USER MOD reduce.3.24.130724 H: found=0, std=0, add=970, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 970 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: 1 87 ASN : amide:sc= -7.05! C(o=-6.8!,f=-13!) USER MOD Set 1.2: 1 109 THR OG1 : rot 162:sc= 0.596 USER MOD Set 1.3: 1 110 THR OG1 : rot 180:sc= -0.331 USER MOD Set 2.1: 1 49 THR OG1 : rot -149:sc= -3.55! USER MOD Set 2.2: 1 53 ASN : amide:sc= -6.46! C(o=-9.8!,f=-8.4!) USER MOD Set 2.3: 1 98 SER OG : rot -77:sc= 0.218 USER MOD Single : 1 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : 1 1 MET N :NH3+ 151:sc= -0.203 (180deg=-1.09) USER MOD Single : 1 4 SER OG : rot 180:sc= 0 USER MOD Single : 1 5 HIS : no HD1:sc= -0.0293 X(o=-0.029,f=-0.14) USER MOD Single : 1 6 HIS : no HD1:sc= -0.73 K(o=-0.73,f=-0.13) USER MOD Single : 1 7 HIS : no HD1:sc= -0.126 K(o=-0.13,f=-0.63) USER MOD Single : 1 8 HIS : no HD1:sc= -0.451 K(o=-0.45,f=-1.1!) USER MOD Single : 1 9 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : 1 10 HIS : no HD1:sc= -0.063 X(o=-0.063,f=-0.28) USER MOD Single : 1 12 SER OG : rot 180:sc= 0 USER MOD Single : 1 15 THR OG1 : rot 180:sc= 0 USER MOD Single : 1 16 THR OG1 : rot 180:sc= 0 USER MOD Single : 1 18 THR OG1 : rot -8:sc= 0.672 USER MOD Single : 1 19 THR OG1 : rot 180:sc= 0 USER MOD Single : 1 20 ASN : amide:sc= -0.314 X(o=-0.31,f=-0.1) USER MOD Single : 1 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : 1 24 TYR OH : rot 144:sc= -7.14! USER MOD Single : 1 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : 1 30 GLN : amide:sc= -13.6! C(o=-14!,f=-7.3!) USER MOD Single : 1 31 LYS NZ :NH3+ 151:sc= 0.274 (180deg=-1.02) USER MOD Single : 1 33 ASN : amide:sc= -0.935 K(o=-0.93,f=-0.013) USER MOD Single : 1 37 GLN : amide:sc= -18.5! C(o=-18!,f=-21!) USER MOD Single : 1 40 ASN : amide:sc= -7.08! C(o=-7.1!,f=-10!) USER MOD Single : 1 41 ASN : amide:sc= -15.8! C(o=-16!,f=-6.2!) USER MOD Single : 1 46 THR OG1 : rot -88:sc= 1.24 USER MOD Single : 1 64 THR OG1 : rot 180:sc= -1.4! USER MOD Single : 1 65 SER OG : rot 180:sc= 0.0836 USER MOD Single : 1 66 ASN : amide:sc= -0.0784 X(o=-0.078,f=-0.45) USER MOD Single : 1 68 THR OG1 : rot 180:sc= 0 USER MOD Single : 1 70 THR OG1 : rot -13:sc= 0.99 USER MOD Single : 1 71 SER OG : rot 180:sc= 0 USER MOD Single : 1 73 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : 1 76 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : 1 77 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.138) USER MOD Single : 1 80 TYR OH : rot 180:sc= 0 USER MOD Single : 1 84 ASN : amide:sc= -4.03 K(o=-4,f=-3.1) USER MOD Single : 1 86 ASN : amide:sc= -0.167 X(o=-0.17,f=0) USER MOD Single : 1 89 LYS NZ :NH3+ 145:sc= -1.28 (180deg=-3.07!) USER MOD Single : 1 90 SER OG : rot 180:sc= 0 USER MOD Single : 1 93 THR OG1 : rot 180:sc= 0.11 USER MOD Single : 1 95 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : 1 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : 1 102 SER OG : rot 180:sc= 0 USER MOD Single : 1 105 GLN : amide:sc= -3! C(o=-3!,f=-3.1!) USER MOD Single : 1 107 ASN : amide:sc= -0.301 K(o=-0.3,f=-3.6!) USER MOD Single : 1 113 ASN : amide:sc= -1.96 X(o=-2,f=-1.9) USER MOD Single : 1 117 ASN : amide:sc= -14.3! C(o=-14!,f=-20!) USER MOD Single : 1 118 THR OG1 : rot -46:sc= -0.0931 USER MOD Single : 1 119 THR OG1 : rot -47:sc= 0.332 USER MOD Single : 1 120 SER OG : rot -119:sc= -1.52 USER MOD Single : 1 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : 1 123 ASN : amide:sc= -20.9! C(o=-21!,f=-21!) USER MOD Single : 1 126 TYR OH : rot 180:sc= -2.2! USER MOD Single : 1 128 LYS NZ :NH3+ 169:sc= 0.0445 (180deg=0.0262) USER MOD ----------------------------------------------------------------- ATOM 1 N MET 1 1 26.729 5.000 -31.893 1.00 0.00 N ATOM 2 CA MET 1 1 26.879 5.285 -30.439 1.00 0.00 C ATOM 3 C MET 1 1 28.283 5.787 -30.113 1.00 0.00 C ATOM 4 O MET 1 1 28.819 5.506 -29.042 1.00 0.00 O ATOM 5 CB MET 1 1 26.586 4.005 -29.654 1.00 0.00 C ATOM 6 CG MET 1 1 27.516 2.853 -29.999 1.00 0.00 C ATOM 7 SD MET 1 1 26.735 1.242 -29.788 1.00 0.00 S ATOM 8 CE MET 1 1 26.947 0.992 -28.028 1.00 0.00 C ATOM 0 H1 MET 1 1 26.024 4.248 -32.028 1.00 0.00 H new ATOM 0 H2 MET 1 1 26.415 5.861 -32.385 1.00 0.00 H new ATOM 0 H3 MET 1 1 27.643 4.692 -32.283 1.00 0.00 H new ATOM 0 HA MET 1 1 26.175 6.069 -30.159 1.00 0.00 H new ATOM 0 HB2 MET 1 1 26.664 4.217 -28.588 1.00 0.00 H new ATOM 0 HB3 MET 1 1 25.557 3.700 -29.844 1.00 0.00 H new ATOM 0 HG2 MET 1 1 27.850 2.958 -31.031 1.00 0.00 H new ATOM 0 HG3 MET 1 1 28.404 2.907 -29.369 1.00 0.00 H new ATOM 0 HE1 MET 1 1 26.513 0.034 -27.742 1.00 0.00 H new ATOM 0 HE2 MET 1 1 28.010 0.997 -27.785 1.00 0.00 H new ATOM 0 HE3 MET 1 1 26.447 1.793 -27.484 1.00 0.00 H new ATOM 20 N ARG 1 2 28.874 6.529 -31.045 1.00 0.00 N ATOM 21 CA ARG 1 2 30.216 7.066 -30.852 1.00 0.00 C ATOM 22 C ARG 1 2 30.197 8.243 -29.881 1.00 0.00 C ATOM 23 O ARG 1 2 29.326 9.110 -29.955 1.00 0.00 O ATOM 24 CB ARG 1 2 30.812 7.502 -32.193 1.00 0.00 C ATOM 25 CG ARG 1 2 32.250 7.048 -32.394 1.00 0.00 C ATOM 26 CD ARG 1 2 32.978 7.934 -33.392 1.00 0.00 C ATOM 27 NE ARG 1 2 34.347 7.482 -33.629 1.00 0.00 N ATOM 28 CZ ARG 1 2 35.330 7.600 -32.741 1.00 0.00 C ATOM 29 NH1 ARG 1 2 35.102 8.155 -31.556 1.00 0.00 N ATOM 30 NH2 ARG 1 2 36.547 7.162 -33.036 1.00 0.00 N ATOM 0 H ARG 1 2 28.446 6.771 -31.939 1.00 0.00 H new ATOM 0 HA ARG 1 2 30.838 6.279 -30.426 1.00 0.00 H new ATOM 0 HB2 ARG 1 2 30.198 7.105 -33.001 1.00 0.00 H new ATOM 0 HB3 ARG 1 2 30.769 8.589 -32.265 1.00 0.00 H new ATOM 0 HG2 ARG 1 2 32.775 7.065 -31.439 1.00 0.00 H new ATOM 0 HG3 ARG 1 2 32.261 6.016 -32.745 1.00 0.00 H new ATOM 0 HD2 ARG 1 2 32.431 7.943 -34.335 1.00 0.00 H new ATOM 0 HD3 ARG 1 2 32.994 8.959 -33.022 1.00 0.00 H new ATOM 0 HE ARG 1 2 34.561 7.051 -34.528 1.00 0.00 H new ATOM 0 HH11 ARG 1 2 34.169 8.494 -31.323 1.00 0.00 H new ATOM 0 HH12 ARG 1 2 35.860 8.242 -30.879 1.00 0.00 H new ATOM 0 HH21 ARG 1 2 36.729 6.735 -33.944 1.00 0.00 H new ATOM 0 HH22 ARG 1 2 37.301 7.253 -32.355 1.00 0.00 H new ATOM 44 N GLY 1 3 31.165 8.267 -28.970 1.00 0.00 N ATOM 45 CA GLY 1 3 31.244 9.341 -27.997 1.00 0.00 C ATOM 46 C GLY 1 3 31.754 8.869 -26.649 1.00 0.00 C ATOM 47 O GLY 1 3 32.937 8.563 -26.498 1.00 0.00 O ATOM 0 H GLY 1 3 31.897 7.561 -28.888 1.00 0.00 H new ATOM 0 HA2 GLY 1 3 31.902 10.123 -28.377 1.00 0.00 H new ATOM 0 HA3 GLY 1 3 30.257 9.787 -27.872 1.00 0.00 H new ATOM 51 N SER 1 4 30.859 8.807 -25.668 1.00 0.00 N ATOM 52 CA SER 1 4 31.222 8.368 -24.326 1.00 0.00 C ATOM 53 C SER 1 4 32.298 9.268 -23.726 1.00 0.00 C ATOM 54 O SER 1 4 33.481 9.131 -24.038 1.00 0.00 O ATOM 55 CB SER 1 4 31.711 6.918 -24.355 1.00 0.00 C ATOM 56 OG SER 1 4 30.970 6.149 -25.286 1.00 0.00 O ATOM 0 H SER 1 4 29.876 9.056 -25.778 1.00 0.00 H new ATOM 0 HA SER 1 4 30.332 8.433 -23.700 1.00 0.00 H new ATOM 0 HB2 SER 1 4 32.769 6.893 -24.618 1.00 0.00 H new ATOM 0 HB3 SER 1 4 31.619 6.480 -23.361 1.00 0.00 H new ATOM 0 HG SER 1 4 31.303 5.227 -25.287 1.00 0.00 H new ATOM 62 N HIS 1 5 31.878 10.188 -22.864 1.00 0.00 N ATOM 63 CA HIS 1 5 32.805 11.111 -22.219 1.00 0.00 C ATOM 64 C HIS 1 5 33.371 10.507 -20.938 1.00 0.00 C ATOM 65 O HIS 1 5 33.082 9.360 -20.600 1.00 0.00 O ATOM 66 CB HIS 1 5 32.102 12.434 -21.903 1.00 0.00 C ATOM 67 CG HIS 1 5 31.718 13.212 -23.122 1.00 0.00 C ATOM 68 ND1 HIS 1 5 32.455 13.198 -24.288 1.00 0.00 N ATOM 69 CD2 HIS 1 5 30.666 14.033 -23.355 1.00 0.00 C ATOM 70 CE1 HIS 1 5 31.874 13.976 -25.183 1.00 0.00 C ATOM 71 NE2 HIS 1 5 30.787 14.493 -24.643 1.00 0.00 N ATOM 0 H HIS 1 5 30.902 10.314 -22.596 1.00 0.00 H new ATOM 0 HA HIS 1 5 33.629 11.299 -22.907 1.00 0.00 H new ATOM 0 HB2 HIS 1 5 31.207 12.229 -21.315 1.00 0.00 H new ATOM 0 HB3 HIS 1 5 32.757 13.046 -21.283 1.00 0.00 H new ATOM 0 HD2 HIS 1 5 29.879 14.280 -22.658 1.00 0.00 H new ATOM 0 HE1 HIS 1 5 32.229 14.158 -26.187 1.00 0.00 H new ATOM 0 HE2 HIS 1 5 30.141 15.131 -25.107 1.00 0.00 H new ATOM 80 N HIS 1 6 34.177 11.289 -20.228 1.00 0.00 N ATOM 81 CA HIS 1 6 34.782 10.833 -18.983 1.00 0.00 C ATOM 82 C HIS 1 6 35.248 12.017 -18.141 1.00 0.00 C ATOM 83 O HIS 1 6 36.186 12.723 -18.509 1.00 0.00 O ATOM 84 CB HIS 1 6 35.959 9.899 -19.274 1.00 0.00 C ATOM 85 CG HIS 1 6 35.631 8.450 -19.087 1.00 0.00 C ATOM 86 ND1 HIS 1 6 35.776 7.793 -17.883 1.00 0.00 N ATOM 87 CD2 HIS 1 6 35.159 7.529 -19.961 1.00 0.00 C ATOM 88 CE1 HIS 1 6 35.410 6.532 -18.024 1.00 0.00 C ATOM 89 NE2 HIS 1 6 35.030 6.347 -19.274 1.00 0.00 N ATOM 0 H HIS 1 6 34.426 12.242 -20.494 1.00 0.00 H new ATOM 0 HA HIS 1 6 34.027 10.285 -18.419 1.00 0.00 H new ATOM 0 HB2 HIS 1 6 36.294 10.058 -20.299 1.00 0.00 H new ATOM 0 HB3 HIS 1 6 36.792 10.162 -18.622 1.00 0.00 H new ATOM 0 HD2 HIS 1 6 34.927 7.693 -21.003 1.00 0.00 H new ATOM 0 HE1 HIS 1 6 35.420 5.780 -17.249 1.00 0.00 H new ATOM 0 HE2 HIS 1 6 34.694 5.468 -19.667 1.00 0.00 H new ATOM 98 N HIS 1 7 34.586 12.224 -17.008 1.00 0.00 N ATOM 99 CA HIS 1 7 34.930 13.321 -16.111 1.00 0.00 C ATOM 100 C HIS 1 7 34.915 12.852 -14.660 1.00 0.00 C ATOM 101 O HIS 1 7 33.867 12.489 -14.126 1.00 0.00 O ATOM 102 CB HIS 1 7 33.954 14.485 -16.294 1.00 0.00 C ATOM 103 CG HIS 1 7 33.741 14.867 -17.726 1.00 0.00 C ATOM 104 ND1 HIS 1 7 34.764 15.276 -18.556 1.00 0.00 N ATOM 105 CD2 HIS 1 7 32.614 14.903 -18.476 1.00 0.00 C ATOM 106 CE1 HIS 1 7 34.274 15.548 -19.753 1.00 0.00 C ATOM 107 NE2 HIS 1 7 32.972 15.328 -19.730 1.00 0.00 N ATOM 0 H HIS 1 7 33.808 11.647 -16.689 1.00 0.00 H new ATOM 0 HA HIS 1 7 35.936 13.661 -16.358 1.00 0.00 H new ATOM 0 HB2 HIS 1 7 32.995 14.217 -15.851 1.00 0.00 H new ATOM 0 HB3 HIS 1 7 34.327 15.351 -15.747 1.00 0.00 H new ATOM 0 HD2 HIS 1 7 31.618 14.645 -18.148 1.00 0.00 H new ATOM 0 HE1 HIS 1 7 34.842 15.892 -20.605 1.00 0.00 H new ATOM 0 HE2 HIS 1 7 32.336 15.454 -20.517 1.00 0.00 H new ATOM 116 N HIS 1 8 36.084 12.856 -14.030 1.00 0.00 N ATOM 117 CA HIS 1 8 36.204 12.424 -12.643 1.00 0.00 C ATOM 118 C HIS 1 8 36.007 13.595 -11.684 1.00 0.00 C ATOM 119 O HIS 1 8 36.972 14.159 -11.166 1.00 0.00 O ATOM 120 CB HIS 1 8 37.570 11.771 -12.406 1.00 0.00 C ATOM 121 CG HIS 1 8 37.495 10.347 -11.938 1.00 0.00 C ATOM 122 ND1 HIS 1 8 36.311 9.650 -11.801 1.00 0.00 N ATOM 123 CD2 HIS 1 8 38.477 9.486 -11.577 1.00 0.00 C ATOM 124 CE1 HIS 1 8 36.569 8.427 -11.374 1.00 0.00 C ATOM 125 NE2 HIS 1 8 37.874 8.303 -11.231 1.00 0.00 N ATOM 0 H HIS 1 8 36.961 13.153 -14.457 1.00 0.00 H new ATOM 0 HA HIS 1 8 35.421 11.690 -12.449 1.00 0.00 H new ATOM 0 HB2 HIS 1 8 38.144 11.808 -13.332 1.00 0.00 H new ATOM 0 HB3 HIS 1 8 38.118 12.357 -11.668 1.00 0.00 H new ATOM 0 HD2 HIS 1 8 39.537 9.692 -11.564 1.00 0.00 H new ATOM 0 HE1 HIS 1 8 35.836 7.659 -11.176 1.00 0.00 H new ATOM 0 HE2 HIS 1 8 38.358 7.463 -10.914 1.00 0.00 H new ATOM 134 N HIS 1 9 34.749 13.950 -11.446 1.00 0.00 N ATOM 135 CA HIS 1 9 34.420 15.043 -10.542 1.00 0.00 C ATOM 136 C HIS 1 9 33.457 14.564 -9.461 1.00 0.00 C ATOM 137 O HIS 1 9 33.823 14.464 -8.291 1.00 0.00 O ATOM 138 CB HIS 1 9 33.809 16.214 -11.318 1.00 0.00 C ATOM 139 CG HIS 1 9 34.654 17.450 -11.294 1.00 0.00 C ATOM 140 ND1 HIS 1 9 35.899 17.521 -11.883 1.00 0.00 N ATOM 141 CD2 HIS 1 9 34.430 18.667 -10.744 1.00 0.00 C ATOM 142 CE1 HIS 1 9 36.404 18.728 -11.695 1.00 0.00 C ATOM 143 NE2 HIS 1 9 35.532 19.441 -11.008 1.00 0.00 N ATOM 0 H HIS 1 9 33.940 13.495 -11.868 1.00 0.00 H new ATOM 0 HA HIS 1 9 35.338 15.386 -10.064 1.00 0.00 H new ATOM 0 HB2 HIS 1 9 33.651 15.911 -12.353 1.00 0.00 H new ATOM 0 HB3 HIS 1 9 32.829 16.445 -10.900 1.00 0.00 H new ATOM 0 HD2 HIS 1 9 33.549 18.972 -10.199 1.00 0.00 H new ATOM 0 HE1 HIS 1 9 37.366 19.072 -12.044 1.00 0.00 H new ATOM 0 HE2 HIS 1 9 35.657 20.411 -10.720 1.00 0.00 H new ATOM 152 N HIS 1 10 32.230 14.248 -9.866 1.00 0.00 N ATOM 153 CA HIS 1 10 31.203 13.769 -8.937 1.00 0.00 C ATOM 154 C HIS 1 10 31.347 12.270 -8.663 1.00 0.00 C ATOM 155 O HIS 1 10 30.350 11.566 -8.503 1.00 0.00 O ATOM 156 CB HIS 1 10 29.811 14.047 -9.511 1.00 0.00 C ATOM 157 CG HIS 1 10 29.398 15.484 -9.424 1.00 0.00 C ATOM 158 ND1 HIS 1 10 29.846 16.340 -8.439 1.00 0.00 N ATOM 159 CD2 HIS 1 10 28.571 16.216 -10.207 1.00 0.00 C ATOM 160 CE1 HIS 1 10 29.312 17.534 -8.621 1.00 0.00 C ATOM 161 NE2 HIS 1 10 28.536 17.485 -9.688 1.00 0.00 N ATOM 0 H HIS 1 10 31.919 14.314 -10.835 1.00 0.00 H new ATOM 0 HA HIS 1 10 31.333 14.303 -7.996 1.00 0.00 H new ATOM 0 HB2 HIS 1 10 29.790 13.735 -10.555 1.00 0.00 H new ATOM 0 HB3 HIS 1 10 29.081 13.436 -8.981 1.00 0.00 H new ATOM 0 HD2 HIS 1 10 28.038 15.866 -11.078 1.00 0.00 H new ATOM 0 HE1 HIS 1 10 29.481 18.403 -8.002 1.00 0.00 H new ATOM 0 HE2 HIS 1 10 27.998 18.265 -10.065 1.00 0.00 H new ATOM 170 N GLY 1 11 32.585 11.785 -8.595 1.00 0.00 N ATOM 171 CA GLY 1 11 32.815 10.375 -8.333 1.00 0.00 C ATOM 172 C GLY 1 11 32.686 10.014 -6.863 1.00 0.00 C ATOM 173 O GLY 1 11 32.941 8.873 -6.477 1.00 0.00 O ATOM 0 H GLY 1 11 33.431 12.342 -8.716 1.00 0.00 H new ATOM 0 HA2 GLY 1 11 32.104 9.784 -8.910 1.00 0.00 H new ATOM 0 HA3 GLY 1 11 33.812 10.105 -8.681 1.00 0.00 H new ATOM 177 N SER 1 12 32.291 10.982 -6.039 1.00 0.00 N ATOM 178 CA SER 1 12 32.135 10.751 -4.608 1.00 0.00 C ATOM 179 C SER 1 12 30.664 10.577 -4.231 1.00 0.00 C ATOM 180 O SER 1 12 30.350 10.106 -3.137 1.00 0.00 O ATOM 181 CB SER 1 12 32.737 11.914 -3.819 1.00 0.00 C ATOM 182 OG SER 1 12 34.098 11.671 -3.511 1.00 0.00 O ATOM 0 H SER 1 12 32.074 11.932 -6.339 1.00 0.00 H new ATOM 0 HA SER 1 12 32.663 9.831 -4.358 1.00 0.00 H new ATOM 0 HB2 SER 1 12 32.651 12.834 -4.398 1.00 0.00 H new ATOM 0 HB3 SER 1 12 32.173 12.063 -2.898 1.00 0.00 H new ATOM 0 HG SER 1 12 34.460 12.430 -3.008 1.00 0.00 H new ATOM 188 N GLU 1 13 29.764 10.963 -5.134 1.00 0.00 N ATOM 189 CA GLU 1 13 28.333 10.848 -4.877 1.00 0.00 C ATOM 190 C GLU 1 13 27.524 11.086 -6.151 1.00 0.00 C ATOM 191 O GLU 1 13 27.225 12.229 -6.500 1.00 0.00 O ATOM 192 CB GLU 1 13 27.911 11.844 -3.793 1.00 0.00 C ATOM 193 CG GLU 1 13 27.329 11.183 -2.555 1.00 0.00 C ATOM 194 CD GLU 1 13 27.217 12.138 -1.384 1.00 0.00 C ATOM 195 OE1 GLU 1 13 28.268 12.610 -0.902 1.00 0.00 O ATOM 196 OE2 GLU 1 13 26.079 12.414 -0.949 1.00 0.00 O ATOM 0 H GLU 1 13 30.001 11.356 -6.045 1.00 0.00 H new ATOM 0 HA GLU 1 13 28.131 9.834 -4.531 1.00 0.00 H new ATOM 0 HB2 GLU 1 13 28.775 12.442 -3.504 1.00 0.00 H new ATOM 0 HB3 GLU 1 13 27.174 12.531 -4.209 1.00 0.00 H new ATOM 0 HG2 GLU 1 13 26.342 10.785 -2.790 1.00 0.00 H new ATOM 0 HG3 GLU 1 13 27.955 10.337 -2.271 1.00 0.00 H new ATOM 203 N PRO 1 14 27.150 10.008 -6.862 1.00 0.00 N ATOM 204 CA PRO 1 14 26.367 10.110 -8.099 1.00 0.00 C ATOM 205 C PRO 1 14 24.927 10.540 -7.837 1.00 0.00 C ATOM 206 O PRO 1 14 24.233 9.949 -7.011 1.00 0.00 O ATOM 207 CB PRO 1 14 26.406 8.689 -8.660 1.00 0.00 C ATOM 208 CG PRO 1 14 26.600 7.817 -7.469 1.00 0.00 C ATOM 209 CD PRO 1 14 27.457 8.605 -6.516 1.00 0.00 C ATOM 0 HA PRO 1 14 26.770 10.862 -8.777 1.00 0.00 H new ATOM 0 HB2 PRO 1 14 25.482 8.444 -9.183 1.00 0.00 H new ATOM 0 HB3 PRO 1 14 27.219 8.568 -9.376 1.00 0.00 H new ATOM 0 HG2 PRO 1 14 25.644 7.560 -7.013 1.00 0.00 H new ATOM 0 HG3 PRO 1 14 27.083 6.880 -7.746 1.00 0.00 H new ATOM 0 HD2 PRO 1 14 27.211 8.384 -5.477 1.00 0.00 H new ATOM 0 HD3 PRO 1 14 28.516 8.381 -6.648 1.00 0.00 H new ATOM 217 N THR 1 15 24.484 11.572 -8.549 1.00 0.00 N ATOM 218 CA THR 1 15 23.125 12.078 -8.393 1.00 0.00 C ATOM 219 C THR 1 15 22.198 11.462 -9.437 1.00 0.00 C ATOM 220 O THR 1 15 21.518 12.173 -10.178 1.00 0.00 O ATOM 221 CB THR 1 15 23.109 13.603 -8.509 1.00 0.00 C ATOM 222 OG1 THR 1 15 23.972 14.187 -7.550 1.00 0.00 O ATOM 223 CG2 THR 1 15 21.734 14.206 -8.314 1.00 0.00 C ATOM 0 H THR 1 15 25.045 12.073 -9.238 1.00 0.00 H new ATOM 0 HA THR 1 15 22.767 11.797 -7.403 1.00 0.00 H new ATOM 0 HB THR 1 15 23.441 13.818 -9.525 1.00 0.00 H new ATOM 0 HG1 THR 1 15 23.950 15.163 -7.641 1.00 0.00 H new ATOM 0 HG21 THR 1 15 21.795 15.290 -8.409 1.00 0.00 H new ATOM 0 HG22 THR 1 15 21.054 13.813 -9.070 1.00 0.00 H new ATOM 0 HG23 THR 1 15 21.361 13.949 -7.322 1.00 0.00 H new ATOM 231 N THR 1 16 22.176 10.134 -9.489 1.00 0.00 N ATOM 232 CA THR 1 16 21.335 9.417 -10.439 1.00 0.00 C ATOM 233 C THR 1 16 20.038 8.957 -9.776 1.00 0.00 C ATOM 234 O THR 1 16 20.041 8.539 -8.618 1.00 0.00 O ATOM 235 CB THR 1 16 22.089 8.214 -11.006 1.00 0.00 C ATOM 236 OG1 THR 1 16 23.489 8.422 -10.942 1.00 0.00 O ATOM 237 CG2 THR 1 16 21.736 7.907 -12.444 1.00 0.00 C ATOM 0 H THR 1 16 22.733 9.532 -8.882 1.00 0.00 H new ATOM 0 HA THR 1 16 21.083 10.096 -11.254 1.00 0.00 H new ATOM 0 HB THR 1 16 21.787 7.369 -10.387 1.00 0.00 H new ATOM 0 HG1 THR 1 16 23.953 7.640 -11.308 1.00 0.00 H new ATOM 0 HG21 THR 1 16 22.307 7.042 -12.782 1.00 0.00 H new ATOM 0 HG22 THR 1 16 20.670 7.690 -12.519 1.00 0.00 H new ATOM 0 HG23 THR 1 16 21.976 8.767 -13.069 1.00 0.00 H new ATOM 245 N PRO 1 17 18.907 9.026 -10.502 1.00 0.00 N ATOM 246 CA PRO 1 17 17.604 8.614 -9.971 1.00 0.00 C ATOM 247 C PRO 1 17 17.494 7.104 -9.800 1.00 0.00 C ATOM 248 O PRO 1 17 17.541 6.352 -10.774 1.00 0.00 O ATOM 249 CB PRO 1 17 16.617 9.101 -11.031 1.00 0.00 C ATOM 250 CG PRO 1 17 17.407 9.137 -12.293 1.00 0.00 C ATOM 251 CD PRO 1 17 18.807 9.513 -11.891 1.00 0.00 C ATOM 0 HA PRO 1 17 17.424 9.026 -8.978 1.00 0.00 H new ATOM 0 HB2 PRO 1 17 15.764 8.428 -11.117 1.00 0.00 H new ATOM 0 HB3 PRO 1 17 16.222 10.086 -10.782 1.00 0.00 H new ATOM 0 HG2 PRO 1 17 17.391 8.168 -12.792 1.00 0.00 H new ATOM 0 HG3 PRO 1 17 16.993 9.863 -12.993 1.00 0.00 H new ATOM 0 HD2 PRO 1 17 19.550 9.043 -12.536 1.00 0.00 H new ATOM 0 HD3 PRO 1 17 18.967 10.589 -11.952 1.00 0.00 H new ATOM 259 N THR 1 18 17.339 6.669 -8.555 1.00 0.00 N ATOM 260 CA THR 1 18 17.211 5.248 -8.250 1.00 0.00 C ATOM 261 C THR 1 18 15.926 4.970 -7.469 1.00 0.00 C ATOM 262 O THR 1 18 15.622 3.820 -7.150 1.00 0.00 O ATOM 263 CB THR 1 18 18.426 4.763 -7.456 1.00 0.00 C ATOM 264 OG1 THR 1 18 18.224 3.441 -6.987 1.00 0.00 O ATOM 265 CG2 THR 1 18 18.748 5.632 -6.260 1.00 0.00 C ATOM 0 H THR 1 18 17.299 7.280 -7.739 1.00 0.00 H new ATOM 0 HA THR 1 18 17.163 4.702 -9.192 1.00 0.00 H new ATOM 0 HB THR 1 18 19.263 4.811 -8.153 1.00 0.00 H new ATOM 0 HG1 THR 1 18 17.301 3.167 -7.168 1.00 0.00 H new ATOM 0 HG21 THR 1 18 19.620 5.231 -5.743 1.00 0.00 H new ATOM 0 HG22 THR 1 18 18.960 6.647 -6.595 1.00 0.00 H new ATOM 0 HG23 THR 1 18 17.897 5.645 -5.580 1.00 0.00 H new ATOM 273 N THR 1 19 15.171 6.026 -7.167 1.00 0.00 N ATOM 274 CA THR 1 19 13.925 5.894 -6.421 1.00 0.00 C ATOM 275 C THR 1 19 12.975 4.907 -7.099 1.00 0.00 C ATOM 276 O THR 1 19 12.894 4.852 -8.326 1.00 0.00 O ATOM 277 CB THR 1 19 13.246 7.257 -6.277 1.00 0.00 C ATOM 278 OG1 THR 1 19 11.981 7.124 -5.653 1.00 0.00 O ATOM 279 CG2 THR 1 19 13.037 7.966 -7.597 1.00 0.00 C ATOM 0 H THR 1 19 15.404 6.984 -7.429 1.00 0.00 H new ATOM 0 HA THR 1 19 14.168 5.508 -5.431 1.00 0.00 H new ATOM 0 HB THR 1 19 13.925 7.854 -5.668 1.00 0.00 H new ATOM 0 HG1 THR 1 19 11.564 8.007 -5.568 1.00 0.00 H new ATOM 0 HG21 THR 1 19 12.551 8.926 -7.422 1.00 0.00 H new ATOM 0 HG22 THR 1 19 14.001 8.130 -8.079 1.00 0.00 H new ATOM 0 HG23 THR 1 19 12.408 7.354 -8.243 1.00 0.00 H new ATOM 287 N ASN 1 20 12.262 4.131 -6.290 1.00 0.00 N ATOM 288 CA ASN 1 20 11.315 3.145 -6.801 1.00 0.00 C ATOM 289 C ASN 1 20 10.651 2.392 -5.652 1.00 0.00 C ATOM 290 O ASN 1 20 11.327 1.874 -4.764 1.00 0.00 O ATOM 291 CB ASN 1 20 12.013 2.160 -7.739 1.00 0.00 C ATOM 292 CG ASN 1 20 11.184 1.855 -8.971 1.00 0.00 C ATOM 293 OD1 ASN 1 20 10.952 0.693 -9.306 1.00 0.00 O ATOM 294 ND2 ASN 1 20 10.731 2.900 -9.653 1.00 0.00 N ATOM 0 H ASN 1 20 12.322 4.166 -5.272 1.00 0.00 H new ATOM 0 HA ASN 1 20 10.546 3.675 -7.363 1.00 0.00 H new ATOM 0 HB2 ASN 1 20 12.975 2.571 -8.044 1.00 0.00 H new ATOM 0 HB3 ASN 1 20 12.218 1.233 -7.203 1.00 0.00 H new ATOM 0 HD21 ASN 1 20 10.167 2.757 -10.490 1.00 0.00 H new ATOM 0 HD22 ASN 1 20 10.947 3.846 -9.340 1.00 0.00 H new ATOM 301 N LEU 1 21 9.325 2.340 -5.674 1.00 0.00 N ATOM 302 CA LEU 1 21 8.566 1.664 -4.634 1.00 0.00 C ATOM 303 C LEU 1 21 8.892 0.179 -4.593 1.00 0.00 C ATOM 304 O LEU 1 21 8.209 -0.636 -5.213 1.00 0.00 O ATOM 305 CB LEU 1 21 7.062 1.852 -4.855 1.00 0.00 C ATOM 306 CG LEU 1 21 6.634 3.223 -5.386 1.00 0.00 C ATOM 307 CD1 LEU 1 21 5.485 3.072 -6.370 1.00 0.00 C ATOM 308 CD2 LEU 1 21 6.240 4.139 -4.239 1.00 0.00 C ATOM 0 H LEU 1 21 8.752 2.761 -6.406 1.00 0.00 H new ATOM 0 HA LEU 1 21 8.847 2.110 -3.680 1.00 0.00 H new ATOM 0 HB2 LEU 1 21 6.718 1.089 -5.553 1.00 0.00 H new ATOM 0 HB3 LEU 1 21 6.550 1.673 -3.910 1.00 0.00 H new ATOM 0 HG LEU 1 21 7.479 3.673 -5.908 1.00 0.00 H new ATOM 0 HD11 LEU 1 21 5.191 4.054 -6.739 1.00 0.00 H new ATOM 0 HD12 LEU 1 21 5.802 2.450 -7.207 1.00 0.00 H new ATOM 0 HD13 LEU 1 21 4.637 2.604 -5.870 1.00 0.00 H new ATOM 0 HD21 LEU 1 21 5.939 5.109 -4.635 1.00 0.00 H new ATOM 0 HD22 LEU 1 21 5.409 3.697 -3.690 1.00 0.00 H new ATOM 0 HD23 LEU 1 21 7.090 4.269 -3.569 1.00 0.00 H new ATOM 320 N LYS 1 22 9.933 -0.166 -3.850 1.00 0.00 N ATOM 321 CA LYS 1 22 10.354 -1.551 -3.714 1.00 0.00 C ATOM 322 C LYS 1 22 9.178 -2.459 -3.346 1.00 0.00 C ATOM 323 O LYS 1 22 8.074 -1.991 -3.066 1.00 0.00 O ATOM 324 CB LYS 1 22 11.474 -1.669 -2.689 1.00 0.00 C ATOM 325 CG LYS 1 22 12.826 -1.993 -3.304 1.00 0.00 C ATOM 326 CD LYS 1 22 13.970 -1.565 -2.397 1.00 0.00 C ATOM 327 CE LYS 1 22 15.013 -2.664 -2.259 1.00 0.00 C ATOM 328 NZ LYS 1 22 16.144 -2.485 -3.213 1.00 0.00 N ATOM 0 H LYS 1 22 10.504 0.499 -3.329 1.00 0.00 H new ATOM 0 HA LYS 1 22 10.734 -1.883 -4.680 1.00 0.00 H new ATOM 0 HB2 LYS 1 22 11.550 -0.733 -2.136 1.00 0.00 H new ATOM 0 HB3 LYS 1 22 11.216 -2.445 -1.968 1.00 0.00 H new ATOM 0 HG2 LYS 1 22 12.893 -3.064 -3.494 1.00 0.00 H new ATOM 0 HG3 LYS 1 22 12.918 -1.492 -4.268 1.00 0.00 H new ATOM 0 HD2 LYS 1 22 14.438 -0.666 -2.799 1.00 0.00 H new ATOM 0 HD3 LYS 1 22 13.579 -1.308 -1.413 1.00 0.00 H new ATOM 0 HE2 LYS 1 22 15.397 -2.673 -1.239 1.00 0.00 H new ATOM 0 HE3 LYS 1 22 14.544 -3.633 -2.431 1.00 0.00 H new ATOM 0 HZ1 LYS 1 22 16.831 -3.255 -3.085 1.00 0.00 H new ATOM 0 HZ2 LYS 1 22 15.782 -2.502 -4.188 1.00 0.00 H new ATOM 0 HZ3 LYS 1 22 16.609 -1.572 -3.033 1.00 0.00 H new ATOM 342 N ILE 1 23 9.420 -3.762 -3.414 1.00 0.00 N ATOM 343 CA ILE 1 23 8.406 -4.772 -3.165 1.00 0.00 C ATOM 344 C ILE 1 23 7.985 -4.939 -1.701 1.00 0.00 C ATOM 345 O ILE 1 23 8.752 -4.705 -0.768 1.00 0.00 O ATOM 346 CB ILE 1 23 8.919 -6.125 -3.703 1.00 0.00 C ATOM 347 CG1 ILE 1 23 8.078 -6.536 -4.892 1.00 0.00 C ATOM 348 CG2 ILE 1 23 8.928 -7.215 -2.637 1.00 0.00 C ATOM 349 CD1 ILE 1 23 8.903 -6.940 -6.089 1.00 0.00 C ATOM 0 H ILE 1 23 10.335 -4.148 -3.646 1.00 0.00 H new ATOM 0 HA ILE 1 23 7.510 -4.428 -3.681 1.00 0.00 H new ATOM 0 HB ILE 1 23 9.957 -5.996 -4.011 1.00 0.00 H new ATOM 0 HG12 ILE 1 23 7.435 -7.367 -4.604 1.00 0.00 H new ATOM 0 HG13 ILE 1 23 7.425 -5.709 -5.171 1.00 0.00 H new ATOM 0 HG21 ILE 1 23 9.298 -8.144 -3.070 1.00 0.00 H new ATOM 0 HG22 ILE 1 23 9.577 -6.914 -1.815 1.00 0.00 H new ATOM 0 HG23 ILE 1 23 7.915 -7.366 -2.263 1.00 0.00 H new ATOM 0 HD11 ILE 1 23 8.242 -7.224 -6.908 1.00 0.00 H new ATOM 0 HD12 ILE 1 23 9.527 -6.102 -6.400 1.00 0.00 H new ATOM 0 HD13 ILE 1 23 9.537 -7.786 -5.825 1.00 0.00 H new ATOM 361 N TYR 1 24 6.748 -5.423 -1.557 1.00 0.00 N ATOM 362 CA TYR 1 24 6.124 -5.741 -0.289 1.00 0.00 C ATOM 363 C TYR 1 24 6.073 -7.254 -0.211 1.00 0.00 C ATOM 364 O TYR 1 24 6.311 -7.921 -1.212 1.00 0.00 O ATOM 365 CB TYR 1 24 4.689 -5.252 -0.276 1.00 0.00 C ATOM 366 CG TYR 1 24 4.418 -3.920 0.373 1.00 0.00 C ATOM 367 CD1 TYR 1 24 4.780 -2.732 -0.237 1.00 0.00 C ATOM 368 CD2 TYR 1 24 3.748 -3.859 1.582 1.00 0.00 C ATOM 369 CE1 TYR 1 24 4.482 -1.518 0.346 1.00 0.00 C ATOM 370 CE2 TYR 1 24 3.452 -2.655 2.177 1.00 0.00 C ATOM 371 CZ TYR 1 24 3.819 -1.488 1.555 1.00 0.00 C ATOM 372 OH TYR 1 24 3.503 -0.283 2.134 1.00 0.00 O ATOM 0 H TYR 1 24 6.140 -5.607 -2.355 1.00 0.00 H new ATOM 0 HA TYR 1 24 6.677 -5.282 0.531 1.00 0.00 H new ATOM 0 HB2 TYR 1 24 4.341 -5.201 -1.308 1.00 0.00 H new ATOM 0 HB3 TYR 1 24 4.081 -6.003 0.229 1.00 0.00 H new ATOM 0 HD1 TYR 1 24 5.303 -2.756 -1.182 1.00 0.00 H new ATOM 0 HD2 TYR 1 24 3.451 -4.776 2.069 1.00 0.00 H new ATOM 0 HE1 TYR 1 24 4.766 -0.597 -0.141 1.00 0.00 H new ATOM 0 HE2 TYR 1 24 2.935 -2.628 3.125 1.00 0.00 H new ATOM 0 HH TYR 1 24 2.636 -0.354 2.584 1.00 0.00 H new ATOM 382 N LYS 1 25 5.726 -7.813 0.923 1.00 0.00 N ATOM 383 CA LYS 1 25 5.614 -9.261 1.011 1.00 0.00 C ATOM 384 C LYS 1 25 4.186 -9.680 1.336 1.00 0.00 C ATOM 385 O LYS 1 25 3.700 -9.455 2.436 1.00 0.00 O ATOM 386 CB LYS 1 25 6.571 -9.817 2.041 1.00 0.00 C ATOM 387 CG LYS 1 25 7.993 -9.980 1.522 1.00 0.00 C ATOM 388 CD LYS 1 25 8.241 -11.386 0.995 1.00 0.00 C ATOM 389 CE LYS 1 25 8.235 -12.415 2.116 1.00 0.00 C ATOM 390 NZ LYS 1 25 9.535 -13.132 2.224 1.00 0.00 N ATOM 0 H LYS 1 25 5.519 -7.307 1.784 1.00 0.00 H new ATOM 0 HA LYS 1 25 5.880 -9.672 0.037 1.00 0.00 H new ATOM 0 HB2 LYS 1 25 6.583 -9.157 2.908 1.00 0.00 H new ATOM 0 HB3 LYS 1 25 6.204 -10.785 2.382 1.00 0.00 H new ATOM 0 HG2 LYS 1 25 8.176 -9.256 0.728 1.00 0.00 H new ATOM 0 HG3 LYS 1 25 8.700 -9.761 2.322 1.00 0.00 H new ATOM 0 HD2 LYS 1 25 7.475 -11.641 0.263 1.00 0.00 H new ATOM 0 HD3 LYS 1 25 9.200 -11.417 0.477 1.00 0.00 H new ATOM 0 HE2 LYS 1 25 8.015 -11.919 3.062 1.00 0.00 H new ATOM 0 HE3 LYS 1 25 7.437 -13.136 1.941 1.00 0.00 H new ATOM 0 HZ1 LYS 1 25 9.487 -13.823 3.000 1.00 0.00 H new ATOM 0 HZ2 LYS 1 25 9.734 -13.627 1.331 1.00 0.00 H new ATOM 0 HZ3 LYS 1 25 10.294 -12.448 2.417 1.00 0.00 H new ATOM 404 N VAL 1 26 3.508 -10.302 0.396 1.00 0.00 N ATOM 405 CA VAL 1 26 2.161 -10.732 0.651 1.00 0.00 C ATOM 406 C VAL 1 26 2.179 -12.027 1.416 1.00 0.00 C ATOM 407 O VAL 1 26 2.049 -13.118 0.860 1.00 0.00 O ATOM 408 CB VAL 1 26 1.309 -10.863 -0.605 1.00 0.00 C ATOM 409 CG1 VAL 1 26 0.015 -10.171 -0.340 1.00 0.00 C ATOM 410 CG2 VAL 1 26 1.994 -10.254 -1.802 1.00 0.00 C ATOM 0 H VAL 1 26 3.864 -10.516 -0.535 1.00 0.00 H new ATOM 0 HA VAL 1 26 1.690 -9.950 1.247 1.00 0.00 H new ATOM 0 HB VAL 1 26 1.148 -11.916 -0.835 1.00 0.00 H new ATOM 0 HG11 VAL 1 26 -0.624 -10.244 -1.220 1.00 0.00 H new ATOM 0 HG12 VAL 1 26 -0.482 -10.641 0.509 1.00 0.00 H new ATOM 0 HG13 VAL 1 26 0.203 -9.121 -0.114 1.00 0.00 H new ATOM 0 HG21 VAL 1 26 1.358 -10.365 -2.681 1.00 0.00 H new ATOM 0 HG22 VAL 1 26 2.176 -9.195 -1.617 1.00 0.00 H new ATOM 0 HG23 VAL 1 26 2.943 -10.761 -1.975 1.00 0.00 H new ATOM 420 N ASP 1 27 2.383 -11.859 2.702 1.00 0.00 N ATOM 421 CA ASP 1 27 2.471 -12.967 3.648 1.00 0.00 C ATOM 422 C ASP 1 27 1.100 -13.476 4.043 1.00 0.00 C ATOM 423 O ASP 1 27 0.946 -14.639 4.413 1.00 0.00 O ATOM 424 CB ASP 1 27 3.291 -12.554 4.880 1.00 0.00 C ATOM 425 CG ASP 1 27 4.776 -12.636 4.603 1.00 0.00 C ATOM 426 OD1 ASP 1 27 5.354 -13.728 4.785 1.00 0.00 O ATOM 427 OD2 ASP 1 27 5.360 -11.610 4.201 1.00 0.00 O ATOM 0 H ASP 1 27 2.495 -10.942 3.134 1.00 0.00 H new ATOM 0 HA ASP 1 27 2.985 -13.791 3.154 1.00 0.00 H new ATOM 0 HB2 ASP 1 27 3.028 -11.537 5.170 1.00 0.00 H new ATOM 0 HB3 ASP 1 27 3.039 -13.200 5.721 1.00 0.00 H new ATOM 432 N ASP 1 28 0.102 -12.610 3.968 1.00 0.00 N ATOM 433 CA ASP 1 28 -1.246 -13.011 4.330 1.00 0.00 C ATOM 434 C ASP 1 28 -2.269 -11.912 4.059 1.00 0.00 C ATOM 435 O ASP 1 28 -2.208 -10.834 4.648 1.00 0.00 O ATOM 436 CB ASP 1 28 -1.280 -13.397 5.808 1.00 0.00 C ATOM 437 CG ASP 1 28 -2.367 -14.403 6.123 1.00 0.00 C ATOM 438 OD1 ASP 1 28 -3.546 -14.108 5.839 1.00 0.00 O ATOM 439 OD2 ASP 1 28 -2.041 -15.484 6.655 1.00 0.00 O ATOM 0 H ASP 1 28 0.197 -11.641 3.665 1.00 0.00 H new ATOM 0 HA ASP 1 28 -1.516 -13.865 3.709 1.00 0.00 H new ATOM 0 HB2 ASP 1 28 -0.313 -13.811 6.094 1.00 0.00 H new ATOM 0 HB3 ASP 1 28 -1.434 -12.501 6.410 1.00 0.00 H new ATOM 444 N LEU 1 29 -3.231 -12.205 3.191 1.00 0.00 N ATOM 445 CA LEU 1 29 -4.283 -11.261 2.884 1.00 0.00 C ATOM 446 C LEU 1 29 -5.636 -11.952 2.917 1.00 0.00 C ATOM 447 O LEU 1 29 -5.791 -13.068 2.433 1.00 0.00 O ATOM 448 CB LEU 1 29 -4.051 -10.553 1.568 1.00 0.00 C ATOM 449 CG LEU 1 29 -5.278 -10.463 0.687 1.00 0.00 C ATOM 450 CD1 LEU 1 29 -5.397 -9.093 0.071 1.00 0.00 C ATOM 451 CD2 LEU 1 29 -5.216 -11.542 -0.349 1.00 0.00 C ATOM 0 H LEU 1 29 -3.298 -13.091 2.691 1.00 0.00 H new ATOM 0 HA LEU 1 29 -4.271 -10.489 3.653 1.00 0.00 H new ATOM 0 HB2 LEU 1 29 -3.688 -9.545 1.770 1.00 0.00 H new ATOM 0 HB3 LEU 1 29 -3.263 -11.073 1.023 1.00 0.00 H new ATOM 0 HG LEU 1 29 -6.175 -10.613 1.288 1.00 0.00 H new ATOM 0 HD11 LEU 1 29 -6.286 -9.053 -0.558 1.00 0.00 H new ATOM 0 HD12 LEU 1 29 -5.476 -8.345 0.860 1.00 0.00 H new ATOM 0 HD13 LEU 1 29 -4.514 -8.889 -0.535 1.00 0.00 H new ATOM 0 HD21 LEU 1 29 -6.097 -11.484 -0.988 1.00 0.00 H new ATOM 0 HD22 LEU 1 29 -4.319 -11.414 -0.955 1.00 0.00 H new ATOM 0 HD23 LEU 1 29 -5.187 -12.515 0.141 1.00 0.00 H new ATOM 463 N GLN 1 30 -6.590 -11.272 3.530 1.00 0.00 N ATOM 464 CA GLN 1 30 -7.947 -11.777 3.715 1.00 0.00 C ATOM 465 C GLN 1 30 -9.009 -10.795 3.280 1.00 0.00 C ATOM 466 O GLN 1 30 -8.776 -9.591 3.235 1.00 0.00 O ATOM 467 CB GLN 1 30 -8.178 -12.068 5.207 1.00 0.00 C ATOM 468 CG GLN 1 30 -8.105 -13.534 5.571 1.00 0.00 C ATOM 469 CD GLN 1 30 -6.825 -14.151 5.087 1.00 0.00 C ATOM 470 OE1 GLN 1 30 -5.942 -14.493 5.873 1.00 0.00 O ATOM 471 NE2 GLN 1 30 -6.727 -14.301 3.781 1.00 0.00 N ATOM 0 H GLN 1 30 -6.445 -10.341 3.920 1.00 0.00 H new ATOM 0 HA GLN 1 30 -8.032 -12.672 3.099 1.00 0.00 H new ATOM 0 HB2 GLN 1 30 -7.437 -11.523 5.791 1.00 0.00 H new ATOM 0 HB3 GLN 1 30 -9.156 -11.682 5.494 1.00 0.00 H new ATOM 0 HG2 GLN 1 30 -8.180 -13.647 6.653 1.00 0.00 H new ATOM 0 HG3 GLN 1 30 -8.954 -14.062 5.136 1.00 0.00 H new ATOM 0 HE21 GLN 1 30 -7.490 -14.000 3.174 1.00 0.00 H new ATOM 0 HE22 GLN 1 30 -5.888 -14.718 3.377 1.00 0.00 H new ATOM 480 N LYS 1 31 -10.218 -11.305 3.046 1.00 0.00 N ATOM 481 CA LYS 1 31 -11.312 -10.419 2.738 1.00 0.00 C ATOM 482 C LYS 1 31 -11.586 -9.725 4.062 1.00 0.00 C ATOM 483 O LYS 1 31 -12.071 -10.342 5.010 1.00 0.00 O ATOM 484 CB LYS 1 31 -12.530 -11.200 2.235 1.00 0.00 C ATOM 485 CG LYS 1 31 -13.463 -10.425 1.305 1.00 0.00 C ATOM 486 CD LYS 1 31 -12.809 -9.209 0.665 1.00 0.00 C ATOM 487 CE LYS 1 31 -13.626 -8.708 -0.516 1.00 0.00 C ATOM 488 NZ LYS 1 31 -13.217 -7.341 -0.938 1.00 0.00 N ATOM 0 H LYS 1 31 -10.450 -12.298 3.065 1.00 0.00 H new ATOM 0 HA LYS 1 31 -11.084 -9.714 1.939 1.00 0.00 H new ATOM 0 HB2 LYS 1 31 -12.180 -12.090 1.712 1.00 0.00 H new ATOM 0 HB3 LYS 1 31 -13.104 -11.541 3.097 1.00 0.00 H new ATOM 0 HG2 LYS 1 31 -13.817 -11.093 0.520 1.00 0.00 H new ATOM 0 HG3 LYS 1 31 -14.339 -10.103 1.868 1.00 0.00 H new ATOM 0 HD2 LYS 1 31 -12.708 -8.415 1.405 1.00 0.00 H new ATOM 0 HD3 LYS 1 31 -11.803 -9.465 0.333 1.00 0.00 H new ATOM 0 HE2 LYS 1 31 -13.511 -9.396 -1.354 1.00 0.00 H new ATOM 0 HE3 LYS 1 31 -14.683 -8.704 -0.250 1.00 0.00 H new ATOM 0 HZ1 LYS 1 31 -13.396 -7.224 -1.956 1.00 0.00 H new ATOM 0 HZ2 LYS 1 31 -13.765 -6.635 -0.406 1.00 0.00 H new ATOM 0 HZ3 LYS 1 31 -12.203 -7.207 -0.747 1.00 0.00 H new ATOM 502 N ILE 1 32 -11.120 -8.495 4.165 1.00 0.00 N ATOM 503 CA ILE 1 32 -11.151 -7.776 5.424 1.00 0.00 C ATOM 504 C ILE 1 32 -11.869 -6.432 5.349 1.00 0.00 C ATOM 505 O ILE 1 32 -11.501 -5.552 4.575 1.00 0.00 O ATOM 506 CB ILE 1 32 -9.672 -7.627 5.819 1.00 0.00 C ATOM 507 CG1 ILE 1 32 -9.060 -9.026 5.848 1.00 0.00 C ATOM 508 CG2 ILE 1 32 -9.440 -6.892 7.124 1.00 0.00 C ATOM 509 CD1 ILE 1 32 -8.109 -9.260 6.970 1.00 0.00 C ATOM 0 H ILE 1 32 -10.714 -7.972 3.389 1.00 0.00 H new ATOM 0 HA ILE 1 32 -11.730 -8.320 6.170 1.00 0.00 H new ATOM 0 HB ILE 1 32 -9.185 -6.997 5.075 1.00 0.00 H new ATOM 0 HG12 ILE 1 32 -9.864 -9.759 5.911 1.00 0.00 H new ATOM 0 HG13 ILE 1 32 -8.541 -9.202 4.906 1.00 0.00 H new ATOM 0 HG21 ILE 1 32 -8.370 -6.834 7.323 1.00 0.00 H new ATOM 0 HG22 ILE 1 32 -9.851 -5.885 7.053 1.00 0.00 H new ATOM 0 HG23 ILE 1 32 -9.932 -7.428 7.936 1.00 0.00 H new ATOM 0 HD11 ILE 1 32 -7.723 -10.278 6.913 1.00 0.00 H new ATOM 0 HD12 ILE 1 32 -7.282 -8.554 6.899 1.00 0.00 H new ATOM 0 HD13 ILE 1 32 -8.625 -9.120 7.920 1.00 0.00 H new ATOM 521 N ASN 1 33 -12.908 -6.291 6.173 1.00 0.00 N ATOM 522 CA ASN 1 33 -13.695 -5.069 6.212 1.00 0.00 C ATOM 523 C ASN 1 33 -14.337 -4.816 4.857 1.00 0.00 C ATOM 524 O ASN 1 33 -14.475 -3.672 4.423 1.00 0.00 O ATOM 525 CB ASN 1 33 -12.811 -3.892 6.612 1.00 0.00 C ATOM 526 CG ASN 1 33 -12.808 -3.664 8.109 1.00 0.00 C ATOM 527 OD1 ASN 1 33 -13.093 -2.564 8.582 1.00 0.00 O ATOM 528 ND2 ASN 1 33 -12.486 -4.708 8.863 1.00 0.00 N ATOM 0 H ASN 1 33 -13.221 -7.013 6.822 1.00 0.00 H new ATOM 0 HA ASN 1 33 -14.486 -5.179 6.954 1.00 0.00 H new ATOM 0 HB2 ASN 1 33 -11.792 -4.073 6.271 1.00 0.00 H new ATOM 0 HB3 ASN 1 33 -13.160 -2.990 6.109 1.00 0.00 H new ATOM 0 HD21 ASN 1 33 -12.468 -4.617 9.879 1.00 0.00 H new ATOM 0 HD22 ASN 1 33 -12.257 -5.601 8.427 1.00 0.00 H new ATOM 535 N GLY 1 34 -14.721 -5.900 4.190 1.00 0.00 N ATOM 536 CA GLY 1 34 -15.329 -5.796 2.887 1.00 0.00 C ATOM 537 C GLY 1 34 -14.313 -5.473 1.808 1.00 0.00 C ATOM 538 O GLY 1 34 -14.669 -5.260 0.650 1.00 0.00 O ATOM 0 H GLY 1 34 -14.618 -6.854 4.537 1.00 0.00 H new ATOM 0 HA2 GLY 1 34 -15.829 -6.734 2.645 1.00 0.00 H new ATOM 0 HA3 GLY 1 34 -16.096 -5.022 2.906 1.00 0.00 H new ATOM 542 N ILE 1 35 -13.041 -5.430 2.198 1.00 0.00 N ATOM 543 CA ILE 1 35 -11.961 -5.125 1.286 1.00 0.00 C ATOM 544 C ILE 1 35 -10.802 -6.086 1.515 1.00 0.00 C ATOM 545 O ILE 1 35 -10.445 -6.374 2.655 1.00 0.00 O ATOM 546 CB ILE 1 35 -11.458 -3.677 1.486 1.00 0.00 C ATOM 547 CG1 ILE 1 35 -12.175 -3.004 2.666 1.00 0.00 C ATOM 548 CG2 ILE 1 35 -11.646 -2.864 0.211 1.00 0.00 C ATOM 549 CD1 ILE 1 35 -11.264 -2.170 3.531 1.00 0.00 C ATOM 0 H ILE 1 35 -12.739 -5.607 3.156 1.00 0.00 H new ATOM 0 HA ILE 1 35 -12.340 -5.231 0.270 1.00 0.00 H new ATOM 0 HB ILE 1 35 -10.393 -3.718 1.716 1.00 0.00 H new ATOM 0 HG12 ILE 1 35 -12.975 -2.372 2.281 1.00 0.00 H new ATOM 0 HG13 ILE 1 35 -12.643 -3.772 3.281 1.00 0.00 H new ATOM 0 HG21 ILE 1 35 -11.286 -1.848 0.371 1.00 0.00 H new ATOM 0 HG22 ILE 1 35 -11.083 -3.325 -0.601 1.00 0.00 H new ATOM 0 HG23 ILE 1 35 -12.704 -2.837 -0.051 1.00 0.00 H new ATOM 0 HD11 ILE 1 35 -11.839 -1.726 4.343 1.00 0.00 H new ATOM 0 HD12 ILE 1 35 -10.478 -2.801 3.946 1.00 0.00 H new ATOM 0 HD13 ILE 1 35 -10.815 -1.379 2.930 1.00 0.00 H new ATOM 561 N TRP 1 36 -10.200 -6.569 0.441 1.00 0.00 N ATOM 562 CA TRP 1 36 -9.078 -7.489 0.570 1.00 0.00 C ATOM 563 C TRP 1 36 -7.957 -6.802 1.349 1.00 0.00 C ATOM 564 O TRP 1 36 -7.598 -5.670 1.040 1.00 0.00 O ATOM 565 CB TRP 1 36 -8.600 -7.927 -0.817 1.00 0.00 C ATOM 566 CG TRP 1 36 -9.622 -8.743 -1.550 1.00 0.00 C ATOM 567 CD1 TRP 1 36 -10.317 -8.382 -2.668 1.00 0.00 C ATOM 568 CD2 TRP 1 36 -10.082 -10.054 -1.199 1.00 0.00 C ATOM 569 NE1 TRP 1 36 -11.177 -9.390 -3.036 1.00 0.00 N ATOM 570 CE2 TRP 1 36 -11.051 -10.425 -2.148 1.00 0.00 C ATOM 571 CE3 TRP 1 36 -9.766 -10.951 -0.172 1.00 0.00 C ATOM 572 CZ2 TRP 1 36 -11.709 -11.653 -2.101 1.00 0.00 C ATOM 573 CZ3 TRP 1 36 -10.421 -12.168 -0.127 1.00 0.00 C ATOM 574 CH2 TRP 1 36 -11.382 -12.509 -1.086 1.00 0.00 C ATOM 0 H TRP 1 36 -10.463 -6.345 -0.519 1.00 0.00 H new ATOM 0 HA TRP 1 36 -9.387 -8.381 1.114 1.00 0.00 H new ATOM 0 HB2 TRP 1 36 -8.354 -7.044 -1.408 1.00 0.00 H new ATOM 0 HB3 TRP 1 36 -7.683 -8.507 -0.714 1.00 0.00 H new ATOM 0 HD1 TRP 1 36 -10.207 -7.442 -3.188 1.00 0.00 H new ATOM 0 HE1 TRP 1 36 -11.806 -9.370 -3.839 1.00 0.00 H new ATOM 0 HE3 TRP 1 36 -9.025 -10.697 0.571 1.00 0.00 H new ATOM 0 HZ2 TRP 1 36 -12.451 -11.919 -2.840 1.00 0.00 H new ATOM 0 HZ3 TRP 1 36 -10.187 -12.868 0.662 1.00 0.00 H new ATOM 0 HH2 TRP 1 36 -11.875 -13.468 -1.023 1.00 0.00 H new ATOM 585 N GLN 1 37 -7.433 -7.461 2.384 1.00 0.00 N ATOM 586 CA GLN 1 37 -6.391 -6.857 3.207 1.00 0.00 C ATOM 587 C GLN 1 37 -5.105 -7.634 3.126 1.00 0.00 C ATOM 588 O GLN 1 37 -5.120 -8.842 2.985 1.00 0.00 O ATOM 589 CB GLN 1 37 -6.857 -6.773 4.649 1.00 0.00 C ATOM 590 CG GLN 1 37 -5.812 -6.268 5.620 1.00 0.00 C ATOM 591 CD GLN 1 37 -5.689 -7.096 6.904 1.00 0.00 C ATOM 592 OE1 GLN 1 37 -5.761 -6.572 8.017 1.00 0.00 O ATOM 593 NE2 GLN 1 37 -5.492 -8.390 6.770 1.00 0.00 N ATOM 0 H GLN 1 37 -7.710 -8.401 2.668 1.00 0.00 H new ATOM 0 HA GLN 1 37 -6.200 -5.854 2.826 1.00 0.00 H new ATOM 0 HB2 GLN 1 37 -7.727 -6.118 4.698 1.00 0.00 H new ATOM 0 HB3 GLN 1 37 -7.184 -7.762 4.970 1.00 0.00 H new ATOM 0 HG2 GLN 1 37 -4.845 -6.252 5.118 1.00 0.00 H new ATOM 0 HG3 GLN 1 37 -6.049 -5.238 5.887 1.00 0.00 H new ATOM 0 HE21 GLN 1 37 -5.436 -8.804 5.839 1.00 0.00 H new ATOM 0 HE22 GLN 1 37 -5.396 -8.980 7.597 1.00 0.00 H new ATOM 602 N VAL 1 38 -3.995 -6.913 3.188 1.00 0.00 N ATOM 603 CA VAL 1 38 -2.685 -7.526 3.064 1.00 0.00 C ATOM 604 C VAL 1 38 -1.829 -7.459 4.316 1.00 0.00 C ATOM 605 O VAL 1 38 -1.937 -6.525 5.118 1.00 0.00 O ATOM 606 CB VAL 1 38 -1.911 -6.845 1.921 1.00 0.00 C ATOM 607 CG1 VAL 1 38 -0.610 -7.584 1.649 1.00 0.00 C ATOM 608 CG2 VAL 1 38 -2.771 -6.784 0.670 1.00 0.00 C ATOM 0 H VAL 1 38 -3.978 -5.902 3.324 1.00 0.00 H new ATOM 0 HA VAL 1 38 -2.876 -8.581 2.869 1.00 0.00 H new ATOM 0 HB VAL 1 38 -1.666 -5.826 2.219 1.00 0.00 H new ATOM 0 HG11 VAL 1 38 -0.074 -7.091 0.838 1.00 0.00 H new ATOM 0 HG12 VAL 1 38 0.006 -7.578 2.548 1.00 0.00 H new ATOM 0 HG13 VAL 1 38 -0.829 -8.614 1.366 1.00 0.00 H new ATOM 0 HG21 VAL 1 38 -2.213 -6.300 -0.132 1.00 0.00 H new ATOM 0 HG22 VAL 1 38 -3.042 -7.795 0.365 1.00 0.00 H new ATOM 0 HG23 VAL 1 38 -3.676 -6.213 0.878 1.00 0.00 H new ATOM 618 N ARG 1 39 -0.953 -8.465 4.442 1.00 0.00 N ATOM 619 CA ARG 1 39 -0.010 -8.556 5.546 1.00 0.00 C ATOM 620 C ARG 1 39 1.318 -9.148 5.083 1.00 0.00 C ATOM 621 O ARG 1 39 1.337 -10.091 4.292 1.00 0.00 O ATOM 622 CB ARG 1 39 -0.566 -9.422 6.672 1.00 0.00 C ATOM 623 CG ARG 1 39 -1.904 -8.963 7.189 1.00 0.00 C ATOM 624 CD ARG 1 39 -2.863 -10.130 7.354 1.00 0.00 C ATOM 625 NE ARG 1 39 -2.866 -10.669 8.709 1.00 0.00 N ATOM 626 CZ ARG 1 39 -3.722 -11.599 9.126 1.00 0.00 C ATOM 627 NH1 ARG 1 39 -4.641 -12.081 8.296 1.00 0.00 N ATOM 628 NH2 ARG 1 39 -3.660 -12.052 10.369 1.00 0.00 N ATOM 0 H ARG 1 39 -0.885 -9.235 3.777 1.00 0.00 H new ATOM 0 HA ARG 1 39 0.152 -7.543 5.914 1.00 0.00 H new ATOM 0 HB2 ARG 1 39 -0.657 -10.449 6.317 1.00 0.00 H new ATOM 0 HB3 ARG 1 39 0.147 -9.432 7.496 1.00 0.00 H new ATOM 0 HG2 ARG 1 39 -1.773 -8.459 8.147 1.00 0.00 H new ATOM 0 HG3 ARG 1 39 -2.331 -8.233 6.501 1.00 0.00 H new ATOM 0 HD2 ARG 1 39 -3.871 -9.806 7.094 1.00 0.00 H new ATOM 0 HD3 ARG 1 39 -2.591 -10.920 6.654 1.00 0.00 H new ATOM 0 HE ARG 1 39 -2.176 -10.315 9.372 1.00 0.00 H new ATOM 0 HH11 ARG 1 39 -4.692 -11.738 7.337 1.00 0.00 H new ATOM 0 HH12 ARG 1 39 -5.296 -12.794 8.618 1.00 0.00 H new ATOM 0 HH21 ARG 1 39 -2.955 -11.688 11.010 1.00 0.00 H new ATOM 0 HH22 ARG 1 39 -4.317 -12.765 10.685 1.00 0.00 H new ATOM 642 N ASN 1 40 2.420 -8.667 5.648 1.00 0.00 N ATOM 643 CA ASN 1 40 3.716 -9.232 5.362 1.00 0.00 C ATOM 644 C ASN 1 40 4.429 -9.445 6.655 1.00 0.00 C ATOM 645 O ASN 1 40 4.204 -8.756 7.628 1.00 0.00 O ATOM 646 CB ASN 1 40 4.640 -8.414 4.470 1.00 0.00 C ATOM 647 CG ASN 1 40 4.001 -7.246 3.768 1.00 0.00 C ATOM 648 OD1 ASN 1 40 2.818 -7.266 3.427 1.00 0.00 O ATOM 649 ND2 ASN 1 40 4.800 -6.215 3.554 1.00 0.00 N ATOM 0 H ASN 1 40 2.433 -7.887 6.305 1.00 0.00 H new ATOM 0 HA ASN 1 40 3.500 -10.144 4.806 1.00 0.00 H new ATOM 0 HB2 ASN 1 40 5.466 -8.043 5.077 1.00 0.00 H new ATOM 0 HB3 ASN 1 40 5.069 -9.076 3.718 1.00 0.00 H new ATOM 0 HD21 ASN 1 40 4.444 -5.382 3.085 1.00 0.00 H new ATOM 0 HD22 ASN 1 40 5.773 -6.252 3.858 1.00 0.00 H new ATOM 656 N ASN 1 41 5.275 -10.408 6.637 1.00 0.00 N ATOM 657 CA ASN 1 41 6.057 -10.771 7.794 1.00 0.00 C ATOM 658 C ASN 1 41 6.986 -9.634 8.265 1.00 0.00 C ATOM 659 O ASN 1 41 7.498 -9.680 9.384 1.00 0.00 O ATOM 660 CB ASN 1 41 6.897 -12.013 7.473 1.00 0.00 C ATOM 661 CG ASN 1 41 7.454 -11.996 6.051 1.00 0.00 C ATOM 662 OD1 ASN 1 41 7.899 -13.021 5.535 1.00 0.00 O ATOM 663 ND2 ASN 1 41 7.430 -10.823 5.419 1.00 0.00 N ATOM 0 H ASN 1 41 5.457 -10.983 5.815 1.00 0.00 H new ATOM 0 HA ASN 1 41 5.358 -10.977 8.605 1.00 0.00 H new ATOM 0 HB2 ASN 1 41 7.723 -12.081 8.181 1.00 0.00 H new ATOM 0 HB3 ASN 1 41 6.286 -12.905 7.609 1.00 0.00 H new ATOM 0 HD21 ASN 1 41 7.790 -10.749 4.468 1.00 0.00 H new ATOM 0 HD22 ASN 1 41 7.051 -9.999 5.887 1.00 0.00 H new ATOM 670 N ILE 1 42 7.219 -8.625 7.415 1.00 0.00 N ATOM 671 CA ILE 1 42 8.084 -7.528 7.752 1.00 0.00 C ATOM 672 C ILE 1 42 7.335 -6.486 8.540 1.00 0.00 C ATOM 673 O ILE 1 42 7.769 -6.041 9.604 1.00 0.00 O ATOM 674 CB ILE 1 42 8.600 -6.863 6.487 1.00 0.00 C ATOM 675 CG1 ILE 1 42 9.170 -7.904 5.555 1.00 0.00 C ATOM 676 CG2 ILE 1 42 9.624 -5.823 6.825 1.00 0.00 C ATOM 677 CD1 ILE 1 42 8.179 -8.301 4.505 1.00 0.00 C ATOM 0 H ILE 1 42 6.807 -8.562 6.484 1.00 0.00 H new ATOM 0 HA ILE 1 42 8.909 -7.926 8.343 1.00 0.00 H new ATOM 0 HB ILE 1 42 7.772 -6.366 5.982 1.00 0.00 H new ATOM 0 HG12 ILE 1 42 10.070 -7.514 5.079 1.00 0.00 H new ATOM 0 HG13 ILE 1 42 9.467 -8.783 6.127 1.00 0.00 H new ATOM 0 HG21 ILE 1 42 9.984 -5.356 5.909 1.00 0.00 H new ATOM 0 HG22 ILE 1 42 9.175 -5.065 7.467 1.00 0.00 H new ATOM 0 HG23 ILE 1 42 10.459 -6.291 7.346 1.00 0.00 H new ATOM 0 HD11 ILE 1 42 8.623 -9.052 3.851 1.00 0.00 H new ATOM 0 HD12 ILE 1 42 7.290 -8.714 4.981 1.00 0.00 H new ATOM 0 HD13 ILE 1 42 7.902 -7.426 3.917 1.00 0.00 H new ATOM 689 N LEU 1 43 6.191 -6.110 7.997 1.00 0.00 N ATOM 690 CA LEU 1 43 5.344 -5.137 8.622 1.00 0.00 C ATOM 691 C LEU 1 43 4.190 -5.821 9.324 1.00 0.00 C ATOM 692 O LEU 1 43 3.452 -5.191 10.076 1.00 0.00 O ATOM 693 CB LEU 1 43 4.786 -4.156 7.599 1.00 0.00 C ATOM 694 CG LEU 1 43 5.805 -3.515 6.663 1.00 0.00 C ATOM 695 CD1 LEU 1 43 7.165 -3.359 7.330 1.00 0.00 C ATOM 696 CD2 LEU 1 43 5.920 -4.315 5.379 1.00 0.00 C ATOM 0 H LEU 1 43 5.833 -6.475 7.114 1.00 0.00 H new ATOM 0 HA LEU 1 43 5.948 -4.590 9.346 1.00 0.00 H new ATOM 0 HB2 LEU 1 43 4.043 -4.676 6.994 1.00 0.00 H new ATOM 0 HB3 LEU 1 43 4.263 -3.363 8.133 1.00 0.00 H new ATOM 0 HG LEU 1 43 5.449 -2.514 6.420 1.00 0.00 H new ATOM 0 HD11 LEU 1 43 7.863 -2.899 6.630 1.00 0.00 H new ATOM 0 HD12 LEU 1 43 7.067 -2.728 8.213 1.00 0.00 H new ATOM 0 HD13 LEU 1 43 7.540 -4.339 7.625 1.00 0.00 H new ATOM 0 HD21 LEU 1 43 6.651 -3.845 4.721 1.00 0.00 H new ATOM 0 HD22 LEU 1 43 6.241 -5.331 5.611 1.00 0.00 H new ATOM 0 HD23 LEU 1 43 4.951 -4.345 4.881 1.00 0.00 H new ATOM 708 N VAL 1 44 4.007 -7.112 9.055 1.00 0.00 N ATOM 709 CA VAL 1 44 2.904 -7.829 9.658 1.00 0.00 C ATOM 710 C VAL 1 44 3.237 -9.275 9.905 1.00 0.00 C ATOM 711 O VAL 1 44 2.692 -10.176 9.267 1.00 0.00 O ATOM 712 CB VAL 1 44 1.636 -7.751 8.824 1.00 0.00 C ATOM 713 CG1 VAL 1 44 0.427 -8.061 9.689 1.00 0.00 C ATOM 714 CG2 VAL 1 44 1.500 -6.394 8.166 1.00 0.00 C ATOM 0 H VAL 1 44 4.598 -7.667 8.436 1.00 0.00 H new ATOM 0 HA VAL 1 44 2.726 -7.335 10.613 1.00 0.00 H new ATOM 0 HB VAL 1 44 1.696 -8.495 8.030 1.00 0.00 H new ATOM 0 HG11 VAL 1 44 -0.478 -8.003 9.084 1.00 0.00 H new ATOM 0 HG12 VAL 1 44 0.523 -9.065 10.103 1.00 0.00 H new ATOM 0 HG13 VAL 1 44 0.366 -7.338 10.502 1.00 0.00 H new ATOM 0 HG21 VAL 1 44 0.584 -6.366 7.576 1.00 0.00 H new ATOM 0 HG22 VAL 1 44 1.461 -5.620 8.933 1.00 0.00 H new ATOM 0 HG23 VAL 1 44 2.357 -6.218 7.515 1.00 0.00 H new ATOM 724 N PRO 1 45 4.119 -9.518 10.864 1.00 0.00 N ATOM 725 CA PRO 1 45 4.503 -10.861 11.245 1.00 0.00 C ATOM 726 C PRO 1 45 3.260 -11.688 11.477 1.00 0.00 C ATOM 727 O PRO 1 45 3.224 -12.891 11.222 1.00 0.00 O ATOM 728 CB PRO 1 45 5.246 -10.612 12.548 1.00 0.00 C ATOM 729 CG PRO 1 45 5.844 -9.280 12.373 1.00 0.00 C ATOM 730 CD PRO 1 45 4.775 -8.501 11.691 1.00 0.00 C ATOM 0 HA PRO 1 45 5.096 -11.399 10.506 1.00 0.00 H new ATOM 0 HB2 PRO 1 45 4.570 -10.636 13.403 1.00 0.00 H new ATOM 0 HB3 PRO 1 45 6.008 -11.371 12.723 1.00 0.00 H new ATOM 0 HG2 PRO 1 45 6.116 -8.834 13.330 1.00 0.00 H new ATOM 0 HG3 PRO 1 45 6.752 -9.325 11.772 1.00 0.00 H new ATOM 0 HD2 PRO 1 45 4.084 -8.050 12.404 1.00 0.00 H new ATOM 0 HD3 PRO 1 45 5.185 -7.691 11.088 1.00 0.00 H new ATOM 738 N THR 1 46 2.236 -10.987 11.946 1.00 0.00 N ATOM 739 CA THR 1 46 0.938 -11.577 12.227 1.00 0.00 C ATOM 740 C THR 1 46 0.037 -10.600 12.984 1.00 0.00 C ATOM 741 O THR 1 46 0.517 -9.727 13.706 1.00 0.00 O ATOM 742 CB THR 1 46 1.112 -12.855 13.052 1.00 0.00 C ATOM 743 OG1 THR 1 46 -0.119 -13.544 13.176 1.00 0.00 O ATOM 744 CG2 THR 1 46 1.643 -12.602 14.448 1.00 0.00 C ATOM 0 H THR 1 46 2.285 -9.987 12.143 1.00 0.00 H new ATOM 0 HA THR 1 46 0.465 -11.815 11.275 1.00 0.00 H new ATOM 0 HB THR 1 46 1.844 -13.451 12.508 1.00 0.00 H new ATOM 0 HG1 THR 1 46 -0.602 -13.213 13.962 1.00 0.00 H new ATOM 0 HG21 THR 1 46 1.742 -13.550 14.977 1.00 0.00 H new ATOM 0 HG22 THR 1 46 2.618 -12.118 14.384 1.00 0.00 H new ATOM 0 HG23 THR 1 46 0.952 -11.955 14.989 1.00 0.00 H new ATOM 752 N ASP 1 47 -1.275 -10.791 12.849 1.00 0.00 N ATOM 753 CA ASP 1 47 -2.267 -9.964 13.555 1.00 0.00 C ATOM 754 C ASP 1 47 -2.402 -8.537 13.025 1.00 0.00 C ATOM 755 O ASP 1 47 -2.340 -7.581 13.798 1.00 0.00 O ATOM 756 CB ASP 1 47 -1.899 -9.848 15.016 1.00 0.00 C ATOM 757 CG ASP 1 47 -1.244 -11.095 15.584 1.00 0.00 C ATOM 758 OD1 ASP 1 47 -1.458 -12.188 15.020 1.00 0.00 O ATOM 759 OD2 ASP 1 47 -0.519 -10.976 16.594 1.00 0.00 O ATOM 0 H ASP 1 47 -1.682 -11.514 12.255 1.00 0.00 H new ATOM 0 HA ASP 1 47 -3.215 -10.477 13.394 1.00 0.00 H new ATOM 0 HB2 ASP 1 47 -1.223 -9.003 15.145 1.00 0.00 H new ATOM 0 HB3 ASP 1 47 -2.798 -9.627 15.591 1.00 0.00 H new ATOM 764 N PHE 1 48 -2.672 -8.383 11.745 1.00 0.00 N ATOM 765 CA PHE 1 48 -2.878 -7.084 11.177 1.00 0.00 C ATOM 766 C PHE 1 48 -4.310 -6.695 11.439 1.00 0.00 C ATOM 767 O PHE 1 48 -5.221 -7.321 10.911 1.00 0.00 O ATOM 768 CB PHE 1 48 -2.638 -7.135 9.679 1.00 0.00 C ATOM 769 CG PHE 1 48 -1.852 -5.996 9.085 1.00 0.00 C ATOM 770 CD1 PHE 1 48 -1.349 -4.946 9.846 1.00 0.00 C ATOM 771 CD2 PHE 1 48 -1.610 -5.995 7.731 1.00 0.00 C ATOM 772 CE1 PHE 1 48 -0.629 -3.929 9.242 1.00 0.00 C ATOM 773 CE2 PHE 1 48 -0.896 -4.992 7.130 1.00 0.00 C ATOM 774 CZ PHE 1 48 -0.405 -3.955 7.882 1.00 0.00 C ATOM 0 H PHE 1 48 -2.753 -9.153 11.081 1.00 0.00 H new ATOM 0 HA PHE 1 48 -2.191 -6.362 11.618 1.00 0.00 H new ATOM 0 HB2 PHE 1 48 -2.118 -8.065 9.448 1.00 0.00 H new ATOM 0 HB3 PHE 1 48 -3.606 -7.178 9.180 1.00 0.00 H new ATOM 0 HD1 PHE 1 48 -1.521 -4.924 10.912 1.00 0.00 H new ATOM 0 HD2 PHE 1 48 -1.992 -6.805 7.127 1.00 0.00 H new ATOM 0 HE1 PHE 1 48 -0.243 -3.115 9.837 1.00 0.00 H new ATOM 0 HE2 PHE 1 48 -0.720 -5.018 6.065 1.00 0.00 H new ATOM 0 HZ PHE 1 48 0.155 -3.161 7.410 1.00 0.00 H new ATOM 784 N THR 1 49 -4.513 -5.704 12.268 1.00 0.00 N ATOM 785 CA THR 1 49 -5.862 -5.280 12.603 1.00 0.00 C ATOM 786 C THR 1 49 -6.705 -5.140 11.355 1.00 0.00 C ATOM 787 O THR 1 49 -6.759 -4.085 10.729 1.00 0.00 O ATOM 788 CB THR 1 49 -5.872 -3.958 13.343 1.00 0.00 C ATOM 789 OG1 THR 1 49 -4.629 -3.710 13.975 1.00 0.00 O ATOM 790 CG2 THR 1 49 -6.946 -3.886 14.386 1.00 0.00 C ATOM 0 H THR 1 49 -3.771 -5.174 12.725 1.00 0.00 H new ATOM 0 HA THR 1 49 -6.279 -6.050 13.252 1.00 0.00 H new ATOM 0 HB THR 1 49 -6.067 -3.202 12.582 1.00 0.00 H new ATOM 0 HG1 THR 1 49 -4.775 -3.184 14.789 1.00 0.00 H new ATOM 0 HG21 THR 1 49 -6.905 -2.917 14.884 1.00 0.00 H new ATOM 0 HG22 THR 1 49 -7.921 -4.011 13.914 1.00 0.00 H new ATOM 0 HG23 THR 1 49 -6.794 -4.677 15.120 1.00 0.00 H new ATOM 798 N TRP 1 50 -7.381 -6.218 11.026 1.00 0.00 N ATOM 799 CA TRP 1 50 -8.261 -6.267 9.873 1.00 0.00 C ATOM 800 C TRP 1 50 -9.124 -5.009 9.795 1.00 0.00 C ATOM 801 O TRP 1 50 -9.539 -4.577 8.720 1.00 0.00 O ATOM 802 CB TRP 1 50 -9.199 -7.462 10.027 1.00 0.00 C ATOM 803 CG TRP 1 50 -8.594 -8.820 9.800 1.00 0.00 C ATOM 804 CD1 TRP 1 50 -7.268 -9.150 9.825 1.00 0.00 C ATOM 805 CD2 TRP 1 50 -9.301 -10.036 9.516 1.00 0.00 C ATOM 806 NE1 TRP 1 50 -7.110 -10.492 9.575 1.00 0.00 N ATOM 807 CE2 TRP 1 50 -8.341 -11.057 9.382 1.00 0.00 C ATOM 808 CE3 TRP 1 50 -10.652 -10.358 9.363 1.00 0.00 C ATOM 809 CZ2 TRP 1 50 -8.691 -12.376 9.103 1.00 0.00 C ATOM 810 CZ3 TRP 1 50 -10.997 -11.668 9.085 1.00 0.00 C ATOM 811 CH2 TRP 1 50 -10.020 -12.662 8.958 1.00 0.00 C ATOM 0 H TRP 1 50 -7.338 -7.091 11.551 1.00 0.00 H new ATOM 0 HA TRP 1 50 -7.651 -6.347 8.973 1.00 0.00 H new ATOM 0 HB2 TRP 1 50 -9.620 -7.439 11.032 1.00 0.00 H new ATOM 0 HB3 TRP 1 50 -10.029 -7.337 9.331 1.00 0.00 H new ATOM 0 HD1 TRP 1 50 -6.462 -8.457 10.014 1.00 0.00 H new ATOM 0 HE1 TRP 1 50 -6.219 -10.987 9.539 1.00 0.00 H new ATOM 0 HE3 TRP 1 50 -11.413 -9.598 9.460 1.00 0.00 H new ATOM 0 HZ2 TRP 1 50 -7.939 -13.145 9.005 1.00 0.00 H new ATOM 0 HZ3 TRP 1 50 -12.038 -11.928 8.964 1.00 0.00 H new ATOM 0 HH2 TRP 1 50 -10.322 -13.676 8.741 1.00 0.00 H new ATOM 822 N VAL 1 51 -9.399 -4.449 10.962 1.00 0.00 N ATOM 823 CA VAL 1 51 -10.231 -3.262 11.088 1.00 0.00 C ATOM 824 C VAL 1 51 -9.737 -2.141 10.223 1.00 0.00 C ATOM 825 O VAL 1 51 -10.470 -1.574 9.412 1.00 0.00 O ATOM 826 CB VAL 1 51 -10.304 -2.763 12.552 1.00 0.00 C ATOM 827 CG1 VAL 1 51 -9.017 -2.076 12.990 1.00 0.00 C ATOM 828 CG2 VAL 1 51 -11.481 -1.822 12.737 1.00 0.00 C ATOM 0 H VAL 1 51 -9.051 -4.806 11.852 1.00 0.00 H new ATOM 0 HA VAL 1 51 -11.227 -3.558 10.759 1.00 0.00 H new ATOM 0 HB VAL 1 51 -10.441 -3.642 13.182 1.00 0.00 H new ATOM 0 HG11 VAL 1 51 -9.116 -1.743 14.023 1.00 0.00 H new ATOM 0 HG12 VAL 1 51 -8.186 -2.777 12.912 1.00 0.00 H new ATOM 0 HG13 VAL 1 51 -8.827 -1.216 12.348 1.00 0.00 H new ATOM 0 HG21 VAL 1 51 -11.516 -1.482 13.772 1.00 0.00 H new ATOM 0 HG22 VAL 1 51 -11.367 -0.963 12.076 1.00 0.00 H new ATOM 0 HG23 VAL 1 51 -12.406 -2.345 12.496 1.00 0.00 H new ATOM 838 N ASP 1 52 -8.500 -1.803 10.446 1.00 0.00 N ATOM 839 CA ASP 1 52 -7.892 -0.706 9.735 1.00 0.00 C ATOM 840 C ASP 1 52 -6.392 -0.838 9.596 1.00 0.00 C ATOM 841 O ASP 1 52 -5.770 -0.108 8.829 1.00 0.00 O ATOM 842 CB ASP 1 52 -8.204 0.572 10.480 1.00 0.00 C ATOM 843 CG ASP 1 52 -7.714 1.816 9.762 1.00 0.00 C ATOM 844 OD1 ASP 1 52 -7.367 1.713 8.566 1.00 0.00 O ATOM 845 OD2 ASP 1 52 -7.676 2.891 10.395 1.00 0.00 O ATOM 0 H ASP 1 52 -7.888 -2.270 11.115 1.00 0.00 H new ATOM 0 HA ASP 1 52 -8.303 -0.703 8.725 1.00 0.00 H new ATOM 0 HB2 ASP 1 52 -9.282 0.646 10.627 1.00 0.00 H new ATOM 0 HB3 ASP 1 52 -7.749 0.529 11.470 1.00 0.00 H new ATOM 850 N ASN 1 53 -5.807 -1.747 10.337 1.00 0.00 N ATOM 851 CA ASN 1 53 -4.370 -1.913 10.274 1.00 0.00 C ATOM 852 C ASN 1 53 -4.002 -2.827 9.159 1.00 0.00 C ATOM 853 O ASN 1 53 -2.867 -2.838 8.693 1.00 0.00 O ATOM 854 CB ASN 1 53 -3.794 -2.402 11.599 1.00 0.00 C ATOM 855 CG ASN 1 53 -4.035 -1.447 12.770 1.00 0.00 C ATOM 856 OD1 ASN 1 53 -3.404 -1.580 13.819 1.00 0.00 O ATOM 857 ND2 ASN 1 53 -4.941 -0.478 12.609 1.00 0.00 N ATOM 0 H ASN 1 53 -6.290 -2.374 10.980 1.00 0.00 H new ATOM 0 HA ASN 1 53 -3.931 -0.934 10.080 1.00 0.00 H new ATOM 0 HB2 ASN 1 53 -4.231 -3.372 11.838 1.00 0.00 H new ATOM 0 HB3 ASN 1 53 -2.721 -2.555 11.483 1.00 0.00 H new ATOM 0 HD21 ASN 1 53 -5.126 0.178 13.368 1.00 0.00 H new ATOM 0 HD22 ASN 1 53 -5.447 -0.394 11.727 1.00 0.00 H new ATOM 864 N GLY 1 54 -4.984 -3.522 8.671 1.00 0.00 N ATOM 865 CA GLY 1 54 -4.779 -4.338 7.570 1.00 0.00 C ATOM 866 C GLY 1 54 -4.799 -3.498 6.335 1.00 0.00 C ATOM 867 O GLY 1 54 -5.541 -2.518 6.250 1.00 0.00 O ATOM 0 H GLY 1 54 -5.935 -3.523 9.040 1.00 0.00 H new ATOM 0 HA2 GLY 1 54 -3.824 -4.857 7.658 1.00 0.00 H new ATOM 0 HA3 GLY 1 54 -5.554 -5.103 7.518 1.00 0.00 H new ATOM 871 N ILE 1 55 -3.984 -3.855 5.394 1.00 0.00 N ATOM 872 CA ILE 1 55 -3.904 -3.094 4.164 1.00 0.00 C ATOM 873 C ILE 1 55 -4.989 -3.501 3.188 1.00 0.00 C ATOM 874 O ILE 1 55 -5.026 -4.631 2.745 1.00 0.00 O ATOM 875 CB ILE 1 55 -2.544 -3.260 3.444 1.00 0.00 C ATOM 876 CG1 ILE 1 55 -2.729 -3.374 1.950 1.00 0.00 C ATOM 877 CG2 ILE 1 55 -1.766 -4.423 3.942 1.00 0.00 C ATOM 878 CD1 ILE 1 55 -2.640 -2.046 1.289 1.00 0.00 C ATOM 0 H ILE 1 55 -3.363 -4.663 5.442 1.00 0.00 H new ATOM 0 HA ILE 1 55 -4.028 -2.054 4.464 1.00 0.00 H new ATOM 0 HB ILE 1 55 -1.972 -2.360 3.670 1.00 0.00 H new ATOM 0 HG12 ILE 1 55 -1.970 -4.039 1.538 1.00 0.00 H new ATOM 0 HG13 ILE 1 55 -3.698 -3.825 1.735 1.00 0.00 H new ATOM 0 HG21 ILE 1 55 -0.822 -4.489 3.400 1.00 0.00 H new ATOM 0 HG22 ILE 1 55 -1.565 -4.298 5.006 1.00 0.00 H new ATOM 0 HG23 ILE 1 55 -2.338 -5.337 3.786 1.00 0.00 H new ATOM 0 HD11 ILE 1 55 -2.778 -2.165 0.214 1.00 0.00 H new ATOM 0 HD12 ILE 1 55 -3.416 -1.390 1.684 1.00 0.00 H new ATOM 0 HD13 ILE 1 55 -1.661 -1.608 1.483 1.00 0.00 H new ATOM 890 N ALA 1 56 -5.848 -2.572 2.806 1.00 0.00 N ATOM 891 CA ALA 1 56 -6.855 -2.896 1.830 1.00 0.00 C ATOM 892 C ALA 1 56 -6.182 -3.080 0.497 1.00 0.00 C ATOM 893 O ALA 1 56 -6.011 -2.133 -0.266 1.00 0.00 O ATOM 894 CB ALA 1 56 -7.949 -1.846 1.773 1.00 0.00 C ATOM 0 H ALA 1 56 -5.865 -1.612 3.151 1.00 0.00 H new ATOM 0 HA ALA 1 56 -7.352 -3.823 2.116 1.00 0.00 H new ATOM 0 HB1 ALA 1 56 -8.688 -2.130 1.024 1.00 0.00 H new ATOM 0 HB2 ALA 1 56 -8.431 -1.770 2.747 1.00 0.00 H new ATOM 0 HB3 ALA 1 56 -7.515 -0.882 1.507 1.00 0.00 H new ATOM 900 N ALA 1 57 -5.748 -4.303 0.260 1.00 0.00 N ATOM 901 CA ALA 1 57 -5.026 -4.644 -0.943 1.00 0.00 C ATOM 902 C ALA 1 57 -5.506 -3.888 -2.182 1.00 0.00 C ATOM 903 O ALA 1 57 -4.709 -3.530 -3.046 1.00 0.00 O ATOM 904 CB ALA 1 57 -5.068 -6.137 -1.193 1.00 0.00 C ATOM 0 H ALA 1 57 -5.888 -5.086 0.899 1.00 0.00 H new ATOM 0 HA ALA 1 57 -3.996 -4.332 -0.769 1.00 0.00 H new ATOM 0 HB1 ALA 1 57 -4.517 -6.369 -2.105 1.00 0.00 H new ATOM 0 HB2 ALA 1 57 -4.613 -6.660 -0.352 1.00 0.00 H new ATOM 0 HB3 ALA 1 57 -6.104 -6.458 -1.303 1.00 0.00 H new ATOM 910 N ASP 1 58 -6.802 -3.639 -2.268 1.00 0.00 N ATOM 911 CA ASP 1 58 -7.359 -2.921 -3.406 1.00 0.00 C ATOM 912 C ASP 1 58 -6.663 -1.580 -3.580 1.00 0.00 C ATOM 913 O ASP 1 58 -6.496 -1.086 -4.695 1.00 0.00 O ATOM 914 CB ASP 1 58 -8.852 -2.727 -3.232 1.00 0.00 C ATOM 915 CG ASP 1 58 -9.544 -2.337 -4.524 1.00 0.00 C ATOM 916 OD1 ASP 1 58 -9.221 -1.260 -5.069 1.00 0.00 O ATOM 917 OD2 ASP 1 58 -10.407 -3.108 -4.991 1.00 0.00 O ATOM 0 H ASP 1 58 -7.487 -3.921 -1.567 1.00 0.00 H new ATOM 0 HA ASP 1 58 -7.192 -3.515 -4.305 1.00 0.00 H new ATOM 0 HB2 ASP 1 58 -9.293 -3.649 -2.852 1.00 0.00 H new ATOM 0 HB3 ASP 1 58 -9.030 -1.956 -2.482 1.00 0.00 H new ATOM 922 N ASP 1 59 -6.261 -1.002 -2.458 1.00 0.00 N ATOM 923 CA ASP 1 59 -5.580 0.267 -2.434 1.00 0.00 C ATOM 924 C ASP 1 59 -4.176 0.157 -3.019 1.00 0.00 C ATOM 925 O ASP 1 59 -3.643 1.134 -3.546 1.00 0.00 O ATOM 926 CB ASP 1 59 -5.485 0.745 -0.990 1.00 0.00 C ATOM 927 CG ASP 1 59 -6.760 0.522 -0.200 1.00 0.00 C ATOM 928 OD1 ASP 1 59 -7.778 0.136 -0.808 1.00 0.00 O ATOM 929 OD2 ASP 1 59 -6.739 0.737 1.031 1.00 0.00 O ATOM 0 H ASP 1 59 -6.404 -1.411 -1.535 1.00 0.00 H new ATOM 0 HA ASP 1 59 -6.145 0.975 -3.040 1.00 0.00 H new ATOM 0 HB2 ASP 1 59 -4.664 0.226 -0.496 1.00 0.00 H new ATOM 0 HB3 ASP 1 59 -5.241 1.807 -0.981 1.00 0.00 H new ATOM 934 N VAL 1 60 -3.563 -1.021 -2.905 1.00 0.00 N ATOM 935 CA VAL 1 60 -2.226 -1.212 -3.404 1.00 0.00 C ATOM 936 C VAL 1 60 -2.201 -1.913 -4.743 1.00 0.00 C ATOM 937 O VAL 1 60 -3.239 -2.142 -5.362 1.00 0.00 O ATOM 938 CB VAL 1 60 -1.388 -1.989 -2.417 1.00 0.00 C ATOM 939 CG1 VAL 1 60 -1.329 -1.246 -1.115 1.00 0.00 C ATOM 940 CG2 VAL 1 60 -1.934 -3.382 -2.250 1.00 0.00 C ATOM 0 H VAL 1 60 -3.979 -1.846 -2.472 1.00 0.00 H new ATOM 0 HA VAL 1 60 -1.805 -0.216 -3.539 1.00 0.00 H new ATOM 0 HB VAL 1 60 -0.370 -2.087 -2.794 1.00 0.00 H new ATOM 0 HG11 VAL 1 60 -0.724 -1.807 -0.403 1.00 0.00 H new ATOM 0 HG12 VAL 1 60 -0.883 -0.265 -1.276 1.00 0.00 H new ATOM 0 HG13 VAL 1 60 -2.337 -1.126 -0.719 1.00 0.00 H new ATOM 0 HG21 VAL 1 60 -1.320 -3.930 -1.536 1.00 0.00 H new ATOM 0 HG22 VAL 1 60 -2.959 -3.329 -1.882 1.00 0.00 H new ATOM 0 HG23 VAL 1 60 -1.919 -3.896 -3.211 1.00 0.00 H new ATOM 950 N ILE 1 61 -0.997 -2.202 -5.203 1.00 0.00 N ATOM 951 CA ILE 1 61 -0.803 -2.817 -6.477 1.00 0.00 C ATOM 952 C ILE 1 61 0.314 -3.838 -6.453 1.00 0.00 C ATOM 953 O ILE 1 61 1.478 -3.502 -6.264 1.00 0.00 O ATOM 954 CB ILE 1 61 -0.497 -1.734 -7.463 1.00 0.00 C ATOM 955 CG1 ILE 1 61 0.073 -0.560 -6.739 1.00 0.00 C ATOM 956 CG2 ILE 1 61 -1.776 -1.307 -8.079 1.00 0.00 C ATOM 957 CD1 ILE 1 61 1.085 0.210 -7.514 1.00 0.00 C ATOM 0 H ILE 1 61 -0.134 -2.012 -4.694 1.00 0.00 H new ATOM 0 HA ILE 1 61 -1.708 -3.356 -6.757 1.00 0.00 H new ATOM 0 HB ILE 1 61 0.208 -2.095 -8.212 1.00 0.00 H new ATOM 0 HG12 ILE 1 61 -0.741 0.110 -6.461 1.00 0.00 H new ATOM 0 HG13 ILE 1 61 0.530 -0.907 -5.812 1.00 0.00 H new ATOM 0 HG21 ILE 1 61 -1.584 -0.516 -8.804 1.00 0.00 H new ATOM 0 HG22 ILE 1 61 -2.239 -2.156 -8.582 1.00 0.00 H new ATOM 0 HG23 ILE 1 61 -2.446 -0.934 -7.304 1.00 0.00 H new ATOM 0 HD11 ILE 1 61 1.446 1.044 -6.913 1.00 0.00 H new ATOM 0 HD12 ILE 1 61 1.921 -0.442 -7.769 1.00 0.00 H new ATOM 0 HD13 ILE 1 61 0.630 0.591 -8.428 1.00 0.00 H new ATOM 969 N GLU 1 62 -0.060 -5.083 -6.640 1.00 0.00 N ATOM 970 CA GLU 1 62 0.894 -6.186 -6.617 1.00 0.00 C ATOM 971 C GLU 1 62 1.906 -6.122 -7.746 1.00 0.00 C ATOM 972 O GLU 1 62 1.557 -6.005 -8.922 1.00 0.00 O ATOM 973 CB GLU 1 62 0.161 -7.526 -6.665 1.00 0.00 C ATOM 974 CG GLU 1 62 0.306 -8.339 -5.391 1.00 0.00 C ATOM 975 CD GLU 1 62 0.035 -9.815 -5.603 1.00 0.00 C ATOM 976 OE1 GLU 1 62 -1.148 -10.186 -5.754 1.00 0.00 O ATOM 977 OE2 GLU 1 62 1.006 -10.600 -5.617 1.00 0.00 O ATOM 0 H GLU 1 62 -1.025 -5.366 -6.812 1.00 0.00 H new ATOM 0 HA GLU 1 62 1.446 -6.093 -5.682 1.00 0.00 H new ATOM 0 HB2 GLU 1 62 -0.897 -7.346 -6.854 1.00 0.00 H new ATOM 0 HB3 GLU 1 62 0.540 -8.109 -7.504 1.00 0.00 H new ATOM 0 HG2 GLU 1 62 1.314 -8.212 -4.997 1.00 0.00 H new ATOM 0 HG3 GLU 1 62 -0.381 -7.952 -4.638 1.00 0.00 H new ATOM 984 N VAL 1 63 3.170 -6.229 -7.364 1.00 0.00 N ATOM 985 CA VAL 1 63 4.261 -6.222 -8.312 1.00 0.00 C ATOM 986 C VAL 1 63 4.937 -7.588 -8.331 1.00 0.00 C ATOM 987 O VAL 1 63 4.849 -8.340 -7.359 1.00 0.00 O ATOM 988 CB VAL 1 63 5.319 -5.166 -7.942 1.00 0.00 C ATOM 989 CG1 VAL 1 63 4.910 -3.783 -8.407 1.00 0.00 C ATOM 990 CG2 VAL 1 63 5.567 -5.171 -6.445 1.00 0.00 C ATOM 0 H VAL 1 63 3.462 -6.322 -6.391 1.00 0.00 H new ATOM 0 HA VAL 1 63 3.845 -5.984 -9.291 1.00 0.00 H new ATOM 0 HB VAL 1 63 6.245 -5.427 -8.455 1.00 0.00 H new ATOM 0 HG11 VAL 1 63 5.680 -3.063 -8.129 1.00 0.00 H new ATOM 0 HG12 VAL 1 63 4.789 -3.784 -9.490 1.00 0.00 H new ATOM 0 HG13 VAL 1 63 3.967 -3.505 -7.937 1.00 0.00 H new ATOM 0 HG21 VAL 1 63 6.317 -4.420 -6.198 1.00 0.00 H new ATOM 0 HG22 VAL 1 63 4.639 -4.943 -5.922 1.00 0.00 H new ATOM 0 HG23 VAL 1 63 5.924 -6.154 -6.139 1.00 0.00 H new ATOM 1000 N THR 1 64 5.631 -7.903 -9.419 1.00 0.00 N ATOM 1001 CA THR 1 64 6.331 -9.181 -9.511 1.00 0.00 C ATOM 1002 C THR 1 64 7.698 -9.045 -8.865 1.00 0.00 C ATOM 1003 O THR 1 64 8.189 -7.929 -8.713 1.00 0.00 O ATOM 1004 CB THR 1 64 6.461 -9.661 -10.963 1.00 0.00 C ATOM 1005 OG1 THR 1 64 7.604 -9.110 -11.596 1.00 0.00 O ATOM 1006 CG2 THR 1 64 5.252 -9.333 -11.818 1.00 0.00 C ATOM 0 H THR 1 64 5.724 -7.302 -10.238 1.00 0.00 H new ATOM 0 HA THR 1 64 5.747 -9.934 -8.983 1.00 0.00 H new ATOM 0 HB THR 1 64 6.550 -10.745 -10.887 1.00 0.00 H new ATOM 0 HG1 THR 1 64 7.657 -9.438 -12.518 1.00 0.00 H new ATOM 0 HG21 THR 1 64 5.412 -9.701 -12.831 1.00 0.00 H new ATOM 0 HG22 THR 1 64 4.367 -9.809 -11.395 1.00 0.00 H new ATOM 0 HG23 THR 1 64 5.106 -8.253 -11.843 1.00 0.00 H new ATOM 1014 N SER 1 65 8.295 -10.179 -8.488 1.00 0.00 N ATOM 1015 CA SER 1 65 9.600 -10.213 -7.818 1.00 0.00 C ATOM 1016 C SER 1 65 10.567 -9.158 -8.348 1.00 0.00 C ATOM 1017 O SER 1 65 11.355 -8.598 -7.585 1.00 0.00 O ATOM 1018 CB SER 1 65 10.226 -11.598 -7.976 1.00 0.00 C ATOM 1019 OG SER 1 65 9.242 -12.615 -7.891 1.00 0.00 O ATOM 0 H SER 1 65 7.887 -11.102 -8.639 1.00 0.00 H new ATOM 0 HA SER 1 65 9.422 -9.991 -6.766 1.00 0.00 H new ATOM 0 HB2 SER 1 65 10.738 -11.662 -8.936 1.00 0.00 H new ATOM 0 HB3 SER 1 65 10.979 -11.751 -7.203 1.00 0.00 H new ATOM 0 HG SER 1 65 9.667 -13.491 -7.997 1.00 0.00 H new ATOM 1025 N ASN 1 66 10.514 -8.884 -9.643 1.00 0.00 N ATOM 1026 CA ASN 1 66 11.393 -7.894 -10.231 1.00 0.00 C ATOM 1027 C ASN 1 66 10.916 -6.478 -9.914 1.00 0.00 C ATOM 1028 O ASN 1 66 11.613 -5.497 -10.171 1.00 0.00 O ATOM 1029 CB ASN 1 66 11.457 -8.082 -11.731 1.00 0.00 C ATOM 1030 CG ASN 1 66 12.873 -8.007 -12.269 1.00 0.00 C ATOM 1031 OD1 ASN 1 66 13.803 -8.557 -11.680 1.00 0.00 O ATOM 1032 ND2 ASN 1 66 13.043 -7.322 -13.394 1.00 0.00 N ATOM 0 H ASN 1 66 9.875 -9.332 -10.300 1.00 0.00 H new ATOM 0 HA ASN 1 66 12.386 -8.029 -9.803 1.00 0.00 H new ATOM 0 HB2 ASN 1 66 11.024 -9.048 -11.991 1.00 0.00 H new ATOM 0 HB3 ASN 1 66 10.848 -7.319 -12.215 1.00 0.00 H new ATOM 0 HD21 ASN 1 66 13.973 -7.236 -13.803 1.00 0.00 H new ATOM 0 HD22 ASN 1 66 12.243 -6.882 -13.849 1.00 0.00 H new ATOM 1039 N GLY 1 67 9.717 -6.396 -9.360 1.00 0.00 N ATOM 1040 CA GLY 1 67 9.122 -5.124 -9.011 1.00 0.00 C ATOM 1041 C GLY 1 67 8.212 -4.618 -10.098 1.00 0.00 C ATOM 1042 O GLY 1 67 7.961 -3.418 -10.203 1.00 0.00 O ATOM 0 H GLY 1 67 9.135 -7.205 -9.142 1.00 0.00 H new ATOM 0 HA2 GLY 1 67 8.558 -5.228 -8.084 1.00 0.00 H new ATOM 0 HA3 GLY 1 67 9.909 -4.393 -8.825 1.00 0.00 H new ATOM 1046 N THR 1 68 7.722 -5.538 -10.919 1.00 0.00 N ATOM 1047 CA THR 1 68 6.847 -5.179 -12.013 1.00 0.00 C ATOM 1048 C THR 1 68 5.453 -4.829 -11.505 1.00 0.00 C ATOM 1049 O THR 1 68 4.768 -5.661 -10.918 1.00 0.00 O ATOM 1050 CB THR 1 68 6.789 -6.313 -13.037 1.00 0.00 C ATOM 1051 OG1 THR 1 68 7.617 -6.027 -14.151 1.00 0.00 O ATOM 1052 CG2 THR 1 68 5.402 -6.571 -13.556 1.00 0.00 C ATOM 0 H THR 1 68 7.919 -6.536 -10.843 1.00 0.00 H new ATOM 0 HA THR 1 68 7.252 -4.293 -12.502 1.00 0.00 H new ATOM 0 HB THR 1 68 7.134 -7.200 -12.506 1.00 0.00 H new ATOM 0 HG1 THR 1 68 7.567 -6.765 -14.794 1.00 0.00 H new ATOM 0 HG21 THR 1 68 5.430 -7.387 -14.278 1.00 0.00 H new ATOM 0 HG22 THR 1 68 4.748 -6.842 -12.727 1.00 0.00 H new ATOM 0 HG23 THR 1 68 5.021 -5.671 -14.039 1.00 0.00 H new ATOM 1060 N ARG 1 69 5.051 -3.585 -11.716 1.00 0.00 N ATOM 1061 CA ARG 1 69 3.737 -3.120 -11.280 1.00 0.00 C ATOM 1062 C ARG 1 69 2.628 -3.664 -12.178 1.00 0.00 C ATOM 1063 O ARG 1 69 2.761 -3.688 -13.401 1.00 0.00 O ATOM 1064 CB ARG 1 69 3.700 -1.593 -11.233 1.00 0.00 C ATOM 1065 CG ARG 1 69 3.848 -1.035 -9.826 1.00 0.00 C ATOM 1066 CD ARG 1 69 3.303 0.379 -9.725 1.00 0.00 C ATOM 1067 NE ARG 1 69 4.045 1.313 -10.567 1.00 0.00 N ATOM 1068 CZ ARG 1 69 5.291 1.706 -10.318 1.00 0.00 C ATOM 1069 NH1 ARG 1 69 5.935 1.258 -9.248 1.00 0.00 N ATOM 1070 NH2 ARG 1 69 5.896 2.551 -11.142 1.00 0.00 N ATOM 0 H ARG 1 69 5.614 -2.877 -12.187 1.00 0.00 H new ATOM 0 HA ARG 1 69 3.561 -3.502 -10.274 1.00 0.00 H new ATOM 0 HB2 ARG 1 69 4.499 -1.197 -11.860 1.00 0.00 H new ATOM 0 HB3 ARG 1 69 2.758 -1.245 -11.658 1.00 0.00 H new ATOM 0 HG2 ARG 1 69 3.322 -1.679 -9.121 1.00 0.00 H new ATOM 0 HG3 ARG 1 69 4.900 -1.041 -9.540 1.00 0.00 H new ATOM 0 HD2 ARG 1 69 2.253 0.384 -10.016 1.00 0.00 H new ATOM 0 HD3 ARG 1 69 3.348 0.712 -8.688 1.00 0.00 H new ATOM 0 HE ARG 1 69 3.580 1.686 -11.395 1.00 0.00 H new ATOM 0 HH11 ARG 1 69 5.475 0.608 -8.611 1.00 0.00 H new ATOM 0 HH12 ARG 1 69 6.890 1.563 -9.063 1.00 0.00 H new ATOM 0 HH21 ARG 1 69 5.406 2.899 -11.966 1.00 0.00 H new ATOM 0 HH22 ARG 1 69 6.852 2.853 -10.952 1.00 0.00 H new ATOM 1084 N THR 1 70 1.530 -4.090 -11.553 1.00 0.00 N ATOM 1085 CA THR 1 70 0.381 -4.638 -12.277 1.00 0.00 C ATOM 1086 C THR 1 70 -0.905 -4.400 -11.485 1.00 0.00 C ATOM 1087 O THR 1 70 -1.280 -5.206 -10.633 1.00 0.00 O ATOM 1088 CB THR 1 70 0.553 -6.146 -12.506 1.00 0.00 C ATOM 1089 OG1 THR 1 70 0.718 -6.822 -11.273 1.00 0.00 O ATOM 1090 CG2 THR 1 70 1.731 -6.510 -13.386 1.00 0.00 C ATOM 0 H THR 1 70 1.411 -4.066 -10.540 1.00 0.00 H new ATOM 0 HA THR 1 70 0.319 -4.133 -13.241 1.00 0.00 H new ATOM 0 HB THR 1 70 -0.359 -6.454 -13.018 1.00 0.00 H new ATOM 0 HG1 THR 1 70 0.902 -6.170 -10.565 1.00 0.00 H new ATOM 0 HG21 THR 1 70 1.781 -7.593 -13.497 1.00 0.00 H new ATOM 0 HG22 THR 1 70 1.609 -6.050 -14.367 1.00 0.00 H new ATOM 0 HG23 THR 1 70 2.652 -6.149 -12.928 1.00 0.00 H new ATOM 1098 N SER 1 71 -1.568 -3.282 -11.767 1.00 0.00 N ATOM 1099 CA SER 1 71 -2.804 -2.922 -11.075 1.00 0.00 C ATOM 1100 C SER 1 71 -4.031 -3.511 -11.764 1.00 0.00 C ATOM 1101 O SER 1 71 -5.047 -3.778 -11.122 1.00 0.00 O ATOM 1102 CB SER 1 71 -2.937 -1.398 -11.007 1.00 0.00 C ATOM 1103 OG SER 1 71 -3.042 -0.830 -12.303 1.00 0.00 O ATOM 0 H SER 1 71 -1.270 -2.607 -12.472 1.00 0.00 H new ATOM 0 HA SER 1 71 -2.752 -3.337 -10.068 1.00 0.00 H new ATOM 0 HB2 SER 1 71 -3.816 -1.134 -10.420 1.00 0.00 H new ATOM 0 HB3 SER 1 71 -2.072 -0.978 -10.493 1.00 0.00 H new ATOM 0 HG SER 1 71 -3.127 0.143 -12.228 1.00 0.00 H new ATOM 1109 N ASP 1 72 -3.938 -3.698 -13.076 1.00 0.00 N ATOM 1110 CA ASP 1 72 -5.047 -4.240 -13.853 1.00 0.00 C ATOM 1111 C ASP 1 72 -5.530 -5.573 -13.283 1.00 0.00 C ATOM 1112 O ASP 1 72 -6.725 -5.871 -13.305 1.00 0.00 O ATOM 1113 CB ASP 1 72 -4.628 -4.414 -15.315 1.00 0.00 C ATOM 1114 CG ASP 1 72 -5.667 -3.882 -16.282 1.00 0.00 C ATOM 1115 OD1 ASP 1 72 -6.419 -2.961 -15.899 1.00 0.00 O ATOM 1116 OD2 ASP 1 72 -5.728 -4.386 -17.423 1.00 0.00 O ATOM 0 H ASP 1 72 -3.105 -3.482 -13.624 1.00 0.00 H new ATOM 0 HA ASP 1 72 -5.874 -3.532 -13.796 1.00 0.00 H new ATOM 0 HB2 ASP 1 72 -3.682 -3.899 -15.483 1.00 0.00 H new ATOM 0 HB3 ASP 1 72 -4.455 -5.471 -15.517 1.00 0.00 H new ATOM 1121 N GLN 1 73 -4.596 -6.369 -12.775 1.00 0.00 N ATOM 1122 CA GLN 1 73 -4.924 -7.675 -12.205 1.00 0.00 C ATOM 1123 C GLN 1 73 -5.525 -7.543 -10.807 1.00 0.00 C ATOM 1124 O GLN 1 73 -5.728 -6.435 -10.309 1.00 0.00 O ATOM 1125 CB GLN 1 73 -3.670 -8.549 -12.150 1.00 0.00 C ATOM 1126 CG GLN 1 73 -3.195 -9.014 -13.517 1.00 0.00 C ATOM 1127 CD GLN 1 73 -3.223 -10.523 -13.662 1.00 0.00 C ATOM 1128 OE1 GLN 1 73 -2.284 -11.214 -13.264 1.00 0.00 O ATOM 1129 NE2 GLN 1 73 -4.303 -11.043 -14.232 1.00 0.00 N ATOM 0 H GLN 1 73 -3.604 -6.134 -12.745 1.00 0.00 H new ATOM 0 HA GLN 1 73 -5.669 -8.143 -12.848 1.00 0.00 H new ATOM 0 HB2 GLN 1 73 -2.869 -7.991 -11.666 1.00 0.00 H new ATOM 0 HB3 GLN 1 73 -3.872 -9.421 -11.528 1.00 0.00 H new ATOM 0 HG2 GLN 1 73 -3.823 -8.567 -14.287 1.00 0.00 H new ATOM 0 HG3 GLN 1 73 -2.180 -8.655 -13.686 1.00 0.00 H new ATOM 0 HE21 GLN 1 73 -5.057 -10.433 -14.547 1.00 0.00 H new ATOM 0 HE22 GLN 1 73 -4.379 -12.053 -14.355 1.00 0.00 H new ATOM 1138 N VAL 1 74 -5.805 -8.684 -10.180 1.00 0.00 N ATOM 1139 CA VAL 1 74 -6.380 -8.713 -8.835 1.00 0.00 C ATOM 1140 C VAL 1 74 -5.347 -9.203 -7.820 1.00 0.00 C ATOM 1141 O VAL 1 74 -4.695 -10.225 -8.029 1.00 0.00 O ATOM 1142 CB VAL 1 74 -7.629 -9.617 -8.779 1.00 0.00 C ATOM 1143 CG1 VAL 1 74 -7.287 -11.041 -9.190 1.00 0.00 C ATOM 1144 CG2 VAL 1 74 -8.254 -9.591 -7.390 1.00 0.00 C ATOM 0 H VAL 1 74 -5.642 -9.606 -10.584 1.00 0.00 H new ATOM 0 HA VAL 1 74 -6.678 -7.695 -8.583 1.00 0.00 H new ATOM 0 HB VAL 1 74 -8.360 -9.227 -9.488 1.00 0.00 H new ATOM 0 HG11 VAL 1 74 -8.184 -11.659 -9.142 1.00 0.00 H new ATOM 0 HG12 VAL 1 74 -6.899 -11.042 -10.209 1.00 0.00 H new ATOM 0 HG13 VAL 1 74 -6.533 -11.444 -8.514 1.00 0.00 H new ATOM 0 HG21 VAL 1 74 -9.133 -10.235 -7.374 1.00 0.00 H new ATOM 0 HG22 VAL 1 74 -7.529 -9.948 -6.658 1.00 0.00 H new ATOM 0 HG23 VAL 1 74 -8.548 -8.571 -7.142 1.00 0.00 H new ATOM 1154 N LEU 1 75 -5.189 -8.457 -6.730 1.00 0.00 N ATOM 1155 CA LEU 1 75 -4.219 -8.805 -5.694 1.00 0.00 C ATOM 1156 C LEU 1 75 -4.504 -10.167 -5.072 1.00 0.00 C ATOM 1157 O LEU 1 75 -5.651 -10.606 -4.985 1.00 0.00 O ATOM 1158 CB LEU 1 75 -4.192 -7.733 -4.612 1.00 0.00 C ATOM 1159 CG LEU 1 75 -2.798 -7.226 -4.254 1.00 0.00 C ATOM 1160 CD1 LEU 1 75 -2.822 -5.732 -3.977 1.00 0.00 C ATOM 1161 CD2 LEU 1 75 -2.252 -7.986 -3.058 1.00 0.00 C ATOM 0 H LEU 1 75 -5.720 -7.607 -6.541 1.00 0.00 H new ATOM 0 HA LEU 1 75 -3.242 -8.862 -6.174 1.00 0.00 H new ATOM 0 HB2 LEU 1 75 -4.798 -6.889 -4.940 1.00 0.00 H new ATOM 0 HB3 LEU 1 75 -4.661 -8.131 -3.713 1.00 0.00 H new ATOM 0 HG LEU 1 75 -2.139 -7.400 -5.105 1.00 0.00 H new ATOM 0 HD11 LEU 1 75 -1.818 -5.393 -3.724 1.00 0.00 H new ATOM 0 HD12 LEU 1 75 -3.171 -5.203 -4.864 1.00 0.00 H new ATOM 0 HD13 LEU 1 75 -3.495 -5.527 -3.144 1.00 0.00 H new ATOM 0 HD21 LEU 1 75 -1.257 -7.614 -2.814 1.00 0.00 H new ATOM 0 HD22 LEU 1 75 -2.913 -7.843 -2.203 1.00 0.00 H new ATOM 0 HD23 LEU 1 75 -2.194 -9.048 -3.297 1.00 0.00 H new ATOM 1173 N GLN 1 76 -3.434 -10.815 -4.630 1.00 0.00 N ATOM 1174 CA GLN 1 76 -3.511 -12.121 -3.997 1.00 0.00 C ATOM 1175 C GLN 1 76 -2.292 -12.345 -3.109 1.00 0.00 C ATOM 1176 O GLN 1 76 -1.159 -12.090 -3.518 1.00 0.00 O ATOM 1177 CB GLN 1 76 -3.593 -13.225 -5.054 1.00 0.00 C ATOM 1178 CG GLN 1 76 -4.646 -12.972 -6.122 1.00 0.00 C ATOM 1179 CD GLN 1 76 -4.768 -14.121 -7.104 1.00 0.00 C ATOM 1180 OE1 GLN 1 76 -5.774 -14.832 -7.125 1.00 0.00 O ATOM 1181 NE2 GLN 1 76 -3.740 -14.312 -7.925 1.00 0.00 N ATOM 0 H GLN 1 76 -2.486 -10.446 -4.702 1.00 0.00 H new ATOM 0 HA GLN 1 76 -4.412 -12.155 -3.384 1.00 0.00 H new ATOM 0 HB2 GLN 1 76 -2.620 -13.330 -5.534 1.00 0.00 H new ATOM 0 HB3 GLN 1 76 -3.809 -14.173 -4.561 1.00 0.00 H new ATOM 0 HG2 GLN 1 76 -5.611 -12.804 -5.643 1.00 0.00 H new ATOM 0 HG3 GLN 1 76 -4.396 -12.060 -6.664 1.00 0.00 H new ATOM 0 HE21 GLN 1 76 -2.926 -13.700 -7.874 1.00 0.00 H new ATOM 0 HE22 GLN 1 76 -3.765 -15.071 -8.606 1.00 0.00 H new ATOM 1190 N LYS 1 77 -2.530 -12.817 -1.896 1.00 0.00 N ATOM 1191 CA LYS 1 77 -1.449 -13.065 -0.939 1.00 0.00 C ATOM 1192 C LYS 1 77 -0.620 -14.286 -1.273 1.00 0.00 C ATOM 1193 O LYS 1 77 -1.098 -15.243 -1.882 1.00 0.00 O ATOM 1194 CB LYS 1 77 -1.953 -13.186 0.491 1.00 0.00 C ATOM 1195 CG LYS 1 77 -2.534 -14.550 0.846 1.00 0.00 C ATOM 1196 CD LYS 1 77 -4.012 -14.641 0.505 1.00 0.00 C ATOM 1197 CE LYS 1 77 -4.648 -15.894 1.089 1.00 0.00 C ATOM 1198 NZ LYS 1 77 -3.877 -17.122 0.750 1.00 0.00 N ATOM 0 H LYS 1 77 -3.462 -13.038 -1.545 1.00 0.00 H new ATOM 0 HA LYS 1 77 -0.810 -12.186 -1.020 1.00 0.00 H new ATOM 0 HB2 LYS 1 77 -1.130 -12.968 1.172 1.00 0.00 H new ATOM 0 HB3 LYS 1 77 -2.716 -12.426 0.659 1.00 0.00 H new ATOM 0 HG2 LYS 1 77 -1.989 -15.327 0.311 1.00 0.00 H new ATOM 0 HG3 LYS 1 77 -2.394 -14.738 1.910 1.00 0.00 H new ATOM 0 HD2 LYS 1 77 -4.528 -13.760 0.886 1.00 0.00 H new ATOM 0 HD3 LYS 1 77 -4.136 -14.641 -0.578 1.00 0.00 H new ATOM 0 HE2 LYS 1 77 -4.714 -15.795 2.173 1.00 0.00 H new ATOM 0 HE3 LYS 1 77 -5.667 -15.991 0.715 1.00 0.00 H new ATOM 0 HZ1 LYS 1 77 -4.442 -17.963 0.987 1.00 0.00 H new ATOM 0 HZ2 LYS 1 77 -3.660 -17.126 -0.267 1.00 0.00 H new ATOM 0 HZ3 LYS 1 77 -2.990 -17.136 1.293 1.00 0.00 H new ATOM 1212 N GLY 1 78 0.636 -14.233 -0.851 1.00 0.00 N ATOM 1213 CA GLY 1 78 1.543 -15.322 -1.087 1.00 0.00 C ATOM 1214 C GLY 1 78 2.704 -14.892 -1.934 1.00 0.00 C ATOM 1215 O GLY 1 78 3.399 -15.732 -2.510 1.00 0.00 O ATOM 0 H GLY 1 78 1.039 -13.444 -0.345 1.00 0.00 H new ATOM 0 HA2 GLY 1 78 1.908 -15.707 -0.135 1.00 0.00 H new ATOM 0 HA3 GLY 1 78 1.014 -16.138 -1.579 1.00 0.00 H new ATOM 1219 N GLY 1 79 2.923 -13.581 -2.033 1.00 0.00 N ATOM 1220 CA GLY 1 79 4.020 -13.122 -2.850 1.00 0.00 C ATOM 1221 C GLY 1 79 4.601 -11.794 -2.427 1.00 0.00 C ATOM 1222 O GLY 1 79 5.272 -11.689 -1.401 1.00 0.00 O ATOM 0 H GLY 1 79 2.375 -12.853 -1.575 1.00 0.00 H new ATOM 0 HA2 GLY 1 79 4.810 -13.873 -2.831 1.00 0.00 H new ATOM 0 HA3 GLY 1 79 3.680 -13.043 -3.883 1.00 0.00 H new ATOM 1226 N TYR 1 80 4.347 -10.791 -3.246 1.00 0.00 N ATOM 1227 CA TYR 1 80 4.832 -9.448 -3.021 1.00 0.00 C ATOM 1228 C TYR 1 80 3.882 -8.459 -3.656 1.00 0.00 C ATOM 1229 O TYR 1 80 3.136 -8.815 -4.564 1.00 0.00 O ATOM 1230 CB TYR 1 80 6.225 -9.267 -3.631 1.00 0.00 C ATOM 1231 CG TYR 1 80 7.102 -10.497 -3.559 1.00 0.00 C ATOM 1232 CD1 TYR 1 80 6.961 -11.529 -4.479 1.00 0.00 C ATOM 1233 CD2 TYR 1 80 8.073 -10.622 -2.574 1.00 0.00 C ATOM 1234 CE1 TYR 1 80 7.764 -12.653 -4.418 1.00 0.00 C ATOM 1235 CE2 TYR 1 80 8.880 -11.742 -2.506 1.00 0.00 C ATOM 1236 CZ TYR 1 80 8.722 -12.756 -3.429 1.00 0.00 C ATOM 1237 OH TYR 1 80 9.526 -13.873 -3.361 1.00 0.00 O ATOM 0 H TYR 1 80 3.791 -10.890 -4.096 1.00 0.00 H new ATOM 0 HA TYR 1 80 4.892 -9.275 -1.946 1.00 0.00 H new ATOM 0 HB2 TYR 1 80 6.116 -8.974 -4.675 1.00 0.00 H new ATOM 0 HB3 TYR 1 80 6.728 -8.446 -3.120 1.00 0.00 H new ATOM 0 HD1 TYR 1 80 6.213 -11.452 -5.254 1.00 0.00 H new ATOM 0 HD2 TYR 1 80 8.200 -9.831 -1.849 1.00 0.00 H new ATOM 0 HE1 TYR 1 80 7.642 -13.447 -5.140 1.00 0.00 H new ATOM 0 HE2 TYR 1 80 9.631 -11.823 -1.734 1.00 0.00 H new ATOM 0 HH TYR 1 80 10.146 -13.784 -2.608 1.00 0.00 H new ATOM 1247 N PHE 1 81 3.941 -7.217 -3.224 1.00 0.00 N ATOM 1248 CA PHE 1 81 3.100 -6.190 -3.813 1.00 0.00 C ATOM 1249 C PHE 1 81 3.734 -4.845 -3.668 1.00 0.00 C ATOM 1250 O PHE 1 81 4.743 -4.675 -3.013 1.00 0.00 O ATOM 1251 CB PHE 1 81 1.705 -6.133 -3.209 1.00 0.00 C ATOM 1252 CG PHE 1 81 1.697 -6.022 -1.723 1.00 0.00 C ATOM 1253 CD1 PHE 1 81 2.229 -7.035 -0.951 1.00 0.00 C ATOM 1254 CD2 PHE 1 81 1.133 -4.917 -1.097 1.00 0.00 C ATOM 1255 CE1 PHE 1 81 2.202 -6.953 0.427 1.00 0.00 C ATOM 1256 CE2 PHE 1 81 1.097 -4.831 0.270 1.00 0.00 C ATOM 1257 CZ PHE 1 81 1.631 -5.849 1.040 1.00 0.00 C ATOM 0 H PHE 1 81 4.554 -6.894 -2.476 1.00 0.00 H new ATOM 0 HA PHE 1 81 2.999 -6.459 -4.864 1.00 0.00 H new ATOM 0 HB2 PHE 1 81 1.171 -5.281 -3.630 1.00 0.00 H new ATOM 0 HB3 PHE 1 81 1.156 -7.029 -3.500 1.00 0.00 H new ATOM 0 HD1 PHE 1 81 2.670 -7.898 -1.428 1.00 0.00 H new ATOM 0 HD2 PHE 1 81 0.719 -4.118 -1.694 1.00 0.00 H new ATOM 0 HE1 PHE 1 81 2.625 -7.747 1.025 1.00 0.00 H new ATOM 0 HE2 PHE 1 81 0.652 -3.970 0.746 1.00 0.00 H new ATOM 0 HZ PHE 1 81 1.603 -5.783 2.118 1.00 0.00 H new ATOM 1267 N VAL 1 82 3.125 -3.885 -4.282 1.00 0.00 N ATOM 1268 CA VAL 1 82 3.624 -2.546 -4.210 1.00 0.00 C ATOM 1269 C VAL 1 82 2.461 -1.619 -3.978 1.00 0.00 C ATOM 1270 O VAL 1 82 1.496 -1.639 -4.718 1.00 0.00 O ATOM 1271 CB VAL 1 82 4.402 -2.207 -5.505 1.00 0.00 C ATOM 1272 CG1 VAL 1 82 4.049 -0.831 -6.071 1.00 0.00 C ATOM 1273 CG2 VAL 1 82 5.899 -2.304 -5.252 1.00 0.00 C ATOM 0 H VAL 1 82 2.279 -4.000 -4.841 1.00 0.00 H new ATOM 0 HA VAL 1 82 4.324 -2.432 -3.382 1.00 0.00 H new ATOM 0 HB VAL 1 82 4.105 -2.939 -6.256 1.00 0.00 H new ATOM 0 HG11 VAL 1 82 4.627 -0.652 -6.978 1.00 0.00 H new ATOM 0 HG12 VAL 1 82 2.985 -0.796 -6.305 1.00 0.00 H new ATOM 0 HG13 VAL 1 82 4.283 -0.063 -5.334 1.00 0.00 H new ATOM 0 HG21 VAL 1 82 6.439 -2.064 -6.168 1.00 0.00 H new ATOM 0 HG22 VAL 1 82 6.182 -1.601 -4.469 1.00 0.00 H new ATOM 0 HG23 VAL 1 82 6.150 -3.317 -4.938 1.00 0.00 H new ATOM 1283 N ILE 1 83 2.547 -0.820 -2.941 1.00 0.00 N ATOM 1284 CA ILE 1 83 1.475 0.092 -2.617 1.00 0.00 C ATOM 1285 C ILE 1 83 1.459 1.249 -3.573 1.00 0.00 C ATOM 1286 O ILE 1 83 2.377 2.070 -3.589 1.00 0.00 O ATOM 1287 CB ILE 1 83 1.623 0.657 -1.206 1.00 0.00 C ATOM 1288 CG1 ILE 1 83 1.373 -0.407 -0.133 1.00 0.00 C ATOM 1289 CG2 ILE 1 83 0.698 1.850 -0.995 1.00 0.00 C ATOM 1290 CD1 ILE 1 83 1.663 -1.833 -0.556 1.00 0.00 C ATOM 0 H ILE 1 83 3.346 -0.782 -2.308 1.00 0.00 H new ATOM 0 HA ILE 1 83 0.548 -0.478 -2.687 1.00 0.00 H new ATOM 0 HB ILE 1 83 2.655 0.993 -1.105 1.00 0.00 H new ATOM 0 HG12 ILE 1 83 1.985 -0.172 0.738 1.00 0.00 H new ATOM 0 HG13 ILE 1 83 0.332 -0.344 0.183 1.00 0.00 H new ATOM 0 HG21 ILE 1 83 0.823 2.233 0.018 1.00 0.00 H new ATOM 0 HG22 ILE 1 83 0.945 2.633 -1.712 1.00 0.00 H new ATOM 0 HG23 ILE 1 83 -0.336 1.538 -1.139 1.00 0.00 H new ATOM 0 HD11 ILE 1 83 1.454 -2.508 0.274 1.00 0.00 H new ATOM 0 HD12 ILE 1 83 1.032 -2.096 -1.405 1.00 0.00 H new ATOM 0 HD13 ILE 1 83 2.711 -1.922 -0.841 1.00 0.00 H new ATOM 1302 N ASN 1 84 0.410 1.332 -4.353 1.00 0.00 N ATOM 1303 CA ASN 1 84 0.289 2.419 -5.283 1.00 0.00 C ATOM 1304 C ASN 1 84 0.368 3.744 -4.521 1.00 0.00 C ATOM 1305 O ASN 1 84 -0.515 4.059 -3.723 1.00 0.00 O ATOM 1306 CB ASN 1 84 -1.029 2.328 -6.031 1.00 0.00 C ATOM 1307 CG ASN 1 84 -0.868 2.576 -7.518 1.00 0.00 C ATOM 1308 OD1 ASN 1 84 -0.128 3.468 -7.932 1.00 0.00 O ATOM 1309 ND2 ASN 1 84 -1.552 1.785 -8.329 1.00 0.00 N ATOM 0 H ASN 1 84 -0.363 0.666 -4.361 1.00 0.00 H new ATOM 0 HA ASN 1 84 1.102 2.365 -6.008 1.00 0.00 H new ATOM 0 HB2 ASN 1 84 -1.465 1.341 -5.875 1.00 0.00 H new ATOM 0 HB3 ASN 1 84 -1.729 3.054 -5.618 1.00 0.00 H new ATOM 0 HD21 ASN 1 84 -1.477 1.903 -9.339 1.00 0.00 H new ATOM 0 HD22 ASN 1 84 -2.154 1.058 -7.944 1.00 0.00 H new ATOM 1316 N PRO 1 85 1.416 4.543 -4.766 1.00 0.00 N ATOM 1317 CA PRO 1 85 1.602 5.848 -4.111 1.00 0.00 C ATOM 1318 C PRO 1 85 0.594 6.839 -4.614 1.00 0.00 C ATOM 1319 O PRO 1 85 0.215 7.794 -3.937 1.00 0.00 O ATOM 1320 CB PRO 1 85 2.993 6.257 -4.570 1.00 0.00 C ATOM 1321 CG PRO 1 85 3.070 5.641 -5.913 1.00 0.00 C ATOM 1322 CD PRO 1 85 2.493 4.274 -5.727 1.00 0.00 C ATOM 0 HA PRO 1 85 1.485 5.805 -3.028 1.00 0.00 H new ATOM 0 HB2 PRO 1 85 3.106 7.340 -4.611 1.00 0.00 H new ATOM 0 HB3 PRO 1 85 3.769 5.880 -3.904 1.00 0.00 H new ATOM 0 HG2 PRO 1 85 2.504 6.215 -6.647 1.00 0.00 H new ATOM 0 HG3 PRO 1 85 4.099 5.593 -6.270 1.00 0.00 H new ATOM 0 HD2 PRO 1 85 2.116 3.857 -6.661 1.00 0.00 H new ATOM 0 HD3 PRO 1 85 3.226 3.568 -5.336 1.00 0.00 H new ATOM 1330 N ASN 1 86 0.169 6.592 -5.823 1.00 0.00 N ATOM 1331 CA ASN 1 86 -0.799 7.437 -6.462 1.00 0.00 C ATOM 1332 C ASN 1 86 -2.175 7.189 -5.873 1.00 0.00 C ATOM 1333 O ASN 1 86 -2.998 8.100 -5.777 1.00 0.00 O ATOM 1334 CB ASN 1 86 -0.791 7.222 -7.970 1.00 0.00 C ATOM 1335 CG ASN 1 86 -0.003 8.288 -8.702 1.00 0.00 C ATOM 1336 OD1 ASN 1 86 -0.556 9.054 -9.491 1.00 0.00 O ATOM 1337 ND2 ASN 1 86 1.298 8.344 -8.440 1.00 0.00 N ATOM 0 H ASN 1 86 0.483 5.804 -6.389 1.00 0.00 H new ATOM 0 HA ASN 1 86 -0.534 8.478 -6.280 1.00 0.00 H new ATOM 0 HB2 ASN 1 86 -0.366 6.243 -8.192 1.00 0.00 H new ATOM 0 HB3 ASN 1 86 -1.817 7.215 -8.339 1.00 0.00 H new ATOM 0 HD21 ASN 1 86 1.881 9.043 -8.900 1.00 0.00 H new ATOM 0 HD22 ASN 1 86 1.714 7.688 -7.778 1.00 0.00 H new ATOM 1344 N ASN 1 87 -2.389 5.967 -5.413 1.00 0.00 N ATOM 1345 CA ASN 1 87 -3.611 5.611 -4.753 1.00 0.00 C ATOM 1346 C ASN 1 87 -3.494 6.031 -3.315 1.00 0.00 C ATOM 1347 O ASN 1 87 -4.406 5.841 -2.516 1.00 0.00 O ATOM 1348 CB ASN 1 87 -3.749 4.138 -4.767 1.00 0.00 C ATOM 1349 CG ASN 1 87 -4.986 3.649 -5.463 1.00 0.00 C ATOM 1350 OD1 ASN 1 87 -5.912 4.406 -5.754 1.00 0.00 O ATOM 1351 ND2 ASN 1 87 -4.983 2.365 -5.738 1.00 0.00 N ATOM 0 H ASN 1 87 -1.716 5.204 -5.492 1.00 0.00 H new ATOM 0 HA ASN 1 87 -4.459 6.085 -5.247 1.00 0.00 H new ATOM 0 HB2 ASN 1 87 -2.875 3.706 -5.254 1.00 0.00 H new ATOM 0 HB3 ASN 1 87 -3.754 3.774 -3.740 1.00 0.00 H new ATOM 0 HD21 ASN 1 87 -5.778 1.945 -6.219 1.00 0.00 H new ATOM 0 HD22 ASN 1 87 -4.185 1.788 -5.471 1.00 0.00 H new ATOM 1358 N VAL 1 88 -2.326 6.559 -2.994 1.00 0.00 N ATOM 1359 CA VAL 1 88 -2.001 6.982 -1.706 1.00 0.00 C ATOM 1360 C VAL 1 88 -2.207 8.450 -1.533 1.00 0.00 C ATOM 1361 O VAL 1 88 -1.739 9.284 -2.308 1.00 0.00 O ATOM 1362 CB VAL 1 88 -0.566 6.672 -1.409 1.00 0.00 C ATOM 1363 CG1 VAL 1 88 -0.152 7.441 -0.184 1.00 0.00 C ATOM 1364 CG2 VAL 1 88 -0.436 5.193 -1.215 1.00 0.00 C ATOM 0 H VAL 1 88 -1.574 6.696 -3.669 1.00 0.00 H new ATOM 0 HA VAL 1 88 -2.661 6.450 -1.021 1.00 0.00 H new ATOM 0 HB VAL 1 88 0.089 6.968 -2.228 1.00 0.00 H new ATOM 0 HG11 VAL 1 88 0.892 7.226 0.045 1.00 0.00 H new ATOM 0 HG12 VAL 1 88 -0.270 8.509 -0.368 1.00 0.00 H new ATOM 0 HG13 VAL 1 88 -0.777 7.146 0.659 1.00 0.00 H new ATOM 0 HG21 VAL 1 88 0.603 4.945 -0.997 1.00 0.00 H new ATOM 0 HG22 VAL 1 88 -1.066 4.878 -0.383 1.00 0.00 H new ATOM 0 HG23 VAL 1 88 -0.750 4.678 -2.123 1.00 0.00 H new ATOM 1374 N LYS 1 89 -2.895 8.721 -0.485 1.00 0.00 N ATOM 1375 CA LYS 1 89 -3.201 10.061 -0.095 1.00 0.00 C ATOM 1376 C LYS 1 89 -2.047 10.585 0.706 1.00 0.00 C ATOM 1377 O LYS 1 89 -1.606 11.722 0.539 1.00 0.00 O ATOM 1378 CB LYS 1 89 -4.472 10.106 0.741 1.00 0.00 C ATOM 1379 CG LYS 1 89 -5.701 9.500 0.090 1.00 0.00 C ATOM 1380 CD LYS 1 89 -5.442 8.179 -0.603 1.00 0.00 C ATOM 1381 CE LYS 1 89 -4.869 8.359 -1.991 1.00 0.00 C ATOM 1382 NZ LYS 1 89 -5.888 8.182 -3.059 1.00 0.00 N ATOM 0 H LYS 1 89 -3.271 8.010 0.142 1.00 0.00 H new ATOM 0 HA LYS 1 89 -3.364 10.673 -0.982 1.00 0.00 H new ATOM 0 HB2 LYS 1 89 -4.287 9.587 1.681 1.00 0.00 H new ATOM 0 HB3 LYS 1 89 -4.688 11.146 0.988 1.00 0.00 H new ATOM 0 HG2 LYS 1 89 -6.468 9.355 0.850 1.00 0.00 H new ATOM 0 HG3 LYS 1 89 -6.101 10.207 -0.636 1.00 0.00 H new ATOM 0 HD2 LYS 1 89 -4.753 7.586 -0.002 1.00 0.00 H new ATOM 0 HD3 LYS 1 89 -6.374 7.617 -0.667 1.00 0.00 H new ATOM 0 HE2 LYS 1 89 -4.432 9.354 -2.073 1.00 0.00 H new ATOM 0 HE3 LYS 1 89 -4.062 7.642 -2.142 1.00 0.00 H new ATOM 0 HZ1 LYS 1 89 -5.685 8.833 -3.844 1.00 0.00 H new ATOM 0 HZ2 LYS 1 89 -5.860 7.202 -3.406 1.00 0.00 H new ATOM 0 HZ3 LYS 1 89 -6.833 8.387 -2.675 1.00 0.00 H new ATOM 1396 N SER 1 90 -1.553 9.721 1.578 1.00 0.00 N ATOM 1397 CA SER 1 90 -0.415 10.086 2.435 1.00 0.00 C ATOM 1398 C SER 1 90 -0.050 8.990 3.430 1.00 0.00 C ATOM 1399 O SER 1 90 -0.783 8.033 3.598 1.00 0.00 O ATOM 1400 CB SER 1 90 -0.728 11.378 3.201 1.00 0.00 C ATOM 1401 OG SER 1 90 -1.155 11.104 4.525 1.00 0.00 O ATOM 0 H SER 1 90 -1.908 8.775 1.717 1.00 0.00 H new ATOM 0 HA SER 1 90 0.441 10.231 1.775 1.00 0.00 H new ATOM 0 HB2 SER 1 90 0.159 12.011 3.227 1.00 0.00 H new ATOM 0 HB3 SER 1 90 -1.503 11.936 2.675 1.00 0.00 H new ATOM 0 HG SER 1 90 -1.345 11.946 4.988 1.00 0.00 H new ATOM 1407 N VAL 1 91 1.062 9.188 4.134 1.00 0.00 N ATOM 1408 CA VAL 1 91 1.510 8.288 5.171 1.00 0.00 C ATOM 1409 C VAL 1 91 1.253 8.975 6.513 1.00 0.00 C ATOM 1410 O VAL 1 91 1.664 10.117 6.722 1.00 0.00 O ATOM 1411 CB VAL 1 91 3.001 7.930 5.025 1.00 0.00 C ATOM 1412 CG1 VAL 1 91 3.149 6.507 4.516 1.00 0.00 C ATOM 1413 CG2 VAL 1 91 3.722 8.905 4.103 1.00 0.00 C ATOM 0 H VAL 1 91 1.677 9.989 3.992 1.00 0.00 H new ATOM 0 HA VAL 1 91 0.962 7.348 5.099 1.00 0.00 H new ATOM 0 HB VAL 1 91 3.463 8.005 6.009 1.00 0.00 H new ATOM 0 HG11 VAL 1 91 4.207 6.264 4.416 1.00 0.00 H new ATOM 0 HG12 VAL 1 91 2.684 5.818 5.221 1.00 0.00 H new ATOM 0 HG13 VAL 1 91 2.663 6.416 3.545 1.00 0.00 H new ATOM 0 HG21 VAL 1 91 4.772 8.622 4.023 1.00 0.00 H new ATOM 0 HG22 VAL 1 91 3.263 8.878 3.115 1.00 0.00 H new ATOM 0 HG23 VAL 1 91 3.648 9.913 4.510 1.00 0.00 H new ATOM 1423 N GLY 1 92 0.510 8.310 7.382 1.00 0.00 N ATOM 1424 CA GLY 1 92 0.126 8.874 8.643 1.00 0.00 C ATOM 1425 C GLY 1 92 0.995 8.472 9.803 1.00 0.00 C ATOM 1426 O GLY 1 92 1.957 7.714 9.678 1.00 0.00 O ATOM 0 H GLY 1 92 0.162 7.365 7.223 1.00 0.00 H new ATOM 0 HA2 GLY 1 92 0.137 9.961 8.558 1.00 0.00 H new ATOM 0 HA3 GLY 1 92 -0.902 8.582 8.858 1.00 0.00 H new ATOM 1430 N THR 1 93 0.615 9.017 10.934 1.00 0.00 N ATOM 1431 CA THR 1 93 1.267 8.808 12.202 1.00 0.00 C ATOM 1432 C THR 1 93 1.201 7.366 12.630 1.00 0.00 C ATOM 1433 O THR 1 93 0.189 6.680 12.489 1.00 0.00 O ATOM 1434 CB THR 1 93 0.588 9.701 13.228 1.00 0.00 C ATOM 1435 OG1 THR 1 93 -0.030 10.808 12.595 1.00 0.00 O ATOM 1436 CG2 THR 1 93 1.528 10.242 14.263 1.00 0.00 C ATOM 0 H THR 1 93 -0.188 9.642 10.997 1.00 0.00 H new ATOM 0 HA THR 1 93 2.324 9.060 12.113 1.00 0.00 H new ATOM 0 HB THR 1 93 -0.144 9.064 13.723 1.00 0.00 H new ATOM 0 HG1 THR 1 93 -0.463 11.371 13.270 1.00 0.00 H new ATOM 0 HG21 THR 1 93 0.977 10.870 14.962 1.00 0.00 H new ATOM 0 HG22 THR 1 93 1.989 9.415 14.804 1.00 0.00 H new ATOM 0 HG23 THR 1 93 2.303 10.834 13.777 1.00 0.00 H new ATOM 1444 N PRO 1 94 2.329 6.909 13.147 1.00 0.00 N ATOM 1445 CA PRO 1 94 2.520 5.550 13.617 1.00 0.00 C ATOM 1446 C PRO 1 94 1.976 5.313 15.017 1.00 0.00 C ATOM 1447 O PRO 1 94 1.832 6.238 15.817 1.00 0.00 O ATOM 1448 CB PRO 1 94 4.022 5.445 13.595 1.00 0.00 C ATOM 1449 CG PRO 1 94 4.441 6.782 14.052 1.00 0.00 C ATOM 1450 CD PRO 1 94 3.554 7.712 13.311 1.00 0.00 C ATOM 0 HA PRO 1 94 1.993 4.812 13.013 1.00 0.00 H new ATOM 0 HB2 PRO 1 94 4.384 4.658 14.257 1.00 0.00 H new ATOM 0 HB3 PRO 1 94 4.399 5.221 12.597 1.00 0.00 H new ATOM 0 HG2 PRO 1 94 4.321 6.891 15.130 1.00 0.00 H new ATOM 0 HG3 PRO 1 94 5.491 6.969 13.828 1.00 0.00 H new ATOM 0 HD2 PRO 1 94 3.368 8.629 13.870 1.00 0.00 H new ATOM 0 HD3 PRO 1 94 3.981 8.004 12.352 1.00 0.00 H new ATOM 1458 N MET 1 95 1.692 4.057 15.291 1.00 0.00 N ATOM 1459 CA MET 1 95 1.169 3.638 16.584 1.00 0.00 C ATOM 1460 C MET 1 95 1.611 2.218 16.910 1.00 0.00 C ATOM 1461 O MET 1 95 1.521 1.328 16.064 1.00 0.00 O ATOM 1462 CB MET 1 95 -0.357 3.730 16.601 1.00 0.00 C ATOM 1463 CG MET 1 95 -0.882 5.105 16.228 1.00 0.00 C ATOM 1464 SD MET 1 95 -2.546 5.408 16.849 1.00 0.00 S ATOM 1465 CE MET 1 95 -2.703 7.164 16.531 1.00 0.00 C ATOM 0 H MET 1 95 1.816 3.294 14.626 1.00 0.00 H new ATOM 0 HA MET 1 95 1.569 4.309 17.344 1.00 0.00 H new ATOM 0 HB2 MET 1 95 -0.766 2.993 15.910 1.00 0.00 H new ATOM 0 HB3 MET 1 95 -0.718 3.469 17.596 1.00 0.00 H new ATOM 0 HG2 MET 1 95 -0.208 5.866 16.622 1.00 0.00 H new ATOM 0 HG3 MET 1 95 -0.880 5.208 15.143 1.00 0.00 H new ATOM 0 HE1 MET 1 95 -3.683 7.507 16.861 1.00 0.00 H new ATOM 0 HE2 MET 1 95 -1.928 7.703 17.075 1.00 0.00 H new ATOM 0 HE3 MET 1 95 -2.594 7.352 15.463 1.00 0.00 H new ATOM 1475 N LYS 1 96 2.063 1.995 18.133 1.00 0.00 N ATOM 1476 CA LYS 1 96 2.493 0.661 18.541 1.00 0.00 C ATOM 1477 C LYS 1 96 1.303 -0.166 19.012 1.00 0.00 C ATOM 1478 O LYS 1 96 0.573 0.246 19.914 1.00 0.00 O ATOM 1479 CB LYS 1 96 3.552 0.741 19.647 1.00 0.00 C ATOM 1480 CG LYS 1 96 3.279 1.821 20.684 1.00 0.00 C ATOM 1481 CD LYS 1 96 4.009 3.112 20.349 1.00 0.00 C ATOM 1482 CE LYS 1 96 5.448 3.083 20.837 1.00 0.00 C ATOM 1483 NZ LYS 1 96 5.993 4.453 21.042 1.00 0.00 N ATOM 0 H LYS 1 96 2.143 2.710 18.856 1.00 0.00 H new ATOM 0 HA LYS 1 96 2.937 0.172 17.674 1.00 0.00 H new ATOM 0 HB2 LYS 1 96 3.613 -0.224 20.149 1.00 0.00 H new ATOM 0 HB3 LYS 1 96 4.525 0.925 19.192 1.00 0.00 H new ATOM 0 HG2 LYS 1 96 2.207 2.012 20.739 1.00 0.00 H new ATOM 0 HG3 LYS 1 96 3.591 1.470 21.668 1.00 0.00 H new ATOM 0 HD2 LYS 1 96 3.993 3.271 19.271 1.00 0.00 H new ATOM 0 HD3 LYS 1 96 3.487 3.954 20.803 1.00 0.00 H new ATOM 0 HE2 LYS 1 96 5.503 2.527 21.773 1.00 0.00 H new ATOM 0 HE3 LYS 1 96 6.066 2.551 20.114 1.00 0.00 H new ATOM 0 HZ1 LYS 1 96 6.976 4.389 21.375 1.00 0.00 H new ATOM 0 HZ2 LYS 1 96 5.965 4.976 20.143 1.00 0.00 H new ATOM 0 HZ3 LYS 1 96 5.419 4.952 21.751 1.00 0.00 H new ATOM 1497 N GLY 1 97 1.101 -1.332 18.395 1.00 0.00 N ATOM 1498 CA GLY 1 97 -0.016 -2.171 18.784 1.00 0.00 C ATOM 1499 C GLY 1 97 -0.002 -3.544 18.139 1.00 0.00 C ATOM 1500 O GLY 1 97 -0.124 -4.553 18.831 1.00 0.00 O ATOM 0 H GLY 1 97 1.683 -1.703 17.644 1.00 0.00 H new ATOM 0 HA2 GLY 1 97 -0.010 -2.288 19.868 1.00 0.00 H new ATOM 0 HA3 GLY 1 97 -0.946 -1.666 18.523 1.00 0.00 H new ATOM 1504 N SER 1 98 0.130 -3.588 16.815 1.00 0.00 N ATOM 1505 CA SER 1 98 0.146 -4.861 16.102 1.00 0.00 C ATOM 1506 C SER 1 98 1.382 -5.679 16.488 1.00 0.00 C ATOM 1507 O SER 1 98 2.288 -5.870 15.680 1.00 0.00 O ATOM 1508 CB SER 1 98 0.121 -4.634 14.585 1.00 0.00 C ATOM 1509 OG SER 1 98 -1.203 -4.685 14.084 1.00 0.00 O ATOM 0 H SER 1 98 0.226 -2.765 16.220 1.00 0.00 H new ATOM 0 HA SER 1 98 -0.747 -5.418 16.386 1.00 0.00 H new ATOM 0 HB2 SER 1 98 0.565 -3.666 14.352 1.00 0.00 H new ATOM 0 HB3 SER 1 98 0.730 -5.391 14.091 1.00 0.00 H new ATOM 0 HG SER 1 98 -1.493 -5.619 14.020 1.00 0.00 H new ATOM 1515 N GLY 1 99 1.409 -6.162 17.727 1.00 0.00 N ATOM 1516 CA GLY 1 99 2.534 -6.956 18.195 1.00 0.00 C ATOM 1517 C GLY 1 99 3.413 -6.221 19.196 1.00 0.00 C ATOM 1518 O GLY 1 99 3.733 -6.759 20.256 1.00 0.00 O ATOM 0 H GLY 1 99 0.671 -6.018 18.417 1.00 0.00 H new ATOM 0 HA2 GLY 1 99 2.159 -7.870 18.654 1.00 0.00 H new ATOM 0 HA3 GLY 1 99 3.140 -7.254 17.340 1.00 0.00 H new ATOM 1522 N GLY 1 100 3.809 -4.996 18.862 1.00 0.00 N ATOM 1523 CA GLY 1 100 4.651 -4.219 19.746 1.00 0.00 C ATOM 1524 C GLY 1 100 5.453 -3.154 19.015 1.00 0.00 C ATOM 1525 O GLY 1 100 5.982 -2.230 19.633 1.00 0.00 O ATOM 0 H GLY 1 100 3.559 -4.529 17.991 1.00 0.00 H new ATOM 0 HA2 GLY 1 100 4.030 -3.742 20.505 1.00 0.00 H new ATOM 0 HA3 GLY 1 100 5.335 -4.888 20.268 1.00 0.00 H new ATOM 1529 N LEU 1 101 5.540 -3.288 17.697 1.00 0.00 N ATOM 1530 CA LEU 1 101 6.258 -2.373 16.859 1.00 0.00 C ATOM 1531 C LEU 1 101 5.498 -1.091 16.649 1.00 0.00 C ATOM 1532 O LEU 1 101 4.676 -0.687 17.464 1.00 0.00 O ATOM 1533 CB LEU 1 101 6.465 -3.003 15.513 1.00 0.00 C ATOM 1534 CG LEU 1 101 6.609 -4.512 15.466 1.00 0.00 C ATOM 1535 CD1 LEU 1 101 5.271 -5.224 15.411 1.00 0.00 C ATOM 1536 CD2 LEU 1 101 7.358 -4.823 14.232 1.00 0.00 C ATOM 0 H LEU 1 101 5.101 -4.053 17.185 1.00 0.00 H new ATOM 0 HA LEU 1 101 7.204 -2.148 17.352 1.00 0.00 H new ATOM 0 HB2 LEU 1 101 5.624 -2.724 14.877 1.00 0.00 H new ATOM 0 HB3 LEU 1 101 7.359 -2.565 15.069 1.00 0.00 H new ATOM 0 HG LEU 1 101 7.114 -4.851 16.370 1.00 0.00 H new ATOM 0 HD11 LEU 1 101 5.433 -6.301 15.379 1.00 0.00 H new ATOM 0 HD12 LEU 1 101 4.688 -4.971 16.296 1.00 0.00 H new ATOM 0 HD13 LEU 1 101 4.729 -4.912 14.518 1.00 0.00 H new ATOM 0 HD21 LEU 1 101 7.490 -5.902 14.149 1.00 0.00 H new ATOM 0 HD22 LEU 1 101 6.803 -4.458 13.368 1.00 0.00 H new ATOM 0 HD23 LEU 1 101 8.334 -4.340 14.267 1.00 0.00 H new ATOM 1548 N SER 1 102 5.798 -0.477 15.521 1.00 0.00 N ATOM 1549 CA SER 1 102 5.181 0.745 15.096 1.00 0.00 C ATOM 1550 C SER 1 102 4.415 0.510 13.807 1.00 0.00 C ATOM 1551 O SER 1 102 4.986 0.105 12.799 1.00 0.00 O ATOM 1552 CB SER 1 102 6.235 1.807 14.915 1.00 0.00 C ATOM 1553 OG SER 1 102 6.413 2.561 16.102 1.00 0.00 O ATOM 0 H SER 1 102 6.495 -0.830 14.866 1.00 0.00 H new ATOM 0 HA SER 1 102 4.476 1.086 15.854 1.00 0.00 H new ATOM 0 HB2 SER 1 102 7.179 1.341 14.632 1.00 0.00 H new ATOM 0 HB3 SER 1 102 5.950 2.471 14.099 1.00 0.00 H new ATOM 0 HG SER 1 102 7.103 3.241 15.957 1.00 0.00 H new ATOM 1559 N TRP 1 103 3.127 0.744 13.866 1.00 0.00 N ATOM 1560 CA TRP 1 103 2.235 0.560 12.755 1.00 0.00 C ATOM 1561 C TRP 1 103 1.575 1.894 12.476 1.00 0.00 C ATOM 1562 O TRP 1 103 0.931 2.475 13.344 1.00 0.00 O ATOM 1563 CB TRP 1 103 1.243 -0.515 13.124 1.00 0.00 C ATOM 1564 CG TRP 1 103 1.964 -1.783 13.476 1.00 0.00 C ATOM 1565 CD1 TRP 1 103 2.942 -1.889 14.410 1.00 0.00 C ATOM 1566 CD2 TRP 1 103 1.829 -3.098 12.896 1.00 0.00 C ATOM 1567 NE1 TRP 1 103 3.455 -3.142 14.418 1.00 0.00 N ATOM 1568 CE2 TRP 1 103 2.783 -3.918 13.522 1.00 0.00 C ATOM 1569 CE3 TRP 1 103 1.011 -3.670 11.920 1.00 0.00 C ATOM 1570 CZ2 TRP 1 103 2.942 -5.265 13.199 1.00 0.00 C ATOM 1571 CZ3 TRP 1 103 1.171 -5.007 11.610 1.00 0.00 C ATOM 1572 CH2 TRP 1 103 2.132 -5.786 12.246 1.00 0.00 C ATOM 0 H TRP 1 103 2.661 1.076 14.711 1.00 0.00 H new ATOM 0 HA TRP 1 103 2.748 0.238 11.849 1.00 0.00 H new ATOM 0 HB2 TRP 1 103 0.636 -0.186 13.968 1.00 0.00 H new ATOM 0 HB3 TRP 1 103 0.562 -0.694 12.292 1.00 0.00 H new ATOM 0 HD1 TRP 1 103 3.266 -1.087 15.056 1.00 0.00 H new ATOM 0 HE1 TRP 1 103 4.227 -3.457 15.005 1.00 0.00 H new ATOM 0 HE3 TRP 1 103 0.264 -3.076 11.415 1.00 0.00 H new ATOM 0 HZ2 TRP 1 103 3.686 -5.873 13.692 1.00 0.00 H new ATOM 0 HZ3 TRP 1 103 0.538 -5.456 10.859 1.00 0.00 H new ATOM 0 HH2 TRP 1 103 2.234 -6.826 11.975 1.00 0.00 H new ATOM 1583 N ALA 1 104 1.807 2.402 11.291 1.00 0.00 N ATOM 1584 CA ALA 1 104 1.314 3.720 10.914 1.00 0.00 C ATOM 1585 C ALA 1 104 0.119 3.715 10.006 1.00 0.00 C ATOM 1586 O ALA 1 104 -0.036 2.863 9.133 1.00 0.00 O ATOM 1587 CB ALA 1 104 2.421 4.562 10.306 1.00 0.00 C ATOM 0 H ALA 1 104 2.337 1.926 10.561 1.00 0.00 H new ATOM 0 HA ALA 1 104 0.974 4.163 11.850 1.00 0.00 H new ATOM 0 HB1 ALA 1 104 2.026 5.541 10.034 1.00 0.00 H new ATOM 0 HB2 ALA 1 104 3.225 4.684 11.032 1.00 0.00 H new ATOM 0 HB3 ALA 1 104 2.808 4.066 9.416 1.00 0.00 H new ATOM 1593 N GLN 1 105 -0.713 4.714 10.245 1.00 0.00 N ATOM 1594 CA GLN 1 105 -1.912 4.927 9.503 1.00 0.00 C ATOM 1595 C GLN 1 105 -1.626 5.599 8.180 1.00 0.00 C ATOM 1596 O GLN 1 105 -1.439 6.802 8.147 1.00 0.00 O ATOM 1597 CB GLN 1 105 -2.835 5.827 10.296 1.00 0.00 C ATOM 1598 CG GLN 1 105 -4.266 5.592 9.947 1.00 0.00 C ATOM 1599 CD GLN 1 105 -5.241 6.227 10.916 1.00 0.00 C ATOM 1600 OE1 GLN 1 105 -4.909 7.189 11.609 1.00 0.00 O ATOM 1601 NE2 GLN 1 105 -6.456 5.692 10.971 1.00 0.00 N ATOM 0 H GLN 1 105 -0.557 5.406 10.978 1.00 0.00 H new ATOM 0 HA GLN 1 105 -2.371 3.956 9.319 1.00 0.00 H new ATOM 0 HB2 GLN 1 105 -2.687 5.653 11.362 1.00 0.00 H new ATOM 0 HB3 GLN 1 105 -2.580 6.869 10.105 1.00 0.00 H new ATOM 0 HG2 GLN 1 105 -4.456 5.982 8.947 1.00 0.00 H new ATOM 0 HG3 GLN 1 105 -4.450 4.518 9.911 1.00 0.00 H new ATOM 0 HE21 GLN 1 105 -6.690 4.895 10.379 1.00 0.00 H new ATOM 0 HE22 GLN 1 105 -7.155 6.078 11.605 1.00 0.00 H new ATOM 1610 N VAL 1 106 -1.626 4.859 7.083 1.00 0.00 N ATOM 1611 CA VAL 1 106 -1.382 5.462 5.808 1.00 0.00 C ATOM 1612 C VAL 1 106 -2.707 5.674 5.098 1.00 0.00 C ATOM 1613 O VAL 1 106 -3.598 4.830 5.140 1.00 0.00 O ATOM 1614 CB VAL 1 106 -0.383 4.625 4.998 1.00 0.00 C ATOM 1615 CG1 VAL 1 106 -0.347 5.058 3.557 1.00 0.00 C ATOM 1616 CG2 VAL 1 106 1.001 4.759 5.611 1.00 0.00 C ATOM 0 H VAL 1 106 -1.791 3.853 7.061 1.00 0.00 H new ATOM 0 HA VAL 1 106 -0.918 6.440 5.932 1.00 0.00 H new ATOM 0 HB VAL 1 106 -0.704 3.584 5.028 1.00 0.00 H new ATOM 0 HG11 VAL 1 106 0.370 4.445 3.011 1.00 0.00 H new ATOM 0 HG12 VAL 1 106 -1.337 4.938 3.116 1.00 0.00 H new ATOM 0 HG13 VAL 1 106 -0.049 6.105 3.499 1.00 0.00 H new ATOM 0 HG21 VAL 1 106 1.712 4.165 5.037 1.00 0.00 H new ATOM 0 HG22 VAL 1 106 1.306 5.805 5.595 1.00 0.00 H new ATOM 0 HG23 VAL 1 106 0.979 4.403 6.641 1.00 0.00 H new ATOM 1626 N ASN 1 107 -2.842 6.835 4.504 1.00 0.00 N ATOM 1627 CA ASN 1 107 -4.055 7.234 3.837 1.00 0.00 C ATOM 1628 C ASN 1 107 -4.080 6.759 2.400 1.00 0.00 C ATOM 1629 O ASN 1 107 -3.456 7.363 1.533 1.00 0.00 O ATOM 1630 CB ASN 1 107 -4.148 8.757 3.862 1.00 0.00 C ATOM 1631 CG ASN 1 107 -5.561 9.251 4.093 1.00 0.00 C ATOM 1632 OD1 ASN 1 107 -6.067 10.089 3.347 1.00 0.00 O ATOM 1633 ND2 ASN 1 107 -6.208 8.732 5.130 1.00 0.00 N ATOM 0 H ASN 1 107 -2.103 7.537 4.471 1.00 0.00 H new ATOM 0 HA ASN 1 107 -4.901 6.784 4.357 1.00 0.00 H new ATOM 0 HB2 ASN 1 107 -3.499 9.144 4.647 1.00 0.00 H new ATOM 0 HB3 ASN 1 107 -3.778 9.155 2.917 1.00 0.00 H new ATOM 0 HD21 ASN 1 107 -7.163 9.026 5.334 1.00 0.00 H new ATOM 0 HD22 ASN 1 107 -5.750 8.040 5.722 1.00 0.00 H new ATOM 1640 N PHE 1 108 -4.810 5.686 2.156 1.00 0.00 N ATOM 1641 CA PHE 1 108 -4.940 5.143 0.858 1.00 0.00 C ATOM 1642 C PHE 1 108 -6.260 5.523 0.209 1.00 0.00 C ATOM 1643 O PHE 1 108 -7.193 6.031 0.833 1.00 0.00 O ATOM 1644 CB PHE 1 108 -4.897 3.628 0.874 1.00 0.00 C ATOM 1645 CG PHE 1 108 -3.581 2.981 1.193 1.00 0.00 C ATOM 1646 CD1 PHE 1 108 -2.993 3.137 2.434 1.00 0.00 C ATOM 1647 CD2 PHE 1 108 -2.958 2.165 0.264 1.00 0.00 C ATOM 1648 CE1 PHE 1 108 -1.804 2.501 2.738 1.00 0.00 C ATOM 1649 CE2 PHE 1 108 -1.776 1.524 0.567 1.00 0.00 C ATOM 1650 CZ PHE 1 108 -1.196 1.693 1.805 1.00 0.00 C ATOM 0 H PHE 1 108 -5.326 5.178 2.874 1.00 0.00 H new ATOM 0 HA PHE 1 108 -4.101 5.552 0.295 1.00 0.00 H new ATOM 0 HB2 PHE 1 108 -5.630 3.277 1.600 1.00 0.00 H new ATOM 0 HB3 PHE 1 108 -5.220 3.271 -0.104 1.00 0.00 H new ATOM 0 HD1 PHE 1 108 -3.468 3.763 3.175 1.00 0.00 H new ATOM 0 HD2 PHE 1 108 -3.404 2.029 -0.710 1.00 0.00 H new ATOM 0 HE1 PHE 1 108 -1.352 2.638 3.709 1.00 0.00 H new ATOM 0 HE2 PHE 1 108 -1.304 0.888 -0.167 1.00 0.00 H new ATOM 0 HZ PHE 1 108 -0.268 1.194 2.042 1.00 0.00 H new ATOM 1660 N THR 1 109 -6.272 5.246 -1.070 1.00 0.00 N ATOM 1661 CA THR 1 109 -7.385 5.506 -1.981 1.00 0.00 C ATOM 1662 C THR 1 109 -8.761 4.972 -1.558 1.00 0.00 C ATOM 1663 O THR 1 109 -9.695 5.741 -1.330 1.00 0.00 O ATOM 1664 CB THR 1 109 -7.016 4.862 -3.296 1.00 0.00 C ATOM 1665 OG1 THR 1 109 -8.086 4.910 -4.224 1.00 0.00 O ATOM 1666 CG2 THR 1 109 -6.623 3.433 -3.091 1.00 0.00 C ATOM 0 H THR 1 109 -5.475 4.813 -1.537 1.00 0.00 H new ATOM 0 HA THR 1 109 -7.510 6.588 -2.013 1.00 0.00 H new ATOM 0 HB THR 1 109 -6.175 5.427 -3.699 1.00 0.00 H new ATOM 0 HG1 THR 1 109 -7.742 4.753 -5.128 1.00 0.00 H new ATOM 0 HG21 THR 1 109 -6.361 2.987 -4.050 1.00 0.00 H new ATOM 0 HG22 THR 1 109 -5.764 3.384 -2.421 1.00 0.00 H new ATOM 0 HG23 THR 1 109 -7.457 2.886 -2.652 1.00 0.00 H new ATOM 1674 N THR 1 110 -8.880 3.656 -1.513 1.00 0.00 N ATOM 1675 CA THR 1 110 -10.137 2.986 -1.189 1.00 0.00 C ATOM 1676 C THR 1 110 -10.340 2.808 0.303 1.00 0.00 C ATOM 1677 O THR 1 110 -11.356 3.224 0.861 1.00 0.00 O ATOM 1678 CB THR 1 110 -10.187 1.632 -1.879 1.00 0.00 C ATOM 1679 OG1 THR 1 110 -9.445 1.653 -3.086 1.00 0.00 O ATOM 1680 CG2 THR 1 110 -11.591 1.171 -2.208 1.00 0.00 C ATOM 0 H THR 1 110 -8.108 3.016 -1.700 1.00 0.00 H new ATOM 0 HA THR 1 110 -10.944 3.625 -1.548 1.00 0.00 H new ATOM 0 HB THR 1 110 -9.755 0.933 -1.163 1.00 0.00 H new ATOM 0 HG1 THR 1 110 -9.489 0.772 -3.513 1.00 0.00 H new ATOM 0 HG21 THR 1 110 -11.549 0.198 -2.698 1.00 0.00 H new ATOM 0 HG22 THR 1 110 -12.172 1.089 -1.289 1.00 0.00 H new ATOM 0 HG23 THR 1 110 -12.064 1.893 -2.874 1.00 0.00 H new ATOM 1688 N GLY 1 111 -9.377 2.166 0.939 1.00 0.00 N ATOM 1689 CA GLY 1 111 -9.468 1.915 2.349 1.00 0.00 C ATOM 1690 C GLY 1 111 -9.308 3.165 3.183 1.00 0.00 C ATOM 1691 O GLY 1 111 -9.479 3.116 4.401 1.00 0.00 O ATOM 0 H GLY 1 111 -8.529 1.813 0.495 1.00 0.00 H new ATOM 0 HA2 GLY 1 111 -10.433 1.459 2.570 1.00 0.00 H new ATOM 0 HA3 GLY 1 111 -8.702 1.194 2.634 1.00 0.00 H new ATOM 1695 N GLY 1 112 -8.958 4.287 2.548 1.00 0.00 N ATOM 1696 CA GLY 1 112 -8.764 5.497 3.295 1.00 0.00 C ATOM 1697 C GLY 1 112 -7.657 5.298 4.291 1.00 0.00 C ATOM 1698 O GLY 1 112 -6.501 5.486 3.977 1.00 0.00 O ATOM 0 H GLY 1 112 -8.810 4.367 1.542 1.00 0.00 H new ATOM 0 HA2 GLY 1 112 -8.518 6.318 2.621 1.00 0.00 H new ATOM 0 HA3 GLY 1 112 -9.685 5.772 3.809 1.00 0.00 H new ATOM 1702 N ASN 1 113 -7.992 4.849 5.474 1.00 0.00 N ATOM 1703 CA ASN 1 113 -6.979 4.559 6.452 1.00 0.00 C ATOM 1704 C ASN 1 113 -6.486 3.132 6.236 1.00 0.00 C ATOM 1705 O ASN 1 113 -7.283 2.200 6.119 1.00 0.00 O ATOM 1706 CB ASN 1 113 -7.521 4.741 7.867 1.00 0.00 C ATOM 1707 CG ASN 1 113 -8.957 4.282 8.008 1.00 0.00 C ATOM 1708 OD1 ASN 1 113 -9.799 4.987 8.565 1.00 0.00 O ATOM 1709 ND2 ASN 1 113 -9.238 3.090 7.502 1.00 0.00 N ATOM 0 H ASN 1 113 -8.950 4.678 5.780 1.00 0.00 H new ATOM 0 HA ASN 1 113 -6.147 5.253 6.333 1.00 0.00 H new ATOM 0 HB2 ASN 1 113 -6.896 4.184 8.565 1.00 0.00 H new ATOM 0 HB3 ASN 1 113 -7.451 5.792 8.146 1.00 0.00 H new ATOM 0 HD21 ASN 1 113 -10.186 2.720 7.565 1.00 0.00 H new ATOM 0 HD22 ASN 1 113 -8.506 2.543 7.049 1.00 0.00 H new ATOM 1716 N VAL 1 114 -5.185 2.966 6.185 1.00 0.00 N ATOM 1717 CA VAL 1 114 -4.579 1.664 5.995 1.00 0.00 C ATOM 1718 C VAL 1 114 -3.298 1.632 6.778 1.00 0.00 C ATOM 1719 O VAL 1 114 -2.372 2.381 6.478 1.00 0.00 O ATOM 1720 CB VAL 1 114 -4.262 1.372 4.532 1.00 0.00 C ATOM 1721 CG1 VAL 1 114 -3.988 -0.102 4.341 1.00 0.00 C ATOM 1722 CG2 VAL 1 114 -5.383 1.841 3.617 1.00 0.00 C ATOM 0 H VAL 1 114 -4.514 3.729 6.274 1.00 0.00 H new ATOM 0 HA VAL 1 114 -5.287 0.908 6.333 1.00 0.00 H new ATOM 0 HB VAL 1 114 -3.366 1.930 4.260 1.00 0.00 H new ATOM 0 HG11 VAL 1 114 -3.763 -0.297 3.293 1.00 0.00 H new ATOM 0 HG12 VAL 1 114 -3.137 -0.397 4.956 1.00 0.00 H new ATOM 0 HG13 VAL 1 114 -4.866 -0.677 4.637 1.00 0.00 H new ATOM 0 HG21 VAL 1 114 -5.125 1.618 2.582 1.00 0.00 H new ATOM 0 HG22 VAL 1 114 -6.307 1.326 3.880 1.00 0.00 H new ATOM 0 HG23 VAL 1 114 -5.521 2.916 3.733 1.00 0.00 H new ATOM 1732 N TRP 1 115 -3.241 0.810 7.790 1.00 0.00 N ATOM 1733 CA TRP 1 115 -2.053 0.770 8.610 1.00 0.00 C ATOM 1734 C TRP 1 115 -1.031 -0.222 8.134 1.00 0.00 C ATOM 1735 O TRP 1 115 -1.335 -1.196 7.446 1.00 0.00 O ATOM 1736 CB TRP 1 115 -2.397 0.500 10.051 1.00 0.00 C ATOM 1737 CG TRP 1 115 -3.223 1.553 10.624 1.00 0.00 C ATOM 1738 CD1 TRP 1 115 -4.508 1.830 10.315 1.00 0.00 C ATOM 1739 CD2 TRP 1 115 -2.811 2.502 11.579 1.00 0.00 C ATOM 1740 NE1 TRP 1 115 -4.936 2.864 11.066 1.00 0.00 N ATOM 1741 CE2 TRP 1 115 -3.907 3.306 11.841 1.00 0.00 C ATOM 1742 CE3 TRP 1 115 -1.618 2.735 12.247 1.00 0.00 C ATOM 1743 CZ2 TRP 1 115 -3.864 4.339 12.737 1.00 0.00 C ATOM 1744 CZ3 TRP 1 115 -1.564 3.774 13.152 1.00 0.00 C ATOM 1745 CH2 TRP 1 115 -2.689 4.572 13.391 1.00 0.00 C ATOM 0 H TRP 1 115 -3.985 0.169 8.066 1.00 0.00 H new ATOM 0 HA TRP 1 115 -1.602 1.758 8.522 1.00 0.00 H new ATOM 0 HB2 TRP 1 115 -2.922 -0.453 10.126 1.00 0.00 H new ATOM 0 HB3 TRP 1 115 -1.479 0.404 10.631 1.00 0.00 H new ATOM 0 HD1 TRP 1 115 -5.100 1.305 9.580 1.00 0.00 H new ATOM 0 HE1 TRP 1 115 -5.879 3.253 11.056 1.00 0.00 H new ATOM 0 HE3 TRP 1 115 -0.752 2.117 12.063 1.00 0.00 H new ATOM 0 HZ2 TRP 1 115 -4.734 4.952 12.921 1.00 0.00 H new ATOM 0 HZ3 TRP 1 115 -0.644 3.974 13.682 1.00 0.00 H new ATOM 0 HH2 TRP 1 115 -2.626 5.382 14.102 1.00 0.00 H new ATOM 1756 N LEU 1 116 0.195 0.055 8.522 1.00 0.00 N ATOM 1757 CA LEU 1 116 1.313 -0.769 8.175 1.00 0.00 C ATOM 1758 C LEU 1 116 2.373 -0.607 9.221 1.00 0.00 C ATOM 1759 O LEU 1 116 2.587 0.501 9.700 1.00 0.00 O ATOM 1760 CB LEU 1 116 1.882 -0.330 6.835 1.00 0.00 C ATOM 1761 CG LEU 1 116 2.169 -1.467 5.857 1.00 0.00 C ATOM 1762 CD1 LEU 1 116 1.043 -1.583 4.845 1.00 0.00 C ATOM 1763 CD2 LEU 1 116 3.500 -1.249 5.159 1.00 0.00 C ATOM 0 H LEU 1 116 0.437 0.866 9.091 1.00 0.00 H new ATOM 0 HA LEU 1 116 0.991 -1.809 8.111 1.00 0.00 H new ATOM 0 HB2 LEU 1 116 1.182 0.363 6.369 1.00 0.00 H new ATOM 0 HB3 LEU 1 116 2.806 0.220 7.011 1.00 0.00 H new ATOM 0 HG LEU 1 116 2.230 -2.401 6.416 1.00 0.00 H new ATOM 0 HD11 LEU 1 116 1.258 -2.397 4.153 1.00 0.00 H new ATOM 0 HD12 LEU 1 116 0.107 -1.787 5.364 1.00 0.00 H new ATOM 0 HD13 LEU 1 116 0.955 -0.649 4.290 1.00 0.00 H new ATOM 0 HD21 LEU 1 116 3.686 -2.070 4.466 1.00 0.00 H new ATOM 0 HD22 LEU 1 116 3.472 -0.309 4.608 1.00 0.00 H new ATOM 0 HD23 LEU 1 116 4.298 -1.212 5.901 1.00 0.00 H new ATOM 1775 N ASN 1 117 3.072 -1.669 9.556 1.00 0.00 N ATOM 1776 CA ASN 1 117 4.111 -1.508 10.536 1.00 0.00 C ATOM 1777 C ASN 1 117 5.139 -0.615 9.946 1.00 0.00 C ATOM 1778 O ASN 1 117 5.938 -0.946 9.070 1.00 0.00 O ATOM 1779 CB ASN 1 117 4.652 -2.789 11.052 1.00 0.00 C ATOM 1780 CG ASN 1 117 6.134 -2.781 11.375 1.00 0.00 C ATOM 1781 OD1 ASN 1 117 6.980 -2.938 10.496 1.00 0.00 O ATOM 1782 ND2 ASN 1 117 6.446 -2.617 12.656 1.00 0.00 N ATOM 0 H ASN 1 117 2.947 -2.610 9.182 1.00 0.00 H new ATOM 0 HA ASN 1 117 3.700 -1.049 11.435 1.00 0.00 H new ATOM 0 HB2 ASN 1 117 4.102 -3.061 11.953 1.00 0.00 H new ATOM 0 HB3 ASN 1 117 4.461 -3.569 10.315 1.00 0.00 H new ATOM 0 HD21 ASN 1 117 7.424 -2.618 12.947 1.00 0.00 H new ATOM 0 HD22 ASN 1 117 5.708 -2.490 13.348 1.00 0.00 H new ATOM 1789 N THR 1 118 4.960 0.560 10.420 1.00 0.00 N ATOM 1790 CA THR 1 118 5.677 1.737 10.021 1.00 0.00 C ATOM 1791 C THR 1 118 7.067 1.810 10.585 1.00 0.00 C ATOM 1792 O THR 1 118 7.690 2.872 10.570 1.00 0.00 O ATOM 1793 CB THR 1 118 4.863 2.922 10.461 1.00 0.00 C ATOM 1794 OG1 THR 1 118 5.242 4.100 9.770 1.00 0.00 O ATOM 1795 CG2 THR 1 118 4.967 3.180 11.942 1.00 0.00 C ATOM 0 H THR 1 118 4.267 0.750 11.144 1.00 0.00 H new ATOM 0 HA THR 1 118 5.809 1.718 8.939 1.00 0.00 H new ATOM 0 HB THR 1 118 3.830 2.670 10.223 1.00 0.00 H new ATOM 0 HG1 THR 1 118 6.219 4.171 9.757 1.00 0.00 H new ATOM 0 HG21 THR 1 118 4.360 4.046 12.204 1.00 0.00 H new ATOM 0 HG22 THR 1 118 4.610 2.308 12.489 1.00 0.00 H new ATOM 0 HG23 THR 1 118 6.007 3.373 12.206 1.00 0.00 H new ATOM 1803 N THR 1 119 7.567 0.694 11.068 1.00 0.00 N ATOM 1804 CA THR 1 119 8.923 0.684 11.599 1.00 0.00 C ATOM 1805 C THR 1 119 9.945 1.006 10.480 1.00 0.00 C ATOM 1806 O THR 1 119 11.121 0.659 10.586 1.00 0.00 O ATOM 1807 CB THR 1 119 9.244 -0.671 12.239 1.00 0.00 C ATOM 1808 OG1 THR 1 119 10.419 -0.584 13.027 1.00 0.00 O ATOM 1809 CG2 THR 1 119 9.450 -1.784 11.234 1.00 0.00 C ATOM 0 H THR 1 119 7.075 -0.199 11.107 1.00 0.00 H new ATOM 0 HA THR 1 119 8.994 1.453 12.368 1.00 0.00 H new ATOM 0 HB THR 1 119 8.372 -0.914 12.846 1.00 0.00 H new ATOM 0 HG1 THR 1 119 11.118 -0.118 12.522 1.00 0.00 H new ATOM 0 HG21 THR 1 119 9.673 -2.712 11.760 1.00 0.00 H new ATOM 0 HG22 THR 1 119 8.544 -1.911 10.641 1.00 0.00 H new ATOM 0 HG23 THR 1 119 10.281 -1.531 10.576 1.00 0.00 H new ATOM 1817 N SER 1 120 9.478 1.699 9.422 1.00 0.00 N ATOM 1818 CA SER 1 120 10.290 2.110 8.306 1.00 0.00 C ATOM 1819 C SER 1 120 9.404 2.933 7.380 1.00 0.00 C ATOM 1820 O SER 1 120 8.371 2.466 6.930 1.00 0.00 O ATOM 1821 CB SER 1 120 10.865 0.905 7.558 1.00 0.00 C ATOM 1822 OG SER 1 120 10.334 -0.310 8.058 1.00 0.00 O ATOM 0 H SER 1 120 8.502 1.985 9.337 1.00 0.00 H new ATOM 0 HA SER 1 120 11.138 2.696 8.660 1.00 0.00 H new ATOM 0 HB2 SER 1 120 10.641 0.993 6.495 1.00 0.00 H new ATOM 0 HB3 SER 1 120 11.951 0.898 7.655 1.00 0.00 H new ATOM 0 HG SER 1 120 11.061 -0.864 8.411 1.00 0.00 H new ATOM 1828 N LYS 1 121 9.786 4.159 7.113 1.00 0.00 N ATOM 1829 CA LYS 1 121 8.995 5.015 6.249 1.00 0.00 C ATOM 1830 C LYS 1 121 9.117 4.504 4.828 1.00 0.00 C ATOM 1831 O LYS 1 121 8.136 4.379 4.086 1.00 0.00 O ATOM 1832 CB LYS 1 121 9.456 6.454 6.407 1.00 0.00 C ATOM 1833 CG LYS 1 121 10.630 6.857 5.519 1.00 0.00 C ATOM 1834 CD LYS 1 121 10.688 8.364 5.315 1.00 0.00 C ATOM 1835 CE LYS 1 121 10.748 9.112 6.639 1.00 0.00 C ATOM 1836 NZ LYS 1 121 9.743 10.212 6.700 1.00 0.00 N ATOM 0 H LYS 1 121 10.636 4.589 7.478 1.00 0.00 H new ATOM 0 HA LYS 1 121 7.939 4.992 6.520 1.00 0.00 H new ATOM 0 HB2 LYS 1 121 8.615 7.114 6.194 1.00 0.00 H new ATOM 0 HB3 LYS 1 121 9.734 6.618 7.448 1.00 0.00 H new ATOM 0 HG2 LYS 1 121 11.562 6.514 5.969 1.00 0.00 H new ATOM 0 HG3 LYS 1 121 10.542 6.362 4.552 1.00 0.00 H new ATOM 0 HD2 LYS 1 121 11.563 8.616 4.715 1.00 0.00 H new ATOM 0 HD3 LYS 1 121 9.812 8.689 4.754 1.00 0.00 H new ATOM 0 HE2 LYS 1 121 10.574 8.415 7.459 1.00 0.00 H new ATOM 0 HE3 LYS 1 121 11.747 9.525 6.778 1.00 0.00 H new ATOM 0 HZ1 LYS 1 121 9.815 10.698 7.617 1.00 0.00 H new ATOM 0 HZ2 LYS 1 121 9.924 10.891 5.933 1.00 0.00 H new ATOM 0 HZ3 LYS 1 121 8.788 9.816 6.592 1.00 0.00 H new ATOM 1850 N ASP 1 122 10.328 4.105 4.486 1.00 0.00 N ATOM 1851 CA ASP 1 122 10.571 3.494 3.217 1.00 0.00 C ATOM 1852 C ASP 1 122 9.838 2.160 3.191 1.00 0.00 C ATOM 1853 O ASP 1 122 9.855 1.458 2.201 1.00 0.00 O ATOM 1854 CB ASP 1 122 12.055 3.310 2.974 1.00 0.00 C ATOM 1855 CG ASP 1 122 12.768 4.622 2.719 1.00 0.00 C ATOM 1856 OD1 ASP 1 122 12.214 5.466 1.983 1.00 0.00 O ATOM 1857 OD2 ASP 1 122 13.879 4.808 3.257 1.00 0.00 O ATOM 0 H ASP 1 122 11.153 4.199 5.079 1.00 0.00 H new ATOM 0 HA ASP 1 122 10.202 4.136 2.417 1.00 0.00 H new ATOM 0 HB2 ASP 1 122 12.503 2.819 3.838 1.00 0.00 H new ATOM 0 HB3 ASP 1 122 12.201 2.649 2.120 1.00 0.00 H new ATOM 1862 N ASN 1 123 9.229 1.784 4.317 1.00 0.00 N ATOM 1863 CA ASN 1 123 8.522 0.530 4.400 1.00 0.00 C ATOM 1864 C ASN 1 123 7.354 0.517 3.434 1.00 0.00 C ATOM 1865 O ASN 1 123 7.270 -0.311 2.541 1.00 0.00 O ATOM 1866 CB ASN 1 123 8.009 0.329 5.833 1.00 0.00 C ATOM 1867 CG ASN 1 123 6.870 -0.632 5.838 1.00 0.00 C ATOM 1868 OD1 ASN 1 123 5.964 -0.544 6.661 1.00 0.00 O ATOM 1869 ND2 ASN 1 123 6.921 -1.558 4.897 1.00 0.00 N ATOM 0 H ASN 1 123 9.218 2.336 5.175 1.00 0.00 H new ATOM 0 HA ASN 1 123 9.203 -0.279 4.136 1.00 0.00 H new ATOM 0 HB2 ASN 1 123 8.813 -0.045 6.467 1.00 0.00 H new ATOM 0 HB3 ASN 1 123 7.691 1.284 6.251 1.00 0.00 H new ATOM 0 HD21 ASN 1 123 6.179 -2.254 4.825 1.00 0.00 H new ATOM 0 HD22 ASN 1 123 7.703 -1.577 4.242 1.00 0.00 H new ATOM 1876 N LEU 1 124 6.476 1.442 3.594 1.00 0.00 N ATOM 1877 CA LEU 1 124 5.344 1.534 2.700 1.00 0.00 C ATOM 1878 C LEU 1 124 5.831 1.842 1.310 1.00 0.00 C ATOM 1879 O LEU 1 124 5.555 1.127 0.350 1.00 0.00 O ATOM 1880 CB LEU 1 124 4.362 2.608 3.136 1.00 0.00 C ATOM 1881 CG LEU 1 124 4.462 3.025 4.584 1.00 0.00 C ATOM 1882 CD1 LEU 1 124 4.319 1.810 5.501 1.00 0.00 C ATOM 1883 CD2 LEU 1 124 5.785 3.736 4.818 1.00 0.00 C ATOM 0 H LEU 1 124 6.506 2.150 4.328 1.00 0.00 H new ATOM 0 HA LEU 1 124 4.824 0.576 2.721 1.00 0.00 H new ATOM 0 HB2 LEU 1 124 4.510 3.488 2.511 1.00 0.00 H new ATOM 0 HB3 LEU 1 124 3.350 2.250 2.947 1.00 0.00 H new ATOM 0 HG LEU 1 124 3.650 3.714 4.818 1.00 0.00 H new ATOM 0 HD11 LEU 1 124 4.393 2.128 6.541 1.00 0.00 H new ATOM 0 HD12 LEU 1 124 3.350 1.340 5.334 1.00 0.00 H new ATOM 0 HD13 LEU 1 124 5.112 1.094 5.283 1.00 0.00 H new ATOM 0 HD21 LEU 1 124 5.857 4.037 5.863 1.00 0.00 H new ATOM 0 HD22 LEU 1 124 6.608 3.063 4.577 1.00 0.00 H new ATOM 0 HD23 LEU 1 124 5.841 4.619 4.182 1.00 0.00 H new ATOM 1895 N LEU 1 125 6.555 2.937 1.224 1.00 0.00 N ATOM 1896 CA LEU 1 125 7.094 3.392 -0.024 1.00 0.00 C ATOM 1897 C LEU 1 125 7.993 2.360 -0.669 1.00 0.00 C ATOM 1898 O LEU 1 125 7.916 2.129 -1.872 1.00 0.00 O ATOM 1899 CB LEU 1 125 7.900 4.658 0.203 1.00 0.00 C ATOM 1900 CG LEU 1 125 7.093 5.893 0.584 1.00 0.00 C ATOM 1901 CD1 LEU 1 125 6.648 5.769 2.026 1.00 0.00 C ATOM 1902 CD2 LEU 1 125 7.917 7.156 0.376 1.00 0.00 C ATOM 0 H LEU 1 125 6.782 3.531 2.021 1.00 0.00 H new ATOM 0 HA LEU 1 125 6.252 3.578 -0.691 1.00 0.00 H new ATOM 0 HB2 LEU 1 125 8.630 4.466 0.989 1.00 0.00 H new ATOM 0 HB3 LEU 1 125 8.460 4.878 -0.706 1.00 0.00 H new ATOM 0 HG LEU 1 125 6.214 5.964 -0.056 1.00 0.00 H new ATOM 0 HD11 LEU 1 125 6.070 6.650 2.305 1.00 0.00 H new ATOM 0 HD12 LEU 1 125 6.031 4.878 2.141 1.00 0.00 H new ATOM 0 HD13 LEU 1 125 7.523 5.690 2.671 1.00 0.00 H new ATOM 0 HD21 LEU 1 125 7.324 8.027 0.653 1.00 0.00 H new ATOM 0 HD22 LEU 1 125 8.812 7.113 0.997 1.00 0.00 H new ATOM 0 HD23 LEU 1 125 8.207 7.233 -0.672 1.00 0.00 H new ATOM 1914 N TYR 1 126 8.881 1.777 0.127 1.00 0.00 N ATOM 1915 CA TYR 1 126 9.839 0.820 -0.400 1.00 0.00 C ATOM 1916 C TYR 1 126 9.621 -0.578 0.142 1.00 0.00 C ATOM 1917 O TYR 1 126 9.907 -1.562 -0.538 1.00 0.00 O ATOM 1918 CB TYR 1 126 11.247 1.291 -0.050 1.00 0.00 C ATOM 1919 CG TYR 1 126 11.979 1.926 -1.201 1.00 0.00 C ATOM 1920 CD1 TYR 1 126 11.452 3.036 -1.845 1.00 0.00 C ATOM 1921 CD2 TYR 1 126 13.193 1.422 -1.640 1.00 0.00 C ATOM 1922 CE1 TYR 1 126 12.117 3.626 -2.902 1.00 0.00 C ATOM 1923 CE2 TYR 1 126 13.865 2.006 -2.694 1.00 0.00 C ATOM 1924 CZ TYR 1 126 13.322 3.107 -3.323 1.00 0.00 C ATOM 1925 OH TYR 1 126 13.989 3.692 -4.375 1.00 0.00 O ATOM 0 H TYR 1 126 8.956 1.949 1.130 1.00 0.00 H new ATOM 0 HA TYR 1 126 9.703 0.769 -1.480 1.00 0.00 H new ATOM 0 HB2 TYR 1 126 11.187 2.007 0.770 1.00 0.00 H new ATOM 0 HB3 TYR 1 126 11.825 0.441 0.311 1.00 0.00 H new ATOM 0 HD1 TYR 1 126 10.508 3.445 -1.515 1.00 0.00 H new ATOM 0 HD2 TYR 1 126 13.619 0.559 -1.150 1.00 0.00 H new ATOM 0 HE1 TYR 1 126 11.695 4.489 -3.396 1.00 0.00 H new ATOM 0 HE2 TYR 1 126 14.811 1.603 -3.025 1.00 0.00 H new ATOM 0 HH TYR 1 126 14.822 3.205 -4.545 1.00 0.00 H new ATOM 1935 N GLY 1 127 9.150 -0.678 1.371 1.00 0.00 N ATOM 1936 CA GLY 1 127 8.959 -1.995 1.955 1.00 0.00 C ATOM 1937 C GLY 1 127 10.073 -2.339 2.909 1.00 0.00 C ATOM 1938 O GLY 1 127 10.380 -3.510 3.133 1.00 0.00 O ATOM 0 H GLY 1 127 8.899 0.109 1.970 1.00 0.00 H new ATOM 0 HA2 GLY 1 127 8.005 -2.027 2.481 1.00 0.00 H new ATOM 0 HA3 GLY 1 127 8.912 -2.743 1.163 1.00 0.00 H new ATOM 1942 N LYS 1 128 10.681 -1.303 3.470 1.00 0.00 N ATOM 1943 CA LYS 1 128 11.756 -1.466 4.405 1.00 0.00 C ATOM 1944 C LYS 1 128 11.230 -1.914 5.766 1.00 0.00 C ATOM 1945 O LYS 1 128 10.010 -2.160 5.874 1.00 0.00 O ATOM 1946 CB LYS 1 128 12.474 -0.139 4.556 1.00 0.00 C ATOM 1947 CG LYS 1 128 13.092 0.366 3.272 1.00 0.00 C ATOM 1948 CD LYS 1 128 14.233 1.330 3.565 1.00 0.00 C ATOM 1949 CE LYS 1 128 14.955 1.743 2.293 1.00 0.00 C ATOM 1950 NZ LYS 1 128 16.111 2.637 2.574 1.00 0.00 N ATOM 1951 OXT LYS 1 128 12.042 -2.017 6.709 1.00 0.00 O ATOM 0 H LYS 1 128 10.434 -0.331 3.282 1.00 0.00 H new ATOM 0 HA LYS 1 128 12.438 -2.230 4.032 1.00 0.00 H new ATOM 0 HB2 LYS 1 128 11.769 0.605 4.927 1.00 0.00 H new ATOM 0 HB3 LYS 1 128 13.255 -0.242 5.309 1.00 0.00 H new ATOM 0 HG2 LYS 1 128 13.462 -0.475 2.686 1.00 0.00 H new ATOM 0 HG3 LYS 1 128 12.333 0.866 2.670 1.00 0.00 H new ATOM 0 HD2 LYS 1 128 13.843 2.215 4.067 1.00 0.00 H new ATOM 0 HD3 LYS 1 128 14.940 0.861 4.250 1.00 0.00 H new ATOM 0 HE2 LYS 1 128 15.304 0.853 1.769 1.00 0.00 H new ATOM 0 HE3 LYS 1 128 14.257 2.251 1.628 1.00 0.00 H new ATOM 0 HZ1 LYS 1 128 16.684 2.745 1.713 1.00 0.00 H new ATOM 0 HZ2 LYS 1 128 15.763 3.569 2.878 1.00 0.00 H new ATOM 0 HZ3 LYS 1 128 16.695 2.223 3.328 1.00 0.00 H new TER 1965 LYS 1 128