 1.00 0.00 H new ATOM 0 HD13 LEU A 57 13.187 3.160 -1.727 1.00 0.00 H new ATOM 0 HD21 LEU A 57 15.024 3.985 0.557 1.00 0.00 H new ATOM 0 HD22 LEU A 57 14.080 2.477 0.553 1.00 0.00 H new ATOM 0 HD23 LEU A 57 15.840 2.424 0.810 1.00 0.00 H new ATOM 971 N VAL A 58 16.109 2.549 -4.881 1.00 0.00 N ATOM 972 CA VAL A 58 16.967 3.556 -5.497 1.00 0.00 C ATOM 973 C VAL A 58 16.712 4.879 -4.771 1.00 0.00 C ATOM 974 O VAL A 58 15.551 5.235 -4.560 1.00 0.00 O ATOM 975 CB VAL A 58 16.666 3.652 -7.006 1.00 0.00 C ATOM 976 CG1 VAL A 58 17.655 4.583 -7.723 1.00 0.00 C ATOM 977 CG2 VAL A 58 16.727 2.283 -7.704 1.00 0.00 C ATOM 0 H VAL A 58 15.226 2.403 -5.371 1.00 0.00 H new ATOM 0 HA VAL A 58 18.021 3.293 -5.406 1.00 0.00 H new ATOM 0 HB VAL A 58 15.654 4.051 -7.073 1.00 0.00 H new ATOM 0 HG11 VAL A 58 17.411 4.625 -8.784 1.00 0.00 H new ATOM 0 HG12 VAL A 58 17.588 5.583 -7.295 1.00 0.00 H new ATOM 0 HG13 VAL A 58 18.669 4.202 -7.599 1.00 0.00 H new ATOM 0 HG21 VAL A 58 16.508 2.405 -8.765 1.00 0.00 H new ATOM 0 HG22 VAL A 58 17.724 1.859 -7.586 1.00 0.00 H new ATOM 0 HG23 VAL A 58 15.993 1.613 -7.256 1.00 0.00 H new ATOM 987 N LEU A 59 17.762 5.618 -4.408 1.00 0.00 N ATOM 988 CA LEU A 59 17.648 6.907 -3.713 1.00 0.00 C ATOM 989 C LEU A 59 18.046 8.080 -4.613 1.00 0.00 C ATOM 990 O LEU A 59 18.046 9.220 -4.171 1.00 0.00 O ATOM 991 CB LEU A 59 18.426 6.880 -2.383 1.00 0.00 C ATOM 992 CG LEU A 59 17.811 5.854 -1.408 1.00 0.00 C ATOM 993 CD1 LEU A 59 18.780 4.696 -1.152 1.00 0.00 C ATOM 994 CD2 LEU A 59 17.395 6.464 -0.068 1.00 0.00 C ATOM 0 H LEU A 59 18.726 5.338 -4.589 1.00 0.00 H new ATOM 0 HA LEU A 59 16.598 7.068 -3.466 1.00 0.00 H new ATOM 0 HB2 LEU A 59 19.470 6.628 -2.572 1.00 0.00 H new ATOM 0 HB3 LEU A 59 18.414 7.871 -1.930 1.00 0.00 H new ATOM 0 HG LEU A 59 16.908 5.488 -1.897 1.00 0.00 H new ATOM 0 HD11 LEU A 59 18.324 3.986 -0.462 1.00 0.00 H new ATOM 0 HD12 LEU A 59 19.004 4.194 -2.093 1.00 0.00 H new ATOM 0 HD13 LEU A 59 19.702 5.082 -0.718 1.00 0.00 H new ATOM 0 HD21 LEU A 59 16.971 5.688 0.569 1.00 0.00 H new ATOM 0 HD22 LEU A 59 18.267 6.898 0.421 1.00 0.00 H new ATOM 0 HD23 LEU A 59 16.650 7.241 -0.238 1.00 0.00 H new ATOM 1006 N SER A 60 18.311 7.834 -5.896 1.00 0.00 N ATOM 1007 CA SER A 60 18.704 8.853 -6.860 1.00 0.00 C ATOM 1008 C SER A 60 17.725 10.032 -6.860 1.00 0.00 C ATOM 1009 O SER A 60 18.143 11.191 -6.811 1.00 0.00 O ATOM 1010 CB SER A 60 18.809 8.181 -8.236 1.00 0.00 C ATOM 1011 OG SER A 60 19.083 9.100 -9.270 1.00 0.00 O ATOM 0 H SER A 60 18.256 6.899 -6.300 1.00 0.00 H new ATOM 0 HA SER A 60 19.671 9.277 -6.590 1.00 0.00 H new ATOM 0 HB2 SER A 60 19.595 7.426 -8.208 1.00 0.00 H new ATOM 0 HB3 SER A 60 17.876 7.662 -8.455 1.00 0.00 H new ATOM 0 HG SER A 60 19.142 8.623 -10.124 1.00 0.00 H new ATOM 1017 N ASP A 61 16.417 9.767 -6.918 1.00 0.00 N ATOM 1018 CA ASP A 61 15.395 10.787 -7.176 1.00 0.00 C ATOM 1019 C ASP A 61 14.915 11.468 -5.884 1.00 0.00 C ATOM 1020 O ASP A 61 13.972 12.262 -5.919 1.00 0.00 O ATOM 1021 CB ASP A 61 14.223 10.183 -7.969 1.00 0.00 C ATOM 1022 CG ASP A 61 14.618 9.674 -9.358 1.00 0.00 C ATOM 1023 OD1 ASP A 61 15.412 10.329 -10.071 1.00 0.00 O ATOM 1024 OD2 ASP A 61 14.162 8.570 -9.737 1.00 0.00 O ATOM 0 H ASP A 61 16.034 8.831 -6.786 1.00 0.00 H new ATOM 0 HA ASP A 61 15.852 11.569 -7.783 1.00 0.00 H new ATOM 0 HB2 ASP A 61 13.796 9.359 -7.398 1.00 0.00 H new ATOM 0 HB3 ASP A 61 13.442 10.936 -8.076 1.00 0.00 H new ATOM 1029 N VAL A 62 15.548 11.185 -4.742 1.00 0.00 N ATOM 1030 CA VAL A 62 15.144 11.631 -3.417 1.00 0.00 C ATOM 1031 C VAL A 62 16.389 12.142 -2.687 1.00 0.00 C ATOM 1032 O VAL A 62 17.403 11.458 -2.618 1.00 0.00 O ATOM 1033 CB VAL A 62 14.401 10.466 -2.712 1.00 0.00 C ATOM 1034 CG1 VAL A 62 15.163 9.139 -2.659 1.00 0.00 C ATOM 1035 CG2 VAL A 62 13.978 10.835 -1.288 1.00 0.00 C ATOM 0 H VAL A 62 16.392 10.613 -4.721 1.00 0.00 H new ATOM 0 HA VAL A 62 14.440 12.463 -3.441 1.00 0.00 H new ATOM 0 HB VAL A 62 13.529 10.310 -3.347 1.00 0.00 H new ATOM 0 HG11 VAL A 62 14.557 8.392 -2.146 1.00 0.00 H new ATOM 0 HG12 VAL A 62 15.375 8.801 -3.673 1.00 0.00 H new ATOM 0 HG13 VAL A 62 16.100 9.279 -2.120 1.00 0.00 H new ATOM 0 HG21 VAL A 62 13.461 9.991 -0.832 1.00 0.00 H new ATOM 0 HG22 VAL A 62 14.861 11.082 -0.699 1.00 0.00 H new ATOM 0 HG23 VAL A 62 13.310 11.696 -1.318 1.00 0.00 H new ATOM 1045 N GLU A 63 16.356 13.364 -2.157 1.00 0.00 N ATOM 1046 CA GLU A 63 17.495 13.875 -1.406 1.00 0.00 C ATOM 1047 C GLU A 63 17.521 13.211 -0.033 1.00 0.00 C ATOM 1048 O GLU A 63 18.593 12.895 0.482 1.00 0.00 O ATOM 1049 CB GLU A 63 17.355 15.381 -1.228 1.00 0.00 C ATOM 1050 CG GLU A 63 18.566 16.015 -0.524 1.00 0.00 C ATOM 1051 CD GLU A 63 18.387 17.512 -0.269 1.00 0.00 C ATOM 1052 OE1 GLU A 63 17.297 17.928 0.208 1.00 0.00 O ATOM 1053 OE2 GLU A 63 19.381 18.253 -0.430 1.00 0.00 O ATOM 0 H GLU A 63 15.567 14.006 -2.233 1.00 0.00 H new ATOM 0 HA GLU A 63 18.417 13.657 -1.946 1.00 0.00 H new ATOM 0 HB2 GLU A 63 17.224 15.847 -2.205 1.00 0.00 H new ATOM 0 HB3 GLU A 63 16.454 15.592 -0.651 1.00 0.00 H new ATOM 0 HG2 GLU A 63 18.735 15.507 0.425 1.00 0.00 H new ATOM 0 HG3 GLU A 63 19.457 15.859 -1.132 1.00 0.00 H new ATOM 1060 N SER A 64 16.352 13.079 0.608 1.00 0.00 N ATOM 1061 CA SER A 64 16.257 12.591 1.963 1.00 0.00 C ATOM 1062 C SER A 64 14.842 12.126 2.297 1.00 0.00 C ATOM 1063 O SER A 64 13.928 12.163 1.467 1.00 0.00 O ATOM 1064 CB SER A 64 16.781 13.685 2.905 1.00 0.00 C ATOM 1065 OG SER A 64 15.804 14.556 3.446 1.00 0.00 O ATOM 0 H SER A 64 15.452 13.312 0.188 1.00 0.00 H new ATOM 0 HA SER A 64 16.876 11.703 2.090 1.00 0.00 H new ATOM 0 HB2 SER A 64 17.309 13.205 3.729 1.00 0.00 H new ATOM 0 HB3 SER A 64 17.513 14.284 2.363 1.00 0.00 H new ATOM 0 HG SER A 64 16.154 15.471 3.461 1.00 0.00 H new ATOM 1071 N ILE A 65 14.662 11.697 3.541 1.00 0.00 N ATOM 1072 CA ILE A 65 13.442 11.127 4.059 1.00 0.00 C ATOM 1073 C ILE A 65 13.216 11.663 5.478 1.00 0.00 C ATOM 1074 O ILE A 65 14.159 12.137 6.122 1.00 0.00 O ATOM 1075 CB ILE A 65 13.592 9.594 3.960 1.00 0.00 C ATOM 1076 CG1 ILE A 65 12.256 8.920 4.288 1.00 0.00 C ATOM 1077 CG2 ILE A 65 14.755 9.065 4.827 1.00 0.00 C ATOM 1078 CD1 ILE A 65 12.248 7.443 3.911 1.00 0.00 C ATOM 0 H ILE A 65 15.402 11.743 4.241 1.00 0.00 H new ATOM 0 HA ILE A 65 12.551 11.406 3.496 1.00 0.00 H new ATOM 0 HB ILE A 65 13.856 9.337 2.934 1.00 0.00 H new ATOM 0 HG12 ILE A 65 12.051 9.022 5.354 1.00 0.00 H new ATOM 0 HG13 ILE A 65 11.453 9.433 3.759 1.00 0.00 H new ATOM 0 HG21 ILE A 65 14.821 7.982 4.725 1.00 0.00 H new ATOM 0 HG22 ILE A 65 15.690 9.518 4.498 1.00 0.00 H new ATOM 0 HG23 ILE A 65 14.576 9.321 5.871 1.00 0.00 H new ATOM 0 HD11 ILE A 65 11.280 7.009 4.162 1.00 0.00 H new ATOM 0 HD12 ILE A 65 12.425 7.340 2.840 1.00 0.00 H new ATOM 0 HD13 ILE A 65 13.033 6.923 4.460 1.00 0.00 H new ATOM 1090 N ASP A 66 11.986 11.597 5.973 1.00 0.00 N ATOM 1091 CA ASP A 66 11.634 11.913 7.357 1.00 0.00 C ATOM 1092 C ASP A 66 11.867 10.698 8.258 1.00 0.00 C ATOM 1093 O ASP A 66 11.761 9.553 7.806 1.00 0.00 O ATOM 1094 CB ASP A 66 10.143 12.292 7.431 1.00 0.00 C ATOM 1095 CG ASP A 66 9.856 13.747 7.788 1.00 0.00 C ATOM 1096 OD1 ASP A 66 10.784 14.560 7.997 1.00 0.00 O ATOM 1097 OD2 ASP A 66 8.647 14.068 7.864 1.00 0.00 O ATOM 0 H ASP A 66 11.183 11.315 5.411 1.00 0.00 H new ATOM 0 HA ASP A 66 12.258 12.741 7.693 1.00 0.00 H new ATOM 0 HB2 ASP A 66 9.682 12.074 6.468 1.00 0.00 H new ATOM 0 HB3 ASP A 66 9.659 11.652 8.169 1.00 0.00 H new ATOM 1102 N SER A 67 12.069 10.934 9.559 1.00 0.00 N ATOM 1103 CA SER A 67 12.289 9.905 10.578 1.00 0.00 C ATOM 1104 C SER A 67 11.201 8.827 10.600 1.00 0.00 C ATOM 1105 O SER A 67 11.491 7.691 10.976 1.00 0.00 O ATOM 1106 CB SER A 67 12.352 10.567 11.959 1.00 0.00 C ATOM 1107 OG SER A 67 13.196 11.705 11.921 1.00 0.00 O ATOM 0 H SER A 67 12.084 11.879 9.943 1.00 0.00 H new ATOM 0 HA SER A 67 13.228 9.412 10.326 1.00 0.00 H new ATOM 0 HB2 SER A 67 11.351 10.859 12.276 1.00 0.00 H new ATOM 0 HB3 SER A 67 12.724 9.854 12.695 1.00 0.00 H new ATOM 0 HG SER A 67 13.226 12.120 12.808 1.00 0.00 H new ATOM 1113 N PHE A 68 9.972 9.176 10.204 1.00 0.00 N ATOM 1114 CA PHE A 68 8.821 8.287 10.194 1.00 0.00 C ATOM 1115 C PHE A 68 9.090 7.122 9.240 1.00 0.00 C ATOM 1116 O PHE A 68 9.220 5.977 9.675 1.00 0.00 O ATOM 1117 CB PHE A 68 7.545 9.077 9.864 1.00 0.00 C ATOM 1118 CG PHE A 68 6.254 8.375 10.248 1.00 0.00 C ATOM 1119 CD1 PHE A 68 5.703 7.386 9.415 1.00 0.00 C ATOM 1120 CD2 PHE A 68 5.585 8.727 11.435 1.00 0.00 C ATOM 1121 CE1 PHE A 68 4.498 6.748 9.766 1.00 0.00 C ATOM 1122 CE2 PHE A 68 4.386 8.086 11.792 1.00 0.00 C ATOM 1123 CZ PHE A 68 3.841 7.097 10.958 1.00 0.00 C ATOM 0 H PHE A 68 9.752 10.115 9.873 1.00 0.00 H new ATOM 0 HA PHE A 68 8.658 7.855 11.181 1.00 0.00 H new ATOM 0 HB2 PHE A 68 7.586 10.039 10.374 1.00 0.00 H new ATOM 0 HB3 PHE A 68 7.527 9.284 8.794 1.00 0.00 H new ATOM 0 HD1 PHE A 68 6.207 7.114 8.500 1.00 0.00 H new ATOM 0 HD2 PHE A 68 5.995 9.494 12.075 1.00 0.00 H new ATOM 0 HE1 PHE A 68 4.079 5.991 9.120 1.00 0.00 H new ATOM 0 HE2 PHE A 68 3.883 8.355 12.709 1.00 0.00 H new ATOM 0 HZ PHE A 68 2.919 6.606 11.232 1.00 0.00 H new ATOM 1133 N SER A 69 9.191 7.388 7.936 1.00 0.00 N ATOM 1134 CA SER A 69 9.369 6.324 6.956 1.00 0.00 C ATOM 1135 C SER A 69 10.793 5.759 6.987 1.00 0.00 C ATOM 1136 O SER A 69 10.955 4.572 6.723 1.00 0.00 O ATOM 1137 CB SER A 69 8.890 6.794 5.584 1.00 0.00 C ATOM 1138 OG SER A 69 8.810 5.739 4.649 1.00 0.00 O ATOM 0 H SER A 69 9.152 8.327 7.539 1.00 0.00 H new ATOM 0 HA SER A 69 8.741 5.473 7.218 1.00 0.00 H new ATOM 0 HB2 SER A 69 7.910 7.261 5.685 1.00 0.00 H new ATOM 0 HB3 SER A 69 9.570 7.558 5.207 1.00 0.00 H new ATOM 0 HG SER A 69 8.498 6.088 3.788 1.00 0.00 H new ATOM 1144 N LEU A 70 11.800 6.510 7.450 1.00 0.00 N ATOM 1145 CA LEU A 70 13.167 6.015 7.671 1.00 0.00 C ATOM 1146 C LEU A 70 13.194 4.714 8.490 1.00 0.00 C ATOM 1147 O LEU A 70 14.059 3.874 8.250 1.00 0.00 O ATOM 1148 CB LEU A 70 13.941 7.146 8.382 1.00 0.00 C ATOM 1149 CG LEU A 70 15.419 6.925 8.765 1.00 0.00 C ATOM 1150 CD1 LEU A 70 16.314 6.797 7.531 1.00 0.00 C ATOM 1151 CD2 LEU A 70 15.901 8.134 9.583 1.00 0.00 C ATOM 0 H LEU A 70 11.687 7.496 7.686 1.00 0.00 H new ATOM 0 HA LEU A 70 13.631 5.763 6.718 1.00 0.00 H new ATOM 0 HB2 LEU A 70 13.897 8.026 7.741 1.00 0.00 H new ATOM 0 HB3 LEU A 70 13.399 7.390 9.296 1.00 0.00 H new ATOM 0 HG LEU A 70 15.484 5.999 9.337 1.00 0.00 H new ATOM 0 HD11 LEU A 70 17.346 6.642 7.845 1.00 0.00 H new ATOM 0 HD12 LEU A 70 15.986 5.948 6.930 1.00 0.00 H new ATOM 0 HD13 LEU A 70 16.248 7.709 6.937 1.00 0.00 H new ATOM 0 HD21 LEU A 70 16.945 7.992 9.861 1.00 0.00 H new ATOM 0 HD22 LEU A 70 15.805 9.040 8.984 1.00 0.00 H new ATOM 0 HD23 LEU A 70 15.295 8.229 10.484 1.00 0.00 H new ATOM 1163 N GLY A 71 12.229 4.512 9.397 1.00 0.00 N ATOM 1164 CA GLY A 71 12.098 3.273 10.165 1.00 0.00 C ATOM 1165 C GLY A 71 11.220 2.220 9.479 1.00 0.00 C ATOM 1166 O GLY A 71 11.391 1.022 9.712 1.00 0.00 O ATOM 0 H GLY A 71 11.516 5.208 9.617 1.00 0.00 H new ATOM 0 HA2 GLY A 71 13.090 2.853 10.335 1.00 0.00 H new ATOM 0 HA3 GLY A 71 11.677 3.504 11.144 1.00 0.00 H new ATOM 1170 N VAL A 72 10.302 2.637 8.605 1.00 0.00 N ATOM 1171 CA VAL A 72 9.501 1.739 7.780 1.00 0.00 C ATOM 1172 C VAL A 72 10.428 1.024 6.795 1.00 0.00 C ATOM 1173 O VAL A 72 10.276 -0.183 6.624 1.00 0.00 O ATOM 1174 CB VAL A 72 8.355 2.495 7.066 1.00 0.00 C ATOM 1175 CG1 VAL A 72 7.468 1.529 6.264 1.00 0.00 C ATOM 1176 CG2 VAL A 72 7.461 3.194 8.095 1.00 0.00 C ATOM 0 H VAL A 72 10.093 3.623 8.450 1.00 0.00 H new ATOM 0 HA VAL A 72 9.016 0.994 8.411 1.00 0.00 H new ATOM 0 HB VAL A 72 8.816 3.220 6.395 1.00 0.00 H new ATOM 0 HG11 VAL A 72 6.672 2.089 5.773 1.00 0.00 H new ATOM 0 HG12 VAL A 72 8.071 1.021 5.512 1.00 0.00 H new ATOM 0 HG13 VAL A 72 7.031 0.792 6.938 1.00 0.00 H new ATOM 0 HG21 VAL A 72 6.658 3.722 7.580 1.00 0.00 H new ATOM 0 HG22 VAL A 72 7.033 2.452 8.769 1.00 0.00 H new ATOM 0 HG23 VAL A 72 8.055 3.906 8.669 1.00 0.00 H new ATOM 1186 N ILE A 73 11.422 1.725 6.232 1.00 0.00 N ATOM 1187 CA ILE A 73 12.427 1.141 5.334 1.00 0.00 C ATOM 1188 C ILE A 73 13.057 -0.074 6.018 1.00 0.00 C ATOM 1189 O ILE A 73 13.050 -1.168 5.451 1.00 0.00 O ATOM 1190 CB ILE A 73 13.468 2.206 4.880 1.00 0.00 C ATOM 1191 CG1 ILE A 73 12.999 3.019 3.649 1.00 0.00 C ATOM 1192 CG2 ILE A 73 14.824 1.590 4.482 1.00 0.00 C ATOM 1193 CD1 ILE A 73 11.997 4.120 3.964 1.00 0.00 C ATOM 0 H ILE A 73 11.552 2.724 6.389 1.00 0.00 H new ATOM 0 HA ILE A 73 11.952 0.796 4.415 1.00 0.00 H new ATOM 0 HB ILE A 73 13.574 2.847 5.755 1.00 0.00 H new ATOM 0 HG12 ILE A 73 13.871 3.465 3.170 1.00 0.00 H new ATOM 0 HG13 ILE A 73 12.553 2.335 2.926 1.00 0.00 H new ATOM 0 HG21 ILE A 73 15.507 2.382 4.175 1.00 0.00 H new ATOM 0 HG22 ILE A 73 15.246 1.057 5.334 1.00 0.00 H new ATOM 0 HG23 ILE A 73 14.679 0.895 3.655 1.00 0.00 H new ATOM 0 HD11 ILE A 73 11.724 4.637 3.044 1.00 0.00 H new ATOM 0 HD12 ILE A 73 11.105 3.683 4.413 1.00 0.00 H new ATOM 0 HD13 ILE A 73 12.443 4.830 4.661 1.00 0.00 H new ATOM 1205 N VAL A 74 13.569 0.086 7.244 1.00 0.00 N ATOM 1206 CA VAL A 74 14.101 -1.052 7.980 1.00 0.00 C ATOM 1207 C VAL A 74 13.002 -2.091 8.155 1.00 0.00 C ATOM 1208 O VAL A 74 13.261 -3.265 7.936 1.00 0.00 O ATOM 1209 CB VAL A 74 14.655 -0.621 9.356 1.00 0.00 C ATOM 1210 CG1 VAL A 74 15.029 -1.849 10.199 1.00 0.00 C ATOM 1211 CG2 VAL A 74 15.865 0.302 9.201 1.00 0.00 C ATOM 0 H VAL A 74 13.623 0.978 7.735 1.00 0.00 H new ATOM 0 HA VAL A 74 14.927 -1.481 7.413 1.00 0.00 H new ATOM 0 HB VAL A 74 13.869 -0.068 9.871 1.00 0.00 H new ATOM 0 HG11 VAL A 74 15.417 -1.523 11.164 1.00 0.00 H new ATOM 0 HG12 VAL A 74 14.145 -2.467 10.353 1.00 0.00 H new ATOM 0 HG13 VAL A 74 15.791 -2.429 9.679 1.00 0.00 H new ATOM 0 HG21 VAL A 74 16.233 0.588 10.186 1.00 0.00 H new ATOM 0 HG22 VAL A 74 16.653 -0.219 8.657 1.00 0.00 H new ATOM 0 HG23 VAL A 74 15.573 1.195 8.649 1.00 0.00 H new ATOM 1221 N ASN A 75 11.793 -1.704 8.555 1.00 0.00 N ATOM 1222 CA ASN A 75 10.740 -2.667 8.845 1.00 0.00 C ATOM 1223 C ASN A 75 10.463 -3.599 7.672 1.00 0.00 C ATOM 1224 O ASN A 75 10.291 -4.797 7.881 1.00 0.00 O ATOM 1225 CB ASN A 75 9.442 -1.955 9.204 1.00 0.00 C ATOM 1226 CG ASN A 75 8.884 -2.560 10.469 1.00 0.00 C ATOM 1227 OD1 ASN A 75 8.252 -3.612 10.435 1.00 0.00 O ATOM 1228 ND2 ASN A 75 9.137 -1.931 11.602 1.00 0.00 N ATOM 0 H ASN A 75 11.521 -0.730 8.685 1.00 0.00 H new ATOM 0 HA ASN A 75 11.097 -3.260 9.687 1.00 0.00 H new ATOM 0 HB2 ASN A 75 9.623 -0.889 9.344 1.00 0.00 H new ATOM 0 HB3 ASN A 75 8.722 -2.051 8.391 1.00 0.00 H new ATOM 0 HD21 ASN A 75 8.804 -2.318 12.485 1.00 0.00 H new ATOM 0 HD22 ASN A 75 9.665 -1.058 11.594 1.00 0.00 H new ATOM 1235 N ILE A 76 10.410 -3.046 6.457 1.00 0.00 N ATOM 1236 CA ILE A 76 10.227 -3.798 5.226 1.00 0.00 C ATOM 1237 C ILE A 76 11.385 -4.806 5.076 1.00 0.00 C ATOM 1238 O ILE A 76 11.143 -5.954 4.698 1.00 0.00 O ATOM 1239 CB ILE A 76 10.044 -2.802 4.042 1.00 0.00 C ATOM 1240 CG1 ILE A 76 8.686 -2.039 4.175 1.00 0.00 C ATOM 1241 CG2 ILE A 76 10.146 -3.531 2.687 1.00 0.00 C ATOM 1242 CD1 ILE A 76 8.285 -1.183 2.981 1.00 0.00 C ATOM 0 H ILE A 76 10.496 -2.041 6.305 1.00 0.00 H new ATOM 0 HA ILE A 76 9.318 -4.400 5.239 1.00 0.00 H new ATOM 0 HB ILE A 76 10.849 -2.068 4.082 1.00 0.00 H new ATOM 0 HG12 ILE A 76 7.897 -2.769 4.355 1.00 0.00 H new ATOM 0 HG13 ILE A 76 8.736 -1.399 5.056 1.00 0.00 H new ATOM 0 HG21 ILE A 76 10.015 -2.813 1.877 1.00 0.00 H new ATOM 0 HG22 ILE A 76 11.125 -4.002 2.600 1.00 0.00 H new ATOM 0 HG23 ILE A 76 9.370 -4.294 2.625 1.00 0.00 H new ATOM 0 HD11 ILE A 76 7.328 -0.701 3.184 1.00 0.00 H new ATOM 0 HD12 ILE A 76 9.045 -0.421 2.808 1.00 0.00 H new ATOM 0 HD13 ILE A 76 8.194 -1.813 2.096 1.00 0.00 H new ATOM 1254 N LEU A 77 12.626 -4.435 5.433 1.00 0.00 N ATOM 1255 CA LEU A 77 13.748 -5.374 5.480 1.00 0.00 C ATOM 1256 C LEU A 77 13.444 -6.479 6.484 1.00 0.00 C ATOM 1257 O LEU A 77 13.559 -7.648 6.132 1.00 0.00 O ATOM 1258 CB LEU A 77 15.088 -4.661 5.789 1.00 0.00 C ATOM 1259 CG LEU A 77 16.364 -5.527 5.803 1.00 0.00 C ATOM 1260 CD1 LEU A 77 16.556 -6.290 7.111 1.00 0.00 C ATOM 1261 CD2 LEU A 77 16.527 -6.461 4.602 1.00 0.00 C ATOM 0 H LEU A 77 12.874 -3.481 5.695 1.00 0.00 H new ATOM 0 HA LEU A 77 13.868 -5.823 4.494 1.00 0.00 H new ATOM 0 HB2 LEU A 77 15.226 -3.869 5.053 1.00 0.00 H new ATOM 0 HB3 LEU A 77 14.997 -4.179 6.762 1.00 0.00 H new ATOM 0 HG LEU A 77 17.163 -4.790 5.718 1.00 0.00 H new ATOM 0 HD11 LEU A 77 17.471 -6.880 7.057 1.00 0.00 H new ATOM 0 HD12 LEU A 77 16.628 -5.583 7.937 1.00 0.00 H new ATOM 0 HD13 LEU A 77 15.706 -6.953 7.274 1.00 0.00 H new ATOM 0 HD21 LEU A 77 17.453 -7.027 4.704 1.00 0.00 H new ATOM 0 HD22 LEU A 77 15.684 -7.150 4.560 1.00 0.00 H new ATOM 0 HD23 LEU A 77 16.561 -5.872 3.685 1.00 0.00 H new ATOM 1273 N LYS A 78 13.048 -6.140 7.717 1.00 0.00 N ATOM 1274 CA LYS A 78 12.807 -7.132 8.770 1.00 0.00 C ATOM 1275 C LYS A 78 11.823 -8.191 8.285 1.00 0.00 C ATOM 1276 O LYS A 78 12.128 -9.377 8.431 1.00 0.00 O ATOM 1277 CB LYS A 78 12.286 -6.518 10.076 1.00 0.00 C ATOM 1278 CG LYS A 78 13.109 -5.330 10.590 1.00 0.00 C ATOM 1279 CD LYS A 78 12.571 -4.759 11.914 1.00 0.00 C ATOM 1280 CE LYS A 78 13.460 -5.104 13.113 1.00 0.00 C ATOM 1281 NZ LYS A 78 13.488 -6.552 13.389 1.00 0.00 N ATOM 0 H LYS A 78 12.887 -5.177 8.011 1.00 0.00 H new ATOM 0 HA LYS A 78 13.775 -7.583 8.988 1.00 0.00 H new ATOM 0 HB2 LYS A 78 11.257 -6.193 9.925 1.00 0.00 H new ATOM 0 HB3 LYS A 78 12.267 -7.291 10.844 1.00 0.00 H new ATOM 0 HG2 LYS A 78 14.144 -5.644 10.729 1.00 0.00 H new ATOM 0 HG3 LYS A 78 13.113 -4.543 9.836 1.00 0.00 H new ATOM 0 HD2 LYS A 78 12.487 -3.676 11.830 1.00 0.00 H new ATOM 0 HD3 LYS A 78 11.567 -5.144 12.089 1.00 0.00 H new ATOM 0 HE2 LYS A 78 14.474 -4.753 12.924 1.00 0.00 H new ATOM 0 HE3 LYS A 78 13.099 -4.575 13.995 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 14.102 -6.738 14.208 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 12.525 -6.885 13.596 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 13.858 -7.057 12.558 1.00 0.00 H new ATOM 1295 N SER A 79 10.703 -7.774 7.689 1.00 0.00 N ATOM 1296 CA SER A 79 9.692 -8.669 7.147 1.00 0.00 C ATOM 1297 C SER A 79 10.317 -9.621 6.123 1.00 0.00 C ATOM 1298 O SER A 79 10.298 -10.834 6.325 1.00 0.00 O ATOM 1299 CB SER A 79 8.537 -7.855 6.552 1.00 0.00 C ATOM 1300 OG SER A 79 8.117 -6.806 7.417 1.00 0.00 O ATOM 0 H SER A 79 10.475 -6.787 7.570 1.00 0.00 H new ATOM 0 HA SER A 79 9.282 -9.283 7.949 1.00 0.00 H new ATOM 0 HB2 SER A 79 8.847 -7.433 5.596 1.00 0.00 H new ATOM 0 HB3 SER A 79 7.695 -8.517 6.350 1.00 0.00 H new ATOM 0 HG SER A 79 7.174 -6.600 7.248 1.00 0.00 H new ATOM 1306 N ILE A 80 10.946 -9.076 5.077 1.00 0.00 N ATOM 1307 CA ILE A 80 11.599 -9.831 4.008 1.00 0.00 C ATOM 1308 C ILE A 80 12.599 -10.837 4.590 1.00 0.00 C ATOM 1309 O ILE A 80 12.614 -12.002 4.199 1.00 0.00 O ATOM 1310 CB ILE A 80 12.252 -8.816 3.040 1.00 0.00 C ATOM 1311 CG1 ILE A 80 11.150 -8.134 2.210 1.00 0.00 C ATOM 1312 CG2 ILE A 80 13.301 -9.443 2.110 1.00 0.00 C ATOM 1313 CD1 ILE A 80 11.720 -7.055 1.296 1.00 0.00 C ATOM 0 H ILE A 80 11.016 -8.066 4.949 1.00 0.00 H new ATOM 0 HA ILE A 80 10.876 -10.425 3.450 1.00 0.00 H new ATOM 0 HB ILE A 80 12.786 -8.087 3.649 1.00 0.00 H new ATOM 0 HG12 ILE A 80 10.630 -8.882 1.611 1.00 0.00 H new ATOM 0 HG13 ILE A 80 10.411 -7.692 2.879 1.00 0.00 H new ATOM 0 HG21 ILE A 80 13.717 -8.674 1.459 1.00 0.00 H new ATOM 0 HG22 ILE A 80 14.099 -9.884 2.707 1.00 0.00 H new ATOM 0 HG23 ILE A 80 12.832 -10.217 1.503 1.00 0.00 H new ATOM 0 HD11 ILE A 80 10.912 -6.596 0.726 1.00 0.00 H new ATOM 0 HD12 ILE A 80 12.217 -6.294 1.898 1.00 0.00 H new ATOM 0 HD13 ILE A 80 12.439 -7.502 0.610 1.00 0.00 H new ATOM 1325 N SER A 81 13.432 -10.395 5.530 1.00 0.00 N ATOM 1326 CA SER A 81 14.505 -11.178 6.131 1.00 0.00 C ATOM 1327 C SER A 81 13.973 -12.407 6.867 1.00 0.00 C ATOM 1328 O SER A 81 14.660 -13.425 6.977 1.00 0.00 O ATOM 1329 CB SER A 81 15.272 -10.235 7.063 1.00 0.00 C ATOM 1330 OG SER A 81 14.687 -10.059 8.340 1.00 0.00 O ATOM 0 H SER A 81 13.375 -9.449 5.906 1.00 0.00 H new ATOM 0 HA SER A 81 15.167 -11.574 5.361 1.00 0.00 H new ATOM 0 HB2 SER A 81 16.284 -10.618 7.192 1.00 0.00 H new ATOM 0 HB3 SER A 81 15.359 -9.261 6.581 1.00 0.00 H new ATOM 0 HG SER A 81 13.737 -9.840 8.237 1.00 0.00 H new ATOM 1336 N SER A 82 12.763 -12.257 7.402 1.00 0.00 N ATOM 1337 CA SER A 82 11.993 -13.295 8.076 1.00 0.00 C ATOM 1338 C SER A 82 11.264 -14.202 7.074 1.00 0.00 C ATOM 1339 O SER A 82 11.067 -15.382 7.364 1.00 0.00 O ATOM 1340 CB SER A 82 10.999 -12.627 9.045 1.00 0.00 C ATOM 1341 OG SER A 82 10.724 -13.422 10.186 1.00 0.00 O ATOM 0 H SER A 82 12.271 -11.364 7.375 1.00 0.00 H new ATOM 0 HA SER A 82 12.675 -13.935 8.636 1.00 0.00 H new ATOM 0 HB2 SER A 82 11.402 -11.666 9.366 1.00 0.00 H new ATOM 0 HB3 SER A 82 10.067 -12.422 8.518 1.00 0.00 H new ATOM 0 HG SER A 82 10.091 -12.952 10.767 1.00 0.00 H new ATOM 1347 N SER A 83 10.849 -13.680 5.918 1.00 0.00 N ATOM 1348 CA SER A 83 10.155 -14.447 4.893 1.00 0.00 C ATOM 1349 C SER A 83 11.073 -15.314 4.040 1.00 0.00 C ATOM 1350 O SER A 83 10.561 -16.241 3.410 1.00 0.00 O ATOM 1351 CB SER A 83 9.437 -13.497 3.940 1.00 0.00 C ATOM 1352 OG SER A 83 8.323 -12.913 4.586 1.00 0.00 O ATOM 0 H SER A 83 10.989 -12.701 5.669 1.00 0.00 H new ATOM 0 HA SER A 83 9.471 -15.100 5.434 1.00 0.00 H new ATOM 0 HB2 SER A 83 10.122 -12.719 3.605 1.00 0.00 H new ATOM 0 HB3 SER A 83 9.110 -14.038 3.052 1.00 0.00 H new ATOM 0 HG SER A 83 7.869 -12.303 3.968 1.00 0.00 H new ATOM 1358 N GLY A 84 12.371 -15.014 3.952 1.00 0.00 N ATOM 1359 CA GLY A 84 13.260 -15.736 3.048 1.00 0.00 C ATOM 1360 C GLY A 84 13.954 -14.862 2.011 1.00 0.00 C ATOM 1361 O GLY A 84 14.591 -15.396 1.099 1.00 0.00 O ATOM 0 H GLY A 84 12.825 -14.279 4.494 1.00 0.00 H new ATOM 0 HA2 GLY A 84 14.019 -16.249 3.639 1.00 0.00 H new ATOM 0 HA3 GLY A 84 12.685 -16.504 2.531 1.00 0.00 H new ATOM 1365 N GLY A 85 13.791 -13.537 2.060 1.00 0.00 N ATOM 1366 CA GLY A 85 14.298 -12.669 1.033 1.00 0.00 C ATOM 1367 C GLY A 85 15.405 -11.773 1.538 1.00 0.00 C ATOM 1368 O GLY A 85 15.829 -11.807 2.699 1.00 0.00 O ATOM 0 H GLY A 85 13.304 -13.053 2.815 1.00 0.00 H new ATOM 0 HA2 GLY A 85 14.669 -13.270 0.203 1.00 0.00 H new ATOM 0 HA3 GLY A 85 13.485 -12.056 0.644 1.00 0.00 H new ATOM 1372 N PHE A 86 15.835 -10.910 0.631 1.00 0.00 N ATOM 1373 CA PHE A 86 16.831 -9.882 0.845 1.00 0.00 C ATOM 1374 C PHE A 86 16.298 -8.566 0.299 1.00 0.00 C ATOM 1375 O PHE A 86 15.415 -8.531 -0.560 1.00 0.00 O ATOM 1376 CB PHE A 86 18.148 -10.316 0.183 1.00 0.00 C ATOM 1377 CG PHE A 86 19.146 -10.834 1.196 1.00 0.00 C ATOM 1378 CD1 PHE A 86 18.883 -12.019 1.911 1.00 0.00 C ATOM 1379 CD2 PHE A 86 20.291 -10.074 1.498 1.00 0.00 C ATOM 1380 CE1 PHE A 86 19.716 -12.391 2.978 1.00 0.00 C ATOM 1381 CE2 PHE A 86 21.113 -10.444 2.575 1.00 0.00 C ATOM 1382 CZ PHE A 86 20.822 -11.598 3.319 1.00 0.00 C ATOM 0 H PHE A 86 15.477 -10.911 -0.324 1.00 0.00 H new ATOM 0 HA PHE A 86 17.036 -9.738 1.906 1.00 0.00 H new ATOM 0 HB2 PHE A 86 17.945 -11.092 -0.555 1.00 0.00 H new ATOM 0 HB3 PHE A 86 18.580 -9.471 -0.353 1.00 0.00 H new ATOM 0 HD1 PHE A 86 18.042 -12.640 1.639 1.00 0.00 H new ATOM 0 HD2 PHE A 86 20.537 -9.207 0.902 1.00 0.00 H new ATOM 0 HE1 PHE A 86 19.505 -13.290 3.538 1.00 0.00 H new ATOM 0 HE2 PHE A 86 21.971 -9.839 2.831 1.00 0.00 H new ATOM 0 HZ PHE A 86 21.449 -11.875 4.153 1.00 0.00 H new ATOM 1392 N PHE A 87 16.825 -7.451 0.787 1.00 0.00 N ATOM 1393 CA PHE A 87 16.492 -6.129 0.291 1.00 0.00 C ATOM 1394 C PHE A 87 17.728 -5.269 0.471 1.00 0.00 C ATOM 1395 O PHE A 87 18.401 -5.366 1.499 1.00 0.00 O ATOM 1396 CB PHE A 87 15.219 -5.604 0.973 1.00 0.00 C ATOM 1397 CG PHE A 87 15.066 -4.096 1.060 1.00 0.00 C ATOM 1398 CD1 PHE A 87 15.284 -3.266 -0.055 1.00 0.00 C ATOM 1399 CD2 PHE A 87 14.703 -3.515 2.287 1.00 0.00 C ATOM 1400 CE1 PHE A 87 15.138 -1.876 0.078 1.00 0.00 C ATOM 1401 CE2 PHE A 87 14.585 -2.122 2.433 1.00 0.00 C ATOM 1402 CZ PHE A 87 14.797 -1.297 1.315 1.00 0.00 C ATOM 0 H PHE A 87 17.504 -7.443 1.548 1.00 0.00 H new ATOM 0 HA PHE A 87 16.239 -6.126 -0.769 1.00 0.00 H new ATOM 0 HB2 PHE A 87 14.357 -6.003 0.439 1.00 0.00 H new ATOM 0 HB3 PHE A 87 15.183 -6.009 1.984 1.00 0.00 H new ATOM 0 HD1 PHE A 87 15.562 -3.695 -1.006 1.00 0.00 H new ATOM 0 HD2 PHE A 87 14.510 -4.153 3.137 1.00 0.00 H new ATOM 0 HE1 PHE A 87 15.290 -1.241 -0.782 1.00 0.00 H new ATOM 0 HE2 PHE A 87 14.335 -1.691 3.391 1.00 0.00 H new ATOM 0 HZ PHE A 87 14.699 -0.225 1.404 1.00 0.00 H new ATOM 1412 N ALA A 88 18.049 -4.496 -0.562 1.00 0.00 N ATOM 1413 CA ALA A 88 19.223 -3.648 -0.643 1.00 0.00 C ATOM 1414 C ALA A 88 18.870 -2.316 -1.306 1.00 0.00 C ATOM 1415 O ALA A 88 17.747 -2.150 -1.785 1.00 0.00 O ATOM 1416 CB ALA A 88 20.309 -4.405 -1.403 1.00 0.00 C ATOM 0 H ALA A 88 17.469 -4.445 -1.400 1.00 0.00 H new ATOM 0 HA ALA A 88 19.597 -3.410 0.353 1.00 0.00 H new ATOM 0 HB1 ALA A 88 21.202 -3.784 -1.476 1.00 0.00 H new ATOM 0 HB2 ALA A 88 20.549 -5.326 -0.873 1.00 0.00 H new ATOM 0 HB3 ALA A 88 19.952 -4.646 -2.404 1.00 0.00 H new ATOM 1422 N LEU A 89 19.787 -1.346 -1.293 1.00 0.00 N ATOM 1423 CA LEU A 89 19.534 -0.009 -1.831 1.00 0.00 C ATOM 1424 C LEU A 89 20.497 0.298 -2.967 1.00 0.00 C ATOM 1425 O LEU A 89 21.464 -0.439 -3.175 1.00 0.00 O ATOM 1426 CB LEU A 89 19.573 1.113 -0.774 1.00 0.00 C ATOM 1427 CG LEU A 89 19.357 0.771 0.708 1.00 0.00 C ATOM 1428 CD1 LEU A 89 19.135 2.060 1.505 1.00 0.00 C ATOM 1429 CD2 LEU A 89 18.205 -0.194 0.978 1.00 0.00 C ATOM 0 H LEU A 89 20.725 -1.466 -0.910 1.00 0.00 H new ATOM 0 HA LEU A 89 18.511 -0.028 -2.207 1.00 0.00 H new ATOM 0 HB2 LEU A 89 20.542 1.605 -0.857 1.00 0.00 H new ATOM 0 HB3 LEU A 89 18.818 1.848 -1.052 1.00 0.00 H new ATOM 0 HG LEU A 89 20.263 0.255 1.027 1.00 0.00 H new ATOM 0 HD11 LEU A 89 18.982 1.816 2.556 1.00 0.00 H new ATOM 0 HD12 LEU A 89 20.009 2.704 1.406 1.00 0.00 H new ATOM 0 HD13 LEU A 89 18.256 2.578 1.121 1.00 0.00 H new ATOM 0 HD21 LEU A 89 18.128 -0.377 2.050 1.00 0.00 H new ATOM 0 HD22 LEU A 89 17.273 0.241 0.616 1.00 0.00 H new ATOM 0 HD23 LEU A 89 18.390 -1.136 0.461 1.00 0.00 H new ATOM 1441 N VAL A 90 20.286 1.406 -3.675 1.00 0.00 N ATOM 1442 CA VAL A 90 21.010 1.774 -4.882 1.00 0.00 C ATOM 1443 C VAL A 90 21.150 3.292 -4.956 1.00 0.00 C ATOM 1444 O VAL A 90 20.194 4.006 -4.644 1.00 0.00 O ATOM 1445 CB VAL A 90 20.205 1.244 -6.084 1.00 0.00 C ATOM 1446 CG1 VAL A 90 20.790 1.686 -7.423 1.00 0.00 C ATOM 1447 CG2 VAL A 90 20.090 -0.281 -6.041 1.00 0.00 C ATOM 0 H VAL A 90 19.581 2.094 -3.411 1.00 0.00 H new ATOM 0 HA VAL A 90 22.012 1.345 -4.883 1.00 0.00 H new ATOM 0 HB VAL A 90 19.209 1.680 -6.001 1.00 0.00 H new ATOM 0 HG11 VAL A 90 20.184 1.285 -8.235 1.00 0.00 H new ATOM 0 HG12 VAL A 90 20.794 2.775 -7.477 1.00 0.00 H new ATOM 0 HG13 VAL A 90 21.811 1.315 -7.514 1.00 0.00 H new ATOM 0 HG21 VAL A 90 19.517 -0.627 -6.901 1.00 0.00 H new ATOM 0 HG22 VAL A 90 21.086 -0.722 -6.068 1.00 0.00 H new ATOM 0 HG23 VAL A 90 19.584 -0.582 -5.123 1.00 0.00 H new ATOM 1457 N SER A 91 22.301 3.751 -5.461 1.00 0.00 N ATOM 1458 CA SER A 91 22.691 5.160 -5.570 1.00 0.00 C ATOM 1459 C SER A 91 22.328 5.885 -4.265 1.00 0.00 C ATOM 1460 O SER A 91 21.445 6.746 -4.246 1.00 0.00 O ATOM 1461 CB SER A 91 22.080 5.777 -6.843 1.00 0.00 C ATOM 1462 OG SER A 91 22.506 7.110 -7.080 1.00 0.00 O ATOM 0 H SER A 91 23.018 3.121 -5.821 1.00 0.00 H new ATOM 0 HA SER A 91 23.769 5.267 -5.687 1.00 0.00 H new ATOM 0 HB2 SER A 91 22.346 5.160 -7.701 1.00 0.00 H new ATOM 0 HB3 SER A 91 20.993 5.759 -6.762 1.00 0.00 H new ATOM 0 HG SER A 91 22.087 7.446 -7.900 1.00 0.00 H new ATOM 1468 N PRO A 92 22.952 5.496 -3.139 1.00 0.00 N ATOM 1469 CA PRO A 92 22.681 6.100 -1.856 1.00 0.00 C ATOM 1470 C PRO A 92 23.435 7.426 -1.843 1.00 0.00 C ATOM 1471 O PRO A 92 24.635 7.465 -1.538 1.00 0.00 O ATOM 1472 CB PRO A 92 23.159 5.067 -0.838 1.00 0.00 C ATOM 1473 CG PRO A 92 24.370 4.430 -1.527 1.00 0.00 C ATOM 1474 CD PRO A 92 24.030 4.522 -3.012 1.00 0.00 C ATOM 0 HA PRO A 92 21.641 6.336 -1.633 1.00 0.00 H new ATOM 0 HB2 PRO A 92 23.433 5.532 0.109 1.00 0.00 H new ATOM 0 HB3 PRO A 92 22.386 4.330 -0.619 1.00 0.00 H new ATOM 0 HG2 PRO A 92 25.291 4.964 -1.293 1.00 0.00 H new ATOM 0 HG3 PRO A 92 24.512 3.396 -1.212 1.00 0.00 H new ATOM 0 HD2 PRO A 92 24.901 4.832 -3.589 1.00 0.00 H new ATOM 0 HD3 PRO A 92 23.721 3.551 -3.398 1.00 0.00 H new ATOM 1482 N ASN A 93 22.748 8.490 -2.262 1.00 0.00 N ATOM 1483 CA ASN A 93 23.327 9.816 -2.354 1.00 0.00 C ATOM 1484 C ASN A 93 23.911 10.225 -1.014 1.00 0.00 C ATOM 1485 O ASN A 93 23.509 9.769 0.058 1.00 0.00 O ATOM 1486 CB ASN A 93 22.335 10.870 -2.862 1.00 0.00 C ATOM 1487 CG ASN A 93 21.141 11.119 -1.944 1.00 0.00 C ATOM 1488 OD1 ASN A 93 20.480 10.195 -1.499 1.00 0.00 O ATOM 1489 ND2 ASN A 93 20.830 12.359 -1.611 1.00 0.00 N ATOM 0 H ASN A 93 21.769 8.448 -2.547 1.00 0.00 H new ATOM 0 HA ASN A 93 24.124 9.765 -3.096 1.00 0.00 H new ATOM 0 HB2 ASN A 93 22.867 11.810 -3.006 1.00 0.00 H new ATOM 0 HB3 ASN A 93 21.966 10.560 -3.840 1.00 0.00 H new ATOM 0 HD21 ASN A 93 20.043 12.537 -0.987 1.00 0.00 H new ATOM 0 HD22 ASN A 93 21.377 13.138 -1.978 1.00 0.00 H new ATOM 1496 N GLU A 94 24.875 11.124 -1.075 1.00 0.00 N ATOM 1497 CA GLU A 94 25.737 11.388 0.069 1.00 0.00 C ATOM 1498 C GLU A 94 24.931 11.981 1.243 1.00 0.00 C ATOM 1499 O GLU A 94 25.235 11.778 2.420 1.00 0.00 O ATOM 1500 CB GLU A 94 26.905 12.246 -0.428 1.00 0.00 C ATOM 1501 CG GLU A 94 27.921 12.471 0.681 1.00 0.00 C ATOM 1502 CD GLU A 94 29.300 12.867 0.151 1.00 0.00 C ATOM 1503 OE1 GLU A 94 30.026 12.010 -0.403 1.00 0.00 O ATOM 1504 OE2 GLU A 94 29.742 14.015 0.382 1.00 0.00 O ATOM 0 H GLU A 94 25.083 11.685 -1.901 1.00 0.00 H new ATOM 0 HA GLU A 94 26.159 10.474 0.487 1.00 0.00 H new ATOM 0 HB2 GLU A 94 27.387 11.757 -1.275 1.00 0.00 H new ATOM 0 HB3 GLU A 94 26.531 13.206 -0.785 1.00 0.00 H new ATOM 0 HG2 GLU A 94 27.556 13.251 1.349 1.00 0.00 H new ATOM 0 HG3 GLU A 94 28.012 11.561 1.274 1.00 0.00 H new ATOM 1511 N LYS A 95 23.810 12.628 0.924 1.00 0.00 N ATOM 1512 CA LYS A 95 22.872 13.217 1.855 1.00 0.00 C ATOM 1513 C LYS A 95 22.131 12.152 2.651 1.00 0.00 C ATOM 1514 O LYS A 95 21.821 12.403 3.822 1.00 0.00 O ATOM 1515 CB LYS A 95 21.880 14.103 1.078 1.00 0.00 C ATOM 1516 CG LYS A 95 21.667 15.477 1.712 1.00 0.00 C ATOM 1517 CD LYS A 95 21.087 15.425 3.126 1.00 0.00 C ATOM 1518 CE LYS A 95 19.733 14.746 3.272 1.00 0.00 C ATOM 1519 NZ LYS A 95 18.906 15.514 4.230 1.00 0.00 N ATOM 0 H LYS A 95 23.525 12.757 -0.047 1.00 0.00 H new ATOM 0 HA LYS A 95 23.425 13.826 2.571 1.00 0.00 H new ATOM 0 HB2 LYS A 95 22.243 14.234 0.059 1.00 0.00 H new ATOM 0 HB3 LYS A 95 20.921 13.589 1.011 1.00 0.00 H new ATOM 0 HG2 LYS A 95 22.620 16.005 1.740 1.00 0.00 H new ATOM 0 HG3 LYS A 95 20.999 16.059 1.077 1.00 0.00 H new ATOM 0 HD2 LYS A 95 21.800 14.910 3.770 1.00 0.00 H new ATOM 0 HD3 LYS A 95 21.000 16.446 3.499 1.00 0.00 H new ATOM 0 HE2 LYS A 95 19.234 14.691 2.305 1.00 0.00 H new ATOM 0 HE3 LYS A 95 19.862 13.722 3.623 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 18.313 14.860 4.779 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 19.525 16.045 4.875 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 18.298 16.178 3.709 1.00 0.00 H new ATOM 1533 N VAL A 96 21.794 10.990 2.079 1.00 0.00 N ATOM 1534 CA VAL A 96 21.245 9.934 2.861 1.00 0.00 C ATOM 1535 C VAL A 96 22.346 9.156 3.544 1.00 0.00 C ATOM 1536 O VAL A 96 22.181 8.793 4.694 1.00 0.00 O ATOM 1537 CB VAL A 96 20.370 9.013 2.011 1.00 0.00 C ATOM 1538 CG1 VAL A 96 19.107 9.715 1.515 1.00 0.00 C ATOM 1539 CG2 VAL A 96 21.034 8.160 0.931 1.00 0.00 C ATOM 0 H VAL A 96 21.899 10.781 1.086 1.00 0.00 H new ATOM 0 HA VAL A 96 20.609 10.375 3.628 1.00 0.00 H new ATOM 0 HB VAL A 96 20.095 8.246 2.735 1.00 0.00 H new ATOM 0 HG11 VAL A 96 18.517 9.022 0.916 1.00 0.00 H new ATOM 0 HG12 VAL A 96 18.517 10.049 2.369 1.00 0.00 H new ATOM 0 HG13 VAL A 96 19.384 10.576 0.906 1.00 0.00 H new ATOM 0 HG21 VAL A 96 20.277 7.565 0.420 1.00 0.00 H new ATOM 0 HG22 VAL A 96 21.533 8.808 0.211 1.00 0.00 H new ATOM 0 HG23 VAL A 96 21.767 7.497 1.391 1.00 0.00 H new ATOM 1549 N GLU A 97 23.483 8.920 2.913 1.00 0.00 N ATOM 1550 CA GLU A 97 24.553 8.114 3.484 1.00 0.00 C ATOM 1551 C GLU A 97 24.954 8.675 4.848 1.00 0.00 C ATOM 1552 O GLU A 97 25.169 7.936 5.812 1.00 0.00 O ATOM 1553 CB GLU A 97 25.708 8.041 2.479 1.00 0.00 C ATOM 1554 CG GLU A 97 25.715 6.680 1.788 1.00 0.00 C ATOM 1555 CD GLU A 97 26.477 5.658 2.631 1.00 0.00 C ATOM 1556 OE1 GLU A 97 25.949 5.258 3.694 1.00 0.00 O ATOM 1557 OE2 GLU A 97 27.628 5.341 2.241 1.00 0.00 O ATOM 0 H GLU A 97 23.693 9.284 1.984 1.00 0.00 H new ATOM 0 HA GLU A 97 24.224 7.091 3.666 1.00 0.00 H new ATOM 0 HB2 GLU A 97 25.606 8.834 1.738 1.00 0.00 H new ATOM 0 HB3 GLU A 97 26.657 8.203 2.991 1.00 0.00 H new ATOM 0 HG2 GLU A 97 24.691 6.340 1.630 1.00 0.00 H new ATOM 0 HG3 GLU A 97 26.177 6.767 0.805 1.00 0.00 H new ATOM 1564 N ARG A 98 24.871 10.002 4.993 1.00 0.00 N ATOM 1565 CA ARG A 98 25.169 10.655 6.245 1.00 0.00 C ATOM 1566 C ARG A 98 24.221 10.262 7.378 1.00 0.00 C ATOM 1567 O ARG A 98 24.611 10.322 8.539 1.00 0.00 O ATOM 1568 CB ARG A 98 25.281 12.164 6.016 1.00 0.00 C ATOM 1569 CG ARG A 98 23.996 12.939 6.244 1.00 0.00 C ATOM 1570 CD ARG A 98 23.740 13.223 7.731 1.00 0.00 C ATOM 1571 NE ARG A 98 23.281 14.595 7.925 1.00 0.00 N ATOM 1572 CZ ARG A 98 23.611 15.398 8.934 1.00 0.00 C ATOM 1573 NH1 ARG A 98 24.353 14.998 9.961 1.00 0.00 N ATOM 1574 NH2 ARG A 98 23.203 16.648 8.896 1.00 0.00 N ATOM 0 H ARG A 98 24.596 10.638 4.244 1.00 0.00 H new ATOM 0 HA ARG A 98 26.137 10.300 6.599 1.00 0.00 H new ATOM 0 HB2 ARG A 98 26.051 12.562 6.677 1.00 0.00 H new ATOM 0 HB3 ARG A 98 25.618 12.338 4.994 1.00 0.00 H new ATOM 0 HG2 ARG A 98 24.042 13.882 5.699 1.00 0.00 H new ATOM 0 HG3 ARG A 98 23.157 12.375 5.835 1.00 0.00 H new ATOM 0 HD2 ARG A 98 22.994 12.527 8.116 1.00 0.00 H new ATOM 0 HD3 ARG A 98 24.654 13.057 8.300 1.00 0.00 H new ATOM 0 HE ARG A 98 22.648 14.974 7.221 1.00 0.00 H new ATOM 0 HH11 ARG A 98 24.696 14.038 9.999 1.00 0.00 H new ATOM 0 HH12 ARG A 98 24.580 15.651 10.711 1.00 0.00 H new ATOM 0 HH21 ARG A 98 22.648 16.980 8.107 1.00 0.00 H new ATOM 0 HH22 ARG A 98 23.441 17.286 9.656 1.00 0.00 H new ATOM 1588 N VAL A 99 22.958 9.952 7.077 1.00 0.00 N ATOM 1589 CA VAL A 99 21.928 9.619 8.047 1.00 0.00 C ATOM 1590 C VAL A 99 21.836 8.101 8.159 1.00 0.00 C ATOM 1591 O VAL A 99 21.613 7.578 9.247 1.00 0.00 O ATOM 1592 CB VAL A 99 20.604 10.335 7.686 1.00 0.00 C ATOM 1593 CG1 VAL A 99 19.809 9.834 6.497 1.00 0.00 C ATOM 1594 CG2 VAL A 99 19.644 10.314 8.882 1.00 0.00 C ATOM 0 H VAL A 99 22.619 9.927 6.115 1.00 0.00 H new ATOM 0 HA VAL A 99 22.177 9.985 9.043 1.00 0.00 H new ATOM 0 HB VAL A 99 20.966 11.324 7.406 1.00 0.00 H new ATOM 0 HG11 VAL A 99 18.911 10.440 6.378 1.00 0.00 H new ATOM 0 HG12 VAL A 99 20.418 9.907 5.596 1.00 0.00 H new ATOM 0 HG13 VAL A 99 19.526 8.794 6.661 1.00 0.00 H new ATOM 0 HG21 VAL A 99 18.717 10.821 8.614 1.00 0.00 H new ATOM 0 HG22 VAL A 99 19.427 9.282 9.156 1.00 0.00 H new ATOM 0 HG23 VAL A 99 20.105 10.824 9.728 1.00 0.00 H new ATOM 1604 N LEU A 100 22.098 7.387 7.064 1.00 0.00 N ATOM 1605 CA LEU A 100 22.055 5.944 6.948 1.00 0.00 C ATOM 1606 C LEU A 100 23.124 5.282 7.824 1.00 0.00 C ATOM 1607 O LEU A 100 22.965 4.104 8.153 1.00 0.00 O ATOM 1608 CB LEU A 100 22.238 5.520 5.477 1.00 0.00 C ATOM 1609 CG LEU A 100 21.157 5.876 4.409 1.00 0.00 C ATOM 1610 CD1 LEU A 100 20.695 4.608 3.688 1.00 0.00 C ATOM 1611 CD2 LEU A 100 19.894 6.658 4.840 1.00 0.00 C ATOM 0 H LEU A 100 22.361 7.835 6.186 1.00 0.00 H new ATOM 0 HA LEU A 100 21.078 5.610 7.297 1.00 0.00 H new ATOM 0 HB2 LEU A 100 23.181 5.946 5.134 1.00 0.00 H new ATOM 0 HB3 LEU A 100 22.355 4.436 5.467 1.00 0.00 H new ATOM 0 HG LEU A 100 21.701 6.581 3.780 1.00 0.00 H new ATOM 0 HD11 LEU A 100 19.941 4.866 2.945 1.00 0.00 H new ATOM 0 HD12 LEU A 100 21.546 4.140 3.194 1.00 0.00 H new ATOM 0 HD13 LEU A 100 20.268 3.913 4.411 1.00 0.00 H new ATOM 0 HD21 LEU A 100 19.252 6.819 3.974 1.00 0.00 H new ATOM 0 HD22 LEU A 100 19.351 6.086 5.593 1.00 0.00 H new ATOM 0 HD23 LEU A 100 20.187 7.621 5.258 1.00 0.00 H new ATOM 1623 N SER A 101 24.163 6.006 8.262 1.00 0.00 N ATOM 1624 CA SER A 101 25.069 5.506 9.285 1.00 0.00 C ATOM 1625 C SER A 101 24.384 5.718 10.637 1.00 0.00 C ATOM 1626 O SER A 101 24.118 4.783 11.390 1.00 0.00 O ATOM 1627 CB SER A 101 26.369 6.318 9.202 1.00 0.00 C ATOM 1628 OG SER A 101 27.350 5.713 8.386 1.00 0.00 O ATOM 0 H SER A 101 24.390 6.939 7.919 1.00 0.00 H new ATOM 0 HA SER A 101 25.302 4.449 9.153 1.00 0.00 H new ATOM 0 HB2 SER A 101 26.145 7.312 8.814 1.00 0.00 H new ATOM 0 HB3 SER A 101 26.772 6.451 10.206 1.00 0.00 H new ATOM 0 HG SER A 101 28.153 6.274 8.369 1.00 0.00 H new ATOM 1634 N LEU A 102 24.040 6.982 10.895 1.00 0.00 N ATOM 1635 CA LEU A 102 23.608 7.607 12.143 1.00 0.00 C ATOM 1636 C LEU A 102 22.278 7.074 12.678 1.00 0.00 C ATOM 1637 O LEU A 102 21.809 7.487 13.741 1.00 0.00 O ATOM 1638 CB LEU A 102 23.450 9.112 11.860 1.00 0.00 C ATOM 1639 CG LEU A 102 24.678 10.027 11.738 1.00 0.00 C ATOM 1640 CD1 LEU A 102 25.059 10.577 13.107 1.00 0.00 C ATOM 1641 CD2 LEU A 102 25.896 9.290 11.242 1.00 0.00 C ATOM 0 H LEU A 102 24.061 7.671 10.143 1.00 0.00 H new ATOM 0 HA LEU A 102 24.356 7.384 12.904 1.00 0.00 H new ATOM 0 HB2 LEU A 102 22.889 9.205 10.930 1.00 0.00 H new ATOM 0 HB3 LEU A 102 22.824 9.522 12.652 1.00 0.00 H new ATOM 0 HG LEU A 102 24.398 10.811 11.035 1.00 0.00 H new ATOM 0 HD11 LEU A 102 25.931 11.224 13.009 1.00 0.00 H new ATOM 0 HD12 LEU A 102 24.226 11.150 13.514 1.00 0.00 H new ATOM 0 HD13 LEU A 102 25.294 9.751 13.778 1.00 0.00 H new ATOM 0 HD21 LEU A 102 26.736 9.981 11.173 1.00 0.00 H new ATOM 0 HD22 LEU A 102 26.143 8.486 11.936 1.00 0.00 H new ATOM 0 HD23 LEU A 102 25.691 8.869 10.258 1.00 0.00 H new ATOM 1653 N THR A 103 21.616 6.210 11.925 1.00 0.00 N ATOM 1654 CA THR A 103 20.319 5.643 12.240 1.00 0.00 C ATOM 1655 C THR A 103 20.341 4.119 12.077 1.00 0.00 C ATOM 1656 O THR A 103 19.292 3.488 12.204 1.00 0.00 O ATOM 1657 CB THR A 103 19.295 6.399 11.376 1.00 0.00 C ATOM 1658 OG1 THR A 103 18.038 6.472 12.021 1.00 0.00 O ATOM 1659 CG2 THR A 103 19.191 5.867 9.947 1.00 0.00 C ATOM 0 H THR A 103 21.987 5.871 11.038 1.00 0.00 H new ATOM 0 HA THR A 103 20.032 5.775 13.283 1.00 0.00 H new ATOM 0 HB THR A 103 19.671 7.417 11.269 1.00 0.00 H new ATOM 0 HG1 THR A 103 17.808 5.594 12.390 1.00 0.00 H new ATOM 0 HG21 THR A 103 18.451 6.447 9.396 1.00 0.00 H new ATOM 0 HG22 THR A 103 20.160 5.954 9.455 1.00 0.00 H new ATOM 0 HG23 THR A 103 18.888 4.820 9.970 1.00 0.00 H new ATOM 1667 N ASN A 104 21.529 3.547 11.827 1.00 0.00 N ATOM 1668 CA ASN A 104 21.785 2.166 11.448 1.00 0.00 C ATOM 1669 C ASN A 104 20.823 1.750 10.340 1.00 0.00 C ATOM 1670 O ASN A 104 19.872 1.010 10.575 1.00 0.00 O ATOM 1671 CB ASN A 104 21.735 1.238 12.670 1.00 0.00 C ATOM 1672 CG ASN A 104 22.842 1.556 13.659 1.00 0.00 C ATOM 1673 OD1 ASN A 104 23.981 1.148 13.477 1.00 0.00 O ATOM 1674 ND2 ASN A 104 22.538 2.264 14.734 1.00 0.00 N ATOM 0 H ASN A 104 22.393 4.085 11.892 1.00 0.00 H new ATOM 0 HA ASN A 104 22.796 2.079 11.050 1.00 0.00 H new ATOM 0 HB2 ASN A 104 20.767 1.336 13.162 1.00 0.00 H new ATOM 0 HB3 ASN A 104 21.824 0.202 12.344 1.00 0.00 H new ATOM 0 HD21 ASN A 104 23.258 2.477 15.425 1.00 0.00 H new ATOM 0 HD22 ASN A 104 21.584 2.597 14.872 1.00 0.00 H new ATOM 1681 N LEU A 105 21.063 2.243 9.124 1.00 0.00 N ATOM 1682 CA LEU A 105 20.312 1.860 7.940 1.00 0.00 C ATOM 1683 C LEU A 105 21.205 0.949 7.110 1.00 0.00 C ATOM 1684 O LEU A 105 20.906 -0.233 7.009 1.00 0.00 O ATOM 1685 CB LEU A 105 19.849 3.116 7.178 1.00 0.00 C ATOM 1686 CG LEU A 105 18.559 2.975 6.355 1.00 0.00 C ATOM 1687 CD1 LEU A 105 18.563 1.750 5.439 1.00 0.00 C ATOM 1688 CD2 LEU A 105 17.350 2.954 7.283 1.00 0.00 C ATOM 0 H LEU A 105 21.795 2.928 8.937 1.00 0.00 H new ATOM 0 HA LEU A 105 19.403 1.316 8.195 1.00 0.00 H new ATOM 0 HB2 LEU A 105 19.709 3.921 7.899 1.00 0.00 H new ATOM 0 HB3 LEU A 105 20.651 3.425 6.507 1.00 0.00 H new ATOM 0 HG LEU A 105 18.500 3.844 5.699 1.00 0.00 H new ATOM 0 HD11 LEU A 105 17.625 1.707 4.885 1.00 0.00 H new ATOM 0 HD12 LEU A 105 19.395 1.822 4.739 1.00 0.00 H new ATOM 0 HD13 LEU A 105 18.672 0.847 6.040 1.00 0.00 H new ATOM 0 HD21 LEU A 105 16.440 2.854 6.692 1.00 0.00 H new ATOM 0 HD22 LEU A 105 17.432 2.111 7.969 1.00 0.00 H new ATOM 0 HD23 LEU A 105 17.312 3.882 7.853 1.00 0.00 H new ATOM 1700 N ASP A 106 22.345 1.447 6.613 1.00 0.00 N ATOM 1701 CA ASP A 106 23.351 0.639 5.897 1.00 0.00 C ATOM 1702 C ASP A 106 23.837 -0.512 6.784 1.00 0.00 C ATOM 1703 O ASP A 106 24.128 -1.623 6.349 1.00 0.00 O ATOM 1704 CB ASP A 106 24.546 1.535 5.529 1.00 0.00 C ATOM 1705 CG ASP A 106 25.581 0.866 4.606 1.00 0.00 C ATOM 1706 OD1 ASP A 106 26.028 -0.281 4.844 1.00 0.00 O ATOM 1707 OD2 ASP A 106 26.124 1.551 3.717 1.00 0.00 O ATOM 0 H ASP A 106 22.601 2.431 6.696 1.00 0.00 H new ATOM 0 HA ASP A 106 22.900 0.225 4.995 1.00 0.00 H new ATOM 0 HB2 ASP A 106 24.173 2.437 5.043 1.00 0.00 H new ATOM 0 HB3 ASP A 106 25.044 1.850 6.446 1.00 0.00 H new ATOM 1712 N ARG A 107 23.867 -0.279 8.097 1.00 0.00 N ATOM 1713 CA ARG A 107 24.386 -1.248 9.049 1.00 0.00 C ATOM 1714 C ARG A 107 23.387 -2.379 9.287 1.00 0.00 C ATOM 1715 O ARG A 107 23.644 -3.264 10.104 1.00 0.00 O ATOM 1716 CB ARG A 107 24.838 -0.534 10.336 1.00 0.00 C ATOM 1717 CG ARG A 107 25.614 0.770 10.028 1.00 0.00 C ATOM 1718 CD ARG A 107 26.493 1.274 11.179 1.00 0.00 C ATOM 1719 NE ARG A 107 27.906 1.355 10.761 1.00 0.00 N ATOM 1720 CZ ARG A 107 28.943 1.941 11.372 1.00 0.00 C ATOM 1721 NH1 ARG A 107 28.814 2.581 12.530 1.00 0.00 N ATOM 1722 NH2 ARG A 107 30.130 1.860 10.788 1.00 0.00 N ATOM 0 H ARG A 107 23.532 0.585 8.524 1.00 0.00 H new ATOM 0 HA ARG A 107 25.271 -1.729 8.633 1.00 0.00 H new ATOM 0 HB2 ARG A 107 23.967 -0.302 10.948 1.00 0.00 H new ATOM 0 HB3 ARG A 107 25.469 -1.203 10.920 1.00 0.00 H new ATOM 0 HG2 ARG A 107 26.243 0.606 9.153 1.00 0.00 H new ATOM 0 HG3 ARG A 107 24.899 1.550 9.765 1.00 0.00 H new ATOM 0 HD2 ARG A 107 26.148 2.256 11.503 1.00 0.00 H new ATOM 0 HD3 ARG A 107 26.400 0.605 12.034 1.00 0.00 H new ATOM 0 HE ARG A 107 28.125 0.897 9.876 1.00 0.00 H new ATOM 0 HH11 ARG A 107 27.902 2.637 12.983 1.00 0.00 H new ATOM 0 HH12 ARG A 107 29.627 3.016 12.966 1.00 0.00 H new ATOM 0 HH21 ARG A 107 30.230 1.363 9.903 1.00 0.00 H new ATOM 0 HH22 ARG A 107 30.944 2.294 11.224 1.00 0.00 H new ATOM 1736 N ILE A 108 22.243 -2.364 8.602 1.00 0.00 N ATOM 1737 CA ILE A 108 21.185 -3.345 8.691 1.00 0.00 C ATOM 1738 C ILE A 108 20.885 -3.846 7.273 1.00 0.00 C ATOM 1739 O ILE A 108 20.925 -5.052 7.040 1.00 0.00 O ATOM 1740 CB ILE A 108 19.974 -2.718 9.418 1.00 0.00 C ATOM 1741 CG1 ILE A 108 20.450 -2.134 10.771 1.00 0.00 C ATOM 1742 CG2 ILE A 108 18.859 -3.761 9.591 1.00 0.00 C ATOM 1743 CD1 ILE A 108 19.341 -1.791 11.766 1.00 0.00 C ATOM 0 H ILE A 108 22.028 -1.622 7.936 1.00 0.00 H new ATOM 0 HA ILE A 108 21.469 -4.215 9.283 1.00 0.00 H new ATOM 0 HB ILE A 108 19.554 -1.905 8.825 1.00 0.00 H new ATOM 0 HG12 ILE A 108 21.125 -2.851 11.239 1.00 0.00 H new ATOM 0 HG13 ILE A 108 21.029 -1.232 10.574 1.00 0.00 H new ATOM 0 HG21 ILE A 108 18.012 -3.306 10.105 1.00 0.00 H new ATOM 0 HG22 ILE A 108 18.540 -4.119 8.612 1.00 0.00 H new ATOM 0 HG23 ILE A 108 19.233 -4.599 10.179 1.00 0.00 H new ATOM 0 HD11 ILE A 108 19.782 -1.390 12.679 1.00 0.00 H new ATOM 0 HD12 ILE A 108 18.676 -1.047 11.327 1.00 0.00 H new ATOM 0 HD13 ILE A 108 18.773 -2.691 12.003 1.00 0.00 H new ATOM 1755 N VAL A 109 20.620 -2.941 6.330 1.00 0.00 N ATOM 1756 CA VAL A 109 20.201 -3.228 4.966 1.00 0.00 C ATOM 1757 C VAL A 109 21.408 -3.029 4.043 1.00 0.00 C ATOM 1758 O VAL A 109 22.232 -2.144 4.262 1.00 0.00 O ATOM 1759 CB VAL A 109 19.055 -2.280 4.543 1.00 0.00 C ATOM 1760 CG1 VAL A 109 18.241 -2.880 3.397 1.00 0.00 C ATOM 1761 CG2 VAL A 109 18.066 -1.899 5.665 1.00 0.00 C ATOM 0 H VAL A 109 20.697 -1.940 6.510 1.00 0.00 H new ATOM 0 HA VAL A 109 19.836 -4.253 4.899 1.00 0.00 H new ATOM 0 HB VAL A 109 19.574 -1.370 4.242 1.00 0.00 H new ATOM 0 HG11 VAL A 109 17.442 -2.193 3.120 1.00 0.00 H new ATOM 0 HG12 VAL A 109 18.891 -3.047 2.538 1.00 0.00 H new ATOM 0 HG13 VAL A 109 17.809 -3.829 3.715 1.00 0.00 H new ATOM 0 HG21 VAL A 109 17.302 -1.232 5.265 1.00 0.00 H new ATOM 0 HG22 VAL A 109 17.593 -2.800 6.055 1.00 0.00 H new ATOM 0 HG23 VAL A 109 18.604 -1.395 6.468 1.00 0.00 H new ATOM 1771 N LYS A 110 21.512 -3.829 2.986 1.00 0.00 N ATOM 1772 CA LYS A 110 22.615 -3.746 2.038 1.00 0.00 C ATOM 1773 C LYS A 110 22.515 -2.489 1.188 1.00 0.00 C ATOM 1774 O LYS A 110 21.430 -1.942 0.990 1.00 0.00 O ATOM 1775 CB LYS A 110 22.605 -4.999 1.160 1.00 0.00 C ATOM 1776 CG LYS A 110 23.247 -6.208 1.847 1.00 0.00 C ATOM 1777 CD LYS A 110 24.706 -6.437 1.448 1.00 0.00 C ATOM 1778 CE LYS A 110 25.544 -5.199 1.802 1.00 0.00 C ATOM 1779 NZ LYS A 110 26.992 -5.450 1.798 1.00 0.00 N ATOM 0 H LYS A 110 20.831 -4.555 2.763 1.00 0.00 H new ATOM 0 HA LYS A 110 23.556 -3.690 2.585 1.00 0.00 H new ATOM 0 HB2 LYS A 110 21.577 -5.242 0.893 1.00 0.00 H new ATOM 0 HB3 LYS A 110 23.135 -4.791 0.231 1.00 0.00 H new ATOM 0 HG2 LYS A 110 23.192 -6.073 2.927 1.00 0.00 H new ATOM 0 HG3 LYS A 110 22.669 -7.101 1.607 1.00 0.00 H new ATOM 0 HD2 LYS A 110 25.100 -7.313 1.963 1.00 0.00 H new ATOM 0 HD3 LYS A 110 24.773 -6.639 0.379 1.00 0.00 H new ATOM 0 HE2 LYS A 110 25.319 -4.403 1.092 1.00 0.00 H new ATOM 0 HE3 LYS A 110 25.248 -4.840 2.788 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 27.497 -4.575 2.045 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 27.218 -6.188 2.495 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 27.287 -5.765 0.852 1.00 0.00 H new ATOM 1793 N ILE A 111 23.638 -2.122 0.584 1.00 0.00 N ATOM 1794 CA ILE A 111 23.790 -0.961 -0.283 1.00 0.00 C ATOM 1795 C ILE A 111 24.717 -1.376 -1.436 1.00 0.00 C ATOM 1796 O ILE A 111 25.658 -2.143 -1.204 1.00 0.00 O ATOM 1797 CB ILE A 111 24.313 0.232 0.581 1.00 0.00 C ATOM 1798 CG1 ILE A 111 23.222 1.305 0.802 1.00 0.00 C ATOM 1799 CG2 ILE A 111 25.601 0.906 0.069 1.00 0.00 C ATOM 1800 CD1 ILE A 111 22.802 1.427 2.263 1.00 0.00 C ATOM 0 H ILE A 111 24.505 -2.648 0.690 1.00 0.00 H new ATOM 0 HA ILE A 111 22.855 -0.620 -0.729 1.00 0.00 H new ATOM 0 HB ILE A 111 24.574 -0.238 1.529 1.00 0.00 H new ATOM 0 HG12 ILE A 111 23.591 2.269 0.453 1.00 0.00 H new ATOM 0 HG13 ILE A 111 22.349 1.060 0.197 1.00 0.00 H new ATOM 0 HG21 ILE A 111 25.877 1.720 0.740 1.00 0.00 H new ATOM 0 HG22 ILE A 111 26.407 0.173 0.037 1.00 0.00 H new ATOM 0 HG23 ILE A 111 25.431 1.303 -0.932 1.00 0.00 H new ATOM 0 HD11 ILE A 111 22.034 2.195 2.358 1.00 0.00 H new ATOM 0 HD12 ILE A 111 22.405 0.472 2.608 1.00 0.00 H new ATOM 0 HD13 ILE A 111 23.666 1.701 2.868 1.00 0.00 H new ATOM 1812 N TYR A 112 24.439 -0.863 -2.640 1.00 0.00 N ATOM 1813 CA TYR A 112 25.147 -1.052 -3.903 1.00 0.00 C ATOM 1814 C TYR A 112 25.171 0.274 -4.672 1.00 0.00 C ATOM 1815 O TYR A 112 24.419 1.194 -4.328 1.00 0.00 O ATOM 1816 CB TYR A 112 24.412 -2.112 -4.730 1.00 0.00 C ATOM 1817 CG TYR A 112 24.466 -3.489 -4.104 1.00 0.00 C ATOM 1818 CD1 TYR A 112 25.559 -4.319 -4.390 1.00 0.00 C ATOM 1819 CD2 TYR A 112 23.467 -3.921 -3.211 1.00 0.00 C ATOM 1820 CE1 TYR A 112 25.643 -5.601 -3.821 1.00 0.00 C ATOM 1821 CE2 TYR A 112 23.536 -5.213 -2.647 1.00 0.00 C ATOM 1822 CZ TYR A 112 24.626 -6.062 -2.955 1.00 0.00 C ATOM 1823 OH TYR A 112 24.711 -7.315 -2.421 1.00 0.00 O ATOM 0 H TYR A 112 23.635 -0.247 -2.762 1.00 0.00 H new ATOM 0 HA TYR A 112 26.170 -1.378 -3.713 1.00 0.00 H new ATOM 0 HB2 TYR A 112 23.371 -1.814 -4.851 1.00 0.00 H new ATOM 0 HB3 TYR A 112 24.849 -2.155 -5.728 1.00 0.00 H new ATOM 0 HD1 TYR A 112 26.340 -3.972 -5.050 1.00 0.00 H new ATOM 0 HD2 TYR A 112 22.648 -3.264 -2.958 1.00 0.00 H new ATOM 0 HE1 TYR A 112 26.487 -6.236 -4.046 1.00 0.00 H new ATOM 0 HE2 TYR A 112 22.757 -5.554 -1.981 1.00 0.00 H new ATOM 0 HH TYR A 112 23.934 -7.479 -1.846 1.00 0.00 H new ATOM 1833 N ASP A 113 25.967 0.384 -5.741 1.00 0.00 N ATOM 1834 CA ASP A 113 25.977 1.619 -6.524 1.00 0.00 C ATOM 1835 C ASP A 113 24.817 1.615 -7.499 1.00 0.00 C ATOM 1836 O ASP A 113 24.105 2.615 -7.602 1.00 0.00 O ATOM 1837 CB ASP A 113 27.296 1.856 -7.276 1.00 0.00 C ATOM 1838 CG ASP A 113 28.094 2.941 -6.589 1.00 0.00 C ATOM 1839 OD1 ASP A 113 27.649 4.109 -6.615 1.00 0.00 O ATOM 1840 OD2 ASP A 113 29.110 2.588 -5.946 1.00 0.00 O ATOM 0 H ASP A 113 26.596 -0.346 -6.075 1.00 0.00 H new ATOM 0 HA ASP A 113 25.875 2.441 -5.815 1.00 0.00 H new ATOM 0 HB2 ASP A 113 27.875 0.933 -7.311 1.00 0.00 H new ATOM 0 HB3 ASP A 113 27.090 2.142 -8.307 1.00 0.00 H new ATOM 1845 N THR A 114 24.623 0.504 -8.200 1.00 0.00 N ATOM 1846 CA THR A 114 23.658 0.354 -9.275 1.00 0.00 C ATOM 1847 C THR A 114 22.668 -0.742 -8.900 1.00 0.00 C ATOM 1848 O THR A 114 22.815 -1.431 -7.888 1.00 0.00 O ATOM 1849 CB THR A 114 24.379 0.060 -10.603 1.00 0.00 C ATOM 1850 OG1 THR A 114 25.087 -1.158 -10.546 1.00 0.00 O ATOM 1851 CG2 THR A 114 25.326 1.185 -11.029 1.00 0.00 C ATOM 0 H THR A 114 25.156 -0.348 -8.026 1.00 0.00 H new ATOM 0 HA THR A 114 23.103 1.281 -9.417 1.00 0.00 H new ATOM 0 HB THR A 114 23.594 -0.015 -11.355 1.00 0.00 H new ATOM 0 HG1 THR A 114 25.952 -1.014 -10.108 1.00 0.00 H new ATOM 0 HG21 THR A 114 25.805 0.920 -11.972 1.00 0.00 H new ATOM 0 HG22 THR A 114 24.760 2.108 -11.156 1.00 0.00 H new ATOM 0 HG23 THR A 114 26.088 1.329 -10.263 1.00 0.00 H new ATOM 1859 N ILE A 115 21.638 -0.915 -9.729 1.00 0.00 N ATOM 1860 CA ILE A 115 20.777 -2.072 -9.607 1.00 0.00 C ATOM 1861 C ILE A 115 21.575 -3.312 -9.960 1.00 0.00 C ATOM 1862 O ILE A 115 21.394 -4.316 -9.291 1.00 0.00 O ATOM 1863 CB ILE A 115 19.517 -1.920 -10.483 1.00 0.00 C ATOM 1864 CG1 ILE A 115 18.512 -0.977 -9.803 1.00 0.00 C ATOM 1865 CG2 ILE A 115 18.841 -3.266 -10.813 1.00 0.00 C ATOM 1866 CD1 ILE A 115 17.814 -1.550 -8.568 1.00 0.00 C ATOM 0 H ILE A 115 21.389 -0.272 -10.481 1.00 0.00 H new ATOM 0 HA ILE A 115 20.424 -2.165 -8.580 1.00 0.00 H new ATOM 0 HB ILE A 115 19.845 -1.494 -11.431 1.00 0.00 H new ATOM 0 HG12 ILE A 115 19.033 -0.064 -9.515 1.00 0.00 H new ATOM 0 HG13 ILE A 115 17.752 -0.695 -10.532 1.00 0.00 H new ATOM 0 HG21 ILE A 115 17.961 -3.089 -11.432 1.00 0.00 H new ATOM 0 HG22 ILE A 115 19.542 -3.903 -11.353 1.00 0.00 H new ATOM 0 HG23 ILE A 115 18.541 -3.759 -9.888 1.00 0.00 H new ATOM 0 HD11 ILE A 115 17.126 -0.808 -8.162 1.00 0.00 H new ATOM 0 HD12 ILE A 115 17.259 -2.446 -8.847 1.00 0.00 H new ATOM 0 HD13 ILE A 115 18.559 -1.805 -7.814 1.00 0.00 H new ATOM 1878 N SER A 116 22.411 -3.293 -10.998 1.00 0.00 N ATOM 1879 CA SER A 116 22.966 -4.531 -11.509 1.00 0.00 C ATOM 1880 C SER A 116 23.921 -5.148 -10.508 1.00 0.00 C ATOM 1881 O SER A 116 23.901 -6.367 -10.328 1.00 0.00 O ATOM 1882 CB SER A 116 23.683 -4.268 -12.814 1.00 0.00 C ATOM 1883 OG SER A 116 24.046 -5.486 -13.421 1.00 0.00 O ATOM 0 H SER A 116 22.710 -2.450 -11.488 1.00 0.00 H new ATOM 0 HA SER A 116 22.150 -5.233 -11.679 1.00 0.00 H new ATOM 0 HB2 SER A 116 23.039 -3.697 -13.483 1.00 0.00 H new ATOM 0 HB3 SER A 116 24.572 -3.663 -12.634 1.00 0.00 H new ATOM 0 HG SER A 116 24.508 -5.305 -14.266 1.00 0.00 H new ATOM 1889 N GLU A 117 24.699 -4.313 -9.813 1.00 0.00 N ATOM 1890 CA GLU A 117 25.607 -4.798 -8.803 1.00 0.00 C ATOM 1891 C GLU A 117 24.830 -5.505 -7.711 1.00 0.00 C ATOM 1892 O GLU A 117 25.385 -6.400 -7.088 1.00 0.00 O ATOM 1893 CB GLU A 117 26.327 -3.635 -8.145 1.00 0.00 C ATOM 1894 CG GLU A 117 27.506 -3.079 -8.928 1.00 0.00 C ATOM 1895 CD GLU A 117 27.741 -1.694 -8.357 1.00 0.00 C ATOM 1896 OE1 GLU A 117 27.013 -0.795 -8.827 1.00 0.00 O ATOM 1897 OE2 GLU A 117 28.454 -1.567 -7.332 1.00 0.00 O ATOM 0 H GLU A 117 24.709 -3.301 -9.941 1.00 0.00 H new ATOM 0 HA GLU A 117 26.315 -5.472 -9.284 1.00 0.00 H new ATOM 0 HB2 GLU A 117 25.610 -2.831 -7.979 1.00 0.00 H new ATOM 0 HB3 GLU A 117 26.680 -3.955 -7.165 1.00 0.00 H new ATOM 0 HG2 GLU A 117 28.388 -3.708 -8.812 1.00 0.00 H new ATOM 0 HG3 GLU A 117 27.285 -3.034 -9.994 1.00 0.00 H new ATOM 1904 N ALA A 118 23.573 -5.110 -7.489 1.00 0.00 N ATOM 1905 CA ALA A 118 22.731 -5.688 -6.480 1.00 0.00 C ATOM 1906 C ALA A 118 22.166 -6.972 -7.068 1.00 0.00 C ATOM 1907 O ALA A 118 22.296 -8.049 -6.501 1.00 0.00 O ATOM 1908 CB ALA A 118 21.638 -4.673 -6.117 1.00 0.00 C ATOM 0 H ALA A 118 23.121 -4.367 -8.022 1.00 0.00 H new ATOM 0 HA ALA A 118 23.267 -5.925 -5.561 1.00 0.00 H new ATOM 0 HB1 ALA A 118 20.988 -5.096 -5.351 1.00 0.00 H new ATOM 0 HB2 ALA A 118 22.100 -3.761 -5.738 1.00 0.00 H new ATOM 0 HB3 ALA A 118 21.049 -4.440 -7.004 1.00 0.00 H new ATOM 1914 N MET A 119 21.538 -6.868 -8.231 1.00 0.00 N ATOM 1915 CA MET A 119 20.600 -7.818 -8.773 1.00 0.00 C ATOM 1916 C MET A 119 21.151 -9.234 -8.897 1.00 0.00 C ATOM 1917 O MET A 119 20.393 -10.201 -8.816 1.00 0.00 O ATOM 1918 CB MET A 119 20.184 -7.300 -10.159 1.00 0.00 C ATOM 1919 CG MET A 119 18.763 -7.744 -10.502 1.00 0.00 C ATOM 1920 SD MET A 119 18.637 -8.783 -11.975 1.00 0.00 S ATOM 1921 CE MET A 119 17.761 -10.216 -11.304 1.00 0.00 C ATOM 0 H MET A 119 21.684 -6.070 -8.850 1.00 0.00 H new ATOM 0 HA MET A 119 19.758 -7.895 -8.084 1.00 0.00 H new ATOM 0 HB2 MET A 119 20.244 -6.212 -10.178 1.00 0.00 H new ATOM 0 HB3 MET A 119 20.878 -7.671 -10.914 1.00 0.00 H new ATOM 0 HG2 MET A 119 18.351 -8.289 -9.652 1.00 0.00 H new ATOM 0 HG3 MET A 119 18.143 -6.858 -10.644 1.00 0.00 H new ATOM 0 HE1 MET A 119 17.607 -10.951 -12.094 1.00 0.00 H new ATOM 0 HE2 MET A 119 18.352 -10.662 -10.504 1.00 0.00 H new ATOM 0 HE3 MET A 119 16.796 -9.900 -10.909 1.00 0.00 H new ATOM 1931 N GLU A 120 22.458 -9.365 -9.082 1.00 0.00 N ATOM 1932 CA GLU A 120 23.165 -10.632 -9.215 1.00 0.00 C ATOM 1933 C GLU A 120 23.960 -11.041 -7.983 1.00 0.00 C ATOM 1934 O GLU A 120 24.550 -12.120 -7.983 1.00 0.00 O ATOM 1935 CB GLU A 120 24.019 -10.562 -10.476 1.00 0.00 C ATOM 1936 CG GLU A 120 25.277 -9.707 -10.264 1.00 0.00 C ATOM 1937 CD GLU A 120 26.179 -9.641 -11.493 1.00 0.00 C ATOM 1938 OE1 GLU A 120 26.003 -10.447 -12.439 1.00 0.00 O ATOM 1939 OE2 GLU A 120 27.147 -8.850 -11.440 1.00 0.00 O ATOM 0 H GLU A 120 23.080 -8.559 -9.146 1.00 0.00 H new ATOM 0 HA GLU A 120 22.428 -11.430 -9.306 1.00 0.00 H new ATOM 0 HB2 GLU A 120 24.310 -11.569 -10.775 1.00 0.00 H new ATOM 0 HB3 GLU A 120 23.429 -10.145 -11.292 1.00 0.00 H new ATOM 0 HG2 GLU A 120 24.978 -8.696 -9.987 1.00 0.00 H new ATOM 0 HG3 GLU A 120 25.845 -10.112 -9.427 1.00 0.00 H new ATOM 1946 N GLU A 121 23.943 -10.216 -6.939 1.00 0.00 N ATOM 1947 CA GLU A 121 24.831 -10.299 -5.793 1.00 0.00 C ATOM 1948 C GLU A 121 24.089 -10.419 -4.480 1.00 0.00 C ATOM 1949 O GLU A 121 24.515 -11.162 -3.621 1.00 0.00 O ATOM 1950 CB GLU A 121 25.666 -9.034 -5.722 1.00 0.00 C ATOM 1951 CG GLU A 121 26.924 -9.220 -4.871 1.00 0.00 C ATOM 1952 CD GLU A 121 27.928 -10.211 -5.463 1.00 0.00 C ATOM 1953 OE1 GLU A 121 27.732 -11.443 -5.370 1.00 0.00 O ATOM 1954 OE2 GLU A 121 28.921 -9.756 -6.075 1.00 0.00 O ATOM 0 H GLU A 121 23.282 -9.442 -6.870 1.00 0.00 H new ATOM 0 HA GLU A 121 25.439 -11.193 -5.931 1.00 0.00 H new ATOM 0 HB2 GLU A 121 25.952 -8.732 -6.730 1.00 0.00 H new ATOM 0 HB3 GLU A 121 25.064 -8.226 -5.306 1.00 0.00 H new ATOM 0 HG2 GLU A 121 27.412 -8.254 -4.745 1.00 0.00 H new ATOM 0 HG3 GLU A 121 26.632 -9.562 -3.878 1.00 0.00 H new ATOM 1961 N VAL A 122 22.937 -9.777 -4.338 1.00 0.00 N ATOM 1962 CA VAL A 122 21.920 -10.054 -3.333 1.00 0.00 C ATOM 1963 C VAL A 122 21.476 -11.523 -3.445 1.00 0.00 C ATOM 1964 O VAL A 122 21.086 -12.184 -2.478 1.00 0.00 O ATOM 1965 CB VAL A 122 20.766 -9.086 -3.617 1.00 0.00 C ATOM 1966 CG1 VAL A 122 19.919 -9.055 -2.381 1.00 0.00 C ATOM 1967 CG2 VAL A 122 21.165 -7.633 -3.917 1.00 0.00 C ATOM 0 H VAL A 122 22.673 -9.008 -4.954 1.00 0.00 H new ATOM 0 HA VAL A 122 22.288 -9.912 -2.317 1.00 0.00 H new ATOM 0 HB VAL A 122 20.272 -9.455 -4.516 1.00 0.00 H new ATOM 0 HG11 VAL A 122 19.079 -8.377 -2.532 1.00 0.00 H new ATOM 0 HG12 VAL A 122 19.543 -10.057 -2.172 1.00 0.00 H new ATOM 0 HG13 VAL A 122 20.518 -8.709 -1.538 1.00 0.00 H new ATOM 0 HG21 VAL A 122 20.269 -7.040 -4.102 1.00 0.00 H new ATOM 0 HG22 VAL A 122 21.703 -7.220 -3.064 1.00 0.00 H new ATOM 0 HG23 VAL A 122 21.806 -7.606 -4.798 1.00 0.00 H new ATOM 1977 N ARG A 123 21.599 -12.075 -4.653 1.00 0.00 N ATOM 1978 CA ARG A 123 21.580 -13.522 -4.879 1.00 0.00 C ATOM 1979 C ARG A 123 22.618 -14.282 -4.023 1.00 0.00 C ATOM 1980 O ARG A 123 22.387 -15.446 -3.687 1.00 0.00 O ATOM 1981 CB ARG A 123 21.741 -13.788 -6.389 1.00 0.00 C ATOM 1982 CG ARG A 123 20.446 -13.474 -7.148 1.00 0.00 C ATOM 1983 CD ARG A 123 20.442 -13.993 -8.601 1.00 0.00 C ATOM 1984 NE ARG A 123 20.542 -12.919 -9.597 1.00 0.00 N ATOM 1985 CZ ARG A 123 20.737 -13.069 -10.914 1.00 0.00 C ATOM 1986 NH1 ARG A 123 20.793 -14.275 -11.465 1.00 0.00 N ATOM 1987 NH2 ARG A 123 20.886 -11.997 -11.686 1.00 0.00 N ATOM 0 H ARG A 123 21.715 -11.529 -5.507 1.00 0.00 H new ATOM 0 HA ARG A 123 20.619 -13.916 -4.549 1.00 0.00 H new ATOM 0 HB2 ARG A 123 22.554 -13.179 -6.784 1.00 0.00 H new ATOM 0 HB3 ARG A 123 22.017 -14.830 -6.550 1.00 0.00 H new ATOM 0 HG2 ARG A 123 19.605 -13.913 -6.612 1.00 0.00 H new ATOM 0 HG3 ARG A 123 20.291 -12.395 -7.156 1.00 0.00 H new ATOM 0 HD2 ARG A 123 21.274 -14.684 -8.736 1.00 0.00 H new ATOM 0 HD3 ARG A 123 19.527 -14.558 -8.776 1.00 0.00 H new ATOM 0 HE ARG A 123 20.454 -11.963 -9.252 1.00 0.00 H new ATOM 0 HH11 ARG A 123 20.687 -15.107 -10.884 1.00 0.00 H new ATOM 0 HH12 ARG A 123 20.942 -14.370 -12.470 1.00 0.00 H new ATOM 0 HH21 ARG A 123 20.852 -11.064 -11.275 1.00 0.00 H new ATOM 0 HH22 ARG A 123 21.035 -12.108 -12.689 1.00 0.00 H new ATOM 2001 N ARG A 124 23.774 -13.694 -3.698 1.00 0.00 N ATOM 2002 CA ARG A 124 24.884 -14.285 -2.935 1.00 0.00 C ATOM 2003 C ARG A 124 25.462 -13.495 -1.777 1.00 0.00 C ATOM 2004 O ARG A 124 26.573 -13.778 -1.321 1.00 0.00 O ATOM 2005 CB ARG A 124 26.022 -14.714 -3.886 1.00 0.00 C ATOM 2006 CG ARG A 124 25.564 -15.427 -5.161 1.00 0.00 C ATOM 2007 CD ARG A 124 25.445 -14.529 -6.398 1.00 0.00 C ATOM 2008 NE ARG A 124 25.693 -15.258 -7.657 1.00 0.00 N ATOM 2009 CZ ARG A 124 25.154 -16.417 -8.065 1.00 0.00 C ATOM 2010 NH1 ARG A 124 24.162 -17.007 -7.402 1.00 0.00 N ATOM 2011 NH2 ARG A 124 25.616 -17.031 -9.144 1.00 0.00 N ATOM 0 H ARG A 124 23.974 -12.733 -3.977 1.00 0.00 H new ATOM 0 HA ARG A 124 24.405 -15.134 -2.447 1.00 0.00 H new ATOM 0 HB2 ARG A 124 26.593 -13.829 -4.167 1.00 0.00 H new ATOM 0 HB3 ARG A 124 26.700 -15.372 -3.343 1.00 0.00 H new ATOM 0 HG2 ARG A 124 26.265 -16.232 -5.381 1.00 0.00 H new ATOM 0 HG3 ARG A 124 24.596 -15.890 -4.972 1.00 0.00 H new ATOM 0 HD2 ARG A 124 24.448 -14.089 -6.428 1.00 0.00 H new ATOM 0 HD3 ARG A 124 26.154 -13.706 -6.314 1.00 0.00 H new ATOM 0 HE ARG A 124 26.358 -14.826 -8.298 1.00 0.00 H new ATOM 0 HH11 ARG A 124 23.788 -16.578 -6.555 1.00 0.00 H new ATOM 0 HH12 ARG A 124 23.776 -17.888 -7.741 1.00 0.00 H new ATOM 0 HH21 ARG A 124 26.388 -16.623 -9.672 1.00 0.00 H new ATOM 0 HH22 ARG A 124 25.200 -17.912 -9.447 1.00 0.00 H new ATOM 2025 N LYS A 125 24.682 -12.596 -1.221 1.00 0.00 N ATOM 2026 CA LYS A 125 24.972 -11.721 -0.126 1.00 0.00 C ATOM 2027 C LYS A 125 23.618 -11.489 0.477 1.00 0.00 C ATOM 2028 O LYS A 125 23.317 -12.180 1.473 1.00 0.00 O ATOM 2029 CB LYS A 125 25.591 -10.439 -0.687 1.00 0.00 C ATOM 2030 CG LYS A 125 27.046 -10.739 -1.082 1.00 0.00 C ATOM 2031 CD LYS A 125 27.930 -9.497 -1.334 1.00 0.00 C ATOM 2032 CE LYS A 125 29.321 -9.623 -0.701 1.00 0.00 C ATOM 2033 NZ LYS A 125 30.200 -10.594 -1.393 1.00 0.00 N ATOM 0 H LYS A 125 23.733 -12.451 -1.566 1.00 0.00 H new ATOM 0 HA LYS A 125 25.678 -12.105 0.610 1.00 0.00 H new ATOM 0 HB2 LYS A 125 25.026 -10.092 -1.552 1.00 0.00 H new ATOM 0 HB3 LYS A 125 25.556 -9.643 0.057 1.00 0.00 H new ATOM 0 HG2 LYS A 125 27.504 -11.337 -0.294 1.00 0.00 H new ATOM 0 HG3 LYS A 125 27.042 -11.351 -1.984 1.00 0.00 H new ATOM 0 HD2 LYS A 125 28.036 -9.344 -2.408 1.00 0.00 H new ATOM 0 HD3 LYS A 125 27.432 -8.614 -0.934 1.00 0.00 H new ATOM 0 HE2 LYS A 125 29.802 -8.645 -0.702 1.00 0.00 H new ATOM 0 HE3 LYS A 125 29.211 -9.923 0.341 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 31.123 -10.630 -0.914 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 29.762 -11.537 -1.370 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 30.334 -10.298 -2.381 1.00 0.00 H new TER 2047 LYS A 125