USER MOD reduce.3.24.130724 H: found=0, std=0, add=1038, rem=0, adj=21 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 60 SER OG : rot 180:sc= 1.07 USER MOD Set 1.2: A 91 SER OG : rot 165:sc= 0.993 USER MOD Set 2.1: A 40 LYS NZ :NH3+ -169:sc= 0.88 (180deg=0) USER MOD Set 2.2: A 75 ASN : amide:sc= 0.676 K(o=1.6,f=-6) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (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 7 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 8 HIS : no HD1:sc= -0.498 K(o=-0.5,f=-1.4) USER MOD Single : A 9 HIS : no HD1:sc= -0.104 X(o=-0.1,f=-0.17) USER MOD Single : A 10 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 11 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 12 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 13 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 16 TYR OH : rot -153:sc= 1.17 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 MET CE :methyl 172:sc= -0.0282 (180deg=-0.144) USER MOD Single : A 28 ASN : amide:sc= -0.331 X(o=-0.33,f=-0.091) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 ASN : amide:sc= 0.725 K(o=0.72,f=-0.053) USER MOD Single : A 35 ASN : amide:sc= 0.421 K(o=0.42,f=-3.3) USER MOD Single : A 37 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 ASN : amide:sc= -0.182 K(o=-0.18,f=-0.97) 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= -0.0421 X(o=-0.042,f=0) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot -70:sc= 0.859 USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 82 SER OG : rot 76:sc= 0.556 USER MOD Single : A 83 SER OG : rot 75:sc= 1.31 USER MOD Single : A 93 ASN : amide:sc= -0.0107 X(o=-0.011,f=0) USER MOD Single : A 95 LYS NZ :NH3+ 144:sc= 1.17 (180deg=0.122) USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 104 ASN : amide:sc= -0.0185 K(o=-0.018,f=-2.4!) 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 -106:sc= 1.52 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+ -134:sc= -0.503 (180deg=-2.65!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -10.468 -6.063 15.381 1.00 0.00 N ATOM 2 CA MET A 1 -9.840 -5.278 14.301 1.00 0.00 C ATOM 3 C MET A 1 -10.681 -4.050 14.019 1.00 0.00 C ATOM 4 O MET A 1 -11.837 -4.194 13.626 1.00 0.00 O ATOM 5 CB MET A 1 -9.703 -6.067 12.995 1.00 0.00 C ATOM 6 CG MET A 1 -8.752 -7.251 13.118 1.00 0.00 C ATOM 7 SD MET A 1 -9.517 -8.854 12.807 1.00 0.00 S ATOM 8 CE MET A 1 -7.981 -9.802 12.764 1.00 0.00 C ATOM 0 H1 MET A 1 -9.892 -6.907 15.577 1.00 0.00 H new ATOM 0 H2 MET A 1 -10.533 -5.481 16.241 1.00 0.00 H new ATOM 0 H3 MET A 1 -11.422 -6.355 15.088 1.00 0.00 H new ATOM 0 HA MET A 1 -8.840 -5.013 14.645 1.00 0.00 H new ATOM 0 HB2 MET A 1 -10.685 -6.426 12.688 1.00 0.00 H new ATOM 0 HB3 MET A 1 -9.347 -5.401 12.209 1.00 0.00 H new ATOM 0 HG2 MET A 1 -7.927 -7.114 12.419 1.00 0.00 H new ATOM 0 HG3 MET A 1 -8.323 -7.255 14.120 1.00 0.00 H new ATOM 0 HE1 MET A 1 -8.207 -10.852 12.580 1.00 0.00 H new ATOM 0 HE2 MET A 1 -7.342 -9.423 11.967 1.00 0.00 H new ATOM 0 HE3 MET A 1 -7.466 -9.704 13.720 1.00 0.00 H new ATOM 18 N GLY A 2 -10.120 -2.856 14.175 1.00 0.00 N ATOM 19 CA GLY A 2 -10.770 -1.606 13.835 1.00 0.00 C ATOM 20 C GLY A 2 -9.901 -0.462 14.328 1.00 0.00 C ATOM 21 O GLY A 2 -9.838 -0.218 15.530 1.00 0.00 O ATOM 0 H GLY A 2 -9.180 -2.733 14.550 1.00 0.00 H new ATOM 0 HA2 GLY A 2 -10.914 -1.535 12.757 1.00 0.00 H new ATOM 0 HA3 GLY A 2 -11.758 -1.556 14.293 1.00 0.00 H new ATOM 25 N SER A 3 -9.195 0.201 13.416 1.00 0.00 N ATOM 26 CA SER A 3 -8.486 1.448 13.675 1.00 0.00 C ATOM 27 C SER A 3 -8.580 2.292 12.400 1.00 0.00 C ATOM 28 O SER A 3 -8.336 1.762 11.312 1.00 0.00 O ATOM 29 CB SER A 3 -7.014 1.173 14.039 1.00 0.00 C ATOM 30 OG SER A 3 -6.864 0.292 15.144 1.00 0.00 O ATOM 0 H SER A 3 -9.099 -0.123 12.454 1.00 0.00 H new ATOM 0 HA SER A 3 -8.931 1.975 14.519 1.00 0.00 H new ATOM 0 HB2 SER A 3 -6.506 0.749 13.173 1.00 0.00 H new ATOM 0 HB3 SER A 3 -6.521 2.118 14.267 1.00 0.00 H new ATOM 0 HG SER A 3 -5.911 0.155 15.326 1.00 0.00 H new ATOM 36 N ASP A 4 -8.898 3.582 12.533 1.00 0.00 N ATOM 37 CA ASP A 4 -9.101 4.582 11.471 1.00 0.00 C ATOM 38 C ASP A 4 -10.344 4.296 10.612 1.00 0.00 C ATOM 39 O ASP A 4 -10.961 3.228 10.695 1.00 0.00 O ATOM 40 CB ASP A 4 -7.865 4.763 10.562 1.00 0.00 C ATOM 41 CG ASP A 4 -6.641 5.341 11.260 1.00 0.00 C ATOM 42 OD1 ASP A 4 -6.504 6.583 11.276 1.00 0.00 O ATOM 43 OD2 ASP A 4 -5.799 4.535 11.719 1.00 0.00 O ATOM 0 H ASP A 4 -9.032 3.991 13.458 1.00 0.00 H new ATOM 0 HA ASP A 4 -9.263 5.519 12.004 1.00 0.00 H new ATOM 0 HB2 ASP A 4 -7.600 3.796 10.135 1.00 0.00 H new ATOM 0 HB3 ASP A 4 -8.134 5.415 9.731 1.00 0.00 H new ATOM 48 N LYS A 5 -10.712 5.259 9.754 1.00 0.00 N ATOM 49 CA LYS A 5 -11.584 5.064 8.597 1.00 0.00 C ATOM 50 C LYS A 5 -11.000 5.892 7.449 1.00 0.00 C ATOM 51 O LYS A 5 -11.191 7.102 7.391 1.00 0.00 O ATOM 52 CB LYS A 5 -13.066 5.347 8.940 1.00 0.00 C ATOM 53 CG LYS A 5 -13.444 6.805 9.264 1.00 0.00 C ATOM 54 CD LYS A 5 -14.780 6.925 10.020 1.00 0.00 C ATOM 55 CE LYS A 5 -14.600 7.333 11.491 1.00 0.00 C ATOM 56 NZ LYS A 5 -13.825 6.360 12.286 1.00 0.00 N ATOM 0 H LYS A 5 -10.398 6.224 9.854 1.00 0.00 H new ATOM 0 HA LYS A 5 -11.608 4.022 8.277 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -13.677 5.018 8.099 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -13.340 4.728 9.795 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -12.652 7.256 9.862 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -13.505 7.374 8.336 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -15.411 7.660 9.519 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -15.305 5.971 9.974 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -14.101 8.301 11.532 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -15.582 7.461 11.946 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -13.743 6.699 13.266 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -14.310 5.440 12.277 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -12.875 6.255 11.876 1.00 0.00 H new ATOM 70 N ILE A 6 -10.201 5.272 6.583 1.00 0.00 N ATOM 71 CA ILE A 6 -9.446 5.928 5.516 1.00 0.00 C ATOM 72 C ILE A 6 -9.814 5.175 4.238 1.00 0.00 C ATOM 73 O ILE A 6 -9.386 4.029 4.052 1.00 0.00 O ATOM 74 CB ILE A 6 -7.931 5.900 5.856 1.00 0.00 C ATOM 75 CG1 ILE A 6 -7.620 6.740 7.120 1.00 0.00 C ATOM 76 CG2 ILE A 6 -7.063 6.438 4.704 1.00 0.00 C ATOM 77 CD1 ILE A 6 -6.236 6.456 7.720 1.00 0.00 C ATOM 0 H ILE A 6 -10.056 4.263 6.605 1.00 0.00 H new ATOM 0 HA ILE A 6 -9.687 6.984 5.392 1.00 0.00 H new ATOM 0 HB ILE A 6 -7.688 4.852 6.030 1.00 0.00 H new ATOM 0 HG12 ILE A 6 -7.688 7.798 6.869 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -8.382 6.542 7.874 1.00 0.00 H new ATOM 0 HG21 ILE A 6 -6.012 6.398 4.991 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -7.220 5.828 3.814 1.00 0.00 H new ATOM 0 HG23 ILE A 6 -7.341 7.470 4.490 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -6.087 7.079 8.602 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -6.171 5.405 8.003 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -5.466 6.681 6.982 1.00 0.00 H new ATOM 89 N HIS A 7 -10.659 5.757 3.379 1.00 0.00 N ATOM 90 CA HIS A 7 -11.192 5.070 2.201 1.00 0.00 C ATOM 91 C HIS A 7 -11.304 6.012 0.997 1.00 0.00 C ATOM 92 O HIS A 7 -12.376 6.195 0.417 1.00 0.00 O ATOM 93 CB HIS A 7 -12.496 4.343 2.568 1.00 0.00 C ATOM 94 CG HIS A 7 -13.612 5.179 3.148 1.00 0.00 C ATOM 95 ND1 HIS A 7 -14.803 5.484 2.523 1.00 0.00 N ATOM 96 CD2 HIS A 7 -13.707 5.601 4.447 1.00 0.00 C ATOM 97 CE1 HIS A 7 -15.600 6.075 3.427 1.00 0.00 C ATOM 98 NE2 HIS A 7 -14.968 6.179 4.607 1.00 0.00 N ATOM 0 H HIS A 7 -10.991 6.716 3.482 1.00 0.00 H new ATOM 0 HA HIS A 7 -10.491 4.301 1.877 1.00 0.00 H new ATOM 0 HB2 HIS A 7 -12.873 3.852 1.671 1.00 0.00 H new ATOM 0 HB3 HIS A 7 -12.255 3.557 3.284 1.00 0.00 H new ATOM 0 HD2 HIS A 7 -12.947 5.505 5.208 1.00 0.00 H new ATOM 0 HE1 HIS A 7 -16.606 6.418 3.233 1.00 0.00 H new ATOM 0 HE2 HIS A 7 -15.339 6.600 5.459 1.00 0.00 H new ATOM 106 N HIS A 8 -10.168 6.599 0.607 1.00 0.00 N ATOM 107 CA HIS A 8 -10.069 7.570 -0.485 1.00 0.00 C ATOM 108 C HIS A 8 -8.981 7.240 -1.518 1.00 0.00 C ATOM 109 O HIS A 8 -8.800 7.984 -2.486 1.00 0.00 O ATOM 110 CB HIS A 8 -9.887 8.972 0.108 1.00 0.00 C ATOM 111 CG HIS A 8 -8.810 9.128 1.157 1.00 0.00 C ATOM 112 ND1 HIS A 8 -7.474 9.395 0.941 1.00 0.00 N ATOM 113 CD2 HIS A 8 -9.023 9.173 2.508 1.00 0.00 C ATOM 114 CE1 HIS A 8 -6.902 9.591 2.142 1.00 0.00 C ATOM 115 NE2 HIS A 8 -7.814 9.492 3.120 1.00 0.00 N ATOM 0 H HIS A 8 -9.271 6.407 1.053 1.00 0.00 H new ATOM 0 HA HIS A 8 -11.001 7.525 -1.049 1.00 0.00 H new ATOM 0 HB2 HIS A 8 -9.670 9.662 -0.708 1.00 0.00 H new ATOM 0 HB3 HIS A 8 -10.836 9.283 0.545 1.00 0.00 H new ATOM 0 HD2 HIS A 8 -9.962 8.993 3.010 1.00 0.00 H new ATOM 0 HE1 HIS A 8 -5.854 9.799 2.297 1.00 0.00 H new ATOM 0 HE2 HIS A 8 -7.653 9.625 4.118 1.00 0.00 H new ATOM 123 N HIS A 9 -8.238 6.146 -1.339 1.00 0.00 N ATOM 124 CA HIS A 9 -7.254 5.720 -2.326 1.00 0.00 C ATOM 125 C HIS A 9 -7.962 5.185 -3.581 1.00 0.00 C ATOM 126 O HIS A 9 -9.067 4.632 -3.491 1.00 0.00 O ATOM 127 CB HIS A 9 -6.302 4.698 -1.692 1.00 0.00 C ATOM 128 CG HIS A 9 -6.975 3.496 -1.081 1.00 0.00 C ATOM 129 ND1 HIS A 9 -7.226 3.304 0.258 1.00 0.00 N ATOM 130 CD2 HIS A 9 -7.452 2.406 -1.756 1.00 0.00 C ATOM 131 CE1 HIS A 9 -7.881 2.140 0.380 1.00 0.00 C ATOM 132 NE2 HIS A 9 -8.091 1.579 -0.824 1.00 0.00 N ATOM 0 H HIS A 9 -8.302 5.542 -0.519 1.00 0.00 H new ATOM 0 HA HIS A 9 -6.649 6.568 -2.648 1.00 0.00 H new ATOM 0 HB2 HIS A 9 -5.601 4.356 -2.453 1.00 0.00 H new ATOM 0 HB3 HIS A 9 -5.716 5.199 -0.921 1.00 0.00 H new ATOM 0 HD2 HIS A 9 -7.354 2.218 -2.815 1.00 0.00 H new ATOM 0 HE1 HIS A 9 -8.197 1.711 1.319 1.00 0.00 H new ATOM 0 HE2 HIS A 9 -8.611 0.723 -1.019 1.00 0.00 H new ATOM 140 N HIS A 10 -7.301 5.328 -4.732 1.00 0.00 N ATOM 141 CA HIS A 10 -7.736 4.905 -6.059 1.00 0.00 C ATOM 142 C HIS A 10 -6.450 4.531 -6.801 1.00 0.00 C ATOM 143 O HIS A 10 -5.604 5.412 -6.967 1.00 0.00 O ATOM 144 CB HIS A 10 -8.441 6.065 -6.797 1.00 0.00 C ATOM 145 CG HIS A 10 -9.748 6.547 -6.208 1.00 0.00 C ATOM 146 ND1 HIS A 10 -10.884 5.797 -5.997 1.00 0.00 N ATOM 147 CD2 HIS A 10 -10.046 7.844 -5.879 1.00 0.00 C ATOM 148 CE1 HIS A 10 -11.834 6.628 -5.535 1.00 0.00 C ATOM 149 NE2 HIS A 10 -11.373 7.888 -5.437 1.00 0.00 N ATOM 0 H HIS A 10 -6.384 5.774 -4.760 1.00 0.00 H new ATOM 0 HA HIS A 10 -8.444 4.078 -6.004 1.00 0.00 H new ATOM 0 HB2 HIS A 10 -7.754 6.910 -6.839 1.00 0.00 H new ATOM 0 HB3 HIS A 10 -8.625 5.753 -7.825 1.00 0.00 H new ATOM 0 HD2 HIS A 10 -9.373 8.686 -5.949 1.00 0.00 H new ATOM 0 HE1 HIS A 10 -12.837 6.324 -5.276 1.00 0.00 H new ATOM 0 HE2 HIS A 10 -11.885 8.707 -5.108 1.00 0.00 H new ATOM 157 N HIS A 11 -6.266 3.268 -7.201 1.00 0.00 N ATOM 158 CA HIS A 11 -5.031 2.754 -7.810 1.00 0.00 C ATOM 159 C HIS A 11 -4.571 3.589 -9.016 1.00 0.00 C ATOM 160 O HIS A 11 -5.151 3.493 -10.103 1.00 0.00 O ATOM 161 CB HIS A 11 -5.199 1.270 -8.193 1.00 0.00 C ATOM 162 CG HIS A 11 -4.719 0.312 -7.130 1.00 0.00 C ATOM 163 ND1 HIS A 11 -3.402 -0.002 -6.877 1.00 0.00 N ATOM 164 CD2 HIS A 11 -5.494 -0.459 -6.302 1.00 0.00 C ATOM 165 CE1 HIS A 11 -3.386 -0.943 -5.922 1.00 0.00 C ATOM 166 NE2 HIS A 11 -4.636 -1.245 -5.520 1.00 0.00 N ATOM 0 H HIS A 11 -6.990 2.555 -7.108 1.00 0.00 H new ATOM 0 HA HIS A 11 -4.244 2.838 -7.061 1.00 0.00 H new ATOM 0 HB2 HIS A 11 -6.251 1.074 -8.398 1.00 0.00 H new ATOM 0 HB3 HIS A 11 -4.653 1.078 -9.116 1.00 0.00 H new ATOM 0 HD2 HIS A 11 -6.573 -0.460 -6.260 1.00 0.00 H new ATOM 0 HE1 HIS A 11 -2.490 -1.399 -5.527 1.00 0.00 H new ATOM 0 HE2 HIS A 11 -4.904 -1.910 -4.794 1.00 0.00 H new ATOM 174 N HIS A 12 -3.518 4.391 -8.840 1.00 0.00 N ATOM 175 CA HIS A 12 -2.817 5.115 -9.894 1.00 0.00 C ATOM 176 C HIS A 12 -1.402 5.440 -9.403 1.00 0.00 C ATOM 177 O HIS A 12 -1.206 5.530 -8.190 1.00 0.00 O ATOM 178 CB HIS A 12 -3.549 6.431 -10.197 1.00 0.00 C ATOM 179 CG HIS A 12 -3.326 6.932 -11.601 1.00 0.00 C ATOM 180 ND1 HIS A 12 -3.779 6.331 -12.756 1.00 0.00 N ATOM 181 CD2 HIS A 12 -2.639 8.061 -11.957 1.00 0.00 C ATOM 182 CE1 HIS A 12 -3.361 7.081 -13.791 1.00 0.00 C ATOM 183 NE2 HIS A 12 -2.666 8.141 -13.350 1.00 0.00 N ATOM 0 H HIS A 12 -3.116 4.558 -7.918 1.00 0.00 H new ATOM 0 HA HIS A 12 -2.781 4.505 -10.796 1.00 0.00 H new ATOM 0 HB2 HIS A 12 -4.618 6.289 -10.036 1.00 0.00 H new ATOM 0 HB3 HIS A 12 -3.218 7.193 -9.491 1.00 0.00 H new ATOM 0 HD2 HIS A 12 -2.164 8.760 -11.285 1.00 0.00 H new ATOM 0 HE1 HIS A 12 -3.557 6.861 -14.830 1.00 0.00 H new ATOM 0 HE2 HIS A 12 -2.238 8.868 -13.924 1.00 0.00 H new ATOM 191 N MET A 13 -0.487 5.768 -10.323 1.00 0.00 N ATOM 192 CA MET A 13 0.912 6.147 -10.096 1.00 0.00 C ATOM 193 C MET A 13 1.715 5.002 -9.479 1.00 0.00 C ATOM 194 O MET A 13 1.578 4.691 -8.296 1.00 0.00 O ATOM 195 CB MET A 13 1.048 7.455 -9.291 1.00 0.00 C ATOM 196 CG MET A 13 0.924 8.691 -10.185 1.00 0.00 C ATOM 197 SD MET A 13 2.469 9.151 -11.021 1.00 0.00 S ATOM 198 CE MET A 13 3.291 10.039 -9.669 1.00 0.00 C ATOM 0 H MET A 13 -0.722 5.776 -11.316 1.00 0.00 H new ATOM 0 HA MET A 13 1.344 6.349 -11.076 1.00 0.00 H new ATOM 0 HB2 MET A 13 0.280 7.487 -8.518 1.00 0.00 H new ATOM 0 HB3 MET A 13 2.012 7.470 -8.783 1.00 0.00 H new ATOM 0 HG2 MET A 13 0.156 8.508 -10.937 1.00 0.00 H new ATOM 0 HG3 MET A 13 0.585 9.532 -9.581 1.00 0.00 H new ATOM 0 HE1 MET A 13 4.264 10.396 -10.007 1.00 0.00 H new ATOM 0 HE2 MET A 13 2.678 10.888 -9.366 1.00 0.00 H new ATOM 0 HE3 MET A 13 3.426 9.367 -8.821 1.00 0.00 H new ATOM 208 N PHE A 14 2.577 4.402 -10.304 1.00 0.00 N ATOM 209 CA PHE A 14 3.467 3.308 -9.952 1.00 0.00 C ATOM 210 C PHE A 14 4.917 3.823 -9.901 1.00 0.00 C ATOM 211 O PHE A 14 5.625 3.737 -10.903 1.00 0.00 O ATOM 212 CB PHE A 14 3.254 2.133 -10.931 1.00 0.00 C ATOM 213 CG PHE A 14 3.417 2.417 -12.418 1.00 0.00 C ATOM 214 CD1 PHE A 14 2.389 3.038 -13.150 1.00 0.00 C ATOM 215 CD2 PHE A 14 4.593 2.025 -13.084 1.00 0.00 C ATOM 216 CE1 PHE A 14 2.541 3.276 -14.527 1.00 0.00 C ATOM 217 CE2 PHE A 14 4.746 2.259 -14.458 1.00 0.00 C ATOM 218 CZ PHE A 14 3.722 2.886 -15.184 1.00 0.00 C ATOM 0 H PHE A 14 2.673 4.684 -11.280 1.00 0.00 H new ATOM 0 HA PHE A 14 3.241 2.923 -8.958 1.00 0.00 H new ATOM 0 HB2 PHE A 14 3.952 1.340 -10.662 1.00 0.00 H new ATOM 0 HB3 PHE A 14 2.250 1.741 -10.772 1.00 0.00 H new ATOM 0 HD1 PHE A 14 1.478 3.334 -12.651 1.00 0.00 H new ATOM 0 HD2 PHE A 14 5.384 1.540 -12.532 1.00 0.00 H new ATOM 0 HE1 PHE A 14 1.750 3.759 -15.081 1.00 0.00 H new ATOM 0 HE2 PHE A 14 5.654 1.956 -14.958 1.00 0.00 H new ATOM 0 HZ PHE A 14 3.840 3.068 -16.242 1.00 0.00 H new ATOM 228 N PRO A 15 5.398 4.388 -8.778 1.00 0.00 N ATOM 229 CA PRO A 15 6.773 4.872 -8.632 1.00 0.00 C ATOM 230 C PRO A 15 7.757 3.712 -8.423 1.00 0.00 C ATOM 231 O PRO A 15 8.513 3.664 -7.451 1.00 0.00 O ATOM 232 CB PRO A 15 6.712 5.854 -7.457 1.00 0.00 C ATOM 233 CG PRO A 15 5.625 5.255 -6.569 1.00 0.00 C ATOM 234 CD PRO A 15 4.631 4.698 -7.581 1.00 0.00 C ATOM 0 HA PRO A 15 7.149 5.368 -9.527 1.00 0.00 H new ATOM 0 HB2 PRO A 15 7.667 5.921 -6.937 1.00 0.00 H new ATOM 0 HB3 PRO A 15 6.456 6.861 -7.785 1.00 0.00 H new ATOM 0 HG2 PRO A 15 6.019 4.475 -5.918 1.00 0.00 H new ATOM 0 HG3 PRO A 15 5.168 6.007 -5.925 1.00 0.00 H new ATOM 0 HD2 PRO A 15 4.139 3.806 -7.193 1.00 0.00 H new ATOM 0 HD3 PRO A 15 3.848 5.425 -7.798 1.00 0.00 H new ATOM 242 N TYR A 16 7.736 2.728 -9.319 1.00 0.00 N ATOM 243 CA TYR A 16 8.533 1.519 -9.219 1.00 0.00 C ATOM 244 C TYR A 16 8.608 0.834 -10.583 1.00 0.00 C ATOM 245 O TYR A 16 7.778 1.090 -11.459 1.00 0.00 O ATOM 246 CB TYR A 16 7.906 0.614 -8.141 1.00 0.00 C ATOM 247 CG TYR A 16 6.537 0.049 -8.449 1.00 0.00 C ATOM 248 CD1 TYR A 16 5.387 0.772 -8.084 1.00 0.00 C ATOM 249 CD2 TYR A 16 6.413 -1.214 -9.056 1.00 0.00 C ATOM 250 CE1 TYR A 16 4.112 0.235 -8.316 1.00 0.00 C ATOM 251 CE2 TYR A 16 5.137 -1.738 -9.329 1.00 0.00 C ATOM 252 CZ TYR A 16 3.978 -1.012 -8.962 1.00 0.00 C ATOM 253 OH TYR A 16 2.736 -1.458 -9.268 1.00 0.00 O ATOM 0 H TYR A 16 7.149 2.755 -10.153 1.00 0.00 H new ATOM 0 HA TYR A 16 9.557 1.748 -8.923 1.00 0.00 H new ATOM 0 HB2 TYR A 16 8.585 -0.218 -7.957 1.00 0.00 H new ATOM 0 HB3 TYR A 16 7.840 1.183 -7.214 1.00 0.00 H new ATOM 0 HD1 TYR A 16 5.486 1.744 -7.624 1.00 0.00 H new ATOM 0 HD2 TYR A 16 7.296 -1.780 -9.312 1.00 0.00 H new ATOM 0 HE1 TYR A 16 3.233 0.776 -8.000 1.00 0.00 H new ATOM 0 HE2 TYR A 16 5.041 -2.695 -9.819 1.00 0.00 H new ATOM 0 HH TYR A 16 2.738 -2.438 -9.297 1.00 0.00 H new ATOM 263 N LYS A 17 9.556 -0.090 -10.746 1.00 0.00 N ATOM 264 CA LYS A 17 9.653 -1.024 -11.869 1.00 0.00 C ATOM 265 C LYS A 17 9.826 -2.437 -11.315 1.00 0.00 C ATOM 266 O LYS A 17 10.072 -2.609 -10.117 1.00 0.00 O ATOM 267 CB LYS A 17 10.766 -0.592 -12.856 1.00 0.00 C ATOM 268 CG LYS A 17 12.208 -0.785 -12.385 1.00 0.00 C ATOM 269 CD LYS A 17 13.268 -0.709 -13.491 1.00 0.00 C ATOM 270 CE LYS A 17 14.536 -0.027 -12.971 1.00 0.00 C ATOM 271 NZ LYS A 17 15.721 -0.277 -13.819 1.00 0.00 N ATOM 0 H LYS A 17 10.310 -0.213 -10.070 1.00 0.00 H new ATOM 0 HA LYS A 17 8.736 -1.014 -12.459 1.00 0.00 H new ATOM 0 HB2 LYS A 17 10.633 -1.147 -13.784 1.00 0.00 H new ATOM 0 HB3 LYS A 17 10.622 0.462 -13.092 1.00 0.00 H new ATOM 0 HG2 LYS A 17 12.433 -0.028 -11.634 1.00 0.00 H new ATOM 0 HG3 LYS A 17 12.287 -1.755 -11.893 1.00 0.00 H new ATOM 0 HD2 LYS A 17 13.506 -1.712 -13.844 1.00 0.00 H new ATOM 0 HD3 LYS A 17 12.874 -0.156 -14.344 1.00 0.00 H new ATOM 0 HE2 LYS A 17 14.363 1.047 -12.907 1.00 0.00 H new ATOM 0 HE3 LYS A 17 14.741 -0.378 -11.959 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 16.546 0.210 -13.415 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 15.909 -1.299 -13.861 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 15.543 0.082 -14.779 1.00 0.00 H new ATOM 285 N ILE A 18 9.719 -3.455 -12.164 1.00 0.00 N ATOM 286 CA ILE A 18 9.963 -4.848 -11.803 1.00 0.00 C ATOM 287 C ILE A 18 10.749 -5.439 -12.965 1.00 0.00 C ATOM 288 O ILE A 18 10.330 -5.331 -14.115 1.00 0.00 O ATOM 289 CB ILE A 18 8.653 -5.630 -11.535 1.00 0.00 C ATOM 290 CG1 ILE A 18 7.649 -4.858 -10.646 1.00 0.00 C ATOM 291 CG2 ILE A 18 9.010 -6.981 -10.885 1.00 0.00 C ATOM 292 CD1 ILE A 18 6.353 -5.636 -10.415 1.00 0.00 C ATOM 0 H ILE A 18 9.455 -3.332 -13.142 1.00 0.00 H new ATOM 0 HA ILE A 18 10.518 -4.917 -10.867 1.00 0.00 H new ATOM 0 HB ILE A 18 8.154 -5.778 -12.493 1.00 0.00 H new ATOM 0 HG12 ILE A 18 8.114 -4.639 -9.685 1.00 0.00 H new ATOM 0 HG13 ILE A 18 7.416 -3.901 -11.113 1.00 0.00 H new ATOM 0 HG21 ILE A 18 8.097 -7.544 -10.690 1.00 0.00 H new ATOM 0 HG22 ILE A 18 9.651 -7.551 -11.558 1.00 0.00 H new ATOM 0 HG23 ILE A 18 9.535 -6.806 -9.946 1.00 0.00 H new ATOM 0 HD11 ILE A 18 5.684 -5.050 -9.785 1.00 0.00 H new ATOM 0 HD12 ILE A 18 5.871 -5.832 -11.373 1.00 0.00 H new ATOM 0 HD13 ILE A 18 6.579 -6.582 -9.922 1.00 0.00 H new ATOM 304 N VAL A 19 11.921 -5.993 -12.692 1.00 0.00 N ATOM 305 CA VAL A 19 12.769 -6.616 -13.688 1.00 0.00 C ATOM 306 C VAL A 19 12.557 -8.139 -13.618 1.00 0.00 C ATOM 307 O VAL A 19 11.485 -8.593 -13.195 1.00 0.00 O ATOM 308 CB VAL A 19 14.213 -6.132 -13.486 1.00 0.00 C ATOM 309 CG1 VAL A 19 14.342 -4.610 -13.665 1.00 0.00 C ATOM 310 CG2 VAL A 19 14.839 -6.537 -12.142 1.00 0.00 C ATOM 0 H VAL A 19 12.314 -6.021 -11.751 1.00 0.00 H new ATOM 0 HA VAL A 19 12.513 -6.328 -14.708 1.00 0.00 H new ATOM 0 HB VAL A 19 14.773 -6.645 -14.268 1.00 0.00 H new ATOM 0 HG11 VAL A 19 15.380 -4.312 -13.513 1.00 0.00 H new ATOM 0 HG12 VAL A 19 14.029 -4.334 -14.672 1.00 0.00 H new ATOM 0 HG13 VAL A 19 13.709 -4.103 -12.937 1.00 0.00 H new ATOM 0 HG21 VAL A 19 15.858 -6.154 -12.085 1.00 0.00 H new ATOM 0 HG22 VAL A 19 14.249 -6.121 -11.326 1.00 0.00 H new ATOM 0 HG23 VAL A 19 14.855 -7.624 -12.061 1.00 0.00 H new ATOM 320 N ASP A 20 13.560 -8.921 -14.032 1.00 0.00 N ATOM 321 CA ASP A 20 13.663 -10.378 -14.070 1.00 0.00 C ATOM 322 C ASP A 20 12.748 -11.033 -13.041 1.00 0.00 C ATOM 323 O ASP A 20 11.686 -11.550 -13.408 1.00 0.00 O ATOM 324 CB ASP A 20 15.123 -10.800 -13.843 1.00 0.00 C ATOM 325 CG ASP A 20 16.091 -10.351 -14.931 1.00 0.00 C ATOM 326 OD1 ASP A 20 16.209 -9.120 -15.159 1.00 0.00 O ATOM 327 OD2 ASP A 20 16.716 -11.212 -15.575 1.00 0.00 O ATOM 0 H ASP A 20 14.416 -8.495 -14.389 1.00 0.00 H new ATOM 0 HA ASP A 20 13.339 -10.718 -15.054 1.00 0.00 H new ATOM 0 HB2 ASP A 20 15.459 -10.397 -12.888 1.00 0.00 H new ATOM 0 HB3 ASP A 20 15.165 -11.886 -13.764 1.00 0.00 H new ATOM 332 N ASP A 21 13.116 -10.926 -11.758 1.00 0.00 N ATOM 333 CA ASP A 21 12.304 -11.335 -10.606 1.00 0.00 C ATOM 334 C ASP A 21 12.455 -10.333 -9.455 1.00 0.00 C ATOM 335 O ASP A 21 12.059 -10.633 -8.331 1.00 0.00 O ATOM 336 CB ASP A 21 12.592 -12.770 -10.107 1.00 0.00 C ATOM 337 CG ASP A 21 13.473 -13.671 -10.967 1.00 0.00 C ATOM 338 OD1 ASP A 21 13.077 -14.103 -12.068 1.00 0.00 O ATOM 339 OD2 ASP A 21 14.590 -13.998 -10.499 1.00 0.00 O ATOM 0 H ASP A 21 14.019 -10.539 -11.484 1.00 0.00 H new ATOM 0 HA ASP A 21 11.273 -11.340 -10.961 1.00 0.00 H new ATOM 0 HB2 ASP A 21 13.055 -12.693 -9.123 1.00 0.00 H new ATOM 0 HB3 ASP A 21 11.635 -13.273 -9.971 1.00 0.00 H new ATOM 344 N VAL A 22 13.046 -9.153 -9.678 1.00 0.00 N ATOM 345 CA VAL A 22 13.390 -8.215 -8.611 1.00 0.00 C ATOM 346 C VAL A 22 12.515 -6.977 -8.747 1.00 0.00 C ATOM 347 O VAL A 22 12.290 -6.484 -9.854 1.00 0.00 O ATOM 348 CB VAL A 22 14.901 -7.881 -8.576 1.00 0.00 C ATOM 349 CG1 VAL A 22 15.230 -7.196 -7.245 1.00 0.00 C ATOM 350 CG2 VAL A 22 15.747 -9.153 -8.718 1.00 0.00 C ATOM 0 H VAL A 22 13.299 -8.824 -10.610 1.00 0.00 H new ATOM 0 HA VAL A 22 13.189 -8.684 -7.648 1.00 0.00 H new ATOM 0 HB VAL A 22 15.134 -7.219 -9.410 1.00 0.00 H new ATOM 0 HG11 VAL A 22 16.293 -6.957 -7.212 1.00 0.00 H new ATOM 0 HG12 VAL A 22 14.649 -6.278 -7.155 1.00 0.00 H new ATOM 0 HG13 VAL A 22 14.983 -7.865 -6.421 1.00 0.00 H new ATOM 0 HG21 VAL A 22 16.805 -8.891 -8.690 1.00 0.00 H new ATOM 0 HG22 VAL A 22 15.520 -9.834 -7.898 1.00 0.00 H new ATOM 0 HG23 VAL A 22 15.518 -9.638 -9.667 1.00 0.00 H new ATOM 360 N VAL A 23 12.008 -6.478 -7.626 1.00 0.00 N ATOM 361 CA VAL A 23 11.234 -5.248 -7.564 1.00 0.00 C ATOM 362 C VAL A 23 12.204 -4.086 -7.361 1.00 0.00 C ATOM 363 O VAL A 23 13.179 -4.208 -6.617 1.00 0.00 O ATOM 364 CB VAL A 23 10.242 -5.352 -6.398 1.00 0.00 C ATOM 365 CG1 VAL A 23 9.387 -4.090 -6.255 1.00 0.00 C ATOM 366 CG2 VAL A 23 9.350 -6.595 -6.514 1.00 0.00 C ATOM 0 H VAL A 23 12.127 -6.927 -6.718 1.00 0.00 H new ATOM 0 HA VAL A 23 10.671 -5.083 -8.483 1.00 0.00 H new ATOM 0 HB VAL A 23 10.843 -5.452 -5.494 1.00 0.00 H new ATOM 0 HG11 VAL A 23 8.700 -4.209 -5.417 1.00 0.00 H new ATOM 0 HG12 VAL A 23 10.033 -3.231 -6.075 1.00 0.00 H new ATOM 0 HG13 VAL A 23 8.818 -3.930 -7.171 1.00 0.00 H new ATOM 0 HG21 VAL A 23 8.663 -6.630 -5.669 1.00 0.00 H new ATOM 0 HG22 VAL A 23 8.781 -6.549 -7.443 1.00 0.00 H new ATOM 0 HG23 VAL A 23 9.972 -7.490 -6.513 1.00 0.00 H new ATOM 376 N ILE A 24 11.928 -2.941 -7.976 1.00 0.00 N ATOM 377 CA ILE A 24 12.696 -1.720 -7.839 1.00 0.00 C ATOM 378 C ILE A 24 11.688 -0.650 -7.451 1.00 0.00 C ATOM 379 O ILE A 24 11.018 -0.120 -8.336 1.00 0.00 O ATOM 380 CB ILE A 24 13.408 -1.392 -9.175 1.00 0.00 C ATOM 381 CG1 ILE A 24 14.552 -2.358 -9.539 1.00 0.00 C ATOM 382 CG2 ILE A 24 13.991 0.032 -9.133 1.00 0.00 C ATOM 383 CD1 ILE A 24 14.166 -3.728 -10.074 1.00 0.00 C ATOM 0 H ILE A 24 11.132 -2.840 -8.606 1.00 0.00 H new ATOM 0 HA ILE A 24 13.481 -1.798 -7.087 1.00 0.00 H new ATOM 0 HB ILE A 24 12.636 -1.493 -9.938 1.00 0.00 H new ATOM 0 HG12 ILE A 24 15.181 -1.870 -10.284 1.00 0.00 H new ATOM 0 HG13 ILE A 24 15.166 -2.504 -8.650 1.00 0.00 H new ATOM 0 HG21 ILE A 24 14.489 0.249 -10.078 1.00 0.00 H new ATOM 0 HG22 ILE A 24 13.187 0.750 -8.973 1.00 0.00 H new ATOM 0 HG23 ILE A 24 14.711 0.106 -8.318 1.00 0.00 H new ATOM 0 HD11 ILE A 24 15.067 -4.302 -10.288 1.00 0.00 H new ATOM 0 HD12 ILE A 24 13.569 -4.254 -9.329 1.00 0.00 H new ATOM 0 HD13 ILE A 24 13.585 -3.611 -10.988 1.00 0.00 H new ATOM 395 N LEU A 25 11.542 -0.320 -6.164 1.00 0.00 N ATOM 396 CA LEU A 25 10.881 0.930 -5.832 1.00 0.00 C ATOM 397 C LEU A 25 11.820 2.057 -6.270 1.00 0.00 C ATOM 398 O LEU A 25 13.037 1.955 -6.080 1.00 0.00 O ATOM 399 CB LEU A 25 10.546 1.017 -4.340 1.00 0.00 C ATOM 400 CG LEU A 25 9.568 -0.055 -3.814 1.00 0.00 C ATOM 401 CD1 LEU A 25 8.498 -0.520 -4.806 1.00 0.00 C ATOM 402 CD2 LEU A 25 10.259 -1.311 -3.304 1.00 0.00 C ATOM 0 H LEU A 25 11.859 -0.878 -5.371 1.00 0.00 H new ATOM 0 HA LEU A 25 9.925 1.006 -6.349 1.00 0.00 H new ATOM 0 HB2 LEU A 25 11.474 0.947 -3.773 1.00 0.00 H new ATOM 0 HB3 LEU A 25 10.122 2.001 -4.138 1.00 0.00 H new ATOM 0 HG LEU A 25 9.084 0.486 -3.001 1.00 0.00 H new ATOM 0 HD11 LEU A 25 7.866 -1.272 -4.334 1.00 0.00 H new ATOM 0 HD12 LEU A 25 7.886 0.331 -5.107 1.00 0.00 H new ATOM 0 HD13 LEU A 25 8.979 -0.950 -5.685 1.00 0.00 H new ATOM 0 HD21 LEU A 25 9.510 -2.020 -2.950 1.00 0.00 H new ATOM 0 HD22 LEU A 25 10.834 -1.763 -4.112 1.00 0.00 H new ATOM 0 HD23 LEU A 25 10.928 -1.051 -2.484 1.00 0.00 H new ATOM 414 N MET A 26 11.256 3.125 -6.831 1.00 0.00 N ATOM 415 CA MET A 26 11.936 4.373 -7.162 1.00 0.00 C ATOM 416 C MET A 26 11.063 5.504 -6.608 1.00 0.00 C ATOM 417 O MET A 26 10.382 6.195 -7.374 1.00 0.00 O ATOM 418 CB MET A 26 12.150 4.496 -8.680 1.00 0.00 C ATOM 419 CG MET A 26 13.437 3.819 -9.145 1.00 0.00 C ATOM 420 SD MET A 26 13.532 3.675 -10.948 1.00 0.00 S ATOM 421 CE MET A 26 15.303 3.411 -11.187 1.00 0.00 C ATOM 0 H MET A 26 10.267 3.143 -7.078 1.00 0.00 H new ATOM 0 HA MET A 26 12.931 4.414 -6.719 1.00 0.00 H new ATOM 0 HB2 MET A 26 11.301 4.052 -9.201 1.00 0.00 H new ATOM 0 HB3 MET A 26 12.178 5.550 -8.956 1.00 0.00 H new ATOM 0 HG2 MET A 26 14.294 4.387 -8.783 1.00 0.00 H new ATOM 0 HG3 MET A 26 13.503 2.826 -8.700 1.00 0.00 H new ATOM 0 HE1 MET A 26 15.496 3.164 -12.231 1.00 0.00 H new ATOM 0 HE2 MET A 26 15.845 4.319 -10.923 1.00 0.00 H new ATOM 0 HE3 MET A 26 15.638 2.591 -10.552 1.00 0.00 H new ATOM 431 N PRO A 27 11.046 5.691 -5.278 1.00 0.00 N ATOM 432 CA PRO A 27 10.342 6.805 -4.677 1.00 0.00 C ATOM 433 C PRO A 27 11.044 8.120 -4.998 1.00 0.00 C ATOM 434 O PRO A 27 12.186 8.155 -5.473 1.00 0.00 O ATOM 435 CB PRO A 27 10.347 6.552 -3.177 1.00 0.00 C ATOM 436 CG PRO A 27 11.620 5.756 -2.974 1.00 0.00 C ATOM 437 CD PRO A 27 11.780 4.953 -4.262 1.00 0.00 C ATOM 0 HA PRO A 27 9.326 6.883 -5.063 1.00 0.00 H new ATOM 0 HB2 PRO A 27 10.358 7.483 -2.610 1.00 0.00 H new ATOM 0 HB3 PRO A 27 9.466 5.994 -2.858 1.00 0.00 H new ATOM 0 HG2 PRO A 27 12.475 6.411 -2.806 1.00 0.00 H new ATOM 0 HG3 PRO A 27 11.544 5.102 -2.105 1.00 0.00 H new ATOM 0 HD2 PRO A 27 12.831 4.853 -4.533 1.00 0.00 H new ATOM 0 HD3 PRO A 27 11.383 3.944 -4.147 1.00 0.00 H new ATOM 445 N ASN A 28 10.317 9.198 -4.707 1.00 0.00 N ATOM 446 CA ASN A 28 10.653 10.579 -5.018 1.00 0.00 C ATOM 447 C ASN A 28 9.793 11.440 -4.094 1.00 0.00 C ATOM 448 O ASN A 28 9.915 11.336 -2.877 1.00 0.00 O ATOM 449 CB ASN A 28 10.453 10.858 -6.537 1.00 0.00 C ATOM 450 CG ASN A 28 9.588 9.860 -7.313 1.00 0.00 C ATOM 451 OD1 ASN A 28 10.005 9.336 -8.338 1.00 0.00 O ATOM 452 ND2 ASN A 28 8.364 9.569 -6.892 1.00 0.00 N ATOM 0 H ASN A 28 9.425 9.121 -4.218 1.00 0.00 H new ATOM 0 HA ASN A 28 11.702 10.814 -4.839 1.00 0.00 H new ATOM 0 HB2 ASN A 28 10.010 11.848 -6.645 1.00 0.00 H new ATOM 0 HB3 ASN A 28 11.435 10.895 -7.008 1.00 0.00 H new ATOM 0 HD21 ASN A 28 7.785 8.917 -7.420 1.00 0.00 H new ATOM 0 HD22 ASN A 28 8.002 9.997 -6.040 1.00 0.00 H new ATOM 459 N LYS A 29 8.770 12.113 -4.625 1.00 0.00 N ATOM 460 CA LYS A 29 7.980 13.105 -3.891 1.00 0.00 C ATOM 461 C LYS A 29 6.868 12.506 -3.017 1.00 0.00 C ATOM 462 O LYS A 29 6.068 13.231 -2.435 1.00 0.00 O ATOM 463 CB LYS A 29 7.444 14.161 -4.884 1.00 0.00 C ATOM 464 CG LYS A 29 6.389 13.689 -5.908 1.00 0.00 C ATOM 465 CD LYS A 29 6.857 12.854 -7.118 1.00 0.00 C ATOM 466 CE LYS A 29 7.904 13.566 -7.992 1.00 0.00 C ATOM 467 NZ LYS A 29 7.988 13.011 -9.363 1.00 0.00 N ATOM 0 H LYS A 29 8.463 11.983 -5.589 1.00 0.00 H new ATOM 0 HA LYS A 29 8.645 13.585 -3.173 1.00 0.00 H new ATOM 0 HB2 LYS A 29 7.014 14.980 -4.308 1.00 0.00 H new ATOM 0 HB3 LYS A 29 8.292 14.569 -5.435 1.00 0.00 H new ATOM 0 HG2 LYS A 29 5.644 13.103 -5.370 1.00 0.00 H new ATOM 0 HG3 LYS A 29 5.882 14.574 -6.293 1.00 0.00 H new ATOM 0 HD2 LYS A 29 7.275 11.913 -6.759 1.00 0.00 H new ATOM 0 HD3 LYS A 29 5.992 12.605 -7.733 1.00 0.00 H new ATOM 0 HE2 LYS A 29 7.660 14.627 -8.050 1.00 0.00 H new ATOM 0 HE3 LYS A 29 8.881 13.489 -7.514 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 8.709 13.530 -9.904 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 8.248 12.005 -9.315 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 7.066 13.108 -9.834 1.00 0.00 H new ATOM 481 N GLU A 30 6.745 11.180 -2.971 1.00 0.00 N ATOM 482 CA GLU A 30 5.577 10.506 -2.403 1.00 0.00 C ATOM 483 C GLU A 30 5.709 10.199 -0.909 1.00 0.00 C ATOM 484 O GLU A 30 4.694 9.972 -0.258 1.00 0.00 O ATOM 485 CB GLU A 30 5.326 9.191 -3.158 1.00 0.00 C ATOM 486 CG GLU A 30 6.527 8.235 -3.077 1.00 0.00 C ATOM 487 CD GLU A 30 6.203 6.794 -3.477 1.00 0.00 C ATOM 488 OE1 GLU A 30 5.046 6.352 -3.258 1.00 0.00 O ATOM 489 OE2 GLU A 30 7.133 6.124 -3.959 1.00 0.00 O ATOM 0 H GLU A 30 7.455 10.540 -3.328 1.00 0.00 H new ATOM 0 HA GLU A 30 4.741 11.196 -2.515 1.00 0.00 H new ATOM 0 HB2 GLU A 30 4.445 8.700 -2.745 1.00 0.00 H new ATOM 0 HB3 GLU A 30 5.109 9.410 -4.203 1.00 0.00 H new ATOM 0 HG2 GLU A 30 7.321 8.610 -3.722 1.00 0.00 H new ATOM 0 HG3 GLU A 30 6.914 8.240 -2.058 1.00 0.00 H new ATOM 496 N LEU A 31 6.943 10.104 -0.397 1.00 0.00 N ATOM 497 CA LEU A 31 7.217 9.289 0.782 1.00 0.00 C ATOM 498 C LEU A 31 6.714 9.965 2.044 1.00 0.00 C ATOM 499 O LEU A 31 5.760 9.472 2.636 1.00 0.00 O ATOM 500 CB LEU A 31 8.715 8.976 0.912 1.00 0.00 C ATOM 501 CG LEU A 31 9.213 7.877 -0.032 1.00 0.00 C ATOM 502 CD1 LEU A 31 10.655 7.549 0.370 1.00 0.00 C ATOM 503 CD2 LEU A 31 8.390 6.578 -0.014 1.00 0.00 C ATOM 0 H LEU A 31 7.759 10.580 -0.781 1.00 0.00 H new ATOM 0 HA LEU A 31 6.681 8.349 0.655 1.00 0.00 H new ATOM 0 HB2 LEU A 31 9.283 9.887 0.722 1.00 0.00 H new ATOM 0 HB3 LEU A 31 8.924 8.679 1.940 1.00 0.00 H new ATOM 0 HG LEU A 31 9.121 8.266 -1.046 1.00 0.00 H new ATOM 0 HD11 LEU A 31 11.046 6.768 -0.282 1.00 0.00 H new ATOM 0 HD12 LEU A 31 11.272 8.443 0.275 1.00 0.00 H new ATOM 0 HD13 LEU A 31 10.675 7.203 1.403 1.00 0.00 H new ATOM 0 HD21 LEU A 31 8.822 5.864 -0.715 1.00 0.00 H new ATOM 0 HD22 LEU A 31 8.402 6.154 0.990 1.00 0.00 H new ATOM 0 HD23 LEU A 31 7.362 6.795 -0.304 1.00 0.00 H new ATOM 515 N ASN A 32 7.457 10.978 2.495 1.00 0.00 N ATOM 516 CA ASN A 32 7.067 12.135 3.300 1.00 0.00 C ATOM 517 C ASN A 32 5.799 11.899 4.118 1.00 0.00 C ATOM 518 O ASN A 32 4.823 12.617 3.951 1.00 0.00 O ATOM 519 CB ASN A 32 7.110 13.441 2.467 1.00 0.00 C ATOM 520 CG ASN A 32 7.038 13.216 0.974 1.00 0.00 C ATOM 521 OD1 ASN A 32 8.060 13.028 0.319 1.00 0.00 O ATOM 522 ND2 ASN A 32 5.847 13.113 0.420 1.00 0.00 N ATOM 0 H ASN A 32 8.454 11.010 2.281 1.00 0.00 H new ATOM 0 HA ASN A 32 7.819 12.279 4.076 1.00 0.00 H new ATOM 0 HB2 ASN A 32 6.281 14.081 2.769 1.00 0.00 H new ATOM 0 HB3 ASN A 32 8.029 13.979 2.700 1.00 0.00 H new ATOM 0 HD21 ASN A 32 5.763 12.874 -0.568 1.00 0.00 H new ATOM 0 HD22 ASN A 32 5.009 13.273 0.979 1.00 0.00 H new ATOM 529 N ILE A 33 5.822 10.901 5.011 1.00 0.00 N ATOM 530 CA ILE A 33 4.706 10.377 5.806 1.00 0.00 C ATOM 531 C ILE A 33 3.580 9.747 4.977 1.00 0.00 C ATOM 532 O ILE A 33 3.079 8.685 5.347 1.00 0.00 O ATOM 533 CB ILE A 33 4.222 11.448 6.816 1.00 0.00 C ATOM 534 CG1 ILE A 33 5.154 11.341 8.030 1.00 0.00 C ATOM 535 CG2 ILE A 33 2.753 11.300 7.246 1.00 0.00 C ATOM 536 CD1 ILE A 33 4.978 12.474 9.032 1.00 0.00 C ATOM 0 H ILE A 33 6.688 10.401 5.211 1.00 0.00 H new ATOM 0 HA ILE A 33 5.086 9.530 6.378 1.00 0.00 H new ATOM 0 HB ILE A 33 4.262 12.427 6.337 1.00 0.00 H new ATOM 0 HG12 ILE A 33 4.975 10.391 8.533 1.00 0.00 H new ATOM 0 HG13 ILE A 33 6.188 11.329 7.685 1.00 0.00 H new ATOM 0 HG21 ILE A 33 2.499 12.090 7.953 1.00 0.00 H new ATOM 0 HG22 ILE A 33 2.108 11.376 6.370 1.00 0.00 H new ATOM 0 HG23 ILE A 33 2.609 10.329 7.720 1.00 0.00 H new ATOM 0 HD11 ILE A 33 5.668 12.334 9.864 1.00 0.00 H new ATOM 0 HD12 ILE A 33 5.186 13.426 8.544 1.00 0.00 H new ATOM 0 HD13 ILE A 33 3.954 12.473 9.406 1.00 0.00 H new ATOM 548 N GLU A 34 3.144 10.387 3.898 1.00 0.00 N ATOM 549 CA GLU A 34 1.904 10.065 3.197 1.00 0.00 C ATOM 550 C GLU A 34 1.912 8.658 2.585 1.00 0.00 C ATOM 551 O GLU A 34 0.852 8.065 2.366 1.00 0.00 O ATOM 552 CB GLU A 34 1.633 11.100 2.099 1.00 0.00 C ATOM 553 CG GLU A 34 1.714 12.542 2.618 1.00 0.00 C ATOM 554 CD GLU A 34 1.252 13.561 1.579 1.00 0.00 C ATOM 555 OE1 GLU A 34 1.632 13.435 0.394 1.00 0.00 O ATOM 556 OE2 GLU A 34 0.657 14.582 1.991 1.00 0.00 O ATOM 0 H GLU A 34 3.654 11.163 3.475 1.00 0.00 H new ATOM 0 HA GLU A 34 1.109 10.090 3.942 1.00 0.00 H new ATOM 0 HB2 GLU A 34 2.354 10.967 1.292 1.00 0.00 H new ATOM 0 HB3 GLU A 34 0.644 10.925 1.675 1.00 0.00 H new ATOM 0 HG2 GLU A 34 1.101 12.638 3.514 1.00 0.00 H new ATOM 0 HG3 GLU A 34 2.741 12.764 2.909 1.00 0.00 H new ATOM 563 N ASN A 35 3.098 8.094 2.353 1.00 0.00 N ATOM 564 CA ASN A 35 3.305 6.703 1.972 1.00 0.00 C ATOM 565 C ASN A 35 4.328 6.098 2.932 1.00 0.00 C ATOM 566 O ASN A 35 5.446 5.773 2.528 1.00 0.00 O ATOM 567 CB ASN A 35 3.703 6.583 0.487 1.00 0.00 C ATOM 568 CG ASN A 35 3.975 5.132 0.095 1.00 0.00 C ATOM 569 OD1 ASN A 35 3.525 4.204 0.762 1.00 0.00 O ATOM 570 ND2 ASN A 35 4.749 4.904 -0.958 1.00 0.00 N ATOM 0 H ASN A 35 3.971 8.616 2.429 1.00 0.00 H new ATOM 0 HA ASN A 35 2.378 6.136 2.058 1.00 0.00 H new ATOM 0 HB2 ASN A 35 2.906 6.986 -0.138 1.00 0.00 H new ATOM 0 HB3 ASN A 35 4.592 7.185 0.298 1.00 0.00 H new ATOM 0 HD21 ASN A 35 4.979 3.947 -1.224 1.00 0.00 H new ATOM 0 HD22 ASN A 35 5.114 5.686 -1.501 1.00 0.00 H new ATOM 577 N ALA A 36 3.988 6.029 4.229 1.00 0.00 N ATOM 578 CA ALA A 36 4.882 5.531 5.278 1.00 0.00 C ATOM 579 C ALA A 36 4.261 4.377 6.070 1.00 0.00 C ATOM 580 O ALA A 36 4.738 3.253 5.946 1.00 0.00 O ATOM 581 CB ALA A 36 5.373 6.654 6.184 1.00 0.00 C ATOM 0 H ALA A 36 3.075 6.321 4.579 1.00 0.00 H new ATOM 0 HA ALA A 36 5.760 5.122 4.777 1.00 0.00 H new ATOM 0 HB1 ALA A 36 6.033 6.243 6.948 1.00 0.00 H new ATOM 0 HB2 ALA A 36 5.918 7.388 5.591 1.00 0.00 H new ATOM 0 HB3 ALA A 36 4.520 7.135 6.662 1.00 0.00 H new ATOM 587 N HIS A 37 3.210 4.585 6.868 1.00 0.00 N ATOM 588 CA HIS A 37 2.588 3.467 7.585 1.00 0.00 C ATOM 589 C HIS A 37 2.006 2.457 6.588 1.00 0.00 C ATOM 590 O HIS A 37 2.089 1.243 6.801 1.00 0.00 O ATOM 591 CB HIS A 37 1.531 3.961 8.586 1.00 0.00 C ATOM 592 CG HIS A 37 0.875 2.832 9.342 1.00 0.00 C ATOM 593 ND1 HIS A 37 -0.440 2.433 9.239 1.00 0.00 N ATOM 594 CD2 HIS A 37 1.506 1.971 10.198 1.00 0.00 C ATOM 595 CE1 HIS A 37 -0.594 1.345 10.008 1.00 0.00 C ATOM 596 NE2 HIS A 37 0.567 1.013 10.602 1.00 0.00 N ATOM 0 H HIS A 37 2.779 5.495 7.032 1.00 0.00 H new ATOM 0 HA HIS A 37 3.356 2.959 8.168 1.00 0.00 H new ATOM 0 HB2 HIS A 37 1.999 4.644 9.295 1.00 0.00 H new ATOM 0 HB3 HIS A 37 0.768 4.528 8.053 1.00 0.00 H new ATOM 0 HD2 HIS A 37 2.540 2.021 10.506 1.00 0.00 H new ATOM 0 HE1 HIS A 37 -1.523 0.809 10.133 1.00 0.00 H new ATOM 0 HE2 HIS A 37 0.731 0.221 11.223 1.00 0.00 H new ATOM 604 N LEU A 38 1.443 2.933 5.474 1.00 0.00 N ATOM 605 CA LEU A 38 0.981 2.088 4.386 1.00 0.00 C ATOM 606 C LEU A 38 2.144 1.536 3.557 1.00 0.00 C ATOM 607 O LEU A 38 1.928 0.561 2.852 1.00 0.00 O ATOM 608 CB LEU A 38 -0.095 2.820 3.561 1.00 0.00 C ATOM 609 CG LEU A 38 0.464 3.687 2.416 1.00 0.00 C ATOM 610 CD1 LEU A 38 0.426 2.889 1.115 1.00 0.00 C ATOM 611 CD2 LEU A 38 -0.351 4.965 2.218 1.00 0.00 C ATOM 0 H LEU A 38 1.297 3.929 5.307 1.00 0.00 H new ATOM 0 HA LEU A 38 0.499 1.204 4.803 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -0.779 2.082 3.142 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -0.679 3.453 4.228 1.00 0.00 H new ATOM 0 HG LEU A 38 1.485 3.963 2.681 1.00 0.00 H new ATOM 0 HD11 LEU A 38 0.821 3.499 0.302 1.00 0.00 H new ATOM 0 HD12 LEU A 38 1.033 1.990 1.222 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -0.603 2.608 0.891 1.00 0.00 H new ATOM 0 HD21 LEU A 38 0.077 5.547 1.402 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -1.382 4.705 1.977 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -0.330 5.555 3.134 1.00 0.00 H new ATOM 623 N PHE A 39 3.370 2.070 3.661 1.00 0.00 N ATOM 624 CA PHE A 39 4.495 1.712 2.789 1.00 0.00 C ATOM 625 C PHE A 39 4.701 0.209 2.759 1.00 0.00 C ATOM 626 O PHE A 39 4.804 -0.392 1.691 1.00 0.00 O ATOM 627 CB PHE A 39 5.786 2.395 3.275 1.00 0.00 C ATOM 628 CG PHE A 39 6.949 2.452 2.306 1.00 0.00 C ATOM 629 CD1 PHE A 39 6.741 3.017 1.041 1.00 0.00 C ATOM 630 CD2 PHE A 39 8.252 2.074 2.688 1.00 0.00 C ATOM 631 CE1 PHE A 39 7.808 3.283 0.177 1.00 0.00 C ATOM 632 CE2 PHE A 39 9.326 2.315 1.806 1.00 0.00 C ATOM 633 CZ PHE A 39 9.117 2.943 0.562 1.00 0.00 C ATOM 0 H PHE A 39 3.609 2.771 4.362 1.00 0.00 H new ATOM 0 HA PHE A 39 4.260 2.055 1.781 1.00 0.00 H new ATOM 0 HB2 PHE A 39 5.539 3.416 3.565 1.00 0.00 H new ATOM 0 HB3 PHE A 39 6.122 1.880 4.175 1.00 0.00 H new ATOM 0 HD1 PHE A 39 5.735 3.252 0.726 1.00 0.00 H new ATOM 0 HD2 PHE A 39 8.426 1.605 3.645 1.00 0.00 H new ATOM 0 HE1 PHE A 39 7.628 3.747 -0.781 1.00 0.00 H new ATOM 0 HE2 PHE A 39 10.324 2.014 2.088 1.00 0.00 H new ATOM 0 HZ PHE A 39 9.952 3.160 -0.088 1.00 0.00 H new ATOM 643 N LYS A 40 4.735 -0.401 3.949 1.00 0.00 N ATOM 644 CA LYS A 40 4.837 -1.844 4.037 1.00 0.00 C ATOM 645 C LYS A 40 3.564 -2.499 3.514 1.00 0.00 C ATOM 646 O LYS A 40 3.689 -3.460 2.787 1.00 0.00 O ATOM 647 CB LYS A 40 5.239 -2.291 5.446 1.00 0.00 C ATOM 648 CG LYS A 40 4.063 -2.423 6.428 1.00 0.00 C ATOM 649 CD LYS A 40 4.551 -2.689 7.850 1.00 0.00 C ATOM 650 CE LYS A 40 5.139 -1.399 8.428 1.00 0.00 C ATOM 651 NZ LYS A 40 5.613 -1.592 9.805 1.00 0.00 N ATOM 0 H LYS A 40 4.694 0.082 4.847 1.00 0.00 H new ATOM 0 HA LYS A 40 5.644 -2.188 3.390 1.00 0.00 H new ATOM 0 HB2 LYS A 40 5.750 -3.252 5.378 1.00 0.00 H new ATOM 0 HB3 LYS A 40 5.956 -1.577 5.850 1.00 0.00 H new ATOM 0 HG2 LYS A 40 3.469 -1.510 6.411 1.00 0.00 H new ATOM 0 HG3 LYS A 40 3.410 -3.235 6.108 1.00 0.00 H new ATOM 0 HD2 LYS A 40 3.726 -3.038 8.471 1.00 0.00 H new ATOM 0 HD3 LYS A 40 5.304 -3.477 7.848 1.00 0.00 H new ATOM 0 HE2 LYS A 40 5.965 -1.062 7.802 1.00 0.00 H new ATOM 0 HE3 LYS A 40 4.384 -0.613 8.409 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 5.831 -0.668 10.230 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 4.874 -2.064 10.364 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 6.470 -2.181 9.798 1.00 0.00 H new ATOM 665 N LYS A 41 2.359 -2.008 3.827 1.00 0.00 N ATOM 666 CA LYS A 41 1.108 -2.620 3.371 1.00 0.00 C ATOM 667 C LYS A 41 1.084 -2.751 1.849 1.00 0.00 C ATOM 668 O LYS A 41 0.714 -3.811 1.345 1.00 0.00 O ATOM 669 CB LYS A 41 -0.118 -1.822 3.859 1.00 0.00 C ATOM 670 CG LYS A 41 -1.142 -2.748 4.535 1.00 0.00 C ATOM 671 CD LYS A 41 -2.519 -2.084 4.688 1.00 0.00 C ATOM 672 CE LYS A 41 -3.523 -2.937 5.475 1.00 0.00 C ATOM 673 NZ LYS A 41 -3.827 -4.235 4.836 1.00 0.00 N ATOM 0 H LYS A 41 2.225 -1.177 4.403 1.00 0.00 H new ATOM 0 HA LYS A 41 1.058 -3.619 3.804 1.00 0.00 H new ATOM 0 HB2 LYS A 41 0.201 -1.052 4.561 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -0.584 -1.312 3.016 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -1.245 -3.661 3.949 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -0.771 -3.040 5.517 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -2.397 -1.124 5.190 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -2.926 -1.877 3.698 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -3.128 -3.118 6.475 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -4.449 -2.375 5.595 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -4.510 -4.758 5.420 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -4.232 -4.071 3.892 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -2.953 -4.791 4.745 1.00 0.00 H new ATOM 687 N TRP A 42 1.486 -1.689 1.148 1.00 0.00 N ATOM 688 CA TRP A 42 1.610 -1.656 -0.298 1.00 0.00 C ATOM 689 C TRP A 42 2.646 -2.684 -0.738 1.00 0.00 C ATOM 690 O TRP A 42 2.270 -3.623 -1.430 1.00 0.00 O ATOM 691 CB TRP A 42 1.936 -0.229 -0.760 1.00 0.00 C ATOM 692 CG TRP A 42 2.552 -0.080 -2.124 1.00 0.00 C ATOM 693 CD1 TRP A 42 2.074 -0.558 -3.301 1.00 0.00 C ATOM 694 CD2 TRP A 42 3.845 0.512 -2.439 1.00 0.00 C ATOM 695 NE1 TRP A 42 2.933 -0.210 -4.320 1.00 0.00 N ATOM 696 CE2 TRP A 42 4.062 0.418 -3.844 1.00 0.00 C ATOM 697 CE3 TRP A 42 4.884 1.055 -1.657 1.00 0.00 C ATOM 698 CZ2 TRP A 42 5.230 0.906 -4.446 1.00 0.00 C ATOM 699 CZ3 TRP A 42 6.085 1.473 -2.250 1.00 0.00 C ATOM 700 CH2 TRP A 42 6.234 1.460 -3.644 1.00 0.00 C ATOM 0 H TRP A 42 1.740 -0.806 1.590 1.00 0.00 H new ATOM 0 HA TRP A 42 0.667 -1.928 -0.773 1.00 0.00 H new ATOM 0 HB2 TRP A 42 1.015 0.353 -0.738 1.00 0.00 H new ATOM 0 HB3 TRP A 42 2.613 0.217 -0.031 1.00 0.00 H new ATOM 0 HD1 TRP A 42 1.162 -1.124 -3.420 1.00 0.00 H new ATOM 0 HE1 TRP A 42 2.754 -0.395 -5.307 1.00 0.00 H new ATOM 0 HE3 TRP A 42 4.754 1.150 -0.589 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 5.354 0.855 -5.518 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 6.902 1.808 -1.627 1.00 0.00 H new ATOM 0 HH2 TRP A 42 7.121 1.876 -4.098 1.00 0.00 H new ATOM 711 N VAL A 43 3.921 -2.551 -0.345 1.00 0.00 N ATOM 712 CA VAL A 43 4.964 -3.470 -0.808 1.00 0.00 C ATOM 713 C VAL A 43 4.670 -4.931 -0.420 1.00 0.00 C ATOM 714 O VAL A 43 5.009 -5.844 -1.177 1.00 0.00 O ATOM 715 CB VAL A 43 6.331 -2.967 -0.300 1.00 0.00 C ATOM 716 CG1 VAL A 43 7.523 -3.886 -0.610 1.00 0.00 C ATOM 717 CG2 VAL A 43 6.639 -1.589 -0.924 1.00 0.00 C ATOM 0 H VAL A 43 4.250 -1.821 0.287 1.00 0.00 H new ATOM 0 HA VAL A 43 4.984 -3.476 -1.898 1.00 0.00 H new ATOM 0 HB VAL A 43 6.228 -2.931 0.784 1.00 0.00 H new ATOM 0 HG11 VAL A 43 8.436 -3.444 -0.212 1.00 0.00 H new ATOM 0 HG12 VAL A 43 7.361 -4.860 -0.149 1.00 0.00 H new ATOM 0 HG13 VAL A 43 7.619 -4.006 -1.689 1.00 0.00 H new ATOM 0 HG21 VAL A 43 7.605 -1.234 -0.564 1.00 0.00 H new ATOM 0 HG22 VAL A 43 6.667 -1.679 -2.010 1.00 0.00 H new ATOM 0 HG23 VAL A 43 5.863 -0.879 -0.639 1.00 0.00 H new ATOM 727 N PHE A 44 4.020 -5.176 0.720 1.00 0.00 N ATOM 728 CA PHE A 44 3.516 -6.469 1.112 1.00 0.00 C ATOM 729 C PHE A 44 2.584 -6.943 0.001 1.00 0.00 C ATOM 730 O PHE A 44 2.824 -7.978 -0.599 1.00 0.00 O ATOM 731 CB PHE A 44 2.748 -6.395 2.441 1.00 0.00 C ATOM 732 CG PHE A 44 3.466 -6.492 3.788 1.00 0.00 C ATOM 733 CD1 PHE A 44 4.719 -5.896 4.056 1.00 0.00 C ATOM 734 CD2 PHE A 44 2.795 -7.153 4.835 1.00 0.00 C ATOM 735 CE1 PHE A 44 5.258 -5.934 5.361 1.00 0.00 C ATOM 736 CE2 PHE A 44 3.328 -7.182 6.132 1.00 0.00 C ATOM 737 CZ PHE A 44 4.561 -6.571 6.399 1.00 0.00 C ATOM 0 H PHE A 44 3.830 -4.448 1.409 1.00 0.00 H new ATOM 0 HA PHE A 44 4.346 -7.160 1.259 1.00 0.00 H new ATOM 0 HB2 PHE A 44 2.204 -5.450 2.440 1.00 0.00 H new ATOM 0 HB3 PHE A 44 2.004 -7.191 2.421 1.00 0.00 H new ATOM 0 HD1 PHE A 44 5.266 -5.410 3.261 1.00 0.00 H new ATOM 0 HD2 PHE A 44 1.855 -7.646 4.636 1.00 0.00 H new ATOM 0 HE1 PHE A 44 6.212 -5.470 5.561 1.00 0.00 H new ATOM 0 HE2 PHE A 44 2.788 -7.676 6.926 1.00 0.00 H new ATOM 0 HZ PHE A 44 4.972 -6.590 7.398 1.00 0.00 H new ATOM 747 N ASP A 45 1.518 -6.205 -0.285 1.00 0.00 N ATOM 748 CA ASP A 45 0.459 -6.703 -1.154 1.00 0.00 C ATOM 749 C ASP A 45 0.889 -6.841 -2.606 1.00 0.00 C ATOM 750 O ASP A 45 0.579 -7.831 -3.270 1.00 0.00 O ATOM 751 CB ASP A 45 -0.788 -5.821 -1.061 1.00 0.00 C ATOM 752 CG ASP A 45 -1.971 -6.755 -0.931 1.00 0.00 C ATOM 753 OD1 ASP A 45 -2.186 -7.209 0.218 1.00 0.00 O ATOM 754 OD2 ASP A 45 -2.579 -7.102 -1.972 1.00 0.00 O ATOM 0 H ASP A 45 1.364 -5.262 0.071 1.00 0.00 H new ATOM 0 HA ASP A 45 0.224 -7.704 -0.793 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -0.726 -5.153 -0.202 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -0.885 -5.194 -1.947 1.00 0.00 H new ATOM 759 N GLU A 46 1.586 -5.821 -3.086 1.00 0.00 N ATOM 760 CA GLU A 46 1.952 -5.611 -4.471 1.00 0.00 C ATOM 761 C GLU A 46 3.114 -6.525 -4.884 1.00 0.00 C ATOM 762 O GLU A 46 3.313 -6.746 -6.081 1.00 0.00 O ATOM 763 CB GLU A 46 2.240 -4.100 -4.602 1.00 0.00 C ATOM 764 CG GLU A 46 2.638 -3.544 -5.966 1.00 0.00 C ATOM 765 CD GLU A 46 1.691 -3.857 -7.121 1.00 0.00 C ATOM 766 OE1 GLU A 46 0.500 -4.201 -6.911 1.00 0.00 O ATOM 767 OE2 GLU A 46 2.069 -3.725 -8.294 1.00 0.00 O ATOM 0 H GLU A 46 1.929 -5.076 -2.479 1.00 0.00 H new ATOM 0 HA GLU A 46 1.157 -5.885 -5.165 1.00 0.00 H new ATOM 0 HB2 GLU A 46 1.349 -3.564 -4.274 1.00 0.00 H new ATOM 0 HB3 GLU A 46 3.036 -3.854 -3.900 1.00 0.00 H new ATOM 0 HG2 GLU A 46 2.730 -2.461 -5.882 1.00 0.00 H new ATOM 0 HG3 GLU A 46 3.626 -3.929 -6.218 1.00 0.00 H new ATOM 774 N PHE A 47 3.857 -7.099 -3.922 1.00 0.00 N ATOM 775 CA PHE A 47 5.002 -7.962 -4.201 1.00 0.00 C ATOM 776 C PHE A 47 5.113 -9.154 -3.240 1.00 0.00 C ATOM 777 O PHE A 47 5.192 -10.292 -3.700 1.00 0.00 O ATOM 778 CB PHE A 47 6.303 -7.156 -4.184 1.00 0.00 C ATOM 779 CG PHE A 47 6.252 -5.791 -4.862 1.00 0.00 C ATOM 780 CD1 PHE A 47 6.224 -5.661 -6.263 1.00 0.00 C ATOM 781 CD2 PHE A 47 6.199 -4.631 -4.071 1.00 0.00 C ATOM 782 CE1 PHE A 47 6.157 -4.383 -6.852 1.00 0.00 C ATOM 783 CE2 PHE A 47 6.112 -3.353 -4.650 1.00 0.00 C ATOM 784 CZ PHE A 47 6.104 -3.229 -6.048 1.00 0.00 C ATOM 0 H PHE A 47 3.674 -6.972 -2.927 1.00 0.00 H new ATOM 0 HA PHE A 47 4.835 -8.372 -5.197 1.00 0.00 H new ATOM 0 HB2 PHE A 47 6.605 -7.013 -3.147 1.00 0.00 H new ATOM 0 HB3 PHE A 47 7.081 -7.749 -4.664 1.00 0.00 H new ATOM 0 HD1 PHE A 47 6.254 -6.542 -6.887 1.00 0.00 H new ATOM 0 HD2 PHE A 47 6.226 -4.723 -2.995 1.00 0.00 H new ATOM 0 HE1 PHE A 47 6.146 -4.288 -7.928 1.00 0.00 H new ATOM 0 HE2 PHE A 47 6.052 -2.474 -4.025 1.00 0.00 H new ATOM 0 HZ PHE A 47 6.057 -2.252 -6.505 1.00 0.00 H new ATOM 794 N LEU A 48 5.160 -8.939 -1.920 1.00 0.00 N ATOM 795 CA LEU A 48 5.467 -10.020 -0.967 1.00 0.00 C ATOM 796 C LEU A 48 4.380 -11.098 -0.974 1.00 0.00 C ATOM 797 O LEU A 48 4.692 -12.275 -1.129 1.00 0.00 O ATOM 798 CB LEU A 48 5.641 -9.505 0.474 1.00 0.00 C ATOM 799 CG LEU A 48 6.683 -8.396 0.669 1.00 0.00 C ATOM 800 CD1 LEU A 48 6.789 -8.004 2.147 1.00 0.00 C ATOM 801 CD2 LEU A 48 8.050 -8.808 0.130 1.00 0.00 C ATOM 0 H LEU A 48 4.991 -8.032 -1.486 1.00 0.00 H new ATOM 0 HA LEU A 48 6.413 -10.447 -1.301 1.00 0.00 H new ATOM 0 HB2 LEU A 48 4.677 -9.137 0.826 1.00 0.00 H new ATOM 0 HB3 LEU A 48 5.913 -10.348 1.110 1.00 0.00 H new ATOM 0 HG LEU A 48 6.347 -7.529 0.100 1.00 0.00 H new ATOM 0 HD11 LEU A 48 7.534 -7.216 2.262 1.00 0.00 H new ATOM 0 HD12 LEU A 48 5.822 -7.643 2.498 1.00 0.00 H new ATOM 0 HD13 LEU A 48 7.087 -8.873 2.733 1.00 0.00 H new ATOM 0 HD21 LEU A 48 8.762 -7.997 0.286 1.00 0.00 H new ATOM 0 HD22 LEU A 48 8.394 -9.699 0.655 1.00 0.00 H new ATOM 0 HD23 LEU A 48 7.971 -9.022 -0.936 1.00 0.00 H new ATOM 813 N ASN A 49 3.118 -10.677 -0.837 1.00 0.00 N ATOM 814 CA ASN A 49 1.896 -11.475 -0.890 1.00 0.00 C ATOM 815 C ASN A 49 1.724 -12.057 -2.288 1.00 0.00 C ATOM 816 O ASN A 49 1.138 -13.122 -2.438 1.00 0.00 O ATOM 817 CB ASN A 49 0.645 -10.625 -0.553 1.00 0.00 C ATOM 818 CG ASN A 49 0.565 -10.180 0.905 1.00 0.00 C ATOM 819 OD1 ASN A 49 1.215 -10.757 1.771 1.00 0.00 O ATOM 820 ND2 ASN A 49 -0.224 -9.177 1.255 1.00 0.00 N ATOM 0 H ASN A 49 2.913 -9.691 -0.673 1.00 0.00 H new ATOM 0 HA ASN A 49 1.989 -12.270 -0.150 1.00 0.00 H new ATOM 0 HB2 ASN A 49 0.637 -9.742 -1.192 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -0.248 -11.201 -0.795 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -0.285 -8.894 2.233 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -0.771 -8.687 0.547 1.00 0.00 H new ATOM 827 N LYS A 50 2.221 -11.371 -3.323 1.00 0.00 N ATOM 828 CA LYS A 50 2.316 -11.913 -4.673 1.00 0.00 C ATOM 829 C LYS A 50 3.222 -13.146 -4.656 1.00 0.00 C ATOM 830 O LYS A 50 2.813 -14.185 -5.171 1.00 0.00 O ATOM 831 CB LYS A 50 2.816 -10.829 -5.648 1.00 0.00 C ATOM 832 CG LYS A 50 1.728 -10.386 -6.632 1.00 0.00 C ATOM 833 CD LYS A 50 2.330 -9.732 -7.877 1.00 0.00 C ATOM 834 CE LYS A 50 1.305 -8.840 -8.583 1.00 0.00 C ATOM 835 NZ LYS A 50 0.346 -9.583 -9.423 1.00 0.00 N ATOM 0 H LYS A 50 2.570 -10.416 -3.241 1.00 0.00 H new ATOM 0 HA LYS A 50 1.332 -12.224 -5.025 1.00 0.00 H new ATOM 0 HB2 LYS A 50 3.163 -9.965 -5.081 1.00 0.00 H new ATOM 0 HB3 LYS A 50 3.672 -11.211 -6.204 1.00 0.00 H new ATOM 0 HG2 LYS A 50 1.129 -11.248 -6.926 1.00 0.00 H new ATOM 0 HG3 LYS A 50 1.055 -9.684 -6.140 1.00 0.00 H new ATOM 0 HD2 LYS A 50 3.200 -9.139 -7.595 1.00 0.00 H new ATOM 0 HD3 LYS A 50 2.679 -10.503 -8.564 1.00 0.00 H new ATOM 0 HE2 LYS A 50 0.753 -8.273 -7.833 1.00 0.00 H new ATOM 0 HE3 LYS A 50 1.834 -8.117 -9.204 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -0.316 -8.915 -9.868 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 0.862 -10.104 -10.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -0.185 -10.255 -8.833 1.00 0.00 H new ATOM 849 N GLY A 51 4.381 -13.045 -4.006 1.00 0.00 N ATOM 850 CA GLY A 51 5.311 -14.139 -3.776 1.00 0.00 C ATOM 851 C GLY A 51 6.767 -13.757 -4.055 1.00 0.00 C ATOM 852 O GLY A 51 7.637 -14.627 -3.982 1.00 0.00 O ATOM 0 H GLY A 51 4.706 -12.162 -3.612 1.00 0.00 H new ATOM 0 HA2 GLY A 51 5.221 -14.474 -2.743 1.00 0.00 H new ATOM 0 HA3 GLY A 51 5.035 -14.982 -4.409 1.00 0.00 H new ATOM 856 N TYR A 52 7.054 -12.488 -4.380 1.00 0.00 N ATOM 857 CA TYR A 52 8.408 -12.017 -4.628 1.00 0.00 C ATOM 858 C TYR A 52 9.235 -12.137 -3.348 1.00 0.00 C ATOM 859 O TYR A 52 8.723 -11.907 -2.246 1.00 0.00 O ATOM 860 CB TYR A 52 8.388 -10.556 -5.109 1.00 0.00 C ATOM 861 CG TYR A 52 7.932 -10.348 -6.536 1.00 0.00 C ATOM 862 CD1 TYR A 52 6.566 -10.287 -6.858 1.00 0.00 C ATOM 863 CD2 TYR A 52 8.897 -10.223 -7.548 1.00 0.00 C ATOM 864 CE1 TYR A 52 6.159 -10.154 -8.194 1.00 0.00 C ATOM 865 CE2 TYR A 52 8.508 -10.144 -8.892 1.00 0.00 C ATOM 866 CZ TYR A 52 7.135 -10.110 -9.221 1.00 0.00 C ATOM 867 OH TYR A 52 6.749 -10.115 -10.523 1.00 0.00 O ATOM 0 H TYR A 52 6.344 -11.762 -4.477 1.00 0.00 H new ATOM 0 HA TYR A 52 8.859 -12.631 -5.407 1.00 0.00 H new ATOM 0 HB2 TYR A 52 7.735 -9.983 -4.450 1.00 0.00 H new ATOM 0 HB3 TYR A 52 9.391 -10.143 -5.002 1.00 0.00 H new ATOM 0 HD1 TYR A 52 5.826 -10.343 -6.074 1.00 0.00 H new ATOM 0 HD2 TYR A 52 9.945 -10.188 -7.289 1.00 0.00 H new ATOM 0 HE1 TYR A 52 5.109 -10.086 -8.438 1.00 0.00 H new ATOM 0 HE2 TYR A 52 9.254 -10.109 -9.672 1.00 0.00 H new ATOM 0 HH TYR A 52 7.541 -10.080 -11.099 1.00 0.00 H new ATOM 877 N ASN A 53 10.548 -12.335 -3.500 1.00 0.00 N ATOM 878 CA ASN A 53 11.525 -12.377 -2.408 1.00 0.00 C ATOM 879 C ASN A 53 12.656 -11.352 -2.531 1.00 0.00 C ATOM 880 O ASN A 53 13.474 -11.276 -1.614 1.00 0.00 O ATOM 881 CB ASN A 53 12.114 -13.799 -2.262 1.00 0.00 C ATOM 882 CG ASN A 53 11.338 -14.794 -1.401 1.00 0.00 C ATOM 883 OD1 ASN A 53 11.213 -15.949 -1.780 1.00 0.00 O ATOM 884 ND2 ASN A 53 10.858 -14.439 -0.223 1.00 0.00 N ATOM 0 H ASN A 53 10.974 -12.475 -4.416 1.00 0.00 H new ATOM 0 HA ASN A 53 10.969 -12.105 -1.511 1.00 0.00 H new ATOM 0 HB2 ASN A 53 12.217 -14.225 -3.260 1.00 0.00 H new ATOM 0 HB3 ASN A 53 13.119 -13.707 -1.849 1.00 0.00 H new ATOM 0 HD21 ASN A 53 10.387 -15.127 0.364 1.00 0.00 H new ATOM 0 HD22 ASN A 53 10.959 -13.477 0.100 1.00 0.00 H new ATOM 891 N LYS A 54 12.729 -10.537 -3.581 1.00 0.00 N ATOM 892 CA LYS A 54 13.819 -9.587 -3.789 1.00 0.00 C ATOM 893 C LYS A 54 13.219 -8.248 -4.180 1.00 0.00 C ATOM 894 O LYS A 54 12.516 -8.135 -5.185 1.00 0.00 O ATOM 895 CB LYS A 54 14.815 -10.126 -4.828 1.00 0.00 C ATOM 896 CG LYS A 54 15.773 -11.155 -4.193 1.00 0.00 C ATOM 897 CD LYS A 54 15.927 -12.469 -4.962 1.00 0.00 C ATOM 898 CE LYS A 54 14.592 -13.202 -5.120 1.00 0.00 C ATOM 899 NZ LYS A 54 14.739 -14.424 -5.936 1.00 0.00 N ATOM 0 H LYS A 54 12.025 -10.518 -4.319 1.00 0.00 H new ATOM 0 HA LYS A 54 14.391 -9.449 -2.872 1.00 0.00 H new ATOM 0 HB2 LYS A 54 14.272 -10.589 -5.652 1.00 0.00 H new ATOM 0 HB3 LYS A 54 15.389 -9.301 -5.249 1.00 0.00 H new ATOM 0 HG2 LYS A 54 16.756 -10.696 -4.091 1.00 0.00 H new ATOM 0 HG3 LYS A 54 15.421 -11.382 -3.187 1.00 0.00 H new ATOM 0 HD2 LYS A 54 16.347 -12.265 -5.947 1.00 0.00 H new ATOM 0 HD3 LYS A 54 16.635 -13.113 -4.440 1.00 0.00 H new ATOM 0 HE2 LYS A 54 14.201 -13.465 -4.137 1.00 0.00 H new ATOM 0 HE3 LYS A 54 13.864 -12.538 -5.585 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 13.817 -14.896 -6.023 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 15.089 -14.170 -6.882 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 15.416 -15.068 -5.478 1.00 0.00 H new ATOM 913 N ILE A 55 13.528 -7.225 -3.390 1.00 0.00 N ATOM 914 CA ILE A 55 13.135 -5.840 -3.603 1.00 0.00 C ATOM 915 C ILE A 55 14.382 -4.990 -3.467 1.00 0.00 C ATOM 916 O ILE A 55 15.297 -5.368 -2.736 1.00 0.00 O ATOM 917 CB ILE A 55 12.072 -5.449 -2.550 1.00 0.00 C ATOM 918 CG1 ILE A 55 10.698 -6.058 -2.887 1.00 0.00 C ATOM 919 CG2 ILE A 55 11.852 -3.932 -2.446 1.00 0.00 C ATOM 920 CD1 ILE A 55 10.016 -6.657 -1.666 1.00 0.00 C ATOM 0 H ILE A 55 14.086 -7.347 -2.545 1.00 0.00 H new ATOM 0 HA ILE A 55 12.698 -5.692 -4.591 1.00 0.00 H new ATOM 0 HB ILE A 55 12.466 -5.833 -1.609 1.00 0.00 H new ATOM 0 HG12 ILE A 55 10.057 -5.288 -3.317 1.00 0.00 H new ATOM 0 HG13 ILE A 55 10.822 -6.830 -3.646 1.00 0.00 H new ATOM 0 HG21 ILE A 55 11.095 -3.725 -1.690 1.00 0.00 H new ATOM 0 HG22 ILE A 55 12.787 -3.447 -2.165 1.00 0.00 H new ATOM 0 HG23 ILE A 55 11.518 -3.546 -3.409 1.00 0.00 H new ATOM 0 HD11 ILE A 55 9.051 -7.073 -1.956 1.00 0.00 H new ATOM 0 HD12 ILE A 55 10.642 -7.447 -1.250 1.00 0.00 H new ATOM 0 HD13 ILE A 55 9.866 -5.881 -0.916 1.00 0.00 H new ATOM 932 N PHE A 56 14.359 -3.800 -4.065 1.00 0.00 N ATOM 933 CA PHE A 56 15.294 -2.721 -3.822 1.00 0.00 C ATOM 934 C PHE A 56 14.583 -1.400 -3.600 1.00 0.00 C ATOM 935 O PHE A 56 13.439 -1.213 -4.018 1.00 0.00 O ATOM 936 CB PHE A 56 16.217 -2.583 -5.024 1.00 0.00 C ATOM 937 CG PHE A 56 16.998 -3.823 -5.356 1.00 0.00 C ATOM 938 CD1 PHE A 56 17.599 -4.574 -4.332 1.00 0.00 C ATOM 939 CD2 PHE A 56 17.122 -4.219 -6.694 1.00 0.00 C ATOM 940 CE1 PHE A 56 18.401 -5.670 -4.679 1.00 0.00 C ATOM 941 CE2 PHE A 56 17.866 -5.350 -7.039 1.00 0.00 C ATOM 942 CZ PHE A 56 18.533 -6.059 -6.026 1.00 0.00 C ATOM 0 H PHE A 56 13.654 -3.559 -4.762 1.00 0.00 H new ATOM 0 HA PHE A 56 15.858 -2.962 -2.921 1.00 0.00 H new ATOM 0 HB2 PHE A 56 15.622 -2.300 -5.892 1.00 0.00 H new ATOM 0 HB3 PHE A 56 16.916 -1.768 -4.838 1.00 0.00 H new ATOM 0 HD1 PHE A 56 17.446 -4.311 -3.296 1.00 0.00 H new ATOM 0 HD2 PHE A 56 16.637 -3.643 -7.468 1.00 0.00 H new ATOM 0 HE1 PHE A 56 18.921 -6.220 -3.908 1.00 0.00 H new ATOM 0 HE2 PHE A 56 17.927 -5.674 -8.067 1.00 0.00 H new ATOM 0 HZ PHE A 56 19.151 -6.907 -6.282 1.00 0.00 H new ATOM 952 N LEU A 57 15.309 -0.458 -3.000 1.00 0.00 N ATOM 953 CA LEU A 57 14.893 0.923 -2.809 1.00 0.00 C ATOM 954 C LEU A 57 16.004 1.832 -3.332 1.00 0.00 C ATOM 955 O LEU A 57 16.856 2.280 -2.584 1.00 0.00 O ATOM 956 CB LEU A 57 14.542 1.122 -1.324 1.00 0.00 C ATOM 957 CG LEU A 57 14.378 2.570 -0.825 1.00 0.00 C ATOM 958 CD1 LEU A 57 13.471 3.385 -1.736 1.00 0.00 C ATOM 959 CD2 LEU A 57 13.756 2.588 0.579 1.00 0.00 C ATOM 0 H LEU A 57 16.237 -0.647 -2.621 1.00 0.00 H new ATOM 0 HA LEU A 57 13.995 1.180 -3.371 1.00 0.00 H new ATOM 0 HB2 LEU A 57 13.613 0.588 -1.122 1.00 0.00 H new ATOM 0 HB3 LEU A 57 15.319 0.645 -0.727 1.00 0.00 H new ATOM 0 HG LEU A 57 15.376 3.008 -0.816 1.00 0.00 H new ATOM 0 HD11 LEU A 57 13.382 4.400 -1.348 1.00 0.00 H new ATOM 0 HD12 LEU A 57 13.896 3.416 -2.739 1.00 0.00 H new ATOM 0 HD13 LEU A 57 12.484 2.924 -1.774 1.00 0.00 H new ATOM 0 HD21 LEU A 57 13.648 3.619 0.916 1.00 0.00 H new ATOM 0 HD22 LEU A 57 12.776 2.111 0.549 1.00 0.00 H new ATOM 0 HD23 LEU A 57 14.402 2.047 1.270 1.00 0.00 H new ATOM 971 N VAL A 58 16.044 2.043 -4.642 1.00 0.00 N ATOM 972 CA VAL A 58 16.800 3.059 -5.363 1.00 0.00 C ATOM 973 C VAL A 58 16.396 4.433 -4.791 1.00 0.00 C ATOM 974 O VAL A 58 15.209 4.719 -4.612 1.00 0.00 O ATOM 975 CB VAL A 58 16.374 2.978 -6.848 1.00 0.00 C ATOM 976 CG1 VAL A 58 17.012 4.036 -7.741 1.00 0.00 C ATOM 977 CG2 VAL A 58 16.697 1.621 -7.467 1.00 0.00 C ATOM 0 H VAL A 58 15.503 1.459 -5.280 1.00 0.00 H new ATOM 0 HA VAL A 58 17.876 2.915 -5.267 1.00 0.00 H new ATOM 0 HB VAL A 58 15.298 3.148 -6.811 1.00 0.00 H new ATOM 0 HG11 VAL A 58 16.660 3.908 -8.765 1.00 0.00 H new ATOM 0 HG12 VAL A 58 16.736 5.028 -7.384 1.00 0.00 H new ATOM 0 HG13 VAL A 58 18.096 3.929 -7.714 1.00 0.00 H new ATOM 0 HG21 VAL A 58 16.380 1.612 -8.510 1.00 0.00 H new ATOM 0 HG22 VAL A 58 17.771 1.443 -7.413 1.00 0.00 H new ATOM 0 HG23 VAL A 58 16.171 0.838 -6.921 1.00 0.00 H new ATOM 987 N LEU A 59 17.353 5.318 -4.552 1.00 0.00 N ATOM 988 CA LEU A 59 17.176 6.639 -3.957 1.00 0.00 C ATOM 989 C LEU A 59 17.642 7.736 -4.933 1.00 0.00 C ATOM 990 O LEU A 59 17.701 8.898 -4.552 1.00 0.00 O ATOM 991 CB LEU A 59 17.864 6.675 -2.575 1.00 0.00 C ATOM 992 CG LEU A 59 17.187 5.751 -1.531 1.00 0.00 C ATOM 993 CD1 LEU A 59 18.155 4.711 -0.964 1.00 0.00 C ATOM 994 CD2 LEU A 59 16.676 6.551 -0.337 1.00 0.00 C ATOM 0 H LEU A 59 18.328 5.125 -4.780 1.00 0.00 H new ATOM 0 HA LEU A 59 16.120 6.845 -3.779 1.00 0.00 H new ATOM 0 HB2 LEU A 59 18.907 6.381 -2.688 1.00 0.00 H new ATOM 0 HB3 LEU A 59 17.860 7.699 -2.201 1.00 0.00 H new ATOM 0 HG LEU A 59 16.372 5.262 -2.064 1.00 0.00 H new ATOM 0 HD11 LEU A 59 17.634 4.088 -0.237 1.00 0.00 H new ATOM 0 HD12 LEU A 59 18.533 4.086 -1.773 1.00 0.00 H new ATOM 0 HD13 LEU A 59 18.988 5.217 -0.477 1.00 0.00 H new ATOM 0 HD21 LEU A 59 16.206 5.876 0.379 1.00 0.00 H new ATOM 0 HD22 LEU A 59 17.510 7.064 0.141 1.00 0.00 H new ATOM 0 HD23 LEU A 59 15.946 7.285 -0.677 1.00 0.00 H new ATOM 1006 N SER A 60 17.875 7.390 -6.208 1.00 0.00 N ATOM 1007 CA SER A 60 18.191 8.294 -7.316 1.00 0.00 C ATOM 1008 C SER A 60 17.316 9.550 -7.326 1.00 0.00 C ATOM 1009 O SER A 60 17.790 10.669 -7.550 1.00 0.00 O ATOM 1010 CB SER A 60 17.947 7.540 -8.628 1.00 0.00 C ATOM 1011 OG SER A 60 18.800 6.424 -8.770 1.00 0.00 O ATOM 0 H SER A 60 17.845 6.415 -6.507 1.00 0.00 H new ATOM 0 HA SER A 60 19.228 8.610 -7.200 1.00 0.00 H new ATOM 0 HB2 SER A 60 16.909 7.209 -8.667 1.00 0.00 H new ATOM 0 HB3 SER A 60 18.097 8.218 -9.468 1.00 0.00 H new ATOM 0 HG SER A 60 18.609 5.972 -9.619 1.00 0.00 H new ATOM 1017 N ASP A 61 16.013 9.345 -7.149 1.00 0.00 N ATOM 1018 CA ASP A 61 14.968 10.327 -7.428 1.00 0.00 C ATOM 1019 C ASP A 61 14.475 11.011 -6.145 1.00 0.00 C ATOM 1020 O ASP A 61 13.586 11.860 -6.193 1.00 0.00 O ATOM 1021 CB ASP A 61 13.842 9.625 -8.206 1.00 0.00 C ATOM 1022 CG ASP A 61 13.386 10.401 -9.435 1.00 0.00 C ATOM 1023 OD1 ASP A 61 12.622 11.390 -9.359 1.00 0.00 O ATOM 1024 OD2 ASP A 61 13.800 9.956 -10.525 1.00 0.00 O ATOM 0 H ASP A 61 15.643 8.462 -6.796 1.00 0.00 H new ATOM 0 HA ASP A 61 15.367 11.134 -8.043 1.00 0.00 H new ATOM 0 HB2 ASP A 61 14.184 8.637 -8.515 1.00 0.00 H new ATOM 0 HB3 ASP A 61 12.990 9.475 -7.543 1.00 0.00 H new ATOM 1029 N VAL A 62 15.062 10.656 -4.994 1.00 0.00 N ATOM 1030 CA VAL A 62 14.710 11.141 -3.666 1.00 0.00 C ATOM 1031 C VAL A 62 16.006 11.541 -2.964 1.00 0.00 C ATOM 1032 O VAL A 62 16.849 10.698 -2.684 1.00 0.00 O ATOM 1033 CB VAL A 62 13.864 10.079 -2.914 1.00 0.00 C ATOM 1034 CG1 VAL A 62 14.462 8.673 -2.793 1.00 0.00 C ATOM 1035 CG2 VAL A 62 13.417 10.577 -1.537 1.00 0.00 C ATOM 0 H VAL A 62 15.833 9.989 -4.970 1.00 0.00 H new ATOM 0 HA VAL A 62 14.072 12.024 -3.704 1.00 0.00 H new ATOM 0 HB VAL A 62 13.005 9.956 -3.574 1.00 0.00 H new ATOM 0 HG11 VAL A 62 13.772 8.030 -2.247 1.00 0.00 H new ATOM 0 HG12 VAL A 62 14.630 8.262 -3.789 1.00 0.00 H new ATOM 0 HG13 VAL A 62 15.410 8.726 -2.257 1.00 0.00 H new ATOM 0 HG21 VAL A 62 12.828 9.804 -1.044 1.00 0.00 H new ATOM 0 HG22 VAL A 62 14.293 10.807 -0.931 1.00 0.00 H new ATOM 0 HG23 VAL A 62 12.811 11.476 -1.654 1.00 0.00 H new ATOM 1045 N GLU A 63 16.202 12.823 -2.663 1.00 0.00 N ATOM 1046 CA GLU A 63 17.373 13.283 -1.931 1.00 0.00 C ATOM 1047 C GLU A 63 17.327 12.685 -0.528 1.00 0.00 C ATOM 1048 O GLU A 63 18.364 12.280 0.009 1.00 0.00 O ATOM 1049 CB GLU A 63 17.359 14.813 -1.868 1.00 0.00 C ATOM 1050 CG GLU A 63 18.510 15.401 -1.037 1.00 0.00 C ATOM 1051 CD GLU A 63 18.259 16.861 -0.670 1.00 0.00 C ATOM 1052 OE1 GLU A 63 17.224 17.164 -0.038 1.00 0.00 O ATOM 1053 OE2 GLU A 63 19.112 17.733 -0.942 1.00 0.00 O ATOM 0 H GLU A 63 15.554 13.568 -2.920 1.00 0.00 H new ATOM 0 HA GLU A 63 18.290 12.967 -2.428 1.00 0.00 H new ATOM 0 HB2 GLU A 63 17.412 15.211 -2.881 1.00 0.00 H new ATOM 0 HB3 GLU A 63 16.410 15.143 -1.445 1.00 0.00 H new ATOM 0 HG2 GLU A 63 18.637 14.815 -0.127 1.00 0.00 H new ATOM 0 HG3 GLU A 63 19.441 15.323 -1.599 1.00 0.00 H new ATOM 1060 N SER A 64 16.135 12.600 0.072 1.00 0.00 N ATOM 1061 CA SER A 64 16.014 12.158 1.444 1.00 0.00 C ATOM 1062 C SER A 64 14.667 11.547 1.771 1.00 0.00 C ATOM 1063 O SER A 64 13.619 12.008 1.316 1.00 0.00 O ATOM 1064 CB SER A 64 16.267 13.364 2.338 1.00 0.00 C ATOM 1065 OG SER A 64 15.405 14.451 2.037 1.00 0.00 O ATOM 0 H SER A 64 15.250 12.833 -0.378 1.00 0.00 H new ATOM 0 HA SER A 64 16.744 11.365 1.610 1.00 0.00 H new ATOM 0 HB2 SER A 64 16.132 13.075 3.380 1.00 0.00 H new ATOM 0 HB3 SER A 64 17.303 13.684 2.227 1.00 0.00 H new ATOM 0 HG SER A 64 15.603 15.201 2.636 1.00 0.00 H new ATOM 1071 N ILE A 65 14.724 10.577 2.670 1.00 0.00 N ATOM 1072 CA ILE A 65 13.591 10.069 3.412 1.00 0.00 C ATOM 1073 C ILE A 65 13.629 10.711 4.804 1.00 0.00 C ATOM 1074 O ILE A 65 14.706 11.036 5.318 1.00 0.00 O ATOM 1075 CB ILE A 65 13.667 8.531 3.434 1.00 0.00 C ATOM 1076 CG1 ILE A 65 12.372 7.962 4.030 1.00 0.00 C ATOM 1077 CG2 ILE A 65 14.915 8.015 4.183 1.00 0.00 C ATOM 1078 CD1 ILE A 65 12.264 6.459 3.790 1.00 0.00 C ATOM 0 H ILE A 65 15.597 10.107 2.909 1.00 0.00 H new ATOM 0 HA ILE A 65 12.635 10.324 2.956 1.00 0.00 H new ATOM 0 HB ILE A 65 13.768 8.180 2.407 1.00 0.00 H new ATOM 0 HG12 ILE A 65 12.342 8.164 5.101 1.00 0.00 H new ATOM 0 HG13 ILE A 65 11.513 8.466 3.587 1.00 0.00 H new ATOM 0 HG21 ILE A 65 14.922 6.925 4.170 1.00 0.00 H new ATOM 0 HG22 ILE A 65 15.814 8.390 3.693 1.00 0.00 H new ATOM 0 HG23 ILE A 65 14.891 8.366 5.215 1.00 0.00 H new ATOM 0 HD11 ILE A 65 11.336 6.087 4.224 1.00 0.00 H new ATOM 0 HD12 ILE A 65 12.268 6.260 2.718 1.00 0.00 H new ATOM 0 HD13 ILE A 65 13.110 5.954 4.256 1.00 0.00 H new ATOM 1090 N ASP A 66 12.475 10.879 5.432 1.00 0.00 N ATOM 1091 CA ASP A 66 12.400 11.519 6.733 1.00 0.00 C ATOM 1092 C ASP A 66 12.476 10.475 7.840 1.00 0.00 C ATOM 1093 O ASP A 66 12.290 9.275 7.645 1.00 0.00 O ATOM 1094 CB ASP A 66 11.138 12.388 6.876 1.00 0.00 C ATOM 1095 CG ASP A 66 11.269 13.502 7.930 1.00 0.00 C ATOM 1096 OD1 ASP A 66 12.336 13.634 8.576 1.00 0.00 O ATOM 1097 OD2 ASP A 66 10.251 14.204 8.128 1.00 0.00 O ATOM 0 H ASP A 66 11.575 10.579 5.058 1.00 0.00 H new ATOM 0 HA ASP A 66 13.256 12.188 6.824 1.00 0.00 H new ATOM 0 HB2 ASP A 66 10.907 12.839 5.911 1.00 0.00 H new ATOM 0 HB3 ASP A 66 10.295 11.749 7.139 1.00 0.00 H new ATOM 1102 N SER A 67 12.647 10.982 9.046 1.00 0.00 N ATOM 1103 CA SER A 67 12.598 10.397 10.372 1.00 0.00 C ATOM 1104 C SER A 67 11.350 9.564 10.693 1.00 0.00 C ATOM 1105 O SER A 67 11.220 9.077 11.816 1.00 0.00 O ATOM 1106 CB SER A 67 12.710 11.586 11.342 1.00 0.00 C ATOM 1107 OG SER A 67 11.817 12.646 11.052 1.00 0.00 O ATOM 0 H SER A 67 12.858 11.977 9.126 1.00 0.00 H new ATOM 0 HA SER A 67 13.407 9.672 10.458 1.00 0.00 H new ATOM 0 HB2 SER A 67 12.524 11.234 12.357 1.00 0.00 H new ATOM 0 HB3 SER A 67 13.731 11.967 11.319 1.00 0.00 H new ATOM 0 HG SER A 67 12.097 13.093 10.226 1.00 0.00 H new ATOM 1113 N PHE A 68 10.410 9.430 9.758 1.00 0.00 N ATOM 1114 CA PHE A 68 9.215 8.621 9.914 1.00 0.00 C ATOM 1115 C PHE A 68 9.467 7.282 9.219 1.00 0.00 C ATOM 1116 O PHE A 68 9.660 6.257 9.885 1.00 0.00 O ATOM 1117 CB PHE A 68 7.991 9.384 9.385 1.00 0.00 C ATOM 1118 CG PHE A 68 6.673 8.878 9.930 1.00 0.00 C ATOM 1119 CD1 PHE A 68 6.104 7.705 9.410 1.00 0.00 C ATOM 1120 CD2 PHE A 68 5.998 9.592 10.936 1.00 0.00 C ATOM 1121 CE1 PHE A 68 4.857 7.251 9.872 1.00 0.00 C ATOM 1122 CE2 PHE A 68 4.734 9.159 11.379 1.00 0.00 C ATOM 1123 CZ PHE A 68 4.165 7.986 10.853 1.00 0.00 C ATOM 0 H PHE A 68 10.465 9.895 8.852 1.00 0.00 H new ATOM 0 HA PHE A 68 8.994 8.415 10.961 1.00 0.00 H new ATOM 0 HB2 PHE A 68 8.096 10.439 9.636 1.00 0.00 H new ATOM 0 HB3 PHE A 68 7.974 9.315 8.297 1.00 0.00 H new ATOM 0 HD1 PHE A 68 6.629 7.147 8.649 1.00 0.00 H new ATOM 0 HD2 PHE A 68 6.449 10.473 11.369 1.00 0.00 H new ATOM 0 HE1 PHE A 68 4.431 6.341 9.476 1.00 0.00 H new ATOM 0 HE2 PHE A 68 4.200 9.729 12.125 1.00 0.00 H new ATOM 0 HZ PHE A 68 3.199 7.650 11.201 1.00 0.00 H new ATOM 1133 N SER A 69 9.523 7.285 7.881 1.00 0.00 N ATOM 1134 CA SER A 69 9.594 6.057 7.099 1.00 0.00 C ATOM 1135 C SER A 69 10.993 5.445 7.117 1.00 0.00 C ATOM 1136 O SER A 69 11.104 4.232 6.975 1.00 0.00 O ATOM 1137 CB SER A 69 9.065 6.349 5.704 1.00 0.00 C ATOM 1138 OG SER A 69 8.845 5.189 4.929 1.00 0.00 O ATOM 0 H SER A 69 9.520 8.136 7.319 1.00 0.00 H new ATOM 0 HA SER A 69 8.964 5.288 7.547 1.00 0.00 H new ATOM 0 HB2 SER A 69 8.130 6.903 5.788 1.00 0.00 H new ATOM 0 HB3 SER A 69 9.773 6.995 5.184 1.00 0.00 H new ATOM 0 HG SER A 69 8.505 5.445 4.046 1.00 0.00 H new ATOM 1144 N LEU A 70 12.047 6.204 7.442 1.00 0.00 N ATOM 1145 CA LEU A 70 13.396 5.667 7.677 1.00 0.00 C ATOM 1146 C LEU A 70 13.371 4.463 8.630 1.00 0.00 C ATOM 1147 O LEU A 70 14.146 3.525 8.446 1.00 0.00 O ATOM 1148 CB LEU A 70 14.225 6.832 8.271 1.00 0.00 C ATOM 1149 CG LEU A 70 15.663 6.551 8.762 1.00 0.00 C ATOM 1150 CD1 LEU A 70 16.654 6.499 7.601 1.00 0.00 C ATOM 1151 CD2 LEU A 70 16.122 7.672 9.704 1.00 0.00 C ATOM 0 H LEU A 70 11.988 7.217 7.550 1.00 0.00 H new ATOM 0 HA LEU A 70 13.834 5.300 6.749 1.00 0.00 H new ATOM 0 HB2 LEU A 70 14.282 7.615 7.515 1.00 0.00 H new ATOM 0 HB3 LEU A 70 13.664 7.241 9.111 1.00 0.00 H new ATOM 0 HG LEU A 70 15.644 5.587 9.271 1.00 0.00 H new ATOM 0 HD11 LEU A 70 17.654 6.300 7.985 1.00 0.00 H new ATOM 0 HD12 LEU A 70 16.365 5.706 6.911 1.00 0.00 H new ATOM 0 HD13 LEU A 70 16.651 7.455 7.077 1.00 0.00 H new ATOM 0 HD21 LEU A 70 17.136 7.467 10.046 1.00 0.00 H new ATOM 0 HD22 LEU A 70 16.103 8.624 9.173 1.00 0.00 H new ATOM 0 HD23 LEU A 70 15.453 7.722 10.563 1.00 0.00 H new ATOM 1163 N GLY A 71 12.460 4.453 9.609 1.00 0.00 N ATOM 1164 CA GLY A 71 12.268 3.288 10.465 1.00 0.00 C ATOM 1165 C GLY A 71 11.496 2.153 9.793 1.00 0.00 C ATOM 1166 O GLY A 71 11.804 0.976 9.996 1.00 0.00 O ATOM 0 H GLY A 71 11.847 5.239 9.824 1.00 0.00 H new ATOM 0 HA2 GLY A 71 13.242 2.916 10.781 1.00 0.00 H new ATOM 0 HA3 GLY A 71 11.736 3.594 11.366 1.00 0.00 H new ATOM 1170 N VAL A 72 10.501 2.497 8.980 1.00 0.00 N ATOM 1171 CA VAL A 72 9.649 1.544 8.280 1.00 0.00 C ATOM 1172 C VAL A 72 10.485 0.754 7.266 1.00 0.00 C ATOM 1173 O VAL A 72 10.252 -0.440 7.103 1.00 0.00 O ATOM 1174 CB VAL A 72 8.464 2.281 7.606 1.00 0.00 C ATOM 1175 CG1 VAL A 72 7.490 1.265 6.994 1.00 0.00 C ATOM 1176 CG2 VAL A 72 7.694 3.138 8.622 1.00 0.00 C ATOM 0 H VAL A 72 10.260 3.469 8.786 1.00 0.00 H new ATOM 0 HA VAL A 72 9.227 0.834 8.992 1.00 0.00 H new ATOM 0 HB VAL A 72 8.877 2.926 6.830 1.00 0.00 H new ATOM 0 HG11 VAL A 72 6.661 1.794 6.523 1.00 0.00 H new ATOM 0 HG12 VAL A 72 8.011 0.667 6.246 1.00 0.00 H new ATOM 0 HG13 VAL A 72 7.106 0.612 7.778 1.00 0.00 H new ATOM 0 HG21 VAL A 72 6.869 3.643 8.120 1.00 0.00 H new ATOM 0 HG22 VAL A 72 7.302 2.499 9.413 1.00 0.00 H new ATOM 0 HG23 VAL A 72 8.365 3.881 9.054 1.00 0.00 H new ATOM 1186 N ILE A 73 11.492 1.374 6.640 1.00 0.00 N ATOM 1187 CA ILE A 73 12.424 0.699 5.725 1.00 0.00 C ATOM 1188 C ILE A 73 13.063 -0.504 6.425 1.00 0.00 C ATOM 1189 O ILE A 73 13.108 -1.598 5.866 1.00 0.00 O ATOM 1190 CB ILE A 73 13.482 1.690 5.162 1.00 0.00 C ATOM 1191 CG1 ILE A 73 12.985 2.406 3.891 1.00 0.00 C ATOM 1192 CG2 ILE A 73 14.809 1.007 4.754 1.00 0.00 C ATOM 1193 CD1 ILE A 73 11.724 3.240 4.046 1.00 0.00 C ATOM 0 H ILE A 73 11.686 2.369 6.755 1.00 0.00 H new ATOM 0 HA ILE A 73 11.868 0.326 4.865 1.00 0.00 H new ATOM 0 HB ILE A 73 13.646 2.386 5.985 1.00 0.00 H new ATOM 0 HG12 ILE A 73 13.783 3.054 3.527 1.00 0.00 H new ATOM 0 HG13 ILE A 73 12.808 1.655 3.121 1.00 0.00 H new ATOM 0 HG21 ILE A 73 15.501 1.757 4.370 1.00 0.00 H new ATOM 0 HG22 ILE A 73 15.249 0.518 5.623 1.00 0.00 H new ATOM 0 HG23 ILE A 73 14.613 0.264 3.981 1.00 0.00 H new ATOM 0 HD11 ILE A 73 11.469 3.696 3.089 1.00 0.00 H new ATOM 0 HD12 ILE A 73 10.904 2.602 4.374 1.00 0.00 H new ATOM 0 HD13 ILE A 73 11.893 4.022 4.787 1.00 0.00 H new ATOM 1205 N VAL A 74 13.567 -0.332 7.647 1.00 0.00 N ATOM 1206 CA VAL A 74 14.151 -1.461 8.367 1.00 0.00 C ATOM 1207 C VAL A 74 13.060 -2.481 8.708 1.00 0.00 C ATOM 1208 O VAL A 74 13.292 -3.681 8.590 1.00 0.00 O ATOM 1209 CB VAL A 74 14.850 -0.937 9.639 1.00 0.00 C ATOM 1210 CG1 VAL A 74 15.136 -2.052 10.657 1.00 0.00 C ATOM 1211 CG2 VAL A 74 16.156 -0.231 9.252 1.00 0.00 C ATOM 0 H VAL A 74 13.583 0.556 8.149 1.00 0.00 H new ATOM 0 HA VAL A 74 14.892 -1.963 7.744 1.00 0.00 H new ATOM 0 HB VAL A 74 14.171 -0.234 10.120 1.00 0.00 H new ATOM 0 HG11 VAL A 74 15.628 -1.628 11.532 1.00 0.00 H new ATOM 0 HG12 VAL A 74 14.198 -2.519 10.959 1.00 0.00 H new ATOM 0 HG13 VAL A 74 15.785 -2.801 10.203 1.00 0.00 H new ATOM 0 HG21 VAL A 74 16.650 0.139 10.151 1.00 0.00 H new ATOM 0 HG22 VAL A 74 16.813 -0.935 8.741 1.00 0.00 H new ATOM 0 HG23 VAL A 74 15.935 0.605 8.589 1.00 0.00 H new ATOM 1221 N ASN A 75 11.870 -2.029 9.102 1.00 0.00 N ATOM 1222 CA ASN A 75 10.743 -2.907 9.412 1.00 0.00 C ATOM 1223 C ASN A 75 10.423 -3.825 8.232 1.00 0.00 C ATOM 1224 O ASN A 75 10.115 -5.005 8.397 1.00 0.00 O ATOM 1225 CB ASN A 75 9.519 -2.042 9.727 1.00 0.00 C ATOM 1226 CG ASN A 75 8.837 -2.456 11.005 1.00 0.00 C ATOM 1227 OD1 ASN A 75 7.688 -2.891 11.014 1.00 0.00 O ATOM 1228 ND2 ASN A 75 9.516 -2.275 12.117 1.00 0.00 N ATOM 0 H ASN A 75 11.660 -1.037 9.216 1.00 0.00 H new ATOM 0 HA ASN A 75 11.004 -3.529 10.268 1.00 0.00 H new ATOM 0 HB2 ASN A 75 9.825 -0.999 9.803 1.00 0.00 H new ATOM 0 HB3 ASN A 75 8.809 -2.107 8.902 1.00 0.00 H new ATOM 0 HD21 ASN A 75 9.090 -2.497 13.017 1.00 0.00 H new ATOM 0 HD22 ASN A 75 10.469 -1.912 12.080 1.00 0.00 H new ATOM 1235 N ILE A 76 10.486 -3.263 7.031 1.00 0.00 N ATOM 1236 CA ILE A 76 10.325 -3.930 5.757 1.00 0.00 C ATOM 1237 C ILE A 76 11.432 -4.993 5.584 1.00 0.00 C ATOM 1238 O ILE A 76 11.166 -6.116 5.154 1.00 0.00 O ATOM 1239 CB ILE A 76 10.257 -2.812 4.675 1.00 0.00 C ATOM 1240 CG1 ILE A 76 8.803 -2.319 4.481 1.00 0.00 C ATOM 1241 CG2 ILE A 76 10.890 -3.214 3.351 1.00 0.00 C ATOM 1242 CD1 ILE A 76 8.653 -1.202 3.448 1.00 0.00 C ATOM 0 H ILE A 76 10.663 -2.264 6.921 1.00 0.00 H new ATOM 0 HA ILE A 76 9.404 -4.506 5.671 1.00 0.00 H new ATOM 0 HB ILE A 76 10.857 -1.983 5.051 1.00 0.00 H new ATOM 0 HG12 ILE A 76 8.182 -3.163 4.180 1.00 0.00 H new ATOM 0 HG13 ILE A 76 8.420 -1.967 5.439 1.00 0.00 H new ATOM 0 HG21 ILE A 76 10.808 -2.389 2.643 1.00 0.00 H new ATOM 0 HG22 ILE A 76 11.942 -3.454 3.508 1.00 0.00 H new ATOM 0 HG23 ILE A 76 10.375 -4.088 2.952 1.00 0.00 H new ATOM 0 HD11 ILE A 76 7.604 -0.914 3.373 1.00 0.00 H new ATOM 0 HD12 ILE A 76 9.244 -0.340 3.756 1.00 0.00 H new ATOM 0 HD13 ILE A 76 9.003 -1.554 2.478 1.00 0.00 H new ATOM 1254 N LEU A 77 12.676 -4.713 5.999 1.00 0.00 N ATOM 1255 CA LEU A 77 13.763 -5.685 5.895 1.00 0.00 C ATOM 1256 C LEU A 77 13.481 -6.862 6.816 1.00 0.00 C ATOM 1257 O LEU A 77 13.683 -8.006 6.420 1.00 0.00 O ATOM 1258 CB LEU A 77 15.117 -5.016 6.198 1.00 0.00 C ATOM 1259 CG LEU A 77 16.369 -5.907 6.065 1.00 0.00 C ATOM 1260 CD1 LEU A 77 16.603 -6.827 7.267 1.00 0.00 C ATOM 1261 CD2 LEU A 77 16.433 -6.693 4.747 1.00 0.00 C ATOM 0 H LEU A 77 12.950 -3.820 6.409 1.00 0.00 H new ATOM 0 HA LEU A 77 13.821 -6.065 4.875 1.00 0.00 H new ATOM 0 HB2 LEU A 77 15.233 -4.162 5.530 1.00 0.00 H new ATOM 0 HB3 LEU A 77 15.084 -4.623 7.214 1.00 0.00 H new ATOM 0 HG LEU A 77 17.193 -5.193 6.048 1.00 0.00 H new ATOM 0 HD11 LEU A 77 17.501 -7.422 7.100 1.00 0.00 H new ATOM 0 HD12 LEU A 77 16.729 -6.225 8.167 1.00 0.00 H new ATOM 0 HD13 LEU A 77 15.746 -7.489 7.390 1.00 0.00 H new ATOM 0 HD21 LEU A 77 17.341 -7.296 4.727 1.00 0.00 H new ATOM 0 HD22 LEU A 77 15.563 -7.345 4.669 1.00 0.00 H new ATOM 0 HD23 LEU A 77 16.441 -5.997 3.908 1.00 0.00 H new ATOM 1273 N LYS A 78 12.990 -6.600 8.029 1.00 0.00 N ATOM 1274 CA LYS A 78 12.639 -7.650 8.982 1.00 0.00 C ATOM 1275 C LYS A 78 11.673 -8.642 8.351 1.00 0.00 C ATOM 1276 O LYS A 78 11.906 -9.838 8.493 1.00 0.00 O ATOM 1277 CB LYS A 78 12.071 -7.054 10.278 1.00 0.00 C ATOM 1278 CG LYS A 78 13.141 -6.217 10.976 1.00 0.00 C ATOM 1279 CD LYS A 78 12.638 -5.629 12.302 1.00 0.00 C ATOM 1280 CE LYS A 78 13.815 -5.368 13.248 1.00 0.00 C ATOM 1281 NZ LYS A 78 14.199 -6.569 14.024 1.00 0.00 N ATOM 0 H LYS A 78 12.825 -5.655 8.376 1.00 0.00 H new ATOM 0 HA LYS A 78 13.548 -8.191 9.247 1.00 0.00 H new ATOM 0 HB2 LYS A 78 11.202 -6.436 10.054 1.00 0.00 H new ATOM 0 HB3 LYS A 78 11.733 -7.852 10.938 1.00 0.00 H new ATOM 0 HG2 LYS A 78 14.019 -6.835 11.164 1.00 0.00 H new ATOM 0 HG3 LYS A 78 13.455 -5.408 10.317 1.00 0.00 H new ATOM 0 HD2 LYS A 78 12.100 -4.700 12.115 1.00 0.00 H new ATOM 0 HD3 LYS A 78 11.933 -6.317 12.769 1.00 0.00 H new ATOM 0 HE2 LYS A 78 14.672 -5.025 12.669 1.00 0.00 H new ATOM 0 HE3 LYS A 78 13.552 -4.564 13.936 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 14.999 -6.338 14.647 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 13.391 -6.884 14.599 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 14.477 -7.330 13.372 1.00 0.00 H new ATOM 1295 N SER A 79 10.656 -8.162 7.632 1.00 0.00 N ATOM 1296 CA SER A 79 9.706 -9.002 6.904 1.00 0.00 C ATOM 1297 C SER A 79 10.440 -9.970 5.968 1.00 0.00 C ATOM 1298 O SER A 79 10.235 -11.188 6.018 1.00 0.00 O ATOM 1299 CB SER A 79 8.732 -8.085 6.150 1.00 0.00 C ATOM 1300 OG SER A 79 7.614 -8.783 5.651 1.00 0.00 O ATOM 0 H SER A 79 10.468 -7.164 7.539 1.00 0.00 H new ATOM 0 HA SER A 79 9.138 -9.623 7.597 1.00 0.00 H new ATOM 0 HB2 SER A 79 8.394 -7.292 6.817 1.00 0.00 H new ATOM 0 HB3 SER A 79 9.256 -7.605 5.323 1.00 0.00 H new ATOM 0 HG SER A 79 7.022 -8.159 5.181 1.00 0.00 H new ATOM 1306 N ILE A 80 11.324 -9.434 5.125 1.00 0.00 N ATOM 1307 CA ILE A 80 12.019 -10.209 4.104 1.00 0.00 C ATOM 1308 C ILE A 80 12.990 -11.202 4.753 1.00 0.00 C ATOM 1309 O ILE A 80 13.091 -12.342 4.296 1.00 0.00 O ATOM 1310 CB ILE A 80 12.685 -9.230 3.111 1.00 0.00 C ATOM 1311 CG1 ILE A 80 11.546 -8.441 2.422 1.00 0.00 C ATOM 1312 CG2 ILE A 80 13.565 -9.985 2.094 1.00 0.00 C ATOM 1313 CD1 ILE A 80 12.015 -7.506 1.313 1.00 0.00 C ATOM 0 H ILE A 80 11.577 -8.446 5.134 1.00 0.00 H new ATOM 0 HA ILE A 80 11.322 -10.823 3.533 1.00 0.00 H new ATOM 0 HB ILE A 80 13.354 -8.543 3.629 1.00 0.00 H new ATOM 0 HG12 ILE A 80 10.829 -9.149 2.006 1.00 0.00 H new ATOM 0 HG13 ILE A 80 11.017 -7.857 3.175 1.00 0.00 H new ATOM 0 HG21 ILE A 80 14.021 -9.272 1.408 1.00 0.00 H new ATOM 0 HG22 ILE A 80 14.347 -10.530 2.623 1.00 0.00 H new ATOM 0 HG23 ILE A 80 12.950 -10.687 1.531 1.00 0.00 H new ATOM 0 HD11 ILE A 80 11.156 -6.992 0.883 1.00 0.00 H new ATOM 0 HD12 ILE A 80 12.708 -6.772 1.725 1.00 0.00 H new ATOM 0 HD13 ILE A 80 12.517 -8.084 0.538 1.00 0.00 H new ATOM 1325 N SER A 81 13.683 -10.787 5.813 1.00 0.00 N ATOM 1326 CA SER A 81 14.593 -11.610 6.598 1.00 0.00 C ATOM 1327 C SER A 81 13.831 -12.719 7.336 1.00 0.00 C ATOM 1328 O SER A 81 14.352 -13.828 7.464 1.00 0.00 O ATOM 1329 CB SER A 81 15.384 -10.670 7.528 1.00 0.00 C ATOM 1330 OG SER A 81 16.172 -11.330 8.505 1.00 0.00 O ATOM 0 H SER A 81 13.621 -9.830 6.159 1.00 0.00 H new ATOM 0 HA SER A 81 15.303 -12.138 5.961 1.00 0.00 H new ATOM 0 HB2 SER A 81 16.035 -10.042 6.920 1.00 0.00 H new ATOM 0 HB3 SER A 81 14.683 -10.007 8.034 1.00 0.00 H new ATOM 0 HG SER A 81 16.641 -10.665 9.051 1.00 0.00 H new ATOM 1336 N SER A 82 12.613 -12.466 7.821 1.00 0.00 N ATOM 1337 CA SER A 82 11.767 -13.503 8.396 1.00 0.00 C ATOM 1338 C SER A 82 11.374 -14.511 7.317 1.00 0.00 C ATOM 1339 O SER A 82 11.346 -15.710 7.589 1.00 0.00 O ATOM 1340 CB SER A 82 10.529 -12.866 9.033 1.00 0.00 C ATOM 1341 OG SER A 82 10.882 -12.035 10.127 1.00 0.00 O ATOM 0 H SER A 82 12.191 -11.538 7.824 1.00 0.00 H new ATOM 0 HA SER A 82 12.317 -14.034 9.173 1.00 0.00 H new ATOM 0 HB2 SER A 82 9.994 -12.280 8.286 1.00 0.00 H new ATOM 0 HB3 SER A 82 9.849 -13.647 9.372 1.00 0.00 H new ATOM 0 HG SER A 82 11.253 -11.192 9.791 1.00 0.00 H new ATOM 1347 N SER A 83 11.073 -14.021 6.110 1.00 0.00 N ATOM 1348 CA SER A 83 10.539 -14.823 5.025 1.00 0.00 C ATOM 1349 C SER A 83 11.606 -15.733 4.419 1.00 0.00 C ATOM 1350 O SER A 83 11.526 -16.955 4.577 1.00 0.00 O ATOM 1351 CB SER A 83 9.904 -13.903 3.979 1.00 0.00 C ATOM 1352 OG SER A 83 8.931 -13.065 4.591 1.00 0.00 O ATOM 0 H SER A 83 11.199 -13.039 5.864 1.00 0.00 H new ATOM 0 HA SER A 83 9.767 -15.484 5.419 1.00 0.00 H new ATOM 0 HB2 SER A 83 10.673 -13.294 3.504 1.00 0.00 H new ATOM 0 HB3 SER A 83 9.440 -14.499 3.193 1.00 0.00 H new ATOM 0 HG SER A 83 9.381 -12.363 5.106 1.00 0.00 H new ATOM 1358 N GLY A 84 12.594 -15.162 3.729 1.00 0.00 N ATOM 1359 CA GLY A 84 13.480 -15.937 2.877 1.00 0.00 C ATOM 1360 C GLY A 84 13.949 -15.178 1.647 1.00 0.00 C ATOM 1361 O GLY A 84 14.078 -15.789 0.587 1.00 0.00 O ATOM 0 H GLY A 84 12.797 -14.162 3.747 1.00 0.00 H new ATOM 0 HA2 GLY A 84 14.349 -16.248 3.456 1.00 0.00 H new ATOM 0 HA3 GLY A 84 12.966 -16.845 2.561 1.00 0.00 H new ATOM 1365 N GLY A 85 14.158 -13.864 1.740 1.00 0.00 N ATOM 1366 CA GLY A 85 14.541 -13.045 0.606 1.00 0.00 C ATOM 1367 C GLY A 85 15.778 -12.226 0.911 1.00 0.00 C ATOM 1368 O GLY A 85 16.511 -12.505 1.861 1.00 0.00 O ATOM 0 H GLY A 85 14.064 -13.342 2.611 1.00 0.00 H new ATOM 0 HA2 GLY A 85 14.728 -13.682 -0.259 1.00 0.00 H new ATOM 0 HA3 GLY A 85 13.719 -12.381 0.340 1.00 0.00 H new ATOM 1372 N PHE A 86 16.022 -11.204 0.105 1.00 0.00 N ATOM 1373 CA PHE A 86 17.021 -10.167 0.343 1.00 0.00 C ATOM 1374 C PHE A 86 16.371 -8.847 -0.041 1.00 0.00 C ATOM 1375 O PHE A 86 15.481 -8.791 -0.891 1.00 0.00 O ATOM 1376 CB PHE A 86 18.302 -10.423 -0.477 1.00 0.00 C ATOM 1377 CG PHE A 86 19.493 -10.965 0.313 1.00 0.00 C ATOM 1378 CD1 PHE A 86 19.526 -12.345 0.593 1.00 0.00 C ATOM 1379 CD2 PHE A 86 20.571 -10.150 0.753 1.00 0.00 C ATOM 1380 CE1 PHE A 86 20.592 -12.912 1.311 1.00 0.00 C ATOM 1381 CE2 PHE A 86 21.624 -10.721 1.494 1.00 0.00 C ATOM 1382 CZ PHE A 86 21.641 -12.098 1.768 1.00 0.00 C ATOM 0 H PHE A 86 15.511 -11.067 -0.767 1.00 0.00 H new ATOM 0 HA PHE A 86 17.331 -10.158 1.388 1.00 0.00 H new ATOM 0 HB2 PHE A 86 18.067 -11.128 -1.275 1.00 0.00 H new ATOM 0 HB3 PHE A 86 18.600 -9.489 -0.954 1.00 0.00 H new ATOM 0 HD1 PHE A 86 18.720 -12.977 0.251 1.00 0.00 H new ATOM 0 HD2 PHE A 86 20.583 -9.096 0.520 1.00 0.00 H new ATOM 0 HE1 PHE A 86 20.605 -13.973 1.511 1.00 0.00 H new ATOM 0 HE2 PHE A 86 22.426 -10.094 1.855 1.00 0.00 H new ATOM 0 HZ PHE A 86 22.458 -12.529 2.328 1.00 0.00 H new ATOM 1392 N PHE A 87 16.810 -7.766 0.590 1.00 0.00 N ATOM 1393 CA PHE A 87 16.411 -6.421 0.226 1.00 0.00 C ATOM 1394 C PHE A 87 17.589 -5.528 0.515 1.00 0.00 C ATOM 1395 O PHE A 87 18.375 -5.809 1.429 1.00 0.00 O ATOM 1396 CB PHE A 87 15.139 -6.016 0.982 1.00 0.00 C ATOM 1397 CG PHE A 87 14.852 -4.533 1.193 1.00 0.00 C ATOM 1398 CD1 PHE A 87 14.793 -3.644 0.093 1.00 0.00 C ATOM 1399 CD2 PHE A 87 14.644 -4.038 2.505 1.00 0.00 C ATOM 1400 CE1 PHE A 87 14.450 -2.298 0.322 1.00 0.00 C ATOM 1401 CE2 PHE A 87 14.301 -2.692 2.723 1.00 0.00 C ATOM 1402 CZ PHE A 87 14.175 -1.828 1.621 1.00 0.00 C ATOM 0 H PHE A 87 17.459 -7.803 1.376 1.00 0.00 H new ATOM 0 HA PHE A 87 16.153 -6.341 -0.830 1.00 0.00 H new ATOM 0 HB2 PHE A 87 14.289 -6.445 0.451 1.00 0.00 H new ATOM 0 HB3 PHE A 87 15.174 -6.489 1.964 1.00 0.00 H new ATOM 0 HD1 PHE A 87 15.008 -3.993 -0.906 1.00 0.00 H new ATOM 0 HD2 PHE A 87 14.750 -4.704 3.349 1.00 0.00 H new ATOM 0 HE1 PHE A 87 14.397 -1.614 -0.512 1.00 0.00 H new ATOM 0 HE2 PHE A 87 14.136 -2.326 3.726 1.00 0.00 H new ATOM 0 HZ PHE A 87 13.867 -0.804 1.771 1.00 0.00 H new ATOM 1412 N ALA A 88 17.717 -4.490 -0.302 1.00 0.00 N ATOM 1413 CA ALA A 88 18.774 -3.516 -0.184 1.00 0.00 C ATOM 1414 C ALA A 88 18.350 -2.171 -0.757 1.00 0.00 C ATOM 1415 O ALA A 88 17.267 -2.067 -1.340 1.00 0.00 O ATOM 1416 CB ALA A 88 19.989 -4.071 -0.878 1.00 0.00 C ATOM 0 H ALA A 88 17.076 -4.306 -1.074 1.00 0.00 H new ATOM 0 HA ALA A 88 19.007 -3.333 0.865 1.00 0.00 H new ATOM 0 HB1 ALA A 88 20.808 -3.355 -0.806 1.00 0.00 H new ATOM 0 HB2 ALA A 88 20.283 -5.008 -0.404 1.00 0.00 H new ATOM 0 HB3 ALA A 88 19.757 -4.253 -1.927 1.00 0.00 H new ATOM 1422 N LEU A 89 19.159 -1.134 -0.542 1.00 0.00 N ATOM 1423 CA LEU A 89 18.883 0.215 -1.043 1.00 0.00 C ATOM 1424 C LEU A 89 19.859 0.510 -2.167 1.00 0.00 C ATOM 1425 O LEU A 89 20.809 -0.236 -2.367 1.00 0.00 O ATOM 1426 CB LEU A 89 18.927 1.303 0.052 1.00 0.00 C ATOM 1427 CG LEU A 89 18.449 0.899 1.455 1.00 0.00 C ATOM 1428 CD1 LEU A 89 18.317 2.079 2.425 1.00 0.00 C ATOM 1429 CD2 LEU A 89 17.060 0.311 1.396 1.00 0.00 C ATOM 0 H LEU A 89 20.028 -1.205 -0.013 1.00 0.00 H new ATOM 0 HA LEU A 89 17.858 0.241 -1.413 1.00 0.00 H new ATOM 0 HB2 LEU A 89 19.953 1.660 0.134 1.00 0.00 H new ATOM 0 HB3 LEU A 89 18.322 2.145 -0.283 1.00 0.00 H new ATOM 0 HG LEU A 89 19.207 0.198 1.804 1.00 0.00 H new ATOM 0 HD11 LEU A 89 17.975 1.717 3.395 1.00 0.00 H new ATOM 0 HD12 LEU A 89 19.286 2.565 2.540 1.00 0.00 H new ATOM 0 HD13 LEU A 89 17.596 2.795 2.031 1.00 0.00 H new ATOM 0 HD21 LEU A 89 16.740 0.031 2.400 1.00 0.00 H new ATOM 0 HD22 LEU A 89 16.370 1.049 0.988 1.00 0.00 H new ATOM 0 HD23 LEU A 89 17.066 -0.573 0.758 1.00 0.00 H new ATOM 1441 N VAL A 90 19.633 1.567 -2.935 1.00 0.00 N ATOM 1442 CA VAL A 90 20.393 1.907 -4.125 1.00 0.00 C ATOM 1443 C VAL A 90 20.519 3.411 -4.281 1.00 0.00 C ATOM 1444 O VAL A 90 19.656 4.118 -3.789 1.00 0.00 O ATOM 1445 CB VAL A 90 19.872 1.115 -5.359 1.00 0.00 C ATOM 1446 CG1 VAL A 90 18.676 0.167 -5.224 1.00 0.00 C ATOM 1447 CG2 VAL A 90 20.146 1.760 -6.720 1.00 0.00 C ATOM 0 H VAL A 90 18.887 2.234 -2.737 1.00 0.00 H new ATOM 0 HA VAL A 90 21.427 1.576 -4.023 1.00 0.00 H new ATOM 0 HB VAL A 90 20.581 0.287 -5.338 1.00 0.00 H new ATOM 0 HG11 VAL A 90 18.464 -0.291 -6.190 1.00 0.00 H new ATOM 0 HG12 VAL A 90 18.909 -0.611 -4.497 1.00 0.00 H new ATOM 0 HG13 VAL A 90 17.803 0.728 -4.889 1.00 0.00 H new ATOM 0 HG21 VAL A 90 19.742 1.127 -7.510 1.00 0.00 H new ATOM 0 HG22 VAL A 90 19.670 2.740 -6.761 1.00 0.00 H new ATOM 0 HG23 VAL A 90 21.221 1.873 -6.859 1.00 0.00 H new ATOM 1457 N SER A 91 21.582 3.880 -4.938 1.00 0.00 N ATOM 1458 CA SER A 91 21.885 5.284 -5.203 1.00 0.00 C ATOM 1459 C SER A 91 21.593 6.197 -3.995 1.00 0.00 C ATOM 1460 O SER A 91 20.798 7.131 -4.088 1.00 0.00 O ATOM 1461 CB SER A 91 21.214 5.727 -6.509 1.00 0.00 C ATOM 1462 OG SER A 91 19.894 5.230 -6.654 1.00 0.00 O ATOM 0 H SER A 91 22.292 3.255 -5.319 1.00 0.00 H new ATOM 0 HA SER A 91 22.960 5.388 -5.349 1.00 0.00 H new ATOM 0 HB2 SER A 91 21.192 6.816 -6.548 1.00 0.00 H new ATOM 0 HB3 SER A 91 21.817 5.390 -7.352 1.00 0.00 H new ATOM 0 HG SER A 91 19.435 5.723 -7.366 1.00 0.00 H new ATOM 1468 N PRO A 92 22.238 5.939 -2.841 1.00 0.00 N ATOM 1469 CA PRO A 92 21.923 6.575 -1.563 1.00 0.00 C ATOM 1470 C PRO A 92 22.327 8.056 -1.471 1.00 0.00 C ATOM 1471 O PRO A 92 22.190 8.665 -0.402 1.00 0.00 O ATOM 1472 CB PRO A 92 22.610 5.697 -0.517 1.00 0.00 C ATOM 1473 CG PRO A 92 23.824 5.142 -1.265 1.00 0.00 C ATOM 1474 CD PRO A 92 23.281 4.938 -2.662 1.00 0.00 C ATOM 0 HA PRO A 92 20.845 6.629 -1.412 1.00 0.00 H new ATOM 0 HB2 PRO A 92 22.907 6.273 0.360 1.00 0.00 H new ATOM 0 HB3 PRO A 92 21.954 4.900 -0.168 1.00 0.00 H new ATOM 0 HG2 PRO A 92 24.662 5.839 -1.253 1.00 0.00 H new ATOM 0 HG3 PRO A 92 24.179 4.209 -0.827 1.00 0.00 H new ATOM 0 HD2 PRO A 92 24.068 5.058 -3.407 1.00 0.00 H new ATOM 0 HD3 PRO A 92 22.880 3.932 -2.781 1.00 0.00 H new ATOM 1482 N ASN A 93 22.764 8.667 -2.578 1.00 0.00 N ATOM 1483 CA ASN A 93 23.249 10.041 -2.649 1.00 0.00 C ATOM 1484 C ASN A 93 24.400 10.215 -1.655 1.00 0.00 C ATOM 1485 O ASN A 93 25.014 9.249 -1.202 1.00 0.00 O ATOM 1486 CB ASN A 93 22.129 11.078 -2.403 1.00 0.00 C ATOM 1487 CG ASN A 93 20.819 10.856 -3.140 1.00 0.00 C ATOM 1488 OD1 ASN A 93 20.560 11.502 -4.144 1.00 0.00 O ATOM 1489 ND2 ASN A 93 19.939 10.040 -2.588 1.00 0.00 N ATOM 0 H ASN A 93 22.789 8.195 -3.482 1.00 0.00 H new ATOM 0 HA ASN A 93 23.609 10.227 -3.661 1.00 0.00 H new ATOM 0 HB2 ASN A 93 21.918 11.103 -1.334 1.00 0.00 H new ATOM 0 HB3 ASN A 93 22.510 12.062 -2.676 1.00 0.00 H new ATOM 0 HD21 ASN A 93 19.012 9.935 -3.000 1.00 0.00 H new ATOM 0 HD22 ASN A 93 20.187 9.515 -1.750 1.00 0.00 H new ATOM 1496 N GLU A 94 24.717 11.455 -1.288 1.00 0.00 N ATOM 1497 CA GLU A 94 25.554 11.736 -0.134 1.00 0.00 C ATOM 1498 C GLU A 94 24.699 11.843 1.157 1.00 0.00 C ATOM 1499 O GLU A 94 25.219 11.772 2.281 1.00 0.00 O ATOM 1500 CB GLU A 94 26.372 12.998 -0.473 1.00 0.00 C ATOM 1501 CG GLU A 94 27.204 13.363 0.749 1.00 0.00 C ATOM 1502 CD GLU A 94 28.331 14.379 0.583 1.00 0.00 C ATOM 1503 OE1 GLU A 94 28.338 15.177 -0.376 1.00 0.00 O ATOM 1504 OE2 GLU A 94 29.121 14.506 1.553 1.00 0.00 O ATOM 0 H GLU A 94 24.400 12.288 -1.784 1.00 0.00 H new ATOM 0 HA GLU A 94 26.251 10.925 0.079 1.00 0.00 H new ATOM 0 HB2 GLU A 94 27.017 12.814 -1.332 1.00 0.00 H new ATOM 0 HB3 GLU A 94 25.709 13.821 -0.742 1.00 0.00 H new ATOM 0 HG2 GLU A 94 26.524 13.743 1.512 1.00 0.00 H new ATOM 0 HG3 GLU A 94 27.641 12.444 1.140 1.00 0.00 H new ATOM 1511 N LYS A 95 23.375 11.994 1.016 1.00 0.00 N ATOM 1512 CA LYS A 95 22.508 12.520 2.067 1.00 0.00 C ATOM 1513 C LYS A 95 21.797 11.423 2.841 1.00 0.00 C ATOM 1514 O LYS A 95 21.637 11.566 4.053 1.00 0.00 O ATOM 1515 CB LYS A 95 21.578 13.555 1.456 1.00 0.00 C ATOM 1516 CG LYS A 95 21.362 14.748 2.412 1.00 0.00 C ATOM 1517 CD LYS A 95 19.910 14.835 2.851 1.00 0.00 C ATOM 1518 CE LYS A 95 19.369 13.771 3.813 1.00 0.00 C ATOM 1519 NZ LYS A 95 20.158 13.673 5.052 1.00 0.00 N ATOM 0 H LYS A 95 22.876 11.751 0.160 1.00 0.00 H new ATOM 0 HA LYS A 95 23.111 13.018 2.826 1.00 0.00 H new ATOM 0 HB2 LYS A 95 21.996 13.912 0.514 1.00 0.00 H new ATOM 0 HB3 LYS A 95 20.618 13.093 1.224 1.00 0.00 H new ATOM 0 HG2 LYS A 95 22.004 14.640 3.286 1.00 0.00 H new ATOM 0 HG3 LYS A 95 21.652 15.674 1.916 1.00 0.00 H new ATOM 0 HD2 LYS A 95 19.763 15.809 3.318 1.00 0.00 H new ATOM 0 HD3 LYS A 95 19.291 14.815 1.954 1.00 0.00 H new ATOM 0 HE2 LYS A 95 18.334 14.005 4.063 1.00 0.00 H new ATOM 0 HE3 LYS A 95 19.364 12.803 3.312 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 19.525 13.471 5.852 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 20.855 12.907 4.960 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 20.653 14.572 5.221 1.00 0.00 H new ATOM 1533 N VAL A 96 21.439 10.315 2.199 1.00 0.00 N ATOM 1534 CA VAL A 96 21.017 9.092 2.895 1.00 0.00 C ATOM 1535 C VAL A 96 22.274 8.403 3.422 1.00 0.00 C ATOM 1536 O VAL A 96 22.249 8.054 4.597 1.00 0.00 O ATOM 1537 CB VAL A 96 20.055 8.330 1.940 1.00 0.00 C ATOM 1538 CG1 VAL A 96 20.139 6.800 1.809 1.00 0.00 C ATOM 1539 CG2 VAL A 96 18.637 8.760 2.342 1.00 0.00 C ATOM 0 H VAL A 96 21.431 10.234 1.182 1.00 0.00 H new ATOM 0 HA VAL A 96 20.420 9.224 3.797 1.00 0.00 H new ATOM 0 HB VAL A 96 20.372 8.615 0.937 1.00 0.00 H new ATOM 0 HG11 VAL A 96 19.389 6.454 1.098 1.00 0.00 H new ATOM 0 HG12 VAL A 96 21.131 6.519 1.456 1.00 0.00 H new ATOM 0 HG13 VAL A 96 19.957 6.341 2.781 1.00 0.00 H new ATOM 0 HG21 VAL A 96 17.910 8.257 1.705 1.00 0.00 H new ATOM 0 HG22 VAL A 96 18.456 8.490 3.382 1.00 0.00 H new ATOM 0 HG23 VAL A 96 18.537 9.839 2.225 1.00 0.00 H new ATOM 1549 N GLU A 97 23.414 8.387 2.720 1.00 0.00 N ATOM 1550 CA GLU A 97 24.660 7.888 3.302 1.00 0.00 C ATOM 1551 C GLU A 97 24.944 8.594 4.630 1.00 0.00 C ATOM 1552 O GLU A 97 25.400 7.965 5.590 1.00 0.00 O ATOM 1553 CB GLU A 97 25.822 8.076 2.313 1.00 0.00 C ATOM 1554 CG GLU A 97 26.004 6.877 1.374 1.00 0.00 C ATOM 1555 CD GLU A 97 26.538 5.641 2.107 1.00 0.00 C ATOM 1556 OE1 GLU A 97 27.655 5.703 2.677 1.00 0.00 O ATOM 1557 OE2 GLU A 97 25.866 4.591 2.127 1.00 0.00 O ATOM 0 H GLU A 97 23.497 8.712 1.757 1.00 0.00 H new ATOM 0 HA GLU A 97 24.557 6.822 3.502 1.00 0.00 H new ATOM 0 HB2 GLU A 97 25.646 8.973 1.719 1.00 0.00 H new ATOM 0 HB3 GLU A 97 26.745 8.238 2.870 1.00 0.00 H new ATOM 0 HG2 GLU A 97 25.049 6.636 0.907 1.00 0.00 H new ATOM 0 HG3 GLU A 97 26.692 7.147 0.572 1.00 0.00 H new ATOM 1564 N ARG A 98 24.592 9.887 4.733 1.00 0.00 N ATOM 1565 CA ARG A 98 24.932 10.635 5.933 1.00 0.00 C ATOM 1566 C ARG A 98 24.150 10.097 7.139 1.00 0.00 C ATOM 1567 O ARG A 98 24.687 10.015 8.238 1.00 0.00 O ATOM 1568 CB ARG A 98 24.790 12.164 5.735 1.00 0.00 C ATOM 1569 CG ARG A 98 23.490 12.812 6.228 1.00 0.00 C ATOM 1570 CD ARG A 98 23.699 13.308 7.665 1.00 0.00 C ATOM 1571 NE ARG A 98 22.472 13.555 8.443 1.00 0.00 N ATOM 1572 CZ ARG A 98 22.480 13.872 9.745 1.00 0.00 C ATOM 1573 NH1 ARG A 98 23.623 14.145 10.366 1.00 0.00 N ATOM 1574 NH2 ARG A 98 21.361 13.890 10.452 1.00 0.00 N ATOM 0 H ARG A 98 24.088 10.414 4.019 1.00 0.00 H new ATOM 0 HA ARG A 98 25.990 10.480 6.145 1.00 0.00 H new ATOM 0 HB2 ARG A 98 25.624 12.650 6.241 1.00 0.00 H new ATOM 0 HB3 ARG A 98 24.894 12.379 4.671 1.00 0.00 H new ATOM 0 HG2 ARG A 98 23.212 13.642 5.579 1.00 0.00 H new ATOM 0 HG3 ARG A 98 22.672 12.092 6.192 1.00 0.00 H new ATOM 0 HD2 ARG A 98 24.303 12.574 8.198 1.00 0.00 H new ATOM 0 HD3 ARG A 98 24.277 14.232 7.630 1.00 0.00 H new ATOM 0 HE ARG A 98 21.573 13.481 7.967 1.00 0.00 H new ATOM 0 HH11 ARG A 98 24.503 14.114 9.851 1.00 0.00 H new ATOM 0 HH12 ARG A 98 23.620 14.385 11.357 1.00 0.00 H new ATOM 0 HH21 ARG A 98 20.473 13.660 10.007 1.00 0.00 H new ATOM 0 HH22 ARG A 98 21.387 14.134 11.442 1.00 0.00 H new ATOM 1588 N VAL A 99 22.871 9.753 6.964 1.00 0.00 N ATOM 1589 CA VAL A 99 21.970 9.487 8.071 1.00 0.00 C ATOM 1590 C VAL A 99 22.022 7.994 8.352 1.00 0.00 C ATOM 1591 O VAL A 99 21.945 7.585 9.505 1.00 0.00 O ATOM 1592 CB VAL A 99 20.560 10.025 7.732 1.00 0.00 C ATOM 1593 CG1 VAL A 99 19.781 9.218 6.711 1.00 0.00 C ATOM 1594 CG2 VAL A 99 19.672 10.087 8.976 1.00 0.00 C ATOM 0 H VAL A 99 22.438 9.653 6.046 1.00 0.00 H new ATOM 0 HA VAL A 99 22.264 10.004 8.984 1.00 0.00 H new ATOM 0 HB VAL A 99 20.774 11.008 7.311 1.00 0.00 H new ATOM 0 HG11 VAL A 99 18.808 9.681 6.547 1.00 0.00 H new ATOM 0 HG12 VAL A 99 20.333 9.190 5.772 1.00 0.00 H new ATOM 0 HG13 VAL A 99 19.641 8.202 7.080 1.00 0.00 H new ATOM 0 HG21 VAL A 99 18.689 10.469 8.702 1.00 0.00 H new ATOM 0 HG22 VAL A 99 19.568 9.088 9.399 1.00 0.00 H new ATOM 0 HG23 VAL A 99 20.126 10.748 9.714 1.00 0.00 H new ATOM 1604 N LEU A 100 22.210 7.188 7.308 1.00 0.00 N ATOM 1605 CA LEU A 100 22.324 5.760 7.385 1.00 0.00 C ATOM 1606 C LEU A 100 23.575 5.313 8.141 1.00 0.00 C ATOM 1607 O LEU A 100 23.600 4.161 8.572 1.00 0.00 O ATOM 1608 CB LEU A 100 22.214 5.173 5.966 1.00 0.00 C ATOM 1609 CG LEU A 100 20.746 5.010 5.521 1.00 0.00 C ATOM 1610 CD1 LEU A 100 19.893 6.147 5.065 1.00 0.00 C ATOM 1611 CD2 LEU A 100 20.489 3.757 4.687 1.00 0.00 C ATOM 0 H LEU A 100 22.288 7.541 6.354 1.00 0.00 H new ATOM 0 HA LEU A 100 21.500 5.363 7.978 1.00 0.00 H new ATOM 0 HB2 LEU A 100 22.736 5.823 5.263 1.00 0.00 H new ATOM 0 HB3 LEU A 100 22.712 4.204 5.935 1.00 0.00 H new ATOM 0 HG LEU A 100 20.363 4.926 6.538 1.00 0.00 H new ATOM 0 HD11 LEU A 100 18.901 5.777 4.806 1.00 0.00 H new ATOM 0 HD12 LEU A 100 19.808 6.882 5.865 1.00 0.00 H new ATOM 0 HD13 LEU A 100 20.346 6.614 4.190 1.00 0.00 H new ATOM 0 HD21 LEU A 100 19.435 3.713 4.412 1.00 0.00 H new ATOM 0 HD22 LEU A 100 21.098 3.790 3.784 1.00 0.00 H new ATOM 0 HD23 LEU A 100 20.750 2.873 5.269 1.00 0.00 H new ATOM 1623 N SER A 101 24.533 6.200 8.430 1.00 0.00 N ATOM 1624 CA SER A 101 25.590 5.912 9.377 1.00 0.00 C ATOM 1625 C SER A 101 25.070 6.295 10.760 1.00 0.00 C ATOM 1626 O SER A 101 25.116 5.513 11.705 1.00 0.00 O ATOM 1627 CB SER A 101 26.823 6.702 8.942 1.00 0.00 C ATOM 1628 OG SER A 101 27.972 6.277 9.646 1.00 0.00 O ATOM 0 H SER A 101 24.589 7.129 8.012 1.00 0.00 H new ATOM 0 HA SER A 101 25.876 4.861 9.412 1.00 0.00 H new ATOM 0 HB2 SER A 101 26.981 6.575 7.871 1.00 0.00 H new ATOM 0 HB3 SER A 101 26.658 7.765 9.116 1.00 0.00 H new ATOM 0 HG SER A 101 28.748 6.796 9.349 1.00 0.00 H new ATOM 1634 N LEU A 102 24.543 7.512 10.885 1.00 0.00 N ATOM 1635 CA LEU A 102 24.201 8.183 12.141 1.00 0.00 C ATOM 1636 C LEU A 102 23.147 7.435 12.953 1.00 0.00 C ATOM 1637 O LEU A 102 23.229 7.425 14.185 1.00 0.00 O ATOM 1638 CB LEU A 102 23.643 9.593 11.868 1.00 0.00 C ATOM 1639 CG LEU A 102 24.593 10.683 11.331 1.00 0.00 C ATOM 1640 CD1 LEU A 102 24.741 11.769 12.367 1.00 0.00 C ATOM 1641 CD2 LEU A 102 26.014 10.212 11.045 1.00 0.00 C ATOM 0 H LEU A 102 24.331 8.088 10.070 1.00 0.00 H new ATOM 0 HA LEU A 102 25.129 8.221 12.711 1.00 0.00 H new ATOM 0 HB2 LEU A 102 22.824 9.490 11.156 1.00 0.00 H new ATOM 0 HB3 LEU A 102 23.212 9.962 12.799 1.00 0.00 H new ATOM 0 HG LEU A 102 24.136 11.009 10.397 1.00 0.00 H new ATOM 0 HD11 LEU A 102 25.412 12.541 11.991 1.00 0.00 H new ATOM 0 HD12 LEU A 102 23.765 12.207 12.577 1.00 0.00 H new ATOM 0 HD13 LEU A 102 25.153 11.345 13.283 1.00 0.00 H new ATOM 0 HD21 LEU A 102 26.606 11.048 10.672 1.00 0.00 H new ATOM 0 HD22 LEU A 102 26.462 9.831 11.962 1.00 0.00 H new ATOM 0 HD23 LEU A 102 25.991 9.420 10.296 1.00 0.00 H new ATOM 1653 N THR A 103 22.148 6.852 12.290 1.00 0.00 N ATOM 1654 CA THR A 103 21.084 6.127 12.965 1.00 0.00 C ATOM 1655 C THR A 103 21.486 4.672 13.204 1.00 0.00 C ATOM 1656 O THR A 103 20.913 4.032 14.083 1.00 0.00 O ATOM 1657 CB THR A 103 19.770 6.280 12.178 1.00 0.00 C ATOM 1658 OG1 THR A 103 18.732 5.660 12.897 1.00 0.00 O ATOM 1659 CG2 THR A 103 19.772 5.753 10.733 1.00 0.00 C ATOM 0 H THR A 103 22.058 6.872 11.274 1.00 0.00 H new ATOM 0 HA THR A 103 20.914 6.554 13.953 1.00 0.00 H new ATOM 0 HB THR A 103 19.627 7.356 12.077 1.00 0.00 H new ATOM 0 HG1 THR A 103 17.891 5.754 12.403 1.00 0.00 H new ATOM 0 HG21 THR A 103 18.792 5.917 10.284 1.00 0.00 H new ATOM 0 HG22 THR A 103 20.529 6.281 10.154 1.00 0.00 H new ATOM 0 HG23 THR A 103 19.996 4.686 10.735 1.00 0.00 H new ATOM 1667 N ASN A 104 22.495 4.156 12.488 1.00 0.00 N ATOM 1668 CA ASN A 104 22.645 2.747 12.121 1.00 0.00 C ATOM 1669 C ASN A 104 21.475 2.392 11.196 1.00 0.00 C ATOM 1670 O ASN A 104 20.383 2.082 11.658 1.00 0.00 O ATOM 1671 CB ASN A 104 22.753 1.778 13.326 1.00 0.00 C ATOM 1672 CG ASN A 104 23.796 2.224 14.359 1.00 0.00 C ATOM 1673 OD1 ASN A 104 24.951 1.808 14.331 1.00 0.00 O ATOM 1674 ND2 ASN A 104 23.406 3.104 15.267 1.00 0.00 N ATOM 0 H ASN A 104 23.258 4.735 12.136 1.00 0.00 H new ATOM 0 HA ASN A 104 23.600 2.620 11.611 1.00 0.00 H new ATOM 0 HB2 ASN A 104 21.780 1.699 13.811 1.00 0.00 H new ATOM 0 HB3 ASN A 104 23.010 0.783 12.964 1.00 0.00 H new ATOM 0 HD21 ASN A 104 24.069 3.449 15.961 1.00 0.00 H new ATOM 0 HD22 ASN A 104 22.442 3.437 15.273 1.00 0.00 H new ATOM 1681 N LEU A 105 21.673 2.489 9.880 1.00 0.00 N ATOM 1682 CA LEU A 105 20.777 1.976 8.845 1.00 0.00 C ATOM 1683 C LEU A 105 21.573 1.041 7.924 1.00 0.00 C ATOM 1684 O LEU A 105 21.177 -0.109 7.724 1.00 0.00 O ATOM 1685 CB LEU A 105 20.129 3.087 8.058 1.00 0.00 C ATOM 1686 CG LEU A 105 18.709 2.794 7.549 1.00 0.00 C ATOM 1687 CD1 LEU A 105 18.517 1.441 6.851 1.00 0.00 C ATOM 1688 CD2 LEU A 105 17.731 2.948 8.702 1.00 0.00 C ATOM 0 H LEU A 105 22.497 2.947 9.491 1.00 0.00 H new ATOM 0 HA LEU A 105 19.968 1.424 9.323 1.00 0.00 H new ATOM 0 HB2 LEU A 105 20.096 3.980 8.682 1.00 0.00 H new ATOM 0 HB3 LEU A 105 20.762 3.320 7.202 1.00 0.00 H new ATOM 0 HG LEU A 105 18.517 3.524 6.763 1.00 0.00 H new ATOM 0 HD11 LEU A 105 17.479 1.340 6.533 1.00 0.00 H new ATOM 0 HD12 LEU A 105 19.170 1.385 5.980 1.00 0.00 H new ATOM 0 HD13 LEU A 105 18.765 0.636 7.543 1.00 0.00 H new ATOM 0 HD21 LEU A 105 16.720 2.742 8.351 1.00 0.00 H new ATOM 0 HD22 LEU A 105 17.990 2.246 9.495 1.00 0.00 H new ATOM 0 HD23 LEU A 105 17.781 3.966 9.088 1.00 0.00 H new ATOM 1700 N ASP A 106 22.729 1.512 7.421 1.00 0.00 N ATOM 1701 CA ASP A 106 23.588 0.687 6.574 1.00 0.00 C ATOM 1702 C ASP A 106 24.023 -0.562 7.332 1.00 0.00 C ATOM 1703 O ASP A 106 24.202 -1.621 6.746 1.00 0.00 O ATOM 1704 CB ASP A 106 24.809 1.461 6.036 1.00 0.00 C ATOM 1705 CG ASP A 106 26.150 1.002 6.615 1.00 0.00 C ATOM 1706 OD1 ASP A 106 26.548 1.553 7.662 1.00 0.00 O ATOM 1707 OD2 ASP A 106 26.831 0.125 6.035 1.00 0.00 O ATOM 0 H ASP A 106 23.082 2.454 7.589 1.00 0.00 H new ATOM 0 HA ASP A 106 23.003 0.392 5.703 1.00 0.00 H new ATOM 0 HB2 ASP A 106 24.841 1.358 4.951 1.00 0.00 H new ATOM 0 HB3 ASP A 106 24.677 2.521 6.252 1.00 0.00 H new ATOM 1712 N ARG A 107 24.128 -0.431 8.654 1.00 0.00 N ATOM 1713 CA ARG A 107 24.541 -1.436 9.626 1.00 0.00 C ATOM 1714 C ARG A 107 23.425 -2.434 9.941 1.00 0.00 C ATOM 1715 O ARG A 107 23.559 -3.250 10.851 1.00 0.00 O ATOM 1716 CB ARG A 107 25.049 -0.714 10.887 1.00 0.00 C ATOM 1717 CG ARG A 107 26.072 0.375 10.516 1.00 0.00 C ATOM 1718 CD ARG A 107 26.853 0.903 11.715 1.00 0.00 C ATOM 1719 NE ARG A 107 27.964 1.728 11.249 1.00 0.00 N ATOM 1720 CZ ARG A 107 28.762 2.540 11.938 1.00 0.00 C ATOM 1721 NH1 ARG A 107 28.583 2.693 13.241 1.00 0.00 N ATOM 1722 NH2 ARG A 107 29.698 3.200 11.272 1.00 0.00 N ATOM 0 H ARG A 107 23.907 0.456 9.108 1.00 0.00 H new ATOM 0 HA ARG A 107 25.348 -2.034 9.202 1.00 0.00 H new ATOM 0 HB2 ARG A 107 24.210 -0.265 11.418 1.00 0.00 H new ATOM 0 HB3 ARG A 107 25.507 -1.434 11.565 1.00 0.00 H new ATOM 0 HG2 ARG A 107 26.772 -0.028 9.784 1.00 0.00 H new ATOM 0 HG3 ARG A 107 25.552 1.204 10.036 1.00 0.00 H new ATOM 0 HD2 ARG A 107 26.198 1.488 12.360 1.00 0.00 H new ATOM 0 HD3 ARG A 107 27.229 0.072 12.312 1.00 0.00 H new ATOM 0 HE ARG A 107 28.157 1.674 10.249 1.00 0.00 H new ATOM 0 HH11 ARG A 107 27.834 2.189 13.716 1.00 0.00 H new ATOM 0 HH12 ARG A 107 29.194 3.315 13.770 1.00 0.00 H new ATOM 0 HH21 ARG A 107 29.789 3.077 10.264 1.00 0.00 H new ATOM 0 HH22 ARG A 107 30.328 3.831 11.768 1.00 0.00 H new ATOM 1736 N ILE A 108 22.300 -2.344 9.234 1.00 0.00 N ATOM 1737 CA ILE A 108 21.123 -3.166 9.428 1.00 0.00 C ATOM 1738 C ILE A 108 20.773 -3.858 8.104 1.00 0.00 C ATOM 1739 O ILE A 108 20.331 -5.005 8.139 1.00 0.00 O ATOM 1740 CB ILE A 108 19.962 -2.305 9.979 1.00 0.00 C ATOM 1741 CG1 ILE A 108 20.395 -1.378 11.138 1.00 0.00 C ATOM 1742 CG2 ILE A 108 18.863 -3.249 10.484 1.00 0.00 C ATOM 1743 CD1 ILE A 108 19.227 -0.687 11.851 1.00 0.00 C ATOM 0 H ILE A 108 22.186 -1.666 8.481 1.00 0.00 H new ATOM 0 HA ILE A 108 21.315 -3.943 10.168 1.00 0.00 H new ATOM 0 HB ILE A 108 19.610 -1.665 9.170 1.00 0.00 H new ATOM 0 HG12 ILE A 108 20.958 -1.962 11.866 1.00 0.00 H new ATOM 0 HG13 ILE A 108 21.071 -0.617 10.748 1.00 0.00 H new ATOM 0 HG21 ILE A 108 18.033 -2.663 10.878 1.00 0.00 H new ATOM 0 HG22 ILE A 108 18.510 -3.870 9.661 1.00 0.00 H new ATOM 0 HG23 ILE A 108 19.264 -3.885 11.273 1.00 0.00 H new ATOM 0 HD11 ILE A 108 19.612 -0.054 12.651 1.00 0.00 H new ATOM 0 HD12 ILE A 108 18.676 -0.074 11.137 1.00 0.00 H new ATOM 0 HD13 ILE A 108 18.561 -1.440 12.273 1.00 0.00 H new ATOM 1755 N VAL A 109 20.981 -3.213 6.952 1.00 0.00 N ATOM 1756 CA VAL A 109 20.652 -3.732 5.633 1.00 0.00 C ATOM 1757 C VAL A 109 21.900 -3.742 4.729 1.00 0.00 C ATOM 1758 O VAL A 109 23.034 -3.824 5.209 1.00 0.00 O ATOM 1759 CB VAL A 109 19.420 -2.963 5.083 1.00 0.00 C ATOM 1760 CG1 VAL A 109 18.702 -3.885 4.094 1.00 0.00 C ATOM 1761 CG2 VAL A 109 18.374 -2.540 6.142 1.00 0.00 C ATOM 0 H VAL A 109 21.398 -2.283 6.918 1.00 0.00 H new ATOM 0 HA VAL A 109 20.352 -4.779 5.676 1.00 0.00 H new ATOM 0 HB VAL A 109 19.812 -2.045 4.646 1.00 0.00 H new ATOM 0 HG11 VAL A 109 17.829 -3.374 3.688 1.00 0.00 H new ATOM 0 HG12 VAL A 109 19.380 -4.146 3.282 1.00 0.00 H new ATOM 0 HG13 VAL A 109 18.385 -4.793 4.607 1.00 0.00 H new ATOM 0 HG21 VAL A 109 17.556 -2.011 5.654 1.00 0.00 H new ATOM 0 HG22 VAL A 109 17.985 -3.426 6.643 1.00 0.00 H new ATOM 0 HG23 VAL A 109 18.844 -1.885 6.876 1.00 0.00 H new ATOM 1771 N LYS A 110 21.684 -3.778 3.415 1.00 0.00 N ATOM 1772 CA LYS A 110 22.633 -3.598 2.331 1.00 0.00 C ATOM 1773 C LYS A 110 22.237 -2.349 1.560 1.00 0.00 C ATOM 1774 O LYS A 110 21.065 -1.960 1.560 1.00 0.00 O ATOM 1775 CB LYS A 110 22.554 -4.815 1.420 1.00 0.00 C ATOM 1776 CG LYS A 110 23.452 -5.937 1.940 1.00 0.00 C ATOM 1777 CD LYS A 110 24.729 -6.059 1.108 1.00 0.00 C ATOM 1778 CE LYS A 110 25.636 -4.810 1.080 1.00 0.00 C ATOM 1779 NZ LYS A 110 26.408 -4.565 2.319 1.00 0.00 N ATOM 0 H LYS A 110 20.746 -3.951 3.054 1.00 0.00 H new ATOM 0 HA LYS A 110 23.650 -3.491 2.709 1.00 0.00 H new ATOM 0 HB2 LYS A 110 21.523 -5.165 1.361 1.00 0.00 H new ATOM 0 HB3 LYS A 110 22.856 -4.539 0.409 1.00 0.00 H new ATOM 0 HG2 LYS A 110 23.711 -5.745 2.981 1.00 0.00 H new ATOM 0 HG3 LYS A 110 22.908 -6.881 1.916 1.00 0.00 H new ATOM 0 HD2 LYS A 110 25.310 -6.898 1.490 1.00 0.00 H new ATOM 0 HD3 LYS A 110 24.450 -6.305 0.083 1.00 0.00 H new ATOM 0 HE2 LYS A 110 26.334 -4.906 0.249 1.00 0.00 H new ATOM 0 HE3 LYS A 110 25.017 -3.936 0.877 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 26.985 -3.708 2.205 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 25.753 -4.438 3.117 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 27.029 -5.378 2.508 1.00 0.00 H new ATOM 1793 N ILE A 111 23.197 -1.791 0.837 1.00 0.00 N ATOM 1794 CA ILE A 111 23.052 -0.580 0.050 1.00 0.00 C ATOM 1795 C ILE A 111 23.879 -0.775 -1.221 1.00 0.00 C ATOM 1796 O ILE A 111 24.838 -1.547 -1.188 1.00 0.00 O ATOM 1797 CB ILE A 111 23.507 0.600 0.939 1.00 0.00 C ATOM 1798 CG1 ILE A 111 22.687 1.874 0.704 1.00 0.00 C ATOM 1799 CG2 ILE A 111 25.005 0.944 0.843 1.00 0.00 C ATOM 1800 CD1 ILE A 111 21.856 2.186 1.943 1.00 0.00 C ATOM 0 H ILE A 111 24.135 -2.187 0.782 1.00 0.00 H new ATOM 0 HA ILE A 111 22.030 -0.363 -0.262 1.00 0.00 H new ATOM 0 HB ILE A 111 23.324 0.229 1.947 1.00 0.00 H new ATOM 0 HG12 ILE A 111 23.351 2.709 0.480 1.00 0.00 H new ATOM 0 HG13 ILE A 111 22.035 1.744 -0.160 1.00 0.00 H new ATOM 0 HG21 ILE A 111 25.228 1.783 1.501 1.00 0.00 H new ATOM 0 HG22 ILE A 111 25.597 0.079 1.144 1.00 0.00 H new ATOM 0 HG23 ILE A 111 25.251 1.213 -0.184 1.00 0.00 H new ATOM 0 HD11 ILE A 111 21.275 3.092 1.772 1.00 0.00 H new ATOM 0 HD12 ILE A 111 21.181 1.355 2.147 1.00 0.00 H new ATOM 0 HD13 ILE A 111 22.517 2.335 2.797 1.00 0.00 H new ATOM 1812 N TYR A 112 23.537 -0.102 -2.320 1.00 0.00 N ATOM 1813 CA TYR A 112 24.126 -0.333 -3.630 1.00 0.00 C ATOM 1814 C TYR A 112 24.266 0.944 -4.444 1.00 0.00 C ATOM 1815 O TYR A 112 23.660 1.966 -4.137 1.00 0.00 O ATOM 1816 CB TYR A 112 23.223 -1.312 -4.382 1.00 0.00 C ATOM 1817 CG TYR A 112 23.355 -2.712 -3.844 1.00 0.00 C ATOM 1818 CD1 TYR A 112 24.460 -3.455 -4.274 1.00 0.00 C ATOM 1819 CD2 TYR A 112 22.453 -3.256 -2.906 1.00 0.00 C ATOM 1820 CE1 TYR A 112 24.652 -4.770 -3.843 1.00 0.00 C ATOM 1821 CE2 TYR A 112 22.635 -4.602 -2.508 1.00 0.00 C ATOM 1822 CZ TYR A 112 23.732 -5.362 -2.964 1.00 0.00 C ATOM 1823 OH TYR A 112 23.908 -6.645 -2.541 1.00 0.00 O ATOM 0 H TYR A 112 22.829 0.632 -2.320 1.00 0.00 H new ATOM 0 HA TYR A 112 25.131 -0.732 -3.489 1.00 0.00 H new ATOM 0 HB2 TYR A 112 22.186 -0.987 -4.301 1.00 0.00 H new ATOM 0 HB3 TYR A 112 23.478 -1.303 -5.442 1.00 0.00 H new ATOM 0 HD1 TYR A 112 25.174 -3.006 -4.948 1.00 0.00 H new ATOM 0 HD2 TYR A 112 21.646 -2.662 -2.503 1.00 0.00 H new ATOM 0 HE1 TYR A 112 25.509 -5.331 -4.186 1.00 0.00 H new ATOM 0 HE2 TYR A 112 21.918 -5.057 -1.841 1.00 0.00 H new ATOM 0 HH TYR A 112 23.178 -6.893 -1.936 1.00 0.00 H new ATOM 1833 N ASP A 113 25.019 0.868 -5.538 1.00 0.00 N ATOM 1834 CA ASP A 113 25.288 2.019 -6.387 1.00 0.00 C ATOM 1835 C ASP A 113 24.232 2.152 -7.473 1.00 0.00 C ATOM 1836 O ASP A 113 23.662 3.228 -7.660 1.00 0.00 O ATOM 1837 CB ASP A 113 26.677 1.889 -7.022 1.00 0.00 C ATOM 1838 CG ASP A 113 27.604 2.945 -6.452 1.00 0.00 C ATOM 1839 OD1 ASP A 113 27.322 4.141 -6.707 1.00 0.00 O ATOM 1840 OD2 ASP A 113 28.576 2.544 -5.777 1.00 0.00 O ATOM 0 H ASP A 113 25.459 0.005 -5.859 1.00 0.00 H new ATOM 0 HA ASP A 113 25.257 2.915 -5.767 1.00 0.00 H new ATOM 0 HB2 ASP A 113 27.082 0.895 -6.831 1.00 0.00 H new ATOM 0 HB3 ASP A 113 26.604 2.002 -8.104 1.00 0.00 H new ATOM 1845 N THR A 114 23.968 1.065 -8.192 1.00 0.00 N ATOM 1846 CA THR A 114 23.040 1.012 -9.312 1.00 0.00 C ATOM 1847 C THR A 114 22.111 -0.175 -9.092 1.00 0.00 C ATOM 1848 O THR A 114 22.296 -0.946 -8.147 1.00 0.00 O ATOM 1849 CB THR A 114 23.823 0.919 -10.637 1.00 0.00 C ATOM 1850 OG1 THR A 114 24.565 -0.279 -10.727 1.00 0.00 O ATOM 1851 CG2 THR A 114 24.766 2.099 -10.857 1.00 0.00 C ATOM 0 H THR A 114 24.411 0.166 -8.002 1.00 0.00 H new ATOM 0 HA THR A 114 22.436 1.917 -9.374 1.00 0.00 H new ATOM 0 HB THR A 114 23.062 0.937 -11.417 1.00 0.00 H new ATOM 0 HG1 THR A 114 25.516 -0.086 -10.591 1.00 0.00 H new ATOM 0 HG21 THR A 114 25.288 1.976 -11.806 1.00 0.00 H new ATOM 0 HG22 THR A 114 24.192 3.025 -10.877 1.00 0.00 H new ATOM 0 HG23 THR A 114 25.493 2.140 -10.046 1.00 0.00 H new ATOM 1859 N ILE A 115 21.120 -0.344 -9.967 1.00 0.00 N ATOM 1860 CA ILE A 115 20.321 -1.550 -9.958 1.00 0.00 C ATOM 1861 C ILE A 115 21.177 -2.718 -10.398 1.00 0.00 C ATOM 1862 O ILE A 115 21.057 -3.773 -9.788 1.00 0.00 O ATOM 1863 CB ILE A 115 19.053 -1.354 -10.811 1.00 0.00 C ATOM 1864 CG1 ILE A 115 17.993 -0.594 -9.995 1.00 0.00 C ATOM 1865 CG2 ILE A 115 18.465 -2.676 -11.341 1.00 0.00 C ATOM 1866 CD1 ILE A 115 17.579 -1.295 -8.701 1.00 0.00 C ATOM 0 H ILE A 115 20.860 0.336 -10.681 1.00 0.00 H new ATOM 0 HA ILE A 115 19.972 -1.774 -8.950 1.00 0.00 H new ATOM 0 HB ILE A 115 19.346 -0.773 -11.686 1.00 0.00 H new ATOM 0 HG12 ILE A 115 18.379 0.396 -9.752 1.00 0.00 H new ATOM 0 HG13 ILE A 115 17.109 -0.448 -10.615 1.00 0.00 H new ATOM 0 HG21 ILE A 115 17.574 -2.466 -11.933 1.00 0.00 H new ATOM 0 HG22 ILE A 115 19.205 -3.179 -11.964 1.00 0.00 H new ATOM 0 HG23 ILE A 115 18.200 -3.319 -10.502 1.00 0.00 H new ATOM 0 HD11 ILE A 115 16.829 -0.694 -8.186 1.00 0.00 H new ATOM 0 HD12 ILE A 115 17.161 -2.274 -8.935 1.00 0.00 H new ATOM 0 HD13 ILE A 115 18.451 -1.417 -8.058 1.00 0.00 H new ATOM 1878 N SER A 116 22.027 -2.578 -11.414 1.00 0.00 N ATOM 1879 CA SER A 116 22.776 -3.714 -11.918 1.00 0.00 C ATOM 1880 C SER A 116 23.779 -4.173 -10.858 1.00 0.00 C ATOM 1881 O SER A 116 23.919 -5.374 -10.647 1.00 0.00 O ATOM 1882 CB SER A 116 23.404 -3.326 -13.262 1.00 0.00 C ATOM 1883 OG SER A 116 24.242 -4.317 -13.822 1.00 0.00 O ATOM 0 H SER A 116 22.209 -1.698 -11.896 1.00 0.00 H new ATOM 0 HA SER A 116 22.134 -4.574 -12.109 1.00 0.00 H new ATOM 0 HB2 SER A 116 22.607 -3.099 -13.970 1.00 0.00 H new ATOM 0 HB3 SER A 116 23.982 -2.411 -13.129 1.00 0.00 H new ATOM 0 HG SER A 116 24.602 -3.997 -14.675 1.00 0.00 H new ATOM 1889 N GLU A 117 24.365 -3.244 -10.090 1.00 0.00 N ATOM 1890 CA GLU A 117 25.236 -3.592 -8.977 1.00 0.00 C ATOM 1891 C GLU A 117 24.487 -4.241 -7.823 1.00 0.00 C ATOM 1892 O GLU A 117 25.149 -4.656 -6.880 1.00 0.00 O ATOM 1893 CB GLU A 117 25.992 -2.351 -8.474 1.00 0.00 C ATOM 1894 CG GLU A 117 27.403 -2.292 -9.073 1.00 0.00 C ATOM 1895 CD GLU A 117 27.807 -0.865 -9.425 1.00 0.00 C ATOM 1896 OE1 GLU A 117 27.251 -0.364 -10.432 1.00 0.00 O ATOM 1897 OE2 GLU A 117 28.694 -0.280 -8.764 1.00 0.00 O ATOM 0 H GLU A 117 24.245 -2.240 -10.227 1.00 0.00 H new ATOM 0 HA GLU A 117 25.946 -4.326 -9.358 1.00 0.00 H new ATOM 0 HB2 GLU A 117 25.440 -1.450 -8.742 1.00 0.00 H new ATOM 0 HB3 GLU A 117 26.055 -2.374 -7.386 1.00 0.00 H new ATOM 0 HG2 GLU A 117 28.118 -2.708 -8.363 1.00 0.00 H new ATOM 0 HG3 GLU A 117 27.445 -2.913 -9.968 1.00 0.00 H new ATOM 1904 N ALA A 118 23.154 -4.309 -7.863 1.00 0.00 N ATOM 1905 CA ALA A 118 22.340 -4.894 -6.818 1.00 0.00 C ATOM 1906 C ALA A 118 21.713 -6.193 -7.318 1.00 0.00 C ATOM 1907 O ALA A 118 21.652 -7.167 -6.581 1.00 0.00 O ATOM 1908 CB ALA A 118 21.290 -3.893 -6.364 1.00 0.00 C ATOM 0 H ALA A 118 22.607 -3.948 -8.645 1.00 0.00 H new ATOM 0 HA ALA A 118 22.960 -5.137 -5.955 1.00 0.00 H new ATOM 0 HB1 ALA A 118 20.680 -4.337 -5.578 1.00 0.00 H new ATOM 0 HB2 ALA A 118 21.781 -2.999 -5.980 1.00 0.00 H new ATOM 0 HB3 ALA A 118 20.655 -3.624 -7.208 1.00 0.00 H new ATOM 1914 N MET A 119 21.241 -6.226 -8.563 1.00 0.00 N ATOM 1915 CA MET A 119 20.324 -7.214 -9.095 1.00 0.00 C ATOM 1916 C MET A 119 20.893 -8.622 -9.009 1.00 0.00 C ATOM 1917 O MET A 119 20.244 -9.529 -8.484 1.00 0.00 O ATOM 1918 CB MET A 119 19.969 -6.857 -10.552 1.00 0.00 C ATOM 1919 CG MET A 119 18.520 -7.248 -10.832 1.00 0.00 C ATOM 1920 SD MET A 119 18.190 -8.010 -12.443 1.00 0.00 S ATOM 1921 CE MET A 119 18.647 -9.722 -12.064 1.00 0.00 C ATOM 0 H MET A 119 21.505 -5.527 -9.257 1.00 0.00 H new ATOM 0 HA MET A 119 19.419 -7.200 -8.487 1.00 0.00 H new ATOM 0 HB2 MET A 119 20.108 -5.789 -10.720 1.00 0.00 H new ATOM 0 HB3 MET A 119 20.637 -7.378 -11.238 1.00 0.00 H new ATOM 0 HG2 MET A 119 18.196 -7.939 -10.054 1.00 0.00 H new ATOM 0 HG3 MET A 119 17.901 -6.355 -10.743 1.00 0.00 H new ATOM 0 HE1 MET A 119 18.506 -10.341 -12.950 1.00 0.00 H new ATOM 0 HE2 MET A 119 19.692 -9.760 -11.758 1.00 0.00 H new ATOM 0 HE3 MET A 119 18.018 -10.096 -11.256 1.00 0.00 H new ATOM 1931 N GLU A 120 22.089 -8.796 -9.556 1.00 0.00 N ATOM 1932 CA GLU A 120 22.854 -10.027 -9.518 1.00 0.00 C ATOM 1933 C GLU A 120 23.663 -10.133 -8.234 1.00 0.00 C ATOM 1934 O GLU A 120 24.140 -11.210 -7.899 1.00 0.00 O ATOM 1935 CB GLU A 120 23.777 -10.074 -10.740 1.00 0.00 C ATOM 1936 CG GLU A 120 24.648 -8.822 -10.910 1.00 0.00 C ATOM 1937 CD GLU A 120 25.658 -9.089 -12.026 1.00 0.00 C ATOM 1938 OE1 GLU A 120 26.622 -9.863 -11.784 1.00 0.00 O ATOM 1939 OE2 GLU A 120 25.491 -8.547 -13.145 1.00 0.00 O ATOM 0 H GLU A 120 22.569 -8.049 -10.058 1.00 0.00 H new ATOM 0 HA GLU A 120 22.168 -10.874 -9.541 1.00 0.00 H new ATOM 0 HB2 GLU A 120 24.425 -10.947 -10.660 1.00 0.00 H new ATOM 0 HB3 GLU A 120 23.171 -10.207 -11.636 1.00 0.00 H new ATOM 0 HG2 GLU A 120 24.029 -7.959 -11.156 1.00 0.00 H new ATOM 0 HG3 GLU A 120 25.164 -8.589 -9.979 1.00 0.00 H new ATOM 1946 N GLU A 121 23.802 -9.043 -7.485 1.00 0.00 N ATOM 1947 CA GLU A 121 24.740 -8.996 -6.384 1.00 0.00 C ATOM 1948 C GLU A 121 24.042 -9.517 -5.131 1.00 0.00 C ATOM 1949 O GLU A 121 24.505 -10.474 -4.530 1.00 0.00 O ATOM 1950 CB GLU A 121 25.282 -7.568 -6.251 1.00 0.00 C ATOM 1951 CG GLU A 121 26.670 -7.508 -5.593 1.00 0.00 C ATOM 1952 CD GLU A 121 27.815 -7.815 -6.559 1.00 0.00 C ATOM 1953 OE1 GLU A 121 27.732 -8.829 -7.287 1.00 0.00 O ATOM 1954 OE2 GLU A 121 28.827 -7.083 -6.530 1.00 0.00 O ATOM 0 H GLU A 121 23.273 -8.182 -7.626 1.00 0.00 H new ATOM 0 HA GLU A 121 25.605 -9.637 -6.553 1.00 0.00 H new ATOM 0 HB2 GLU A 121 25.335 -7.113 -7.240 1.00 0.00 H new ATOM 0 HB3 GLU A 121 24.582 -6.973 -5.664 1.00 0.00 H new ATOM 0 HG2 GLU A 121 26.820 -6.515 -5.168 1.00 0.00 H new ATOM 0 HG3 GLU A 121 26.703 -8.217 -4.766 1.00 0.00 H new ATOM 1961 N VAL A 122 22.869 -8.979 -4.785 1.00 0.00 N ATOM 1962 CA VAL A 122 21.995 -9.354 -3.663 1.00 0.00 C ATOM 1963 C VAL A 122 21.704 -10.860 -3.595 1.00 0.00 C ATOM 1964 O VAL A 122 21.448 -11.407 -2.521 1.00 0.00 O ATOM 1965 CB VAL A 122 20.731 -8.479 -3.774 1.00 0.00 C ATOM 1966 CG1 VAL A 122 19.595 -9.062 -4.635 1.00 0.00 C ATOM 1967 CG2 VAL A 122 20.299 -8.054 -2.368 1.00 0.00 C ATOM 0 H VAL A 122 22.472 -8.209 -5.323 1.00 0.00 H new ATOM 0 HA VAL A 122 22.494 -9.164 -2.713 1.00 0.00 H new ATOM 0 HB VAL A 122 20.996 -7.591 -4.347 1.00 0.00 H new ATOM 0 HG11 VAL A 122 18.754 -8.368 -4.647 1.00 0.00 H new ATOM 0 HG12 VAL A 122 19.952 -9.216 -5.653 1.00 0.00 H new ATOM 0 HG13 VAL A 122 19.273 -10.015 -4.216 1.00 0.00 H new ATOM 0 HG21 VAL A 122 19.405 -7.434 -2.434 1.00 0.00 H new ATOM 0 HG22 VAL A 122 20.083 -8.940 -1.770 1.00 0.00 H new ATOM 0 HG23 VAL A 122 21.101 -7.485 -1.897 1.00 0.00 H new ATOM 1977 N ARG A 123 21.784 -11.540 -4.736 1.00 0.00 N ATOM 1978 CA ARG A 123 21.652 -12.980 -4.902 1.00 0.00 C ATOM 1979 C ARG A 123 22.680 -13.731 -4.072 1.00 0.00 C ATOM 1980 O ARG A 123 22.386 -14.786 -3.506 1.00 0.00 O ATOM 1981 CB ARG A 123 21.887 -13.273 -6.389 1.00 0.00 C ATOM 1982 CG ARG A 123 20.819 -12.652 -7.306 1.00 0.00 C ATOM 1983 CD ARG A 123 19.855 -13.690 -7.862 1.00 0.00 C ATOM 1984 NE ARG A 123 19.384 -14.589 -6.800 1.00 0.00 N ATOM 1985 CZ ARG A 123 18.328 -15.399 -6.876 1.00 0.00 C ATOM 1986 NH1 ARG A 123 17.504 -15.326 -7.908 1.00 0.00 N ATOM 1987 NH2 ARG A 123 18.102 -16.289 -5.927 1.00 0.00 N ATOM 0 H ARG A 123 21.954 -11.067 -5.624 1.00 0.00 H new ATOM 0 HA ARG A 123 20.666 -13.306 -4.571 1.00 0.00 H new ATOM 0 HB2 ARG A 123 22.868 -12.894 -6.677 1.00 0.00 H new ATOM 0 HB3 ARG A 123 21.904 -14.352 -6.542 1.00 0.00 H new ATOM 0 HG2 ARG A 123 20.258 -11.901 -6.749 1.00 0.00 H new ATOM 0 HG3 ARG A 123 21.309 -12.136 -8.132 1.00 0.00 H new ATOM 0 HD2 ARG A 123 19.004 -13.191 -8.325 1.00 0.00 H new ATOM 0 HD3 ARG A 123 20.348 -14.269 -8.642 1.00 0.00 H new ATOM 0 HE ARG A 123 19.912 -14.594 -5.927 1.00 0.00 H new ATOM 0 HH11 ARG A 123 17.675 -14.648 -8.650 1.00 0.00 H new ATOM 0 HH12 ARG A 123 16.697 -15.948 -7.962 1.00 0.00 H new ATOM 0 HH21 ARG A 123 18.737 -16.359 -5.132 1.00 0.00 H new ATOM 0 HH22 ARG A 123 17.293 -16.907 -5.989 1.00 0.00 H new ATOM 2001 N ARG A 124 23.904 -13.219 -4.065 1.00 0.00 N ATOM 2002 CA ARG A 124 25.108 -13.831 -3.531 1.00 0.00 C ATOM 2003 C ARG A 124 26.059 -12.684 -3.197 1.00 0.00 C ATOM 2004 O ARG A 124 27.147 -12.564 -3.764 1.00 0.00 O ATOM 2005 CB ARG A 124 25.682 -14.893 -4.508 1.00 0.00 C ATOM 2006 CG ARG A 124 25.285 -14.824 -5.993 1.00 0.00 C ATOM 2007 CD ARG A 124 25.720 -13.547 -6.711 1.00 0.00 C ATOM 2008 NE ARG A 124 27.151 -13.515 -7.037 1.00 0.00 N ATOM 2009 CZ ARG A 124 27.812 -12.373 -7.207 1.00 0.00 C ATOM 2010 NH1 ARG A 124 27.611 -11.372 -6.362 1.00 0.00 N ATOM 2011 NH2 ARG A 124 28.644 -12.235 -8.229 1.00 0.00 N ATOM 0 H ARG A 124 24.092 -12.298 -4.462 1.00 0.00 H new ATOM 0 HA ARG A 124 24.917 -14.402 -2.622 1.00 0.00 H new ATOM 0 HB2 ARG A 124 26.769 -14.838 -4.454 1.00 0.00 H new ATOM 0 HB3 ARG A 124 25.394 -15.876 -4.134 1.00 0.00 H new ATOM 0 HG2 ARG A 124 25.716 -15.681 -6.511 1.00 0.00 H new ATOM 0 HG3 ARG A 124 24.202 -14.917 -6.070 1.00 0.00 H new ATOM 0 HD2 ARG A 124 25.144 -13.443 -7.630 1.00 0.00 H new ATOM 0 HD3 ARG A 124 25.479 -12.688 -6.085 1.00 0.00 H new ATOM 0 HE ARG A 124 27.655 -14.396 -7.136 1.00 0.00 H new ATOM 0 HH11 ARG A 124 26.954 -11.481 -5.589 1.00 0.00 H new ATOM 0 HH12 ARG A 124 28.113 -10.493 -6.484 1.00 0.00 H new ATOM 0 HH21 ARG A 124 28.778 -13.004 -8.885 1.00 0.00 H new ATOM 0 HH22 ARG A 124 29.151 -11.359 -8.359 1.00 0.00 H new ATOM 2025 N LYS A 125 25.580 -11.753 -2.368 1.00 0.00 N ATOM 2026 CA LYS A 125 26.431 -10.725 -1.802 1.00 0.00 C ATOM 2027 C LYS A 125 27.446 -11.429 -0.929 1.00 0.00 C ATOM 2028 O LYS A 125 27.084 -12.417 -0.257 1.00 0.00 O ATOM 2029 CB LYS A 125 25.585 -9.641 -1.111 1.00 0.00 C ATOM 2030 CG LYS A 125 25.057 -10.008 0.279 1.00 0.00 C ATOM 2031 CD LYS A 125 25.953 -9.572 1.460 1.00 0.00 C ATOM 2032 CE LYS A 125 26.713 -10.700 2.174 1.00 0.00 C ATOM 2033 NZ LYS A 125 28.170 -10.660 1.929 1.00 0.00 N ATOM 0 H LYS A 125 24.604 -11.697 -2.078 1.00 0.00 H new ATOM 0 HA LYS A 125 26.984 -10.167 -2.557 1.00 0.00 H new ATOM 0 HB2 LYS A 125 26.185 -8.735 -1.026 1.00 0.00 H new ATOM 0 HB3 LYS A 125 24.737 -9.402 -1.752 1.00 0.00 H new ATOM 0 HG2 LYS A 125 24.072 -9.559 0.406 1.00 0.00 H new ATOM 0 HG3 LYS A 125 24.923 -11.089 0.325 1.00 0.00 H new ATOM 0 HD2 LYS A 125 26.679 -8.846 1.092 1.00 0.00 H new ATOM 0 HD3 LYS A 125 25.331 -9.058 2.193 1.00 0.00 H new ATOM 0 HE2 LYS A 125 26.528 -10.633 3.246 1.00 0.00 H new ATOM 0 HE3 LYS A 125 26.321 -11.661 1.843 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 28.510 -11.616 1.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 28.371 -10.020 1.134 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 28.656 -10.316 2.782 1.00 0.00 H new TER 2047 LYS A 125