USER MOD reduce.3.24.130724 H: found=0, std=0, add=981, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 980 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 79 ASN : amide:sc= -1.03 K(o=-2,f=-8.3!) USER MOD Set 1.2: A 80 ASN : amide:sc= -1.01 X(o=-2,f=-1.7) USER MOD Set 2.1: A 73 CYS SG : rot 33:sc= -1.39! USER MOD Set 2.2: A 116 HIS : no HD1:sc= -3.9! C(o=-5.3!,f=-8.2!) USER MOD Set 3.1: A 17 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 39 HIS : no HE2:sc= -1.95! C(o=-1.9!,f=-4.7!) USER MOD Single : A 10 LYS NZ :NH3+ -150:sc= 0 (180deg=-0.0173) USER MOD Single : A 16 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 CYS SG : rot 180:sc= -0.0179 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 141:sc= 0.516 (180deg=0.0505) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 ASN : amide:sc= -0.0459 K(o=-0.046,f=-1.6!) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ -166:sc= 0 (180deg=-0.0139) USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ 173:sc= -0.784 (180deg=-0.871) USER MOD Single : A 43 THR OG1 : rot 180:sc= -0.0222 USER MOD Single : A 45 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 46 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 47 LYS NZ :NH3+ -158:sc= -0.977 (180deg=-1.01) USER MOD Single : A 48 THR OG1 : rot 130:sc= 0 USER MOD Single : A 49 GLN : amide:sc= -1.51 K(o=-1.5,f=-2.4) USER MOD Single : A 56 THR OG1 : rot 180:sc= -0.39 USER MOD Single : A 57 ASN : amide:sc= -0.0012 K(o=-0.0012,f=-1.6) USER MOD Single : A 60 ASN : amide:sc= -1.69 K(o=-1.7,f=-3.6!) USER MOD Single : A 64 ASN : amide:sc= -1.2! C(o=-1.2!,f=-3.5!) USER MOD Single : A 70 ASN : amide:sc= 0 X(o=0,f=-0.47) USER MOD Single : A 71 MET CE :methyl 176:sc= -0.224 (180deg=-0.261) USER MOD Single : A 74 THR OG1 : rot 180:sc= -0.0245 USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 LYS NZ :NH3+ 144:sc= -1.55! (180deg=-3.47!) USER MOD Single : A 85 CYS SG : rot 180:sc= -1.98 USER MOD Single : A 88 ASN : amide:sc= 0.0494 X(o=0.049,f=-0.17) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 ASN : amide:sc= -1.74! C(o=-1.7!,f=-2.4!) USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 101 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 THR OG1 : rot -124:sc= -1.12 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 LYS NZ :NH3+ -156:sc= 0 (180deg=-0.00184) USER MOD Single : A 123 LYS NZ :NH3+ -118:sc= 0.199 (180deg=-0.123) USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 8 12.719 7.349 -18.052 1.00 0.00 N ATOM 2 CA GLU A 8 11.395 6.877 -17.662 1.00 0.00 C ATOM 3 C GLU A 8 10.303 7.661 -18.384 1.00 0.00 C ATOM 4 O GLU A 8 10.566 8.703 -18.985 1.00 0.00 O ATOM 5 CB GLU A 8 11.212 7.001 -16.148 1.00 0.00 C ATOM 6 CG GLU A 8 11.330 8.426 -15.635 1.00 0.00 C ATOM 7 CD GLU A 8 11.177 8.519 -14.129 1.00 0.00 C ATOM 8 OE1 GLU A 8 10.024 8.512 -13.648 1.00 0.00 O ATOM 9 OE2 GLU A 8 12.210 8.598 -13.431 1.00 0.00 O ATOM 0 HA GLU A 8 11.312 5.828 -17.946 1.00 0.00 H new ATOM 0 HB2 GLU A 8 10.234 6.606 -15.875 1.00 0.00 H new ATOM 0 HB3 GLU A 8 11.957 6.381 -15.649 1.00 0.00 H new ATOM 0 HG2 GLU A 8 12.299 8.833 -15.924 1.00 0.00 H new ATOM 0 HG3 GLU A 8 10.570 9.044 -16.112 1.00 0.00 H new ATOM 16 N VAL A 9 9.077 7.152 -18.320 1.00 0.00 N ATOM 17 CA VAL A 9 7.944 7.804 -18.967 1.00 0.00 C ATOM 18 C VAL A 9 7.375 8.914 -18.090 1.00 0.00 C ATOM 19 O VAL A 9 7.165 8.727 -16.891 1.00 0.00 O ATOM 20 CB VAL A 9 6.826 6.795 -19.289 1.00 0.00 C ATOM 21 CG1 VAL A 9 6.219 6.243 -18.009 1.00 0.00 C ATOM 22 CG2 VAL A 9 5.759 7.443 -20.159 1.00 0.00 C ATOM 0 H VAL A 9 8.843 6.290 -17.827 1.00 0.00 H new ATOM 0 HA VAL A 9 8.314 8.234 -19.898 1.00 0.00 H new ATOM 0 HB VAL A 9 7.260 5.963 -19.844 1.00 0.00 H new ATOM 0 HG11 VAL A 9 5.431 5.532 -18.257 1.00 0.00 H new ATOM 0 HG12 VAL A 9 6.992 5.740 -17.427 1.00 0.00 H new ATOM 0 HG13 VAL A 9 5.799 7.061 -17.424 1.00 0.00 H new ATOM 0 HG21 VAL A 9 4.977 6.716 -20.377 1.00 0.00 H new ATOM 0 HG22 VAL A 9 5.327 8.294 -19.632 1.00 0.00 H new ATOM 0 HG23 VAL A 9 6.208 7.784 -21.092 1.00 0.00 H new ATOM 32 N LYS A 10 7.127 10.070 -18.696 1.00 0.00 N ATOM 33 CA LYS A 10 6.580 11.211 -17.972 1.00 0.00 C ATOM 34 C LYS A 10 5.062 11.110 -17.864 1.00 0.00 C ATOM 35 O LYS A 10 4.386 12.092 -17.559 1.00 0.00 O ATOM 36 CB LYS A 10 6.967 12.517 -18.671 1.00 0.00 C ATOM 37 CG LYS A 10 8.465 12.764 -18.713 1.00 0.00 C ATOM 38 CD LYS A 10 8.927 13.595 -17.528 1.00 0.00 C ATOM 39 CE LYS A 10 9.403 12.715 -16.382 1.00 0.00 C ATOM 40 NZ LYS A 10 10.753 12.143 -16.647 1.00 0.00 N ATOM 0 H LYS A 10 7.296 10.241 -19.687 1.00 0.00 H new ATOM 0 HA LYS A 10 6.999 11.206 -16.966 1.00 0.00 H new ATOM 0 HB2 LYS A 10 6.581 12.502 -19.690 1.00 0.00 H new ATOM 0 HB3 LYS A 10 6.484 13.350 -18.160 1.00 0.00 H new ATOM 0 HG2 LYS A 10 8.992 11.810 -18.717 1.00 0.00 H new ATOM 0 HG3 LYS A 10 8.724 13.275 -19.640 1.00 0.00 H new ATOM 0 HD2 LYS A 10 9.735 14.257 -17.839 1.00 0.00 H new ATOM 0 HD3 LYS A 10 8.109 14.229 -17.186 1.00 0.00 H new ATOM 0 HE2 LYS A 10 9.430 13.299 -15.462 1.00 0.00 H new ATOM 0 HE3 LYS A 10 8.690 11.906 -16.225 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 10.839 11.221 -16.173 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 10.882 12.019 -17.671 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 11.482 12.789 -16.282 1.00 0.00 H new ATOM 54 N GLU A 11 4.533 9.917 -18.115 1.00 0.00 N ATOM 55 CA GLU A 11 3.095 9.689 -18.044 1.00 0.00 C ATOM 56 C GLU A 11 2.791 8.277 -17.553 1.00 0.00 C ATOM 57 O GLU A 11 3.005 7.300 -18.270 1.00 0.00 O ATOM 58 CB GLU A 11 2.453 9.913 -19.415 1.00 0.00 C ATOM 59 CG GLU A 11 0.970 9.587 -19.453 1.00 0.00 C ATOM 60 CD GLU A 11 0.691 8.110 -19.245 1.00 0.00 C ATOM 61 OE1 GLU A 11 1.077 7.306 -20.119 1.00 0.00 O ATOM 62 OE2 GLU A 11 0.088 7.760 -18.209 1.00 0.00 O ATOM 0 H GLU A 11 5.079 9.094 -18.369 1.00 0.00 H new ATOM 0 HA GLU A 11 2.675 10.400 -17.333 1.00 0.00 H new ATOM 0 HB2 GLU A 11 2.595 10.953 -19.708 1.00 0.00 H new ATOM 0 HB3 GLU A 11 2.970 9.300 -20.153 1.00 0.00 H new ATOM 0 HG2 GLU A 11 0.456 10.162 -18.683 1.00 0.00 H new ATOM 0 HG3 GLU A 11 0.558 9.899 -20.413 1.00 0.00 H new ATOM 69 N GLU A 12 2.292 8.178 -16.325 1.00 0.00 N ATOM 70 CA GLU A 12 1.960 6.886 -15.737 1.00 0.00 C ATOM 71 C GLU A 12 0.681 6.976 -14.910 1.00 0.00 C ATOM 72 O GLU A 12 0.466 7.947 -14.184 1.00 0.00 O ATOM 73 CB GLU A 12 3.112 6.388 -14.862 1.00 0.00 C ATOM 74 CG GLU A 12 3.668 7.448 -13.926 1.00 0.00 C ATOM 75 CD GLU A 12 4.540 6.862 -12.833 1.00 0.00 C ATOM 76 OE1 GLU A 12 4.190 5.783 -12.310 1.00 0.00 O ATOM 77 OE2 GLU A 12 5.571 7.482 -12.499 1.00 0.00 O ATOM 0 H GLU A 12 2.109 8.977 -15.718 1.00 0.00 H new ATOM 0 HA GLU A 12 1.797 6.178 -16.549 1.00 0.00 H new ATOM 0 HB2 GLU A 12 2.768 5.539 -14.272 1.00 0.00 H new ATOM 0 HB3 GLU A 12 3.915 6.026 -15.504 1.00 0.00 H new ATOM 0 HG2 GLU A 12 4.249 8.168 -14.503 1.00 0.00 H new ATOM 0 HG3 GLU A 12 2.842 7.996 -13.472 1.00 0.00 H new ATOM 84 N ASP A 13 -0.165 5.958 -15.026 1.00 0.00 N ATOM 85 CA ASP A 13 -1.423 5.922 -14.289 1.00 0.00 C ATOM 86 C ASP A 13 -1.269 6.572 -12.918 1.00 0.00 C ATOM 87 O ASP A 13 -1.924 7.569 -12.616 1.00 0.00 O ATOM 88 CB ASP A 13 -1.905 4.479 -14.132 1.00 0.00 C ATOM 89 CG ASP A 13 -1.703 3.660 -15.392 1.00 0.00 C ATOM 90 OD1 ASP A 13 -2.174 4.095 -16.464 1.00 0.00 O ATOM 91 OD2 ASP A 13 -1.072 2.586 -15.307 1.00 0.00 O ATOM 0 H ASP A 13 -0.003 5.147 -15.623 1.00 0.00 H new ATOM 0 HA ASP A 13 -2.164 6.485 -14.856 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -1.370 4.008 -13.307 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -2.963 4.479 -13.868 1.00 0.00 H new ATOM 96 N ALA A 14 -0.399 6.000 -12.092 1.00 0.00 N ATOM 97 CA ALA A 14 -0.158 6.524 -10.753 1.00 0.00 C ATOM 98 C ALA A 14 0.520 7.889 -10.812 1.00 0.00 C ATOM 99 O ALA A 14 1.253 8.189 -11.754 1.00 0.00 O ATOM 100 CB ALA A 14 0.686 5.547 -9.948 1.00 0.00 C ATOM 0 H ALA A 14 0.151 5.173 -12.327 1.00 0.00 H new ATOM 0 HA ALA A 14 -1.122 6.647 -10.258 1.00 0.00 H new ATOM 0 HB1 ALA A 14 0.858 5.951 -8.950 1.00 0.00 H new ATOM 0 HB2 ALA A 14 0.163 4.594 -9.868 1.00 0.00 H new ATOM 0 HB3 ALA A 14 1.643 5.395 -10.448 1.00 0.00 H new ATOM 106 N PHE A 15 0.269 8.712 -9.800 1.00 0.00 N ATOM 107 CA PHE A 15 0.855 10.047 -9.737 1.00 0.00 C ATOM 108 C PHE A 15 2.098 10.054 -8.853 1.00 0.00 C ATOM 109 O PHE A 15 3.153 10.548 -9.250 1.00 0.00 O ATOM 110 CB PHE A 15 -0.170 11.051 -9.206 1.00 0.00 C ATOM 111 CG PHE A 15 -0.793 10.640 -7.902 1.00 0.00 C ATOM 112 CD1 PHE A 15 -1.898 9.805 -7.881 1.00 0.00 C ATOM 113 CD2 PHE A 15 -0.272 11.087 -6.699 1.00 0.00 C ATOM 114 CE1 PHE A 15 -2.474 9.425 -6.683 1.00 0.00 C ATOM 115 CE2 PHE A 15 -0.843 10.710 -5.498 1.00 0.00 C ATOM 116 CZ PHE A 15 -1.945 9.878 -5.490 1.00 0.00 C ATOM 0 H PHE A 15 -0.336 8.479 -9.012 1.00 0.00 H new ATOM 0 HA PHE A 15 1.148 10.337 -10.746 1.00 0.00 H new ATOM 0 HB2 PHE A 15 0.314 12.019 -9.079 1.00 0.00 H new ATOM 0 HB3 PHE A 15 -0.956 11.183 -9.949 1.00 0.00 H new ATOM 0 HD1 PHE A 15 -2.314 9.447 -8.811 1.00 0.00 H new ATOM 0 HD2 PHE A 15 0.590 11.737 -6.699 1.00 0.00 H new ATOM 0 HE1 PHE A 15 -3.336 8.775 -6.680 1.00 0.00 H new ATOM 0 HE2 PHE A 15 -0.428 11.066 -4.567 1.00 0.00 H new ATOM 0 HZ PHE A 15 -2.393 9.582 -4.553 1.00 0.00 H new ATOM 126 N TYR A 16 1.965 9.504 -7.651 1.00 0.00 N ATOM 127 CA TYR A 16 3.075 9.450 -6.708 1.00 0.00 C ATOM 128 C TYR A 16 3.779 8.097 -6.772 1.00 0.00 C ATOM 129 O TYR A 16 3.236 7.081 -6.338 1.00 0.00 O ATOM 130 CB TYR A 16 2.577 9.711 -5.285 1.00 0.00 C ATOM 131 CG TYR A 16 3.690 9.876 -4.275 1.00 0.00 C ATOM 132 CD1 TYR A 16 4.587 10.934 -4.367 1.00 0.00 C ATOM 133 CD2 TYR A 16 3.844 8.976 -3.228 1.00 0.00 C ATOM 134 CE1 TYR A 16 5.605 11.088 -3.446 1.00 0.00 C ATOM 135 CE2 TYR A 16 4.859 9.123 -2.303 1.00 0.00 C ATOM 136 CZ TYR A 16 5.737 10.181 -2.416 1.00 0.00 C ATOM 137 OH TYR A 16 6.749 10.332 -1.496 1.00 0.00 O ATOM 0 H TYR A 16 1.099 9.089 -7.307 1.00 0.00 H new ATOM 0 HA TYR A 16 3.790 10.225 -6.983 1.00 0.00 H new ATOM 0 HB2 TYR A 16 1.960 10.610 -5.284 1.00 0.00 H new ATOM 0 HB3 TYR A 16 1.937 8.885 -4.976 1.00 0.00 H new ATOM 0 HD1 TYR A 16 4.486 11.647 -5.172 1.00 0.00 H new ATOM 0 HD2 TYR A 16 3.158 8.147 -3.136 1.00 0.00 H new ATOM 0 HE1 TYR A 16 6.294 11.915 -3.532 1.00 0.00 H new ATOM 0 HE2 TYR A 16 4.965 8.414 -1.496 1.00 0.00 H new ATOM 0 HH TYR A 16 6.701 9.610 -0.835 1.00 0.00 H new ATOM 147 N SER A 17 4.991 8.094 -7.317 1.00 0.00 N ATOM 148 CA SER A 17 5.770 6.867 -7.442 1.00 0.00 C ATOM 149 C SER A 17 7.124 7.010 -6.754 1.00 0.00 C ATOM 150 O SER A 17 7.925 7.876 -7.107 1.00 0.00 O ATOM 151 CB SER A 17 5.969 6.512 -8.916 1.00 0.00 C ATOM 152 OG SER A 17 6.963 5.514 -9.071 1.00 0.00 O ATOM 0 H SER A 17 5.455 8.927 -7.679 1.00 0.00 H new ATOM 0 HA SER A 17 5.217 6.064 -6.954 1.00 0.00 H new ATOM 0 HB2 SER A 17 5.028 6.161 -9.339 1.00 0.00 H new ATOM 0 HB3 SER A 17 6.255 7.404 -9.473 1.00 0.00 H new ATOM 0 HG SER A 17 7.070 5.304 -10.022 1.00 0.00 H new ATOM 158 N LYS A 18 7.373 6.155 -5.768 1.00 0.00 N ATOM 159 CA LYS A 18 8.630 6.183 -5.029 1.00 0.00 C ATOM 160 C LYS A 18 9.005 4.788 -4.540 1.00 0.00 C ATOM 161 O LYS A 18 8.175 4.071 -3.979 1.00 0.00 O ATOM 162 CB LYS A 18 8.525 7.141 -3.840 1.00 0.00 C ATOM 163 CG LYS A 18 9.866 7.681 -3.374 1.00 0.00 C ATOM 164 CD LYS A 18 10.371 8.783 -4.290 1.00 0.00 C ATOM 165 CE LYS A 18 9.683 10.108 -4.000 1.00 0.00 C ATOM 166 NZ LYS A 18 9.581 10.958 -5.218 1.00 0.00 N ATOM 0 H LYS A 18 6.720 5.433 -5.462 1.00 0.00 H new ATOM 0 HA LYS A 18 9.411 6.534 -5.703 1.00 0.00 H new ATOM 0 HB2 LYS A 18 7.881 7.977 -4.113 1.00 0.00 H new ATOM 0 HB3 LYS A 18 8.042 6.625 -3.010 1.00 0.00 H new ATOM 0 HG2 LYS A 18 9.772 8.065 -2.358 1.00 0.00 H new ATOM 0 HG3 LYS A 18 10.594 6.871 -3.342 1.00 0.00 H new ATOM 0 HD2 LYS A 18 11.448 8.896 -4.165 1.00 0.00 H new ATOM 0 HD3 LYS A 18 10.198 8.502 -5.329 1.00 0.00 H new ATOM 0 HE2 LYS A 18 8.685 9.920 -3.604 1.00 0.00 H new ATOM 0 HE3 LYS A 18 10.237 10.644 -3.229 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 9.106 11.852 -4.979 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 10.534 11.159 -5.582 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 9.031 10.458 -5.945 1.00 0.00 H new ATOM 180 N LYS A 19 10.260 4.408 -4.755 1.00 0.00 N ATOM 181 CA LYS A 19 10.746 3.100 -4.334 1.00 0.00 C ATOM 182 C LYS A 19 10.926 3.047 -2.820 1.00 0.00 C ATOM 183 O LYS A 19 11.348 4.025 -2.201 1.00 0.00 O ATOM 184 CB LYS A 19 12.073 2.778 -5.027 1.00 0.00 C ATOM 185 CG LYS A 19 13.235 3.623 -4.537 1.00 0.00 C ATOM 186 CD LYS A 19 14.569 2.943 -4.798 1.00 0.00 C ATOM 187 CE LYS A 19 15.129 3.321 -6.161 1.00 0.00 C ATOM 188 NZ LYS A 19 16.289 2.468 -6.540 1.00 0.00 N ATOM 0 H LYS A 19 10.959 4.988 -5.219 1.00 0.00 H new ATOM 0 HA LYS A 19 10.003 2.356 -4.620 1.00 0.00 H new ATOM 0 HB2 LYS A 19 12.309 1.725 -4.871 1.00 0.00 H new ATOM 0 HB3 LYS A 19 11.957 2.923 -6.101 1.00 0.00 H new ATOM 0 HG2 LYS A 19 13.216 4.592 -5.035 1.00 0.00 H new ATOM 0 HG3 LYS A 19 13.124 3.811 -3.469 1.00 0.00 H new ATOM 0 HD2 LYS A 19 15.280 3.223 -4.021 1.00 0.00 H new ATOM 0 HD3 LYS A 19 14.445 1.862 -4.741 1.00 0.00 H new ATOM 0 HE2 LYS A 19 14.347 3.226 -6.914 1.00 0.00 H new ATOM 0 HE3 LYS A 19 15.436 4.367 -6.150 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 16.642 2.757 -7.475 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 17.046 2.578 -5.835 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 15.991 1.472 -6.575 1.00 0.00 H new ATOM 202 N CYS A 20 10.606 1.901 -2.230 1.00 0.00 N ATOM 203 CA CYS A 20 10.733 1.722 -0.788 1.00 0.00 C ATOM 204 C CYS A 20 10.601 0.250 -0.409 1.00 0.00 C ATOM 205 O CYS A 20 10.312 -0.596 -1.255 1.00 0.00 O ATOM 206 CB CYS A 20 9.674 2.546 -0.055 1.00 0.00 C ATOM 207 SG CYS A 20 8.016 1.826 -0.101 1.00 0.00 S ATOM 0 H CYS A 20 10.257 1.082 -2.728 1.00 0.00 H new ATOM 0 HA CYS A 20 11.723 2.068 -0.490 1.00 0.00 H new ATOM 0 HB2 CYS A 20 9.978 2.666 0.985 1.00 0.00 H new ATOM 0 HB3 CYS A 20 9.638 3.543 -0.493 1.00 0.00 H new ATOM 0 HG CYS A 20 7.191 2.594 0.547 1.00 0.00 H new ATOM 213 N LYS A 21 10.817 -0.048 0.867 1.00 0.00 N ATOM 214 CA LYS A 21 10.723 -1.418 1.360 1.00 0.00 C ATOM 215 C LYS A 21 9.422 -1.632 2.127 1.00 0.00 C ATOM 216 O LYS A 21 8.774 -0.674 2.550 1.00 0.00 O ATOM 217 CB LYS A 21 11.918 -1.741 2.260 1.00 0.00 C ATOM 218 CG LYS A 21 13.193 -2.046 1.493 1.00 0.00 C ATOM 219 CD LYS A 21 14.422 -1.901 2.375 1.00 0.00 C ATOM 220 CE LYS A 21 15.702 -1.921 1.554 1.00 0.00 C ATOM 221 NZ LYS A 21 16.059 -0.565 1.051 1.00 0.00 N ATOM 0 H LYS A 21 11.059 0.641 1.580 1.00 0.00 H new ATOM 0 HA LYS A 21 10.732 -2.089 0.501 1.00 0.00 H new ATOM 0 HB2 LYS A 21 12.098 -0.898 2.927 1.00 0.00 H new ATOM 0 HB3 LYS A 21 11.668 -2.596 2.888 1.00 0.00 H new ATOM 0 HG2 LYS A 21 13.146 -3.060 1.096 1.00 0.00 H new ATOM 0 HG3 LYS A 21 13.275 -1.373 0.639 1.00 0.00 H new ATOM 0 HD2 LYS A 21 14.362 -0.967 2.934 1.00 0.00 H new ATOM 0 HD3 LYS A 21 14.444 -2.710 3.106 1.00 0.00 H new ATOM 0 HE2 LYS A 21 16.518 -2.309 2.163 1.00 0.00 H new ATOM 0 HE3 LYS A 21 15.582 -2.601 0.711 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 16.937 -0.621 0.496 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 15.291 -0.205 0.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 16.198 0.078 1.856 1.00 0.00 H new ATOM 235 N LEU A 22 9.047 -2.894 2.304 1.00 0.00 N ATOM 236 CA LEU A 22 7.823 -3.234 3.022 1.00 0.00 C ATOM 237 C LEU A 22 8.100 -4.267 4.110 1.00 0.00 C ATOM 238 O LEU A 22 8.840 -5.227 3.895 1.00 0.00 O ATOM 239 CB LEU A 22 6.770 -3.770 2.050 1.00 0.00 C ATOM 240 CG LEU A 22 5.836 -2.730 1.432 1.00 0.00 C ATOM 241 CD1 LEU A 22 5.087 -3.321 0.248 1.00 0.00 C ATOM 242 CD2 LEU A 22 4.859 -2.205 2.475 1.00 0.00 C ATOM 0 H LEU A 22 9.572 -3.698 1.961 1.00 0.00 H new ATOM 0 HA LEU A 22 7.444 -2.328 3.495 1.00 0.00 H new ATOM 0 HB2 LEU A 22 7.283 -4.294 1.243 1.00 0.00 H new ATOM 0 HB3 LEU A 22 6.163 -4.508 2.574 1.00 0.00 H new ATOM 0 HG LEU A 22 6.439 -1.895 1.074 1.00 0.00 H new ATOM 0 HD11 LEU A 22 4.427 -2.566 -0.179 1.00 0.00 H new ATOM 0 HD12 LEU A 22 5.801 -3.648 -0.508 1.00 0.00 H new ATOM 0 HD13 LEU A 22 4.495 -4.174 0.581 1.00 0.00 H new ATOM 0 HD21 LEU A 22 4.201 -1.465 2.018 1.00 0.00 H new ATOM 0 HD22 LEU A 22 4.262 -3.031 2.863 1.00 0.00 H new ATOM 0 HD23 LEU A 22 5.413 -1.742 3.292 1.00 0.00 H new ATOM 254 N PHE A 23 7.498 -4.064 5.277 1.00 0.00 N ATOM 255 CA PHE A 23 7.679 -4.978 6.399 1.00 0.00 C ATOM 256 C PHE A 23 6.384 -5.130 7.191 1.00 0.00 C ATOM 257 O PHE A 23 5.752 -4.141 7.564 1.00 0.00 O ATOM 258 CB PHE A 23 8.796 -4.478 7.318 1.00 0.00 C ATOM 259 CG PHE A 23 10.129 -4.366 6.634 1.00 0.00 C ATOM 260 CD1 PHE A 23 11.002 -5.441 6.609 1.00 0.00 C ATOM 261 CD2 PHE A 23 10.508 -3.185 6.017 1.00 0.00 C ATOM 262 CE1 PHE A 23 12.229 -5.341 5.981 1.00 0.00 C ATOM 263 CE2 PHE A 23 11.733 -3.079 5.386 1.00 0.00 C ATOM 264 CZ PHE A 23 12.596 -4.158 5.369 1.00 0.00 C ATOM 0 H PHE A 23 6.881 -3.275 5.471 1.00 0.00 H new ATOM 0 HA PHE A 23 7.957 -5.953 5.999 1.00 0.00 H new ATOM 0 HB2 PHE A 23 8.518 -3.502 7.717 1.00 0.00 H new ATOM 0 HB3 PHE A 23 8.888 -5.155 8.167 1.00 0.00 H new ATOM 0 HD1 PHE A 23 10.721 -6.368 7.086 1.00 0.00 H new ATOM 0 HD2 PHE A 23 9.839 -2.338 6.029 1.00 0.00 H new ATOM 0 HE1 PHE A 23 12.900 -6.187 5.969 1.00 0.00 H new ATOM 0 HE2 PHE A 23 12.016 -2.153 4.907 1.00 0.00 H new ATOM 0 HZ PHE A 23 13.555 -4.077 4.879 1.00 0.00 H new ATOM 274 N TYR A 24 5.994 -6.374 7.444 1.00 0.00 N ATOM 275 CA TYR A 24 4.772 -6.656 8.189 1.00 0.00 C ATOM 276 C TYR A 24 5.094 -7.226 9.567 1.00 0.00 C ATOM 277 O TYR A 24 6.047 -7.988 9.731 1.00 0.00 O ATOM 278 CB TYR A 24 3.892 -7.637 7.412 1.00 0.00 C ATOM 279 CG TYR A 24 4.523 -8.997 7.221 1.00 0.00 C ATOM 280 CD1 TYR A 24 4.624 -9.893 8.278 1.00 0.00 C ATOM 281 CD2 TYR A 24 5.020 -9.386 5.983 1.00 0.00 C ATOM 282 CE1 TYR A 24 5.201 -11.136 8.109 1.00 0.00 C ATOM 283 CE2 TYR A 24 5.597 -10.628 5.804 1.00 0.00 C ATOM 284 CZ TYR A 24 5.685 -11.500 6.869 1.00 0.00 C ATOM 285 OH TYR A 24 6.261 -12.738 6.695 1.00 0.00 O ATOM 0 H TYR A 24 6.506 -7.204 7.144 1.00 0.00 H new ATOM 0 HA TYR A 24 4.232 -5.719 8.321 1.00 0.00 H new ATOM 0 HB2 TYR A 24 2.944 -7.756 7.937 1.00 0.00 H new ATOM 0 HB3 TYR A 24 3.664 -7.211 6.435 1.00 0.00 H new ATOM 0 HD1 TYR A 24 4.244 -9.612 9.249 1.00 0.00 H new ATOM 0 HD2 TYR A 24 4.954 -8.706 5.147 1.00 0.00 H new ATOM 0 HE1 TYR A 24 5.273 -11.819 8.942 1.00 0.00 H new ATOM 0 HE2 TYR A 24 5.977 -10.915 4.835 1.00 0.00 H new ATOM 0 HH TYR A 24 6.549 -12.837 5.763 1.00 0.00 H new ATOM 295 N LYS A 25 4.291 -6.850 10.557 1.00 0.00 N ATOM 296 CA LYS A 25 4.487 -7.323 11.922 1.00 0.00 C ATOM 297 C LYS A 25 3.764 -8.647 12.148 1.00 0.00 C ATOM 298 O LYS A 25 2.534 -8.699 12.166 1.00 0.00 O ATOM 299 CB LYS A 25 3.985 -6.279 12.922 1.00 0.00 C ATOM 300 CG LYS A 25 4.445 -6.531 14.348 1.00 0.00 C ATOM 301 CD LYS A 25 5.792 -5.883 14.622 1.00 0.00 C ATOM 302 CE LYS A 25 6.276 -6.179 16.033 1.00 0.00 C ATOM 303 NZ LYS A 25 7.762 -6.177 16.122 1.00 0.00 N ATOM 0 H LYS A 25 3.498 -6.219 10.439 1.00 0.00 H new ATOM 0 HA LYS A 25 5.554 -7.481 12.076 1.00 0.00 H new ATOM 0 HB2 LYS A 25 4.327 -5.293 12.608 1.00 0.00 H new ATOM 0 HB3 LYS A 25 2.895 -6.260 12.899 1.00 0.00 H new ATOM 0 HG2 LYS A 25 3.704 -6.140 15.045 1.00 0.00 H new ATOM 0 HG3 LYS A 25 4.514 -7.604 14.525 1.00 0.00 H new ATOM 0 HD2 LYS A 25 6.525 -6.246 13.901 1.00 0.00 H new ATOM 0 HD3 LYS A 25 5.714 -4.805 14.482 1.00 0.00 H new ATOM 0 HE2 LYS A 25 5.870 -5.436 16.719 1.00 0.00 H new ATOM 0 HE3 LYS A 25 5.895 -7.149 16.352 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 8.056 -5.734 17.016 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 8.113 -7.155 16.089 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 8.157 -5.641 15.323 1.00 0.00 H new ATOM 317 N LYS A 26 4.535 -9.715 12.321 1.00 0.00 N ATOM 318 CA LYS A 26 3.969 -11.039 12.549 1.00 0.00 C ATOM 319 C LYS A 26 4.730 -11.775 13.647 1.00 0.00 C ATOM 320 O LYS A 26 5.959 -11.730 13.700 1.00 0.00 O ATOM 321 CB LYS A 26 3.998 -11.858 11.257 1.00 0.00 C ATOM 322 CG LYS A 26 3.079 -13.067 11.281 1.00 0.00 C ATOM 323 CD LYS A 26 2.811 -13.593 9.881 1.00 0.00 C ATOM 324 CE LYS A 26 1.673 -14.602 9.873 1.00 0.00 C ATOM 325 NZ LYS A 26 2.160 -15.989 10.108 1.00 0.00 N ATOM 0 H LYS A 26 5.555 -9.689 12.308 1.00 0.00 H new ATOM 0 HA LYS A 26 2.935 -10.914 12.870 1.00 0.00 H new ATOM 0 HB2 LYS A 26 3.717 -11.215 10.423 1.00 0.00 H new ATOM 0 HB3 LYS A 26 5.019 -12.192 11.072 1.00 0.00 H new ATOM 0 HG2 LYS A 26 3.528 -13.854 11.886 1.00 0.00 H new ATOM 0 HG3 LYS A 26 2.136 -12.798 11.756 1.00 0.00 H new ATOM 0 HD2 LYS A 26 2.566 -12.762 9.220 1.00 0.00 H new ATOM 0 HD3 LYS A 26 3.714 -14.059 9.487 1.00 0.00 H new ATOM 0 HE2 LYS A 26 0.947 -14.337 10.642 1.00 0.00 H new ATOM 0 HE3 LYS A 26 1.154 -14.557 8.915 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 1.354 -16.647 10.095 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 2.833 -16.252 9.360 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 2.633 -16.039 11.033 1.00 0.00 H new ATOM 339 N ASP A 27 3.993 -12.453 14.520 1.00 0.00 N ATOM 340 CA ASP A 27 4.599 -13.201 15.615 1.00 0.00 C ATOM 341 C ASP A 27 5.559 -12.320 16.409 1.00 0.00 C ATOM 342 O ASP A 27 6.635 -12.761 16.808 1.00 0.00 O ATOM 343 CB ASP A 27 5.339 -14.426 15.076 1.00 0.00 C ATOM 344 CG ASP A 27 4.415 -15.396 14.367 1.00 0.00 C ATOM 345 OD1 ASP A 27 3.346 -14.957 13.891 1.00 0.00 O ATOM 346 OD2 ASP A 27 4.760 -16.593 14.286 1.00 0.00 O ATOM 0 H ASP A 27 2.975 -12.500 14.490 1.00 0.00 H new ATOM 0 HA ASP A 27 3.802 -13.532 16.281 1.00 0.00 H new ATOM 0 HB2 ASP A 27 6.118 -14.102 14.386 1.00 0.00 H new ATOM 0 HB3 ASP A 27 5.836 -14.938 15.900 1.00 0.00 H new ATOM 351 N ASN A 28 5.160 -11.072 16.632 1.00 0.00 N ATOM 352 CA ASN A 28 5.986 -10.128 17.377 1.00 0.00 C ATOM 353 C ASN A 28 7.351 -9.961 16.717 1.00 0.00 C ATOM 354 O ASN A 28 8.384 -10.009 17.385 1.00 0.00 O ATOM 355 CB ASN A 28 6.159 -10.600 18.822 1.00 0.00 C ATOM 356 CG ASN A 28 5.004 -10.180 19.710 1.00 0.00 C ATOM 357 OD1 ASN A 28 4.030 -9.589 19.243 1.00 0.00 O ATOM 358 ND2 ASN A 28 5.107 -10.484 20.999 1.00 0.00 N ATOM 0 H ASN A 28 4.271 -10.691 16.308 1.00 0.00 H new ATOM 0 HA ASN A 28 5.481 -9.162 17.376 1.00 0.00 H new ATOM 0 HB2 ASN A 28 6.250 -11.686 18.838 1.00 0.00 H new ATOM 0 HB3 ASN A 28 7.088 -10.197 19.224 1.00 0.00 H new ATOM 0 HD21 ASN A 28 4.361 -10.227 21.645 1.00 0.00 H new ATOM 0 HD22 ASN A 28 5.932 -10.975 21.343 1.00 0.00 H new ATOM 365 N GLU A 29 7.348 -9.765 15.403 1.00 0.00 N ATOM 366 CA GLU A 29 8.586 -9.591 14.653 1.00 0.00 C ATOM 367 C GLU A 29 8.313 -8.966 13.288 1.00 0.00 C ATOM 368 O GLU A 29 7.218 -9.098 12.740 1.00 0.00 O ATOM 369 CB GLU A 29 9.296 -10.935 14.479 1.00 0.00 C ATOM 370 CG GLU A 29 10.808 -10.819 14.396 1.00 0.00 C ATOM 371 CD GLU A 29 11.456 -10.661 15.758 1.00 0.00 C ATOM 372 OE1 GLU A 29 11.375 -11.609 16.567 1.00 0.00 O ATOM 373 OE2 GLU A 29 12.044 -9.590 16.015 1.00 0.00 O ATOM 0 H GLU A 29 6.502 -9.723 14.835 1.00 0.00 H new ATOM 0 HA GLU A 29 9.231 -8.918 15.218 1.00 0.00 H new ATOM 0 HB2 GLU A 29 9.035 -11.585 15.315 1.00 0.00 H new ATOM 0 HB3 GLU A 29 8.927 -11.417 13.574 1.00 0.00 H new ATOM 0 HG2 GLU A 29 11.211 -11.706 13.907 1.00 0.00 H new ATOM 0 HG3 GLU A 29 11.070 -9.964 13.772 1.00 0.00 H new ATOM 380 N PHE A 30 9.316 -8.285 12.744 1.00 0.00 N ATOM 381 CA PHE A 30 9.185 -7.639 11.444 1.00 0.00 C ATOM 382 C PHE A 30 9.789 -8.505 10.342 1.00 0.00 C ATOM 383 O PHE A 30 10.976 -8.829 10.372 1.00 0.00 O ATOM 384 CB PHE A 30 9.865 -6.268 11.461 1.00 0.00 C ATOM 385 CG PHE A 30 8.970 -5.161 11.942 1.00 0.00 C ATOM 386 CD1 PHE A 30 8.073 -4.553 11.079 1.00 0.00 C ATOM 387 CD2 PHE A 30 9.027 -4.729 13.257 1.00 0.00 C ATOM 388 CE1 PHE A 30 7.249 -3.535 11.518 1.00 0.00 C ATOM 389 CE2 PHE A 30 8.205 -3.711 13.702 1.00 0.00 C ATOM 390 CZ PHE A 30 7.315 -3.112 12.831 1.00 0.00 C ATOM 0 H PHE A 30 10.229 -8.166 13.184 1.00 0.00 H new ATOM 0 HA PHE A 30 8.123 -7.508 11.237 1.00 0.00 H new ATOM 0 HB2 PHE A 30 10.746 -6.316 12.101 1.00 0.00 H new ATOM 0 HB3 PHE A 30 10.214 -6.032 10.456 1.00 0.00 H new ATOM 0 HD1 PHE A 30 8.017 -4.879 10.051 1.00 0.00 H new ATOM 0 HD2 PHE A 30 9.721 -5.193 13.942 1.00 0.00 H new ATOM 0 HE1 PHE A 30 6.554 -3.070 10.835 1.00 0.00 H new ATOM 0 HE2 PHE A 30 8.258 -3.384 14.730 1.00 0.00 H new ATOM 0 HZ PHE A 30 6.673 -2.315 13.176 1.00 0.00 H new ATOM 400 N LYS A 31 8.963 -8.876 9.370 1.00 0.00 N ATOM 401 CA LYS A 31 9.413 -9.704 8.258 1.00 0.00 C ATOM 402 C LYS A 31 9.177 -9.000 6.925 1.00 0.00 C ATOM 403 O LYS A 31 8.045 -8.656 6.588 1.00 0.00 O ATOM 404 CB LYS A 31 8.686 -11.051 8.270 1.00 0.00 C ATOM 405 CG LYS A 31 9.114 -11.962 9.408 1.00 0.00 C ATOM 406 CD LYS A 31 10.424 -12.666 9.097 1.00 0.00 C ATOM 407 CE LYS A 31 11.619 -11.858 9.578 1.00 0.00 C ATOM 408 NZ LYS A 31 12.769 -12.731 9.942 1.00 0.00 N ATOM 0 H LYS A 31 7.978 -8.616 9.330 1.00 0.00 H new ATOM 0 HA LYS A 31 10.483 -9.874 8.375 1.00 0.00 H new ATOM 0 HB2 LYS A 31 7.613 -10.875 8.341 1.00 0.00 H new ATOM 0 HB3 LYS A 31 8.864 -11.559 7.322 1.00 0.00 H new ATOM 0 HG2 LYS A 31 9.222 -11.378 10.322 1.00 0.00 H new ATOM 0 HG3 LYS A 31 8.337 -12.703 9.594 1.00 0.00 H new ATOM 0 HD2 LYS A 31 10.432 -13.647 9.571 1.00 0.00 H new ATOM 0 HD3 LYS A 31 10.504 -12.831 8.022 1.00 0.00 H new ATOM 0 HE2 LYS A 31 11.925 -11.162 8.797 1.00 0.00 H new ATOM 0 HE3 LYS A 31 11.329 -11.260 10.442 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 13.563 -12.142 10.265 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 12.486 -13.378 10.705 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 13.063 -13.283 9.111 1.00 0.00 H new ATOM 422 N GLU A 32 10.252 -8.791 6.173 1.00 0.00 N ATOM 423 CA GLU A 32 10.160 -8.128 4.877 1.00 0.00 C ATOM 424 C GLU A 32 9.145 -8.829 3.978 1.00 0.00 C ATOM 425 O GLU A 32 9.150 -10.054 3.853 1.00 0.00 O ATOM 426 CB GLU A 32 11.529 -8.102 4.194 1.00 0.00 C ATOM 427 CG GLU A 32 11.617 -7.111 3.046 1.00 0.00 C ATOM 428 CD GLU A 32 12.934 -7.200 2.298 1.00 0.00 C ATOM 429 OE1 GLU A 32 13.324 -8.321 1.913 1.00 0.00 O ATOM 430 OE2 GLU A 32 13.574 -6.146 2.099 1.00 0.00 O ATOM 0 H GLU A 32 11.196 -9.071 6.438 1.00 0.00 H new ATOM 0 HA GLU A 32 9.826 -7.104 5.045 1.00 0.00 H new ATOM 0 HB2 GLU A 32 12.290 -7.856 4.934 1.00 0.00 H new ATOM 0 HB3 GLU A 32 11.758 -9.100 3.820 1.00 0.00 H new ATOM 0 HG2 GLU A 32 10.796 -7.291 2.352 1.00 0.00 H new ATOM 0 HG3 GLU A 32 11.491 -6.100 3.433 1.00 0.00 H new ATOM 437 N LYS A 33 8.274 -8.043 3.355 1.00 0.00 N ATOM 438 CA LYS A 33 7.252 -8.585 2.467 1.00 0.00 C ATOM 439 C LYS A 33 7.773 -8.691 1.038 1.00 0.00 C ATOM 440 O LYS A 33 7.527 -9.680 0.348 1.00 0.00 O ATOM 441 CB LYS A 33 5.999 -7.707 2.501 1.00 0.00 C ATOM 442 CG LYS A 33 4.954 -8.099 1.471 1.00 0.00 C ATOM 443 CD LYS A 33 4.275 -9.409 1.836 1.00 0.00 C ATOM 444 CE LYS A 33 3.094 -9.698 0.923 1.00 0.00 C ATOM 445 NZ LYS A 33 2.569 -11.078 1.115 1.00 0.00 N ATOM 0 H LYS A 33 8.255 -7.027 3.449 1.00 0.00 H new ATOM 0 HA LYS A 33 6.996 -9.585 2.817 1.00 0.00 H new ATOM 0 HB2 LYS A 33 5.555 -7.760 3.495 1.00 0.00 H new ATOM 0 HB3 LYS A 33 6.288 -6.669 2.336 1.00 0.00 H new ATOM 0 HG2 LYS A 33 4.206 -7.310 1.392 1.00 0.00 H new ATOM 0 HG3 LYS A 33 5.424 -8.192 0.492 1.00 0.00 H new ATOM 0 HD2 LYS A 33 4.995 -10.224 1.770 1.00 0.00 H new ATOM 0 HD3 LYS A 33 3.935 -9.368 2.871 1.00 0.00 H new ATOM 0 HE2 LYS A 33 2.300 -8.977 1.117 1.00 0.00 H new ATOM 0 HE3 LYS A 33 3.397 -9.566 -0.116 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 1.934 -11.320 0.328 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 3.362 -11.751 1.140 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 2.044 -11.128 2.012 1.00 0.00 H new ATOM 459 N GLY A 34 8.497 -7.665 0.599 1.00 0.00 N ATOM 460 CA GLY A 34 9.043 -7.664 -0.746 1.00 0.00 C ATOM 461 C GLY A 34 9.428 -6.274 -1.213 1.00 0.00 C ATOM 462 O GLY A 34 8.596 -5.366 -1.234 1.00 0.00 O ATOM 0 H GLY A 34 8.715 -6.835 1.151 1.00 0.00 H new ATOM 0 HA2 GLY A 34 9.919 -8.311 -0.780 1.00 0.00 H new ATOM 0 HA3 GLY A 34 8.309 -8.085 -1.433 1.00 0.00 H new ATOM 466 N ILE A 35 10.692 -6.107 -1.587 1.00 0.00 N ATOM 467 CA ILE A 35 11.185 -4.818 -2.056 1.00 0.00 C ATOM 468 C ILE A 35 10.559 -4.444 -3.395 1.00 0.00 C ATOM 469 O ILE A 35 10.464 -5.271 -4.301 1.00 0.00 O ATOM 470 CB ILE A 35 12.718 -4.821 -2.202 1.00 0.00 C ATOM 471 CG1 ILE A 35 13.373 -5.341 -0.920 1.00 0.00 C ATOM 472 CG2 ILE A 35 13.222 -3.424 -2.531 1.00 0.00 C ATOM 473 CD1 ILE A 35 14.858 -5.594 -1.060 1.00 0.00 C ATOM 0 H ILE A 35 11.393 -6.848 -1.574 1.00 0.00 H new ATOM 0 HA ILE A 35 10.901 -4.080 -1.306 1.00 0.00 H new ATOM 0 HB ILE A 35 12.989 -5.486 -3.022 1.00 0.00 H new ATOM 0 HG12 ILE A 35 13.209 -4.619 -0.120 1.00 0.00 H new ATOM 0 HG13 ILE A 35 12.882 -6.267 -0.620 1.00 0.00 H new ATOM 0 HG21 ILE A 35 14.307 -3.443 -2.631 1.00 0.00 H new ATOM 0 HG22 ILE A 35 12.777 -3.088 -3.468 1.00 0.00 H new ATOM 0 HG23 ILE A 35 12.943 -2.739 -1.730 1.00 0.00 H new ATOM 0 HD11 ILE A 35 15.255 -5.961 -0.114 1.00 0.00 H new ATOM 0 HD12 ILE A 35 15.029 -6.338 -1.838 1.00 0.00 H new ATOM 0 HD13 ILE A 35 15.361 -4.666 -1.330 1.00 0.00 H new ATOM 485 N GLY A 36 10.135 -3.189 -3.514 1.00 0.00 N ATOM 486 CA GLY A 36 9.525 -2.726 -4.747 1.00 0.00 C ATOM 487 C GLY A 36 9.222 -1.241 -4.722 1.00 0.00 C ATOM 488 O GLY A 36 9.811 -0.492 -3.941 1.00 0.00 O ATOM 0 H GLY A 36 10.203 -2.485 -2.779 1.00 0.00 H new ATOM 0 HA2 GLY A 36 10.191 -2.944 -5.582 1.00 0.00 H new ATOM 0 HA3 GLY A 36 8.602 -3.279 -4.922 1.00 0.00 H new ATOM 492 N THR A 37 8.302 -0.812 -5.580 1.00 0.00 N ATOM 493 CA THR A 37 7.924 0.594 -5.655 1.00 0.00 C ATOM 494 C THR A 37 6.420 0.769 -5.475 1.00 0.00 C ATOM 495 O THR A 37 5.625 0.012 -6.034 1.00 0.00 O ATOM 496 CB THR A 37 8.344 1.217 -7.000 1.00 0.00 C ATOM 497 OG1 THR A 37 9.754 1.057 -7.194 1.00 0.00 O ATOM 498 CG2 THR A 37 7.985 2.695 -7.047 1.00 0.00 C ATOM 0 H THR A 37 7.805 -1.418 -6.233 1.00 0.00 H new ATOM 0 HA THR A 37 8.446 1.106 -4.847 1.00 0.00 H new ATOM 0 HB THR A 37 7.807 0.703 -7.797 1.00 0.00 H new ATOM 0 HG1 THR A 37 10.013 1.454 -8.052 1.00 0.00 H new ATOM 0 HG21 THR A 37 8.291 3.113 -8.006 1.00 0.00 H new ATOM 0 HG22 THR A 37 6.908 2.812 -6.927 1.00 0.00 H new ATOM 0 HG23 THR A 37 8.499 3.220 -6.242 1.00 0.00 H new ATOM 506 N LEU A 38 6.036 1.772 -4.693 1.00 0.00 N ATOM 507 CA LEU A 38 4.626 2.047 -4.440 1.00 0.00 C ATOM 508 C LEU A 38 4.062 3.004 -5.485 1.00 0.00 C ATOM 509 O LEU A 38 4.761 3.894 -5.970 1.00 0.00 O ATOM 510 CB LEU A 38 4.445 2.639 -3.041 1.00 0.00 C ATOM 511 CG LEU A 38 3.102 3.317 -2.767 1.00 0.00 C ATOM 512 CD1 LEU A 38 2.727 3.185 -1.299 1.00 0.00 C ATOM 513 CD2 LEU A 38 3.150 4.781 -3.178 1.00 0.00 C ATOM 0 H LEU A 38 6.681 2.408 -4.224 1.00 0.00 H new ATOM 0 HA LEU A 38 4.081 1.105 -4.504 1.00 0.00 H new ATOM 0 HB2 LEU A 38 4.582 1.842 -2.311 1.00 0.00 H new ATOM 0 HB3 LEU A 38 5.238 3.367 -2.871 1.00 0.00 H new ATOM 0 HG LEU A 38 2.337 2.818 -3.362 1.00 0.00 H new ATOM 0 HD11 LEU A 38 1.769 3.673 -1.123 1.00 0.00 H new ATOM 0 HD12 LEU A 38 2.650 2.130 -1.037 1.00 0.00 H new ATOM 0 HD13 LEU A 38 3.493 3.657 -0.684 1.00 0.00 H new ATOM 0 HD21 LEU A 38 2.186 5.247 -2.976 1.00 0.00 H new ATOM 0 HD22 LEU A 38 3.927 5.293 -2.610 1.00 0.00 H new ATOM 0 HD23 LEU A 38 3.372 4.853 -4.243 1.00 0.00 H new ATOM 525 N HIS A 39 2.791 2.816 -5.827 1.00 0.00 N ATOM 526 CA HIS A 39 2.131 3.664 -6.814 1.00 0.00 C ATOM 527 C HIS A 39 0.736 4.061 -6.342 1.00 0.00 C ATOM 528 O HIS A 39 -0.151 3.216 -6.210 1.00 0.00 O ATOM 529 CB HIS A 39 2.041 2.942 -8.159 1.00 0.00 C ATOM 530 CG HIS A 39 3.376 2.585 -8.737 1.00 0.00 C ATOM 531 ND1 HIS A 39 4.188 3.497 -9.377 1.00 0.00 N ATOM 532 CD2 HIS A 39 4.040 1.406 -8.768 1.00 0.00 C ATOM 533 CE1 HIS A 39 5.293 2.895 -9.778 1.00 0.00 C ATOM 534 NE2 HIS A 39 5.229 1.625 -9.420 1.00 0.00 N ATOM 0 H HIS A 39 2.198 2.084 -5.435 1.00 0.00 H new ATOM 0 HA HIS A 39 2.726 4.569 -6.935 1.00 0.00 H new ATOM 0 HB2 HIS A 39 1.453 2.033 -8.035 1.00 0.00 H new ATOM 0 HB3 HIS A 39 1.505 3.575 -8.867 1.00 0.00 H new ATOM 0 HD1 HIS A 39 3.969 4.483 -9.519 1.00 0.00 H new ATOM 0 HD2 HIS A 39 3.699 0.468 -8.357 1.00 0.00 H new ATOM 0 HE1 HIS A 39 6.110 3.362 -10.308 1.00 0.00 H new ATOM 542 N LEU A 40 0.548 5.351 -6.089 1.00 0.00 N ATOM 543 CA LEU A 40 -0.740 5.861 -5.630 1.00 0.00 C ATOM 544 C LEU A 40 -1.562 6.393 -6.800 1.00 0.00 C ATOM 545 O LEU A 40 -1.161 7.343 -7.474 1.00 0.00 O ATOM 546 CB LEU A 40 -0.534 6.966 -4.593 1.00 0.00 C ATOM 547 CG LEU A 40 -0.478 6.514 -3.133 1.00 0.00 C ATOM 548 CD1 LEU A 40 -0.045 7.663 -2.235 1.00 0.00 C ATOM 549 CD2 LEU A 40 -1.828 5.969 -2.692 1.00 0.00 C ATOM 0 H LEU A 40 1.271 6.063 -6.194 1.00 0.00 H new ATOM 0 HA LEU A 40 -1.286 5.037 -5.170 1.00 0.00 H new ATOM 0 HB2 LEU A 40 0.394 7.488 -4.827 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -1.342 7.690 -4.698 1.00 0.00 H new ATOM 0 HG LEU A 40 0.259 5.716 -3.047 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -0.011 7.323 -1.200 1.00 0.00 H new ATOM 0 HD12 LEU A 40 0.944 8.008 -2.537 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -0.758 8.483 -2.324 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -1.770 5.652 -1.651 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -2.585 6.747 -2.793 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -2.098 5.117 -3.316 1.00 0.00 H new ATOM 561 N LYS A 41 -2.716 5.777 -7.034 1.00 0.00 N ATOM 562 CA LYS A 41 -3.598 6.190 -8.120 1.00 0.00 C ATOM 563 C LYS A 41 -5.034 6.339 -7.628 1.00 0.00 C ATOM 564 O LYS A 41 -5.555 5.497 -6.896 1.00 0.00 O ATOM 565 CB LYS A 41 -3.542 5.174 -9.263 1.00 0.00 C ATOM 566 CG LYS A 41 -3.950 3.771 -8.851 1.00 0.00 C ATOM 567 CD LYS A 41 -3.313 2.719 -9.744 1.00 0.00 C ATOM 568 CE LYS A 41 -3.597 1.313 -9.239 1.00 0.00 C ATOM 569 NZ LYS A 41 -3.647 0.324 -10.352 1.00 0.00 N ATOM 0 H LYS A 41 -3.063 4.990 -6.486 1.00 0.00 H new ATOM 0 HA LYS A 41 -3.256 7.158 -8.485 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -4.194 5.511 -10.069 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -2.529 5.146 -9.663 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -3.658 3.596 -7.816 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -5.035 3.679 -8.896 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -3.692 2.825 -10.760 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -2.236 2.881 -9.787 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -2.825 1.020 -8.527 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -4.546 1.304 -8.702 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -3.724 -0.636 -9.960 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -4.473 0.520 -10.953 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -2.779 0.397 -10.921 1.00 0.00 H new ATOM 583 N PRO A 42 -5.690 7.434 -8.037 1.00 0.00 N ATOM 584 CA PRO A 42 -7.075 7.718 -7.651 1.00 0.00 C ATOM 585 C PRO A 42 -8.067 6.761 -8.304 1.00 0.00 C ATOM 586 O PRO A 42 -8.064 6.582 -9.522 1.00 0.00 O ATOM 587 CB PRO A 42 -7.299 9.146 -8.156 1.00 0.00 C ATOM 588 CG PRO A 42 -6.331 9.307 -9.277 1.00 0.00 C ATOM 589 CD PRO A 42 -5.130 8.480 -8.910 1.00 0.00 C ATOM 0 HA PRO A 42 -7.231 7.601 -6.579 1.00 0.00 H new ATOM 0 HB2 PRO A 42 -8.325 9.290 -8.495 1.00 0.00 H new ATOM 0 HB3 PRO A 42 -7.118 9.877 -7.368 1.00 0.00 H new ATOM 0 HG2 PRO A 42 -6.764 8.969 -10.218 1.00 0.00 H new ATOM 0 HG3 PRO A 42 -6.058 10.354 -9.409 1.00 0.00 H new ATOM 0 HD2 PRO A 42 -4.651 8.054 -9.791 1.00 0.00 H new ATOM 0 HD3 PRO A 42 -4.376 9.074 -8.393 1.00 0.00 H new ATOM 597 N THR A 43 -8.915 6.146 -7.486 1.00 0.00 N ATOM 598 CA THR A 43 -9.912 5.207 -7.983 1.00 0.00 C ATOM 599 C THR A 43 -11.296 5.844 -8.025 1.00 0.00 C ATOM 600 O THR A 43 -11.497 6.947 -7.518 1.00 0.00 O ATOM 601 CB THR A 43 -9.970 3.936 -7.114 1.00 0.00 C ATOM 602 OG1 THR A 43 -10.627 2.883 -7.828 1.00 0.00 O ATOM 603 CG2 THR A 43 -10.705 4.207 -5.810 1.00 0.00 C ATOM 0 H THR A 43 -8.931 6.282 -6.475 1.00 0.00 H new ATOM 0 HA THR A 43 -9.611 4.933 -8.994 1.00 0.00 H new ATOM 0 HB THR A 43 -8.949 3.634 -6.882 1.00 0.00 H new ATOM 0 HG1 THR A 43 -10.658 2.079 -7.269 1.00 0.00 H new ATOM 0 HG21 THR A 43 -10.734 3.296 -5.212 1.00 0.00 H new ATOM 0 HG22 THR A 43 -10.186 4.988 -5.255 1.00 0.00 H new ATOM 0 HG23 THR A 43 -11.723 4.531 -6.027 1.00 0.00 H new ATOM 611 N ALA A 44 -12.247 5.142 -8.633 1.00 0.00 N ATOM 612 CA ALA A 44 -13.613 5.639 -8.739 1.00 0.00 C ATOM 613 C ALA A 44 -14.257 5.772 -7.362 1.00 0.00 C ATOM 614 O ALA A 44 -13.686 5.352 -6.357 1.00 0.00 O ATOM 615 CB ALA A 44 -14.442 4.720 -9.624 1.00 0.00 C ATOM 0 H ALA A 44 -12.096 4.228 -9.059 1.00 0.00 H new ATOM 0 HA ALA A 44 -13.579 6.629 -9.193 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -15.460 5.103 -9.694 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -14.001 4.678 -10.620 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -14.460 3.719 -9.193 1.00 0.00 H new ATOM 621 N ASN A 45 -15.449 6.359 -7.326 1.00 0.00 N ATOM 622 CA ASN A 45 -16.170 6.548 -6.072 1.00 0.00 C ATOM 623 C ASN A 45 -15.372 7.428 -5.114 1.00 0.00 C ATOM 624 O ASN A 45 -15.448 7.263 -3.897 1.00 0.00 O ATOM 625 CB ASN A 45 -16.461 5.196 -5.418 1.00 0.00 C ATOM 626 CG ASN A 45 -17.678 4.515 -6.016 1.00 0.00 C ATOM 627 OD1 ASN A 45 -17.556 3.541 -6.759 1.00 0.00 O ATOM 628 ND2 ASN A 45 -18.860 5.027 -5.693 1.00 0.00 N ATOM 0 H ASN A 45 -15.936 6.712 -8.150 1.00 0.00 H new ATOM 0 HA ASN A 45 -17.113 7.046 -6.295 1.00 0.00 H new ATOM 0 HB2 ASN A 45 -15.593 4.547 -5.530 1.00 0.00 H new ATOM 0 HB3 ASN A 45 -16.616 5.339 -4.349 1.00 0.00 H new ATOM 0 HD21 ASN A 45 -19.714 4.612 -6.065 1.00 0.00 H new ATOM 0 HD22 ASN A 45 -18.913 5.835 -5.073 1.00 0.00 H new ATOM 635 N GLN A 46 -14.609 8.361 -5.672 1.00 0.00 N ATOM 636 CA GLN A 46 -13.798 9.267 -4.867 1.00 0.00 C ATOM 637 C GLN A 46 -12.946 8.491 -3.867 1.00 0.00 C ATOM 638 O GLN A 46 -12.862 8.854 -2.694 1.00 0.00 O ATOM 639 CB GLN A 46 -14.691 10.265 -4.128 1.00 0.00 C ATOM 640 CG GLN A 46 -13.959 11.520 -3.680 1.00 0.00 C ATOM 641 CD GLN A 46 -14.905 12.640 -3.293 1.00 0.00 C ATOM 642 OE1 GLN A 46 -15.184 13.536 -4.090 1.00 0.00 O ATOM 643 NE2 GLN A 46 -15.406 12.594 -2.064 1.00 0.00 N ATOM 0 H GLN A 46 -14.535 8.510 -6.678 1.00 0.00 H new ATOM 0 HA GLN A 46 -13.134 9.812 -5.537 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -15.519 10.549 -4.777 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -15.124 9.776 -3.255 1.00 0.00 H new ATOM 0 HG2 GLN A 46 -13.320 11.280 -2.831 1.00 0.00 H new ATOM 0 HG3 GLN A 46 -13.306 11.862 -4.483 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -15.148 11.833 -1.436 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -16.049 13.320 -1.748 1.00 0.00 H new ATOM 652 N LYS A 47 -12.317 7.420 -4.339 1.00 0.00 N ATOM 653 CA LYS A 47 -11.470 6.593 -3.488 1.00 0.00 C ATOM 654 C LYS A 47 -10.047 6.529 -4.033 1.00 0.00 C ATOM 655 O LYS A 47 -9.770 7.006 -5.134 1.00 0.00 O ATOM 656 CB LYS A 47 -12.049 5.180 -3.378 1.00 0.00 C ATOM 657 CG LYS A 47 -13.116 5.042 -2.306 1.00 0.00 C ATOM 658 CD LYS A 47 -12.507 4.751 -0.945 1.00 0.00 C ATOM 659 CE LYS A 47 -13.506 4.991 0.176 1.00 0.00 C ATOM 660 NZ LYS A 47 -12.829 5.218 1.483 1.00 0.00 N ATOM 0 H LYS A 47 -12.378 7.104 -5.307 1.00 0.00 H new ATOM 0 HA LYS A 47 -11.440 7.046 -2.497 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -12.474 4.894 -4.340 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -11.240 4.480 -3.166 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -13.702 5.960 -2.254 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -13.803 4.240 -2.577 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -12.164 3.717 -0.913 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -11.631 5.382 -0.795 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -14.124 5.855 -0.068 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -14.174 4.133 0.257 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -13.491 5.009 2.258 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -12.000 4.594 1.558 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -12.522 6.210 1.548 1.00 0.00 H new ATOM 674 N THR A 48 -9.146 5.936 -3.256 1.00 0.00 N ATOM 675 CA THR A 48 -7.752 5.809 -3.661 1.00 0.00 C ATOM 676 C THR A 48 -7.288 4.359 -3.589 1.00 0.00 C ATOM 677 O THR A 48 -7.400 3.713 -2.548 1.00 0.00 O ATOM 678 CB THR A 48 -6.831 6.675 -2.781 1.00 0.00 C ATOM 679 OG1 THR A 48 -7.217 8.051 -2.873 1.00 0.00 O ATOM 680 CG2 THR A 48 -5.378 6.522 -3.204 1.00 0.00 C ATOM 0 H THR A 48 -9.357 5.536 -2.342 1.00 0.00 H new ATOM 0 HA THR A 48 -7.690 6.156 -4.692 1.00 0.00 H new ATOM 0 HB THR A 48 -6.930 6.338 -1.749 1.00 0.00 H new ATOM 0 HG1 THR A 48 -7.311 8.425 -1.972 1.00 0.00 H new ATOM 0 HG21 THR A 48 -4.747 7.143 -2.568 1.00 0.00 H new ATOM 0 HG22 THR A 48 -5.078 5.479 -3.105 1.00 0.00 H new ATOM 0 HG23 THR A 48 -5.266 6.835 -4.242 1.00 0.00 H new ATOM 688 N GLN A 49 -6.766 3.854 -4.702 1.00 0.00 N ATOM 689 CA GLN A 49 -6.284 2.479 -4.764 1.00 0.00 C ATOM 690 C GLN A 49 -4.781 2.417 -4.513 1.00 0.00 C ATOM 691 O GLN A 49 -4.001 3.095 -5.182 1.00 0.00 O ATOM 692 CB GLN A 49 -6.612 1.863 -6.125 1.00 0.00 C ATOM 693 CG GLN A 49 -6.039 0.468 -6.315 1.00 0.00 C ATOM 694 CD GLN A 49 -6.312 -0.093 -7.697 1.00 0.00 C ATOM 695 OE1 GLN A 49 -7.100 0.466 -8.461 1.00 0.00 O ATOM 696 NE2 GLN A 49 -5.662 -1.202 -8.026 1.00 0.00 N ATOM 0 H GLN A 49 -6.666 4.376 -5.573 1.00 0.00 H new ATOM 0 HA GLN A 49 -6.787 1.908 -3.984 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -7.695 1.821 -6.244 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -6.229 2.514 -6.911 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -4.963 0.495 -6.144 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -6.464 -0.200 -5.566 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -5.018 -1.632 -7.362 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -5.806 -1.625 -8.943 1.00 0.00 H new ATOM 705 N LEU A 50 -4.382 1.599 -3.546 1.00 0.00 N ATOM 706 CA LEU A 50 -2.971 1.448 -3.206 1.00 0.00 C ATOM 707 C LEU A 50 -2.363 0.248 -3.925 1.00 0.00 C ATOM 708 O LEU A 50 -2.760 -0.895 -3.695 1.00 0.00 O ATOM 709 CB LEU A 50 -2.805 1.287 -1.693 1.00 0.00 C ATOM 710 CG LEU A 50 -1.368 1.282 -1.173 1.00 0.00 C ATOM 711 CD1 LEU A 50 -0.552 0.203 -1.868 1.00 0.00 C ATOM 712 CD2 LEU A 50 -0.725 2.648 -1.367 1.00 0.00 C ATOM 0 H LEU A 50 -5.015 1.030 -2.983 1.00 0.00 H new ATOM 0 HA LEU A 50 -2.447 2.347 -3.530 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -3.346 2.095 -1.200 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -3.282 0.354 -1.392 1.00 0.00 H new ATOM 0 HG LEU A 50 -1.389 1.061 -0.106 1.00 0.00 H new ATOM 0 HD11 LEU A 50 0.468 0.215 -1.485 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -1.000 -0.772 -1.677 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -0.538 0.392 -2.941 1.00 0.00 H new ATOM 0 HD21 LEU A 50 0.298 2.625 -0.991 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -0.716 2.899 -2.428 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -1.296 3.400 -0.821 1.00 0.00 H new ATOM 724 N LEU A 51 -1.396 0.516 -4.796 1.00 0.00 N ATOM 725 CA LEU A 51 -0.731 -0.542 -5.549 1.00 0.00 C ATOM 726 C LEU A 51 0.778 -0.505 -5.323 1.00 0.00 C ATOM 727 O LEU A 51 1.366 0.566 -5.169 1.00 0.00 O ATOM 728 CB LEU A 51 -1.038 -0.404 -7.041 1.00 0.00 C ATOM 729 CG LEU A 51 -0.696 -1.615 -7.911 1.00 0.00 C ATOM 730 CD1 LEU A 51 -1.705 -2.732 -7.691 1.00 0.00 C ATOM 731 CD2 LEU A 51 -0.648 -1.219 -9.380 1.00 0.00 C ATOM 0 H LEU A 51 -1.055 1.456 -4.998 1.00 0.00 H new ATOM 0 HA LEU A 51 -1.110 -1.500 -5.194 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -2.100 -0.188 -7.155 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -0.495 0.459 -7.425 1.00 0.00 H new ATOM 0 HG LEU A 51 0.289 -1.981 -7.621 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -1.446 -3.585 -8.318 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -1.691 -3.034 -6.644 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -2.702 -2.378 -7.953 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -0.403 -2.092 -9.984 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -1.619 -0.828 -9.683 1.00 0.00 H new ATOM 0 HD23 LEU A 51 0.113 -0.452 -9.526 1.00 0.00 H new ATOM 743 N VAL A 52 1.398 -1.680 -5.307 1.00 0.00 N ATOM 744 CA VAL A 52 2.838 -1.782 -5.104 1.00 0.00 C ATOM 745 C VAL A 52 3.456 -2.802 -6.053 1.00 0.00 C ATOM 746 O VAL A 52 3.068 -3.971 -6.063 1.00 0.00 O ATOM 747 CB VAL A 52 3.174 -2.177 -3.654 1.00 0.00 C ATOM 748 CG1 VAL A 52 4.678 -2.311 -3.471 1.00 0.00 C ATOM 749 CG2 VAL A 52 2.599 -1.160 -2.679 1.00 0.00 C ATOM 0 H VAL A 52 0.925 -2.575 -5.432 1.00 0.00 H new ATOM 0 HA VAL A 52 3.257 -0.797 -5.311 1.00 0.00 H new ATOM 0 HB VAL A 52 2.719 -3.145 -3.445 1.00 0.00 H new ATOM 0 HG11 VAL A 52 4.896 -2.591 -2.440 1.00 0.00 H new ATOM 0 HG12 VAL A 52 5.059 -3.079 -4.144 1.00 0.00 H new ATOM 0 HG13 VAL A 52 5.158 -1.359 -3.698 1.00 0.00 H new ATOM 0 HG21 VAL A 52 2.846 -1.454 -1.659 1.00 0.00 H new ATOM 0 HG22 VAL A 52 3.023 -0.177 -2.886 1.00 0.00 H new ATOM 0 HG23 VAL A 52 1.516 -1.119 -2.793 1.00 0.00 H new ATOM 759 N ARG A 53 4.421 -2.354 -6.849 1.00 0.00 N ATOM 760 CA ARG A 53 5.093 -3.228 -7.803 1.00 0.00 C ATOM 761 C ARG A 53 6.413 -3.740 -7.234 1.00 0.00 C ATOM 762 O ARG A 53 7.080 -3.047 -6.467 1.00 0.00 O ATOM 763 CB ARG A 53 5.345 -2.486 -9.117 1.00 0.00 C ATOM 764 CG ARG A 53 6.256 -1.278 -8.970 1.00 0.00 C ATOM 765 CD ARG A 53 7.716 -1.654 -9.168 1.00 0.00 C ATOM 766 NE ARG A 53 7.963 -2.210 -10.496 1.00 0.00 N ATOM 767 CZ ARG A 53 9.155 -2.210 -11.082 1.00 0.00 C ATOM 768 NH1 ARG A 53 10.203 -1.688 -10.461 1.00 0.00 N ATOM 769 NH2 ARG A 53 9.300 -2.735 -12.293 1.00 0.00 N ATOM 0 H ARG A 53 4.755 -1.390 -6.852 1.00 0.00 H new ATOM 0 HA ARG A 53 4.444 -4.082 -7.995 1.00 0.00 H new ATOM 0 HB2 ARG A 53 5.785 -3.177 -9.836 1.00 0.00 H new ATOM 0 HB3 ARG A 53 4.390 -2.162 -9.530 1.00 0.00 H new ATOM 0 HG2 ARG A 53 5.973 -0.517 -9.697 1.00 0.00 H new ATOM 0 HG3 ARG A 53 6.123 -0.839 -7.981 1.00 0.00 H new ATOM 0 HD2 ARG A 53 8.340 -0.772 -9.022 1.00 0.00 H new ATOM 0 HD3 ARG A 53 8.009 -2.381 -8.410 1.00 0.00 H new ATOM 0 HE ARG A 53 7.177 -2.621 -11.001 1.00 0.00 H new ATOM 0 HH11 ARG A 53 10.096 -1.285 -9.530 1.00 0.00 H new ATOM 0 HH12 ARG A 53 11.117 -1.690 -10.914 1.00 0.00 H new ATOM 0 HH21 ARG A 53 8.496 -3.138 -12.774 1.00 0.00 H new ATOM 0 HH22 ARG A 53 10.216 -2.735 -12.743 1.00 0.00 H new ATOM 783 N ALA A 54 6.782 -4.959 -7.616 1.00 0.00 N ATOM 784 CA ALA A 54 8.022 -5.563 -7.146 1.00 0.00 C ATOM 785 C ALA A 54 9.236 -4.873 -7.758 1.00 0.00 C ATOM 786 O ALA A 54 9.185 -4.395 -8.891 1.00 0.00 O ATOM 787 CB ALA A 54 8.040 -7.050 -7.468 1.00 0.00 C ATOM 0 H ALA A 54 6.240 -5.547 -8.249 1.00 0.00 H new ATOM 0 HA ALA A 54 8.072 -5.436 -6.065 1.00 0.00 H new ATOM 0 HB1 ALA A 54 8.972 -7.488 -7.111 1.00 0.00 H new ATOM 0 HB2 ALA A 54 7.198 -7.539 -6.978 1.00 0.00 H new ATOM 0 HB3 ALA A 54 7.963 -7.190 -8.546 1.00 0.00 H new ATOM 793 N ASP A 55 10.327 -4.824 -7.001 1.00 0.00 N ATOM 794 CA ASP A 55 11.555 -4.192 -7.470 1.00 0.00 C ATOM 795 C ASP A 55 12.177 -4.992 -8.611 1.00 0.00 C ATOM 796 O ASP A 55 12.577 -4.431 -9.632 1.00 0.00 O ATOM 797 CB ASP A 55 12.555 -4.057 -6.321 1.00 0.00 C ATOM 798 CG ASP A 55 13.223 -5.374 -5.977 1.00 0.00 C ATOM 799 OD1 ASP A 55 12.498 -6.346 -5.676 1.00 0.00 O ATOM 800 OD2 ASP A 55 14.470 -5.433 -6.008 1.00 0.00 O ATOM 0 H ASP A 55 10.386 -5.214 -6.060 1.00 0.00 H new ATOM 0 HA ASP A 55 11.304 -3.199 -7.842 1.00 0.00 H new ATOM 0 HB2 ASP A 55 13.317 -3.326 -6.591 1.00 0.00 H new ATOM 0 HB3 ASP A 55 12.042 -3.672 -5.440 1.00 0.00 H new ATOM 805 N THR A 56 12.256 -6.307 -8.430 1.00 0.00 N ATOM 806 CA THR A 56 12.831 -7.184 -9.442 1.00 0.00 C ATOM 807 C THR A 56 12.179 -6.956 -10.801 1.00 0.00 C ATOM 808 O THR A 56 11.095 -6.383 -10.892 1.00 0.00 O ATOM 809 CB THR A 56 12.677 -8.667 -9.054 1.00 0.00 C ATOM 810 OG1 THR A 56 11.299 -9.050 -9.120 1.00 0.00 O ATOM 811 CG2 THR A 56 13.211 -8.917 -7.652 1.00 0.00 C ATOM 0 H THR A 56 11.929 -6.788 -7.592 1.00 0.00 H new ATOM 0 HA THR A 56 13.892 -6.941 -9.505 1.00 0.00 H new ATOM 0 HB THR A 56 13.254 -9.266 -9.758 1.00 0.00 H new ATOM 0 HG1 THR A 56 11.210 -9.994 -8.874 1.00 0.00 H new ATOM 0 HG21 THR A 56 13.092 -9.971 -7.400 1.00 0.00 H new ATOM 0 HG22 THR A 56 14.267 -8.652 -7.612 1.00 0.00 H new ATOM 0 HG23 THR A 56 12.657 -8.308 -6.938 1.00 0.00 H new ATOM 819 N ASN A 57 12.848 -7.410 -11.857 1.00 0.00 N ATOM 820 CA ASN A 57 12.333 -7.255 -13.212 1.00 0.00 C ATOM 821 C ASN A 57 10.865 -7.664 -13.286 1.00 0.00 C ATOM 822 O ASN A 57 10.025 -6.915 -13.787 1.00 0.00 O ATOM 823 CB ASN A 57 13.158 -8.093 -14.192 1.00 0.00 C ATOM 824 CG ASN A 57 14.546 -7.524 -14.413 1.00 0.00 C ATOM 825 OD1 ASN A 57 15.008 -6.671 -13.654 1.00 0.00 O ATOM 826 ND2 ASN A 57 15.219 -7.995 -15.456 1.00 0.00 N ATOM 0 H ASN A 57 13.747 -7.888 -11.800 1.00 0.00 H new ATOM 0 HA ASN A 57 12.413 -6.203 -13.487 1.00 0.00 H new ATOM 0 HB2 ASN A 57 13.242 -9.112 -13.813 1.00 0.00 H new ATOM 0 HB3 ASN A 57 12.635 -8.150 -15.147 1.00 0.00 H new ATOM 0 HD21 ASN A 57 16.158 -7.650 -15.655 1.00 0.00 H new ATOM 0 HD22 ASN A 57 14.797 -8.702 -16.058 1.00 0.00 H new ATOM 833 N LEU A 58 10.563 -8.856 -12.784 1.00 0.00 N ATOM 834 CA LEU A 58 9.196 -9.366 -12.792 1.00 0.00 C ATOM 835 C LEU A 58 8.259 -8.422 -12.047 1.00 0.00 C ATOM 836 O LEU A 58 8.549 -7.996 -10.930 1.00 0.00 O ATOM 837 CB LEU A 58 9.146 -10.758 -12.160 1.00 0.00 C ATOM 838 CG LEU A 58 8.955 -10.799 -10.643 1.00 0.00 C ATOM 839 CD1 LEU A 58 7.475 -10.835 -10.293 1.00 0.00 C ATOM 840 CD2 LEU A 58 9.675 -11.999 -10.047 1.00 0.00 C ATOM 0 H LEU A 58 11.246 -9.488 -12.366 1.00 0.00 H new ATOM 0 HA LEU A 58 8.865 -9.433 -13.828 1.00 0.00 H new ATOM 0 HB2 LEU A 58 8.333 -11.317 -12.624 1.00 0.00 H new ATOM 0 HB3 LEU A 58 10.071 -11.280 -12.404 1.00 0.00 H new ATOM 0 HG LEU A 58 9.387 -9.893 -10.217 1.00 0.00 H new ATOM 0 HD11 LEU A 58 7.358 -10.864 -9.210 1.00 0.00 H new ATOM 0 HD12 LEU A 58 6.986 -9.944 -10.687 1.00 0.00 H new ATOM 0 HD13 LEU A 58 7.019 -11.723 -10.731 1.00 0.00 H new ATOM 0 HD21 LEU A 58 9.528 -12.012 -8.967 1.00 0.00 H new ATOM 0 HD22 LEU A 58 9.273 -12.916 -10.479 1.00 0.00 H new ATOM 0 HD23 LEU A 58 10.740 -11.931 -10.267 1.00 0.00 H new ATOM 852 N GLY A 59 7.131 -8.099 -12.673 1.00 0.00 N ATOM 853 CA GLY A 59 6.167 -7.209 -12.053 1.00 0.00 C ATOM 854 C GLY A 59 4.982 -7.954 -11.469 1.00 0.00 C ATOM 855 O GLY A 59 4.037 -8.286 -12.183 1.00 0.00 O ATOM 0 H GLY A 59 6.868 -8.438 -13.598 1.00 0.00 H new ATOM 0 HA2 GLY A 59 6.658 -6.639 -11.265 1.00 0.00 H new ATOM 0 HA3 GLY A 59 5.812 -6.491 -12.792 1.00 0.00 H new ATOM 859 N ASN A 60 5.034 -8.218 -10.168 1.00 0.00 N ATOM 860 CA ASN A 60 3.958 -8.930 -9.489 1.00 0.00 C ATOM 861 C ASN A 60 3.339 -8.065 -8.395 1.00 0.00 C ATOM 862 O ASN A 60 4.047 -7.494 -7.566 1.00 0.00 O ATOM 863 CB ASN A 60 4.482 -10.235 -8.887 1.00 0.00 C ATOM 864 CG ASN A 60 5.160 -10.023 -7.547 1.00 0.00 C ATOM 865 OD1 ASN A 60 6.231 -9.421 -7.469 1.00 0.00 O ATOM 866 ND2 ASN A 60 4.538 -10.519 -6.484 1.00 0.00 N ATOM 0 H ASN A 60 5.810 -7.950 -9.563 1.00 0.00 H new ATOM 0 HA ASN A 60 3.188 -9.161 -10.225 1.00 0.00 H new ATOM 0 HB2 ASN A 60 3.654 -10.934 -8.766 1.00 0.00 H new ATOM 0 HB3 ASN A 60 5.188 -10.694 -9.580 1.00 0.00 H new ATOM 0 HD21 ASN A 60 4.947 -10.408 -5.556 1.00 0.00 H new ATOM 0 HD22 ASN A 60 3.652 -11.011 -6.595 1.00 0.00 H new ATOM 873 N ILE A 61 2.013 -7.975 -8.399 1.00 0.00 N ATOM 874 CA ILE A 61 1.298 -7.182 -7.407 1.00 0.00 C ATOM 875 C ILE A 61 1.695 -7.587 -5.991 1.00 0.00 C ATOM 876 O ILE A 61 1.389 -8.692 -5.541 1.00 0.00 O ATOM 877 CB ILE A 61 -0.227 -7.327 -7.562 1.00 0.00 C ATOM 878 CG1 ILE A 61 -0.680 -6.762 -8.911 1.00 0.00 C ATOM 879 CG2 ILE A 61 -0.945 -6.624 -6.420 1.00 0.00 C ATOM 880 CD1 ILE A 61 -2.121 -7.077 -9.244 1.00 0.00 C ATOM 0 H ILE A 61 1.412 -8.442 -9.078 1.00 0.00 H new ATOM 0 HA ILE A 61 1.574 -6.141 -7.576 1.00 0.00 H new ATOM 0 HB ILE A 61 -0.482 -8.386 -7.528 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -0.544 -5.680 -8.907 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -0.038 -7.161 -9.697 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -2.022 -6.736 -6.544 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -0.641 -7.067 -5.472 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -0.687 -5.565 -6.425 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -2.373 -6.646 -10.213 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -2.258 -8.158 -9.281 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -2.772 -6.655 -8.479 1.00 0.00 H new ATOM 892 N LEU A 62 2.375 -6.685 -5.292 1.00 0.00 N ATOM 893 CA LEU A 62 2.812 -6.946 -3.925 1.00 0.00 C ATOM 894 C LEU A 62 1.671 -6.727 -2.938 1.00 0.00 C ATOM 895 O LEU A 62 1.450 -7.538 -2.037 1.00 0.00 O ATOM 896 CB LEU A 62 3.994 -6.044 -3.565 1.00 0.00 C ATOM 897 CG LEU A 62 5.377 -6.557 -3.968 1.00 0.00 C ATOM 898 CD1 LEU A 62 6.464 -5.645 -3.422 1.00 0.00 C ATOM 899 CD2 LEU A 62 5.580 -7.984 -3.480 1.00 0.00 C ATOM 0 H LEU A 62 2.636 -5.766 -5.650 1.00 0.00 H new ATOM 0 HA LEU A 62 3.127 -7.988 -3.863 1.00 0.00 H new ATOM 0 HB2 LEU A 62 3.839 -5.072 -4.033 1.00 0.00 H new ATOM 0 HB3 LEU A 62 3.988 -5.884 -2.487 1.00 0.00 H new ATOM 0 HG LEU A 62 5.442 -6.554 -5.056 1.00 0.00 H new ATOM 0 HD11 LEU A 62 7.441 -6.026 -3.719 1.00 0.00 H new ATOM 0 HD12 LEU A 62 6.330 -4.640 -3.821 1.00 0.00 H new ATOM 0 HD13 LEU A 62 6.401 -5.615 -2.334 1.00 0.00 H new ATOM 0 HD21 LEU A 62 6.570 -8.332 -3.776 1.00 0.00 H new ATOM 0 HD22 LEU A 62 5.495 -8.013 -2.394 1.00 0.00 H new ATOM 0 HD23 LEU A 62 4.821 -8.631 -3.920 1.00 0.00 H new ATOM 911 N LEU A 63 0.947 -5.627 -3.113 1.00 0.00 N ATOM 912 CA LEU A 63 -0.174 -5.302 -2.238 1.00 0.00 C ATOM 913 C LEU A 63 -1.147 -4.351 -2.929 1.00 0.00 C ATOM 914 O LEU A 63 -0.819 -3.194 -3.190 1.00 0.00 O ATOM 915 CB LEU A 63 0.332 -4.674 -0.938 1.00 0.00 C ATOM 916 CG LEU A 63 -0.734 -4.067 -0.026 1.00 0.00 C ATOM 917 CD1 LEU A 63 -1.453 -5.157 0.754 1.00 0.00 C ATOM 918 CD2 LEU A 63 -0.110 -3.054 0.923 1.00 0.00 C ATOM 0 H LEU A 63 1.116 -4.945 -3.853 1.00 0.00 H new ATOM 0 HA LEU A 63 -0.701 -6.228 -2.006 1.00 0.00 H new ATOM 0 HB2 LEU A 63 0.871 -5.436 -0.376 1.00 0.00 H new ATOM 0 HB3 LEU A 63 1.052 -3.895 -1.190 1.00 0.00 H new ATOM 0 HG LEU A 63 -1.465 -3.551 -0.648 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -2.208 -4.706 1.398 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -1.933 -5.846 0.059 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -0.734 -5.702 1.365 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -0.884 -2.632 1.565 1.00 0.00 H new ATOM 0 HD22 LEU A 63 0.643 -3.547 1.538 1.00 0.00 H new ATOM 0 HD23 LEU A 63 0.358 -2.256 0.347 1.00 0.00 H new ATOM 930 N ASN A 64 -2.344 -4.848 -3.222 1.00 0.00 N ATOM 931 CA ASN A 64 -3.365 -4.042 -3.882 1.00 0.00 C ATOM 932 C ASN A 64 -4.613 -3.925 -3.012 1.00 0.00 C ATOM 933 O ASN A 64 -5.419 -4.852 -2.935 1.00 0.00 O ATOM 934 CB ASN A 64 -3.730 -4.653 -5.237 1.00 0.00 C ATOM 935 CG ASN A 64 -5.075 -4.170 -5.745 1.00 0.00 C ATOM 936 OD1 ASN A 64 -5.568 -3.122 -5.329 1.00 0.00 O ATOM 937 ND2 ASN A 64 -5.674 -4.934 -6.651 1.00 0.00 N ATOM 0 H ASN A 64 -2.631 -5.804 -3.013 1.00 0.00 H new ATOM 0 HA ASN A 64 -2.958 -3.043 -4.039 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -2.958 -4.403 -5.965 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -3.746 -5.739 -5.150 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -6.580 -4.660 -7.031 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -5.228 -5.795 -6.967 1.00 0.00 H new ATOM 944 N VAL A 65 -4.765 -2.778 -2.357 1.00 0.00 N ATOM 945 CA VAL A 65 -5.915 -2.539 -1.493 1.00 0.00 C ATOM 946 C VAL A 65 -6.279 -1.058 -1.460 1.00 0.00 C ATOM 947 O VAL A 65 -5.478 -0.202 -1.837 1.00 0.00 O ATOM 948 CB VAL A 65 -5.648 -3.022 -0.055 1.00 0.00 C ATOM 949 CG1 VAL A 65 -5.139 -4.456 -0.060 1.00 0.00 C ATOM 950 CG2 VAL A 65 -4.659 -2.099 0.641 1.00 0.00 C ATOM 0 H VAL A 65 -4.107 -2.001 -2.408 1.00 0.00 H new ATOM 0 HA VAL A 65 -6.747 -3.106 -1.910 1.00 0.00 H new ATOM 0 HB VAL A 65 -6.586 -2.996 0.499 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -4.956 -4.781 0.964 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -5.885 -5.105 -0.518 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -4.211 -4.511 -0.629 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -4.482 -2.455 1.656 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -3.719 -2.091 0.090 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -5.067 -1.089 0.677 1.00 0.00 H new ATOM 960 N LEU A 66 -7.492 -0.763 -1.007 1.00 0.00 N ATOM 961 CA LEU A 66 -7.963 0.615 -0.924 1.00 0.00 C ATOM 962 C LEU A 66 -7.480 1.279 0.361 1.00 0.00 C ATOM 963 O LEU A 66 -6.998 0.609 1.274 1.00 0.00 O ATOM 964 CB LEU A 66 -9.491 0.657 -0.990 1.00 0.00 C ATOM 965 CG LEU A 66 -10.100 0.796 -2.386 1.00 0.00 C ATOM 966 CD1 LEU A 66 -9.701 2.123 -3.012 1.00 0.00 C ATOM 967 CD2 LEU A 66 -9.671 -0.364 -3.272 1.00 0.00 C ATOM 0 H LEU A 66 -8.167 -1.459 -0.692 1.00 0.00 H new ATOM 0 HA LEU A 66 -7.553 1.165 -1.771 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -9.879 -0.254 -0.535 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -9.838 1.491 -0.380 1.00 0.00 H new ATOM 0 HG LEU A 66 -11.186 0.774 -2.292 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -10.143 2.205 -4.005 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -10.058 2.942 -2.387 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -8.615 2.175 -3.093 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -10.113 -0.249 -4.262 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -8.585 -0.373 -3.359 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -10.007 -1.302 -2.831 1.00 0.00 H new ATOM 979 N ILE A 67 -7.613 2.600 0.424 1.00 0.00 N ATOM 980 CA ILE A 67 -7.192 3.354 1.599 1.00 0.00 C ATOM 981 C ILE A 67 -8.390 3.966 2.317 1.00 0.00 C ATOM 982 O ILE A 67 -8.943 4.983 1.900 1.00 0.00 O ATOM 983 CB ILE A 67 -6.205 4.475 1.224 1.00 0.00 C ATOM 984 CG1 ILE A 67 -5.010 3.899 0.461 1.00 0.00 C ATOM 985 CG2 ILE A 67 -5.740 5.210 2.472 1.00 0.00 C ATOM 986 CD1 ILE A 67 -4.099 4.956 -0.121 1.00 0.00 C ATOM 0 H ILE A 67 -8.009 3.170 -0.324 1.00 0.00 H new ATOM 0 HA ILE A 67 -6.693 2.650 2.265 1.00 0.00 H new ATOM 0 HB ILE A 67 -6.716 5.187 0.576 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -4.433 3.263 1.132 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -5.376 3.263 -0.345 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -5.043 5.999 2.191 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -6.600 5.649 2.978 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -5.243 4.509 3.143 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -3.274 4.476 -0.648 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -4.661 5.578 -0.818 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -3.704 5.578 0.682 1.00 0.00 H new ATOM 998 N PRO A 68 -8.802 3.332 3.426 1.00 0.00 N ATOM 999 CA PRO A 68 -9.937 3.798 4.228 1.00 0.00 C ATOM 1000 C PRO A 68 -9.632 5.097 4.965 1.00 0.00 C ATOM 1001 O PRO A 68 -8.487 5.386 5.316 1.00 0.00 O ATOM 1002 CB PRO A 68 -10.159 2.657 5.224 1.00 0.00 C ATOM 1003 CG PRO A 68 -8.832 1.988 5.336 1.00 0.00 C ATOM 1004 CD PRO A 68 -8.190 2.114 3.982 1.00 0.00 C ATOM 0 HA PRO A 68 -10.808 4.020 3.611 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -10.495 3.034 6.190 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -10.923 1.965 4.869 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -8.220 2.461 6.104 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -8.945 0.941 5.619 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -7.107 2.207 4.058 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -8.392 1.243 3.359 1.00 0.00 H new ATOM 1012 N PRO A 69 -10.678 5.900 5.208 1.00 0.00 N ATOM 1013 CA PRO A 69 -10.547 7.182 5.908 1.00 0.00 C ATOM 1014 C PRO A 69 -10.215 7.005 7.385 1.00 0.00 C ATOM 1015 O PRO A 69 -9.634 7.891 8.011 1.00 0.00 O ATOM 1016 CB PRO A 69 -11.928 7.820 5.743 1.00 0.00 C ATOM 1017 CG PRO A 69 -12.856 6.669 5.555 1.00 0.00 C ATOM 1018 CD PRO A 69 -12.070 5.619 4.819 1.00 0.00 C ATOM 0 HA PRO A 69 -9.733 7.785 5.504 1.00 0.00 H new ATOM 0 HB2 PRO A 69 -12.200 8.409 6.619 1.00 0.00 H new ATOM 0 HB3 PRO A 69 -11.953 8.493 4.886 1.00 0.00 H new ATOM 0 HG2 PRO A 69 -13.209 6.291 6.515 1.00 0.00 H new ATOM 0 HG3 PRO A 69 -13.737 6.967 4.987 1.00 0.00 H new ATOM 0 HD2 PRO A 69 -12.373 4.613 5.109 1.00 0.00 H new ATOM 0 HD3 PRO A 69 -12.209 5.695 3.741 1.00 0.00 H new ATOM 1026 N ASN A 70 -10.586 5.854 7.937 1.00 0.00 N ATOM 1027 CA ASN A 70 -10.327 5.561 9.342 1.00 0.00 C ATOM 1028 C ASN A 70 -8.953 4.923 9.520 1.00 0.00 C ATOM 1029 O ASN A 70 -8.666 4.323 10.556 1.00 0.00 O ATOM 1030 CB ASN A 70 -11.409 4.633 9.898 1.00 0.00 C ATOM 1031 CG ASN A 70 -12.809 5.137 9.607 1.00 0.00 C ATOM 1032 OD1 ASN A 70 -13.035 6.342 9.490 1.00 0.00 O ATOM 1033 ND2 ASN A 70 -13.757 4.215 9.489 1.00 0.00 N ATOM 0 H ASN A 70 -11.067 5.109 7.433 1.00 0.00 H new ATOM 0 HA ASN A 70 -10.345 6.501 9.893 1.00 0.00 H new ATOM 0 HB2 ASN A 70 -11.287 3.639 9.468 1.00 0.00 H new ATOM 0 HB3 ASN A 70 -11.279 4.532 10.976 1.00 0.00 H new ATOM 0 HD21 ASN A 70 -14.718 4.494 9.294 1.00 0.00 H new ATOM 0 HD22 ASN A 70 -13.524 3.228 9.594 1.00 0.00 H new ATOM 1040 N MET A 71 -8.108 5.057 8.503 1.00 0.00 N ATOM 1041 CA MET A 71 -6.763 4.495 8.549 1.00 0.00 C ATOM 1042 C MET A 71 -5.855 5.330 9.446 1.00 0.00 C ATOM 1043 O MET A 71 -5.630 6.517 9.209 1.00 0.00 O ATOM 1044 CB MET A 71 -6.173 4.415 7.139 1.00 0.00 C ATOM 1045 CG MET A 71 -4.682 4.118 7.121 1.00 0.00 C ATOM 1046 SD MET A 71 -3.888 4.646 5.590 1.00 0.00 S ATOM 1047 CE MET A 71 -2.478 5.544 6.233 1.00 0.00 C ATOM 0 H MET A 71 -8.330 5.549 7.638 1.00 0.00 H new ATOM 0 HA MET A 71 -6.830 3.490 8.965 1.00 0.00 H new ATOM 0 HB2 MET A 71 -6.696 3.641 6.578 1.00 0.00 H new ATOM 0 HB3 MET A 71 -6.354 5.359 6.624 1.00 0.00 H new ATOM 0 HG2 MET A 71 -4.206 4.618 7.964 1.00 0.00 H new ATOM 0 HG3 MET A 71 -4.527 3.048 7.256 1.00 0.00 H new ATOM 0 HE1 MET A 71 -1.848 5.873 5.406 1.00 0.00 H new ATOM 0 HE2 MET A 71 -2.824 6.412 6.793 1.00 0.00 H new ATOM 0 HE3 MET A 71 -1.902 4.894 6.891 1.00 0.00 H new ATOM 1057 N PRO A 72 -5.320 4.698 10.501 1.00 0.00 N ATOM 1058 CA PRO A 72 -4.428 5.364 11.454 1.00 0.00 C ATOM 1059 C PRO A 72 -3.071 5.698 10.843 1.00 0.00 C ATOM 1060 O PRO A 72 -2.731 5.215 9.762 1.00 0.00 O ATOM 1061 CB PRO A 72 -4.271 4.332 12.574 1.00 0.00 C ATOM 1062 CG PRO A 72 -4.525 3.019 11.917 1.00 0.00 C ATOM 1063 CD PRO A 72 -5.545 3.284 10.844 1.00 0.00 C ATOM 0 HA PRO A 72 -4.831 6.320 11.790 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -3.273 4.370 13.010 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -4.979 4.514 13.382 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -3.608 2.611 11.492 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -4.895 2.288 12.636 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -5.399 2.633 9.982 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -6.560 3.114 11.204 1.00 0.00 H new ATOM 1071 N CYS A 73 -2.301 6.525 11.540 1.00 0.00 N ATOM 1072 CA CYS A 73 -0.981 6.924 11.065 1.00 0.00 C ATOM 1073 C CYS A 73 0.010 7.009 12.222 1.00 0.00 C ATOM 1074 O CYS A 73 -0.288 7.586 13.268 1.00 0.00 O ATOM 1075 CB CYS A 73 -1.060 8.271 10.345 1.00 0.00 C ATOM 1076 SG CYS A 73 -1.831 9.585 11.320 1.00 0.00 S ATOM 0 H CYS A 73 -2.568 6.933 12.436 1.00 0.00 H new ATOM 0 HA CYS A 73 -0.630 6.166 10.364 1.00 0.00 H new ATOM 0 HB2 CYS A 73 -0.053 8.582 10.068 1.00 0.00 H new ATOM 0 HB3 CYS A 73 -1.621 8.144 9.419 1.00 0.00 H new ATOM 0 HG CYS A 73 -1.556 9.410 12.578 1.00 0.00 H new ATOM 1082 N THR A 74 1.191 6.430 12.027 1.00 0.00 N ATOM 1083 CA THR A 74 2.225 6.437 13.054 1.00 0.00 C ATOM 1084 C THR A 74 3.612 6.563 12.435 1.00 0.00 C ATOM 1085 O THR A 74 4.163 5.590 11.920 1.00 0.00 O ATOM 1086 CB THR A 74 2.172 5.160 13.913 1.00 0.00 C ATOM 1087 OG1 THR A 74 1.868 4.028 13.091 1.00 0.00 O ATOM 1088 CG2 THR A 74 1.128 5.291 15.013 1.00 0.00 C ATOM 0 H THR A 74 1.455 5.950 11.167 1.00 0.00 H new ATOM 0 HA THR A 74 2.034 7.301 13.690 1.00 0.00 H new ATOM 0 HB THR A 74 3.149 5.019 14.376 1.00 0.00 H new ATOM 0 HG1 THR A 74 1.838 3.220 13.645 1.00 0.00 H new ATOM 0 HG21 THR A 74 1.108 4.377 15.607 1.00 0.00 H new ATOM 0 HG22 THR A 74 1.380 6.135 15.655 1.00 0.00 H new ATOM 0 HG23 THR A 74 0.147 5.454 14.566 1.00 0.00 H new ATOM 1096 N ARG A 75 4.173 7.767 12.491 1.00 0.00 N ATOM 1097 CA ARG A 75 5.497 8.020 11.936 1.00 0.00 C ATOM 1098 C ARG A 75 6.586 7.677 12.948 1.00 0.00 C ATOM 1099 O ARG A 75 6.539 8.115 14.099 1.00 0.00 O ATOM 1100 CB ARG A 75 5.624 9.483 11.510 1.00 0.00 C ATOM 1101 CG ARG A 75 5.263 9.727 10.053 1.00 0.00 C ATOM 1102 CD ARG A 75 6.401 9.334 9.124 1.00 0.00 C ATOM 1103 NE ARG A 75 7.574 10.185 9.305 1.00 0.00 N ATOM 1104 CZ ARG A 75 8.560 9.908 10.151 1.00 0.00 C ATOM 1105 NH1 ARG A 75 8.514 8.808 10.890 1.00 0.00 N ATOM 1106 NH2 ARG A 75 9.595 10.731 10.259 1.00 0.00 N ATOM 0 H ARG A 75 3.731 8.582 12.915 1.00 0.00 H new ATOM 0 HA ARG A 75 5.624 7.382 11.061 1.00 0.00 H new ATOM 0 HB2 ARG A 75 4.980 10.094 12.142 1.00 0.00 H new ATOM 0 HB3 ARG A 75 6.648 9.815 11.682 1.00 0.00 H new ATOM 0 HG2 ARG A 75 4.370 9.157 9.798 1.00 0.00 H new ATOM 0 HG3 ARG A 75 5.021 10.780 9.908 1.00 0.00 H new ATOM 0 HD2 ARG A 75 6.675 8.295 9.306 1.00 0.00 H new ATOM 0 HD3 ARG A 75 6.063 9.398 8.090 1.00 0.00 H new ATOM 0 HE ARG A 75 7.640 11.039 8.751 1.00 0.00 H new ATOM 0 HH11 ARG A 75 7.720 8.172 10.810 1.00 0.00 H new ATOM 0 HH12 ARG A 75 9.272 8.597 11.539 1.00 0.00 H new ATOM 0 HH21 ARG A 75 9.634 11.578 9.692 1.00 0.00 H new ATOM 0 HH22 ARG A 75 10.351 10.517 10.909 1.00 0.00 H new ATOM 1120 N THR A 76 7.565 6.891 12.513 1.00 0.00 N ATOM 1121 CA THR A 76 8.665 6.488 13.381 1.00 0.00 C ATOM 1122 C THR A 76 10.012 6.834 12.759 1.00 0.00 C ATOM 1123 O THR A 76 10.170 6.801 11.539 1.00 0.00 O ATOM 1124 CB THR A 76 8.622 4.977 13.678 1.00 0.00 C ATOM 1125 OG1 THR A 76 9.748 4.602 14.479 1.00 0.00 O ATOM 1126 CG2 THR A 76 8.621 4.172 12.387 1.00 0.00 C ATOM 0 H THR A 76 7.619 6.520 11.564 1.00 0.00 H new ATOM 0 HA THR A 76 8.548 7.038 14.315 1.00 0.00 H new ATOM 0 HB THR A 76 7.702 4.762 14.223 1.00 0.00 H new ATOM 0 HG1 THR A 76 9.712 3.640 14.664 1.00 0.00 H new ATOM 0 HG21 THR A 76 8.590 3.108 12.622 1.00 0.00 H new ATOM 0 HG22 THR A 76 7.747 4.438 11.793 1.00 0.00 H new ATOM 0 HG23 THR A 76 9.525 4.393 11.820 1.00 0.00 H new ATOM 1134 N GLY A 77 10.983 7.166 13.605 1.00 0.00 N ATOM 1135 CA GLY A 77 12.305 7.512 13.118 1.00 0.00 C ATOM 1136 C GLY A 77 12.291 8.735 12.223 1.00 0.00 C ATOM 1137 O GLY A 77 11.542 9.682 12.464 1.00 0.00 O ATOM 0 H GLY A 77 10.877 7.201 14.619 1.00 0.00 H new ATOM 0 HA2 GLY A 77 12.965 7.694 13.966 1.00 0.00 H new ATOM 0 HA3 GLY A 77 12.719 6.667 12.567 1.00 0.00 H new ATOM 1141 N LYS A 78 13.122 8.717 11.186 1.00 0.00 N ATOM 1142 CA LYS A 78 13.204 9.833 10.251 1.00 0.00 C ATOM 1143 C LYS A 78 12.806 9.394 8.845 1.00 0.00 C ATOM 1144 O LYS A 78 12.176 10.148 8.105 1.00 0.00 O ATOM 1145 CB LYS A 78 14.622 10.409 10.235 1.00 0.00 C ATOM 1146 CG LYS A 78 14.819 11.509 9.206 1.00 0.00 C ATOM 1147 CD LYS A 78 16.139 12.234 9.412 1.00 0.00 C ATOM 1148 CE LYS A 78 16.033 13.286 10.506 1.00 0.00 C ATOM 1149 NZ LYS A 78 16.034 12.675 11.864 1.00 0.00 N ATOM 0 H LYS A 78 13.749 7.941 10.972 1.00 0.00 H new ATOM 0 HA LYS A 78 12.509 10.605 10.583 1.00 0.00 H new ATOM 0 HB2 LYS A 78 14.857 10.802 11.224 1.00 0.00 H new ATOM 0 HB3 LYS A 78 15.330 9.605 10.035 1.00 0.00 H new ATOM 0 HG2 LYS A 78 14.790 11.081 8.204 1.00 0.00 H new ATOM 0 HG3 LYS A 78 13.997 12.222 9.272 1.00 0.00 H new ATOM 0 HD2 LYS A 78 16.914 11.513 9.673 1.00 0.00 H new ATOM 0 HD3 LYS A 78 16.445 12.707 8.479 1.00 0.00 H new ATOM 0 HE2 LYS A 78 16.866 13.984 10.421 1.00 0.00 H new ATOM 0 HE3 LYS A 78 15.119 13.863 10.368 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 16.549 13.294 12.523 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 15.054 12.558 12.193 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 16.499 11.746 11.826 1.00 0.00 H new ATOM 1163 N ASN A 79 13.176 8.170 8.485 1.00 0.00 N ATOM 1164 CA ASN A 79 12.856 7.631 7.168 1.00 0.00 C ATOM 1165 C ASN A 79 11.920 6.432 7.283 1.00 0.00 C ATOM 1166 O ASN A 79 11.727 5.688 6.323 1.00 0.00 O ATOM 1167 CB ASN A 79 14.137 7.223 6.436 1.00 0.00 C ATOM 1168 CG ASN A 79 14.791 6.001 7.052 1.00 0.00 C ATOM 1169 OD1 ASN A 79 14.338 5.492 8.077 1.00 0.00 O ATOM 1170 ND2 ASN A 79 15.862 5.526 6.428 1.00 0.00 N ATOM 0 H ASN A 79 13.698 7.532 9.086 1.00 0.00 H new ATOM 0 HA ASN A 79 12.351 8.410 6.597 1.00 0.00 H new ATOM 0 HB2 ASN A 79 13.906 7.020 5.390 1.00 0.00 H new ATOM 0 HB3 ASN A 79 14.841 8.055 6.451 1.00 0.00 H new ATOM 0 HD21 ASN A 79 16.345 4.706 6.796 1.00 0.00 H new ATOM 0 HD22 ASN A 79 16.202 5.981 5.581 1.00 0.00 H new ATOM 1177 N ASN A 80 11.340 6.253 8.466 1.00 0.00 N ATOM 1178 CA ASN A 80 10.423 5.145 8.708 1.00 0.00 C ATOM 1179 C ASN A 80 9.016 5.657 8.999 1.00 0.00 C ATOM 1180 O ASN A 80 8.840 6.743 9.552 1.00 0.00 O ATOM 1181 CB ASN A 80 10.919 4.291 9.876 1.00 0.00 C ATOM 1182 CG ASN A 80 12.407 4.008 9.795 1.00 0.00 C ATOM 1183 OD1 ASN A 80 13.200 4.578 10.544 1.00 0.00 O ATOM 1184 ND2 ASN A 80 12.791 3.123 8.882 1.00 0.00 N ATOM 0 H ASN A 80 11.489 6.861 9.271 1.00 0.00 H new ATOM 0 HA ASN A 80 10.388 4.532 7.808 1.00 0.00 H new ATOM 0 HB2 ASN A 80 10.700 4.801 10.814 1.00 0.00 H new ATOM 0 HB3 ASN A 80 10.373 3.348 9.890 1.00 0.00 H new ATOM 0 HD21 ASN A 80 13.779 2.891 8.780 1.00 0.00 H new ATOM 0 HD22 ASN A 80 12.098 2.675 8.283 1.00 0.00 H new ATOM 1191 N VAL A 81 8.015 4.867 8.623 1.00 0.00 N ATOM 1192 CA VAL A 81 6.623 5.239 8.845 1.00 0.00 C ATOM 1193 C VAL A 81 5.738 4.004 8.974 1.00 0.00 C ATOM 1194 O VAL A 81 5.691 3.164 8.075 1.00 0.00 O ATOM 1195 CB VAL A 81 6.089 6.122 7.702 1.00 0.00 C ATOM 1196 CG1 VAL A 81 6.026 5.334 6.402 1.00 0.00 C ATOM 1197 CG2 VAL A 81 4.721 6.686 8.059 1.00 0.00 C ATOM 0 H VAL A 81 8.142 3.965 8.163 1.00 0.00 H new ATOM 0 HA VAL A 81 6.591 5.804 9.776 1.00 0.00 H new ATOM 0 HB VAL A 81 6.776 6.956 7.560 1.00 0.00 H new ATOM 0 HG11 VAL A 81 5.646 5.975 5.606 1.00 0.00 H new ATOM 0 HG12 VAL A 81 7.024 4.983 6.140 1.00 0.00 H new ATOM 0 HG13 VAL A 81 5.362 4.479 6.527 1.00 0.00 H new ATOM 0 HG21 VAL A 81 4.359 7.308 7.240 1.00 0.00 H new ATOM 0 HG22 VAL A 81 4.023 5.867 8.229 1.00 0.00 H new ATOM 0 HG23 VAL A 81 4.801 7.288 8.964 1.00 0.00 H new ATOM 1207 N LEU A 82 5.037 3.901 10.098 1.00 0.00 N ATOM 1208 CA LEU A 82 4.152 2.768 10.346 1.00 0.00 C ATOM 1209 C LEU A 82 2.732 3.074 9.879 1.00 0.00 C ATOM 1210 O LEU A 82 2.313 4.232 9.854 1.00 0.00 O ATOM 1211 CB LEU A 82 4.147 2.416 11.834 1.00 0.00 C ATOM 1212 CG LEU A 82 5.255 1.473 12.304 1.00 0.00 C ATOM 1213 CD1 LEU A 82 5.286 1.401 13.823 1.00 0.00 C ATOM 1214 CD2 LEU A 82 5.064 0.086 11.707 1.00 0.00 C ATOM 0 H LEU A 82 5.064 4.588 10.852 1.00 0.00 H new ATOM 0 HA LEU A 82 4.526 1.916 9.779 1.00 0.00 H new ATOM 0 HB2 LEU A 82 4.218 3.341 12.406 1.00 0.00 H new ATOM 0 HB3 LEU A 82 3.185 1.964 12.077 1.00 0.00 H new ATOM 0 HG LEU A 82 6.211 1.867 11.959 1.00 0.00 H new ATOM 0 HD11 LEU A 82 6.081 0.725 14.139 1.00 0.00 H new ATOM 0 HD12 LEU A 82 5.471 2.395 14.231 1.00 0.00 H new ATOM 0 HD13 LEU A 82 4.328 1.031 14.189 1.00 0.00 H new ATOM 0 HD21 LEU A 82 5.862 -0.572 12.052 1.00 0.00 H new ATOM 0 HD22 LEU A 82 4.101 -0.316 12.021 1.00 0.00 H new ATOM 0 HD23 LEU A 82 5.093 0.151 10.619 1.00 0.00 H new ATOM 1226 N ILE A 83 1.997 2.030 9.513 1.00 0.00 N ATOM 1227 CA ILE A 83 0.623 2.187 9.051 1.00 0.00 C ATOM 1228 C ILE A 83 -0.159 0.886 9.200 1.00 0.00 C ATOM 1229 O ILE A 83 0.414 -0.203 9.163 1.00 0.00 O ATOM 1230 CB ILE A 83 0.573 2.638 7.580 1.00 0.00 C ATOM 1231 CG1 ILE A 83 1.219 1.584 6.678 1.00 0.00 C ATOM 1232 CG2 ILE A 83 1.266 3.982 7.413 1.00 0.00 C ATOM 1233 CD1 ILE A 83 0.219 0.665 6.011 1.00 0.00 C ATOM 0 H ILE A 83 2.330 1.066 9.527 1.00 0.00 H new ATOM 0 HA ILE A 83 0.166 2.956 9.674 1.00 0.00 H new ATOM 0 HB ILE A 83 -0.471 2.751 7.286 1.00 0.00 H new ATOM 0 HG12 ILE A 83 1.808 2.086 5.910 1.00 0.00 H new ATOM 0 HG13 ILE A 83 1.912 0.986 7.270 1.00 0.00 H new ATOM 0 HG21 ILE A 83 1.222 4.287 6.367 1.00 0.00 H new ATOM 0 HG22 ILE A 83 0.766 4.728 8.030 1.00 0.00 H new ATOM 0 HG23 ILE A 83 2.308 3.895 7.722 1.00 0.00 H new ATOM 0 HD11 ILE A 83 0.747 -0.056 5.387 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -0.353 0.135 6.773 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -0.459 1.253 5.392 1.00 0.00 H new ATOM 1245 N VAL A 84 -1.472 1.008 9.366 1.00 0.00 N ATOM 1246 CA VAL A 84 -2.335 -0.158 9.517 1.00 0.00 C ATOM 1247 C VAL A 84 -3.194 -0.370 8.276 1.00 0.00 C ATOM 1248 O VAL A 84 -3.968 0.505 7.887 1.00 0.00 O ATOM 1249 CB VAL A 84 -3.253 -0.021 10.746 1.00 0.00 C ATOM 1250 CG1 VAL A 84 -4.177 -1.224 10.859 1.00 0.00 C ATOM 1251 CG2 VAL A 84 -2.426 0.147 12.012 1.00 0.00 C ATOM 0 H VAL A 84 -1.962 1.902 9.399 1.00 0.00 H new ATOM 0 HA VAL A 84 -1.682 -1.020 9.655 1.00 0.00 H new ATOM 0 HB VAL A 84 -3.869 0.870 10.621 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -4.818 -1.110 11.733 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -4.794 -1.294 9.963 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -3.582 -2.131 10.962 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -3.091 0.242 12.871 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -1.784 -0.723 12.145 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -1.810 1.043 11.928 1.00 0.00 H new ATOM 1261 N CYS A 85 -3.053 -1.538 7.659 1.00 0.00 N ATOM 1262 CA CYS A 85 -3.817 -1.866 6.460 1.00 0.00 C ATOM 1263 C CYS A 85 -3.966 -3.377 6.307 1.00 0.00 C ATOM 1264 O CYS A 85 -3.180 -4.148 6.857 1.00 0.00 O ATOM 1265 CB CYS A 85 -3.138 -1.281 5.221 1.00 0.00 C ATOM 1266 SG CYS A 85 -1.420 -1.801 5.006 1.00 0.00 S ATOM 0 H CYS A 85 -2.417 -2.273 7.969 1.00 0.00 H new ATOM 0 HA CYS A 85 -4.810 -1.429 6.561 1.00 0.00 H new ATOM 0 HB2 CYS A 85 -3.707 -1.570 4.337 1.00 0.00 H new ATOM 0 HB3 CYS A 85 -3.172 -0.193 5.281 1.00 0.00 H new ATOM 0 HG CYS A 85 -0.933 -1.256 3.931 1.00 0.00 H new ATOM 1272 N VAL A 86 -4.981 -3.793 5.557 1.00 0.00 N ATOM 1273 CA VAL A 86 -5.235 -5.211 5.332 1.00 0.00 C ATOM 1274 C VAL A 86 -4.422 -5.733 4.152 1.00 0.00 C ATOM 1275 O VAL A 86 -4.503 -5.222 3.035 1.00 0.00 O ATOM 1276 CB VAL A 86 -6.729 -5.480 5.071 1.00 0.00 C ATOM 1277 CG1 VAL A 86 -6.964 -6.955 4.786 1.00 0.00 C ATOM 1278 CG2 VAL A 86 -7.567 -5.016 6.253 1.00 0.00 C ATOM 0 H VAL A 86 -5.641 -3.168 5.095 1.00 0.00 H new ATOM 0 HA VAL A 86 -4.933 -5.735 6.239 1.00 0.00 H new ATOM 0 HB VAL A 86 -7.035 -4.912 4.192 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -8.025 -7.126 4.604 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -6.393 -7.251 3.906 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -6.643 -7.547 5.643 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -8.620 -5.213 6.052 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -7.261 -5.555 7.150 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -7.421 -3.947 6.405 1.00 0.00 H new ATOM 1288 N PRO A 87 -3.620 -6.779 4.403 1.00 0.00 N ATOM 1289 CA PRO A 87 -2.777 -7.395 3.374 1.00 0.00 C ATOM 1290 C PRO A 87 -3.595 -8.148 2.330 1.00 0.00 C ATOM 1291 O PRO A 87 -4.468 -8.946 2.669 1.00 0.00 O ATOM 1292 CB PRO A 87 -1.900 -8.366 4.169 1.00 0.00 C ATOM 1293 CG PRO A 87 -2.696 -8.685 5.387 1.00 0.00 C ATOM 1294 CD PRO A 87 -3.474 -7.440 5.711 1.00 0.00 C ATOM 0 HA PRO A 87 -2.212 -6.652 2.811 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -1.681 -9.265 3.592 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -0.943 -7.913 4.429 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -3.364 -9.527 5.207 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -2.046 -8.966 6.216 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -4.442 -7.675 6.153 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -2.943 -6.808 6.423 1.00 0.00 H new ATOM 1302 N ASN A 88 -3.306 -7.889 1.059 1.00 0.00 N ATOM 1303 CA ASN A 88 -4.015 -8.542 -0.035 1.00 0.00 C ATOM 1304 C ASN A 88 -3.039 -9.026 -1.104 1.00 0.00 C ATOM 1305 O ASN A 88 -2.398 -8.236 -1.797 1.00 0.00 O ATOM 1306 CB ASN A 88 -5.034 -7.584 -0.654 1.00 0.00 C ATOM 1307 CG ASN A 88 -6.105 -8.311 -1.444 1.00 0.00 C ATOM 1308 OD1 ASN A 88 -6.732 -9.247 -0.947 1.00 0.00 O ATOM 1309 ND2 ASN A 88 -6.320 -7.882 -2.683 1.00 0.00 N ATOM 0 H ASN A 88 -2.585 -7.231 0.761 1.00 0.00 H new ATOM 0 HA ASN A 88 -4.540 -9.407 0.370 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -5.504 -6.998 0.136 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -4.518 -6.882 -1.308 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -7.028 -8.332 -3.263 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -5.777 -7.103 -3.054 1.00 0.00 H new ATOM 1316 N PRO A 89 -2.924 -10.355 -1.242 1.00 0.00 N ATOM 1317 CA PRO A 89 -3.682 -11.305 -0.422 1.00 0.00 C ATOM 1318 C PRO A 89 -3.217 -11.317 1.030 1.00 0.00 C ATOM 1319 O PRO A 89 -2.192 -10.733 1.384 1.00 0.00 O ATOM 1320 CB PRO A 89 -3.395 -12.654 -1.087 1.00 0.00 C ATOM 1321 CG PRO A 89 -2.084 -12.469 -1.768 1.00 0.00 C ATOM 1322 CD PRO A 89 -2.044 -11.032 -2.209 1.00 0.00 C ATOM 0 HA PRO A 89 -4.741 -11.052 -0.379 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -3.349 -13.456 -0.351 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -4.177 -12.919 -1.799 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -1.259 -12.693 -1.092 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -1.989 -13.141 -2.621 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -1.031 -10.631 -2.180 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -2.404 -10.915 -3.231 1.00 0.00 H new ATOM 1330 N PRO A 90 -3.985 -11.998 1.893 1.00 0.00 N ATOM 1331 CA PRO A 90 -3.671 -12.103 3.321 1.00 0.00 C ATOM 1332 C PRO A 90 -2.442 -12.968 3.581 1.00 0.00 C ATOM 1333 O PRO A 90 -2.130 -13.870 2.804 1.00 0.00 O ATOM 1334 CB PRO A 90 -4.921 -12.759 3.912 1.00 0.00 C ATOM 1335 CG PRO A 90 -5.524 -13.515 2.779 1.00 0.00 C ATOM 1336 CD PRO A 90 -5.221 -12.718 1.541 1.00 0.00 C ATOM 0 HA PRO A 90 -3.435 -11.133 3.759 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -4.667 -13.422 4.739 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -5.613 -12.013 4.303 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -5.102 -14.518 2.711 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -6.599 -13.630 2.915 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -5.078 -13.362 0.673 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -6.031 -12.031 1.297 1.00 0.00 H new ATOM 1344 N ILE A 91 -1.749 -12.687 4.680 1.00 0.00 N ATOM 1345 CA ILE A 91 -0.555 -13.440 5.043 1.00 0.00 C ATOM 1346 C ILE A 91 -0.897 -14.595 5.978 1.00 0.00 C ATOM 1347 O ILE A 91 -0.365 -15.696 5.842 1.00 0.00 O ATOM 1348 CB ILE A 91 0.495 -12.540 5.720 1.00 0.00 C ATOM 1349 CG1 ILE A 91 0.887 -11.389 4.791 1.00 0.00 C ATOM 1350 CG2 ILE A 91 1.720 -13.354 6.109 1.00 0.00 C ATOM 1351 CD1 ILE A 91 1.556 -10.236 5.506 1.00 0.00 C ATOM 0 H ILE A 91 -1.994 -11.944 5.334 1.00 0.00 H new ATOM 0 HA ILE A 91 -0.138 -13.836 4.117 1.00 0.00 H new ATOM 0 HB ILE A 91 0.060 -12.119 6.627 1.00 0.00 H new ATOM 0 HG12 ILE A 91 1.559 -11.767 4.021 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -0.005 -11.023 4.283 1.00 0.00 H new ATOM 0 HG21 ILE A 91 2.453 -12.703 6.586 1.00 0.00 H new ATOM 0 HG22 ILE A 91 1.428 -14.142 6.803 1.00 0.00 H new ATOM 0 HG23 ILE A 91 2.158 -13.801 5.217 1.00 0.00 H new ATOM 0 HD11 ILE A 91 1.806 -9.457 4.786 1.00 0.00 H new ATOM 0 HD12 ILE A 91 0.878 -9.831 6.258 1.00 0.00 H new ATOM 0 HD13 ILE A 91 2.467 -10.588 5.991 1.00 0.00 H new ATOM 1363 N ASP A 92 -1.791 -14.335 6.927 1.00 0.00 N ATOM 1364 CA ASP A 92 -2.207 -15.354 7.884 1.00 0.00 C ATOM 1365 C ASP A 92 -3.677 -15.713 7.690 1.00 0.00 C ATOM 1366 O ASP A 92 -4.558 -14.868 7.852 1.00 0.00 O ATOM 1367 CB ASP A 92 -1.972 -14.866 9.314 1.00 0.00 C ATOM 1368 CG ASP A 92 -1.973 -16.001 10.320 1.00 0.00 C ATOM 1369 OD1 ASP A 92 -2.740 -16.966 10.124 1.00 0.00 O ATOM 1370 OD2 ASP A 92 -1.208 -15.922 11.304 1.00 0.00 O ATOM 0 H ASP A 92 -2.241 -13.428 7.054 1.00 0.00 H new ATOM 0 HA ASP A 92 -1.608 -16.248 7.711 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -1.018 -14.341 9.364 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -2.746 -14.147 9.581 1.00 0.00 H new ATOM 1375 N GLU A 93 -3.934 -16.970 7.343 1.00 0.00 N ATOM 1376 CA GLU A 93 -5.297 -17.439 7.126 1.00 0.00 C ATOM 1377 C GLU A 93 -6.127 -17.308 8.400 1.00 0.00 C ATOM 1378 O GLU A 93 -7.267 -16.845 8.367 1.00 0.00 O ATOM 1379 CB GLU A 93 -5.291 -18.895 6.656 1.00 0.00 C ATOM 1380 CG GLU A 93 -6.529 -19.285 5.866 1.00 0.00 C ATOM 1381 CD GLU A 93 -6.257 -20.389 4.863 1.00 0.00 C ATOM 1382 OE1 GLU A 93 -5.603 -21.385 5.238 1.00 0.00 O ATOM 1383 OE2 GLU A 93 -6.698 -20.257 3.702 1.00 0.00 O ATOM 0 H GLU A 93 -3.216 -17.682 7.206 1.00 0.00 H new ATOM 0 HA GLU A 93 -5.749 -16.817 6.353 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -4.408 -19.065 6.039 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -5.204 -19.548 7.524 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -7.308 -19.610 6.556 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -6.912 -18.409 5.342 1.00 0.00 H new ATOM 1390 N LYS A 94 -5.546 -17.719 9.522 1.00 0.00 N ATOM 1391 CA LYS A 94 -6.229 -17.648 10.808 1.00 0.00 C ATOM 1392 C LYS A 94 -7.133 -16.421 10.877 1.00 0.00 C ATOM 1393 O LYS A 94 -8.274 -16.504 11.329 1.00 0.00 O ATOM 1394 CB LYS A 94 -5.210 -17.608 11.949 1.00 0.00 C ATOM 1395 CG LYS A 94 -4.717 -18.981 12.372 1.00 0.00 C ATOM 1396 CD LYS A 94 -5.677 -19.642 13.347 1.00 0.00 C ATOM 1397 CE LYS A 94 -5.220 -21.046 13.714 1.00 0.00 C ATOM 1398 NZ LYS A 94 -4.215 -21.032 14.813 1.00 0.00 N ATOM 0 H LYS A 94 -4.603 -18.105 9.567 1.00 0.00 H new ATOM 0 HA LYS A 94 -6.847 -18.540 10.912 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -4.357 -17.003 11.642 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -5.659 -17.112 12.809 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -4.598 -19.613 11.492 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -3.734 -18.889 12.834 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -5.755 -19.036 14.250 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -6.673 -19.686 12.906 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -6.082 -21.641 14.017 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -4.792 -21.530 12.836 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -3.929 -22.007 15.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -3.382 -20.486 14.515 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -4.632 -20.593 15.659 1.00 0.00 H new ATOM 1412 N ASN A 95 -6.615 -15.284 10.424 1.00 0.00 N ATOM 1413 CA ASN A 95 -7.376 -14.040 10.434 1.00 0.00 C ATOM 1414 C ASN A 95 -6.901 -13.102 9.328 1.00 0.00 C ATOM 1415 O ASN A 95 -5.859 -12.459 9.451 1.00 0.00 O ATOM 1416 CB ASN A 95 -7.247 -13.349 11.794 1.00 0.00 C ATOM 1417 CG ASN A 95 -7.229 -14.337 12.944 1.00 0.00 C ATOM 1418 OD1 ASN A 95 -6.171 -14.825 13.342 1.00 0.00 O ATOM 1419 ND2 ASN A 95 -8.404 -14.637 13.485 1.00 0.00 N ATOM 0 H ASN A 95 -5.672 -15.198 10.046 1.00 0.00 H new ATOM 0 HA ASN A 95 -8.423 -14.283 10.255 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -6.332 -12.757 11.813 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -8.078 -12.656 11.927 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -8.454 -15.296 14.262 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -9.256 -14.209 13.123 1.00 0.00 H new ATOM 1426 N ALA A 96 -7.672 -13.031 8.249 1.00 0.00 N ATOM 1427 CA ALA A 96 -7.332 -12.171 7.122 1.00 0.00 C ATOM 1428 C ALA A 96 -7.989 -10.802 7.259 1.00 0.00 C ATOM 1429 O ALA A 96 -7.308 -9.778 7.321 1.00 0.00 O ATOM 1430 CB ALA A 96 -7.745 -12.828 5.813 1.00 0.00 C ATOM 0 H ALA A 96 -8.537 -13.559 8.131 1.00 0.00 H new ATOM 0 HA ALA A 96 -6.251 -12.028 7.119 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -7.485 -12.175 4.980 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -7.225 -13.780 5.704 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -8.821 -13.001 5.816 1.00 0.00 H new ATOM 1436 N THR A 97 -9.318 -10.789 7.305 1.00 0.00 N ATOM 1437 CA THR A 97 -10.067 -9.546 7.432 1.00 0.00 C ATOM 1438 C THR A 97 -9.332 -8.550 8.322 1.00 0.00 C ATOM 1439 O THR A 97 -9.271 -7.359 8.019 1.00 0.00 O ATOM 1440 CB THR A 97 -11.473 -9.793 8.010 1.00 0.00 C ATOM 1441 OG1 THR A 97 -12.160 -10.773 7.223 1.00 0.00 O ATOM 1442 CG2 THR A 97 -12.279 -8.504 8.042 1.00 0.00 C ATOM 0 H THR A 97 -9.898 -11.627 7.256 1.00 0.00 H new ATOM 0 HA THR A 97 -10.163 -9.131 6.429 1.00 0.00 H new ATOM 0 HB THR A 97 -11.364 -10.159 9.031 1.00 0.00 H new ATOM 0 HG1 THR A 97 -13.053 -10.926 7.597 1.00 0.00 H new ATOM 0 HG21 THR A 97 -13.268 -8.704 8.454 1.00 0.00 H new ATOM 0 HG22 THR A 97 -11.768 -7.770 8.665 1.00 0.00 H new ATOM 0 HG23 THR A 97 -12.380 -8.113 7.030 1.00 0.00 H new ATOM 1450 N MET A 98 -8.775 -9.046 9.422 1.00 0.00 N ATOM 1451 CA MET A 98 -8.042 -8.199 10.356 1.00 0.00 C ATOM 1452 C MET A 98 -6.785 -7.632 9.704 1.00 0.00 C ATOM 1453 O MET A 98 -6.002 -8.349 9.081 1.00 0.00 O ATOM 1454 CB MET A 98 -7.667 -8.991 11.610 1.00 0.00 C ATOM 1455 CG MET A 98 -7.189 -8.118 12.759 1.00 0.00 C ATOM 1456 SD MET A 98 -6.840 -9.066 14.253 1.00 0.00 S ATOM 1457 CE MET A 98 -7.091 -7.818 15.513 1.00 0.00 C ATOM 0 H MET A 98 -8.817 -10.030 9.688 1.00 0.00 H new ATOM 0 HA MET A 98 -8.689 -7.369 10.639 1.00 0.00 H new ATOM 0 HB2 MET A 98 -8.532 -9.568 11.938 1.00 0.00 H new ATOM 0 HB3 MET A 98 -6.884 -9.706 11.358 1.00 0.00 H new ATOM 0 HG2 MET A 98 -6.289 -7.583 12.454 1.00 0.00 H new ATOM 0 HG3 MET A 98 -7.947 -7.366 12.979 1.00 0.00 H new ATOM 0 HE1 MET A 98 -6.912 -8.253 16.496 1.00 0.00 H new ATOM 0 HE2 MET A 98 -6.399 -6.992 15.350 1.00 0.00 H new ATOM 0 HE3 MET A 98 -8.115 -7.449 15.461 1.00 0.00 H new ATOM 1467 N PRO A 99 -6.586 -6.313 9.848 1.00 0.00 N ATOM 1468 CA PRO A 99 -5.425 -5.621 9.279 1.00 0.00 C ATOM 1469 C PRO A 99 -4.125 -5.994 9.985 1.00 0.00 C ATOM 1470 O PRO A 99 -4.139 -6.635 11.035 1.00 0.00 O ATOM 1471 CB PRO A 99 -5.750 -4.142 9.503 1.00 0.00 C ATOM 1472 CG PRO A 99 -6.674 -4.129 10.671 1.00 0.00 C ATOM 1473 CD PRO A 99 -7.478 -5.396 10.577 1.00 0.00 C ATOM 0 HA PRO A 99 -5.266 -5.883 8.233 1.00 0.00 H new ATOM 0 HB2 PRO A 99 -4.848 -3.565 9.706 1.00 0.00 H new ATOM 0 HB3 PRO A 99 -6.219 -3.702 8.623 1.00 0.00 H new ATOM 0 HG2 PRO A 99 -6.118 -4.088 11.608 1.00 0.00 H new ATOM 0 HG3 PRO A 99 -7.322 -3.253 10.646 1.00 0.00 H new ATOM 0 HD2 PRO A 99 -7.734 -5.784 11.563 1.00 0.00 H new ATOM 0 HD3 PRO A 99 -8.415 -5.238 10.043 1.00 0.00 H new ATOM 1481 N VAL A 100 -3.003 -5.587 9.401 1.00 0.00 N ATOM 1482 CA VAL A 100 -1.694 -5.877 9.975 1.00 0.00 C ATOM 1483 C VAL A 100 -0.786 -4.653 9.919 1.00 0.00 C ATOM 1484 O VAL A 100 -0.951 -3.781 9.065 1.00 0.00 O ATOM 1485 CB VAL A 100 -1.007 -7.045 9.243 1.00 0.00 C ATOM 1486 CG1 VAL A 100 -1.949 -8.235 9.135 1.00 0.00 C ATOM 1487 CG2 VAL A 100 -0.529 -6.605 7.868 1.00 0.00 C ATOM 0 H VAL A 100 -2.974 -5.056 8.531 1.00 0.00 H new ATOM 0 HA VAL A 100 -1.859 -6.156 11.016 1.00 0.00 H new ATOM 0 HB VAL A 100 -0.137 -7.353 9.822 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -1.447 -9.051 8.615 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -2.236 -8.564 10.134 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -2.840 -7.944 8.579 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -0.046 -7.443 7.365 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -1.381 -6.269 7.277 1.00 0.00 H new ATOM 0 HG23 VAL A 100 0.183 -5.787 7.975 1.00 0.00 H new ATOM 1497 N THR A 101 0.174 -4.593 10.836 1.00 0.00 N ATOM 1498 CA THR A 101 1.108 -3.476 10.893 1.00 0.00 C ATOM 1499 C THR A 101 2.090 -3.521 9.728 1.00 0.00 C ATOM 1500 O THR A 101 2.669 -4.565 9.431 1.00 0.00 O ATOM 1501 CB THR A 101 1.899 -3.471 12.215 1.00 0.00 C ATOM 1502 OG1 THR A 101 0.999 -3.354 13.323 1.00 0.00 O ATOM 1503 CG2 THR A 101 2.899 -2.325 12.244 1.00 0.00 C ATOM 0 H THR A 101 0.325 -5.306 11.550 1.00 0.00 H new ATOM 0 HA THR A 101 0.514 -2.564 10.830 1.00 0.00 H new ATOM 0 HB THR A 101 2.446 -4.411 12.289 1.00 0.00 H new ATOM 0 HG1 THR A 101 1.509 -3.353 14.160 1.00 0.00 H new ATOM 0 HG21 THR A 101 3.445 -2.342 13.187 1.00 0.00 H new ATOM 0 HG22 THR A 101 3.600 -2.433 11.417 1.00 0.00 H new ATOM 0 HG23 THR A 101 2.369 -1.377 12.149 1.00 0.00 H new ATOM 1511 N MET A 102 2.273 -2.380 9.071 1.00 0.00 N ATOM 1512 CA MET A 102 3.187 -2.289 7.938 1.00 0.00 C ATOM 1513 C MET A 102 4.092 -1.068 8.066 1.00 0.00 C ATOM 1514 O MET A 102 3.616 0.053 8.246 1.00 0.00 O ATOM 1515 CB MET A 102 2.403 -2.222 6.626 1.00 0.00 C ATOM 1516 CG MET A 102 1.774 -3.547 6.226 1.00 0.00 C ATOM 1517 SD MET A 102 1.511 -3.682 4.447 1.00 0.00 S ATOM 1518 CE MET A 102 1.861 -5.419 4.184 1.00 0.00 C ATOM 0 H MET A 102 1.801 -1.506 9.304 1.00 0.00 H new ATOM 0 HA MET A 102 3.811 -3.183 7.934 1.00 0.00 H new ATOM 0 HB2 MET A 102 1.619 -1.470 6.719 1.00 0.00 H new ATOM 0 HB3 MET A 102 3.070 -1.891 5.830 1.00 0.00 H new ATOM 0 HG2 MET A 102 2.415 -4.364 6.558 1.00 0.00 H new ATOM 0 HG3 MET A 102 0.820 -3.662 6.740 1.00 0.00 H new ATOM 0 HE1 MET A 102 1.741 -5.658 3.127 1.00 0.00 H new ATOM 0 HE2 MET A 102 2.884 -5.634 4.491 1.00 0.00 H new ATOM 0 HE3 MET A 102 1.171 -6.023 4.774 1.00 0.00 H new ATOM 1528 N LEU A 103 5.398 -1.293 7.972 1.00 0.00 N ATOM 1529 CA LEU A 103 6.370 -0.210 8.078 1.00 0.00 C ATOM 1530 C LEU A 103 6.972 0.117 6.715 1.00 0.00 C ATOM 1531 O LEU A 103 7.283 -0.781 5.932 1.00 0.00 O ATOM 1532 CB LEU A 103 7.480 -0.588 9.060 1.00 0.00 C ATOM 1533 CG LEU A 103 8.400 0.549 9.504 1.00 0.00 C ATOM 1534 CD1 LEU A 103 8.941 0.285 10.901 1.00 0.00 C ATOM 1535 CD2 LEU A 103 9.542 0.729 8.514 1.00 0.00 C ATOM 0 H LEU A 103 5.808 -2.215 7.823 1.00 0.00 H new ATOM 0 HA LEU A 103 5.852 0.675 8.448 1.00 0.00 H new ATOM 0 HB2 LEU A 103 7.020 -1.023 9.947 1.00 0.00 H new ATOM 0 HB3 LEU A 103 8.092 -1.366 8.604 1.00 0.00 H new ATOM 0 HG LEU A 103 7.819 1.471 9.530 1.00 0.00 H new ATOM 0 HD11 LEU A 103 9.594 1.105 11.199 1.00 0.00 H new ATOM 0 HD12 LEU A 103 8.111 0.207 11.604 1.00 0.00 H new ATOM 0 HD13 LEU A 103 9.506 -0.647 10.902 1.00 0.00 H new ATOM 0 HD21 LEU A 103 10.187 1.543 8.846 1.00 0.00 H new ATOM 0 HD22 LEU A 103 10.121 -0.192 8.456 1.00 0.00 H new ATOM 0 HD23 LEU A 103 9.137 0.966 7.530 1.00 0.00 H new ATOM 1547 N ILE A 104 7.135 1.406 6.439 1.00 0.00 N ATOM 1548 CA ILE A 104 7.702 1.851 5.173 1.00 0.00 C ATOM 1549 C ILE A 104 8.982 2.649 5.394 1.00 0.00 C ATOM 1550 O ILE A 104 8.964 3.711 6.016 1.00 0.00 O ATOM 1551 CB ILE A 104 6.703 2.713 4.380 1.00 0.00 C ATOM 1552 CG1 ILE A 104 5.636 1.830 3.730 1.00 0.00 C ATOM 1553 CG2 ILE A 104 7.431 3.535 3.326 1.00 0.00 C ATOM 1554 CD1 ILE A 104 4.463 2.608 3.175 1.00 0.00 C ATOM 0 H ILE A 104 6.882 2.161 7.076 1.00 0.00 H new ATOM 0 HA ILE A 104 7.931 0.954 4.598 1.00 0.00 H new ATOM 0 HB ILE A 104 6.210 3.397 5.070 1.00 0.00 H new ATOM 0 HG12 ILE A 104 6.093 1.255 2.925 1.00 0.00 H new ATOM 0 HG13 ILE A 104 5.271 1.114 4.466 1.00 0.00 H new ATOM 0 HG21 ILE A 104 6.711 4.139 2.774 1.00 0.00 H new ATOM 0 HG22 ILE A 104 8.156 4.188 3.811 1.00 0.00 H new ATOM 0 HG23 ILE A 104 7.948 2.867 2.637 1.00 0.00 H new ATOM 0 HD11 ILE A 104 3.747 1.918 2.730 1.00 0.00 H new ATOM 0 HD12 ILE A 104 3.981 3.162 3.980 1.00 0.00 H new ATOM 0 HD13 ILE A 104 4.816 3.305 2.415 1.00 0.00 H new ATOM 1566 N ARG A 105 10.093 2.132 4.878 1.00 0.00 N ATOM 1567 CA ARG A 105 11.382 2.797 5.019 1.00 0.00 C ATOM 1568 C ARG A 105 11.906 3.259 3.662 1.00 0.00 C ATOM 1569 O ARG A 105 12.405 2.459 2.872 1.00 0.00 O ATOM 1570 CB ARG A 105 12.396 1.857 5.675 1.00 0.00 C ATOM 1571 CG ARG A 105 13.804 2.426 5.733 1.00 0.00 C ATOM 1572 CD ARG A 105 14.848 1.322 5.804 1.00 0.00 C ATOM 1573 NE ARG A 105 14.857 0.661 7.107 1.00 0.00 N ATOM 1574 CZ ARG A 105 15.658 -0.355 7.409 1.00 0.00 C ATOM 1575 NH1 ARG A 105 16.509 -0.825 6.507 1.00 0.00 N ATOM 1576 NH2 ARG A 105 15.608 -0.904 8.617 1.00 0.00 N ATOM 0 H ARG A 105 10.126 1.255 4.359 1.00 0.00 H new ATOM 0 HA ARG A 105 11.244 3.672 5.654 1.00 0.00 H new ATOM 0 HB2 ARG A 105 12.064 1.627 6.687 1.00 0.00 H new ATOM 0 HB3 ARG A 105 12.416 0.916 5.125 1.00 0.00 H new ATOM 0 HG2 ARG A 105 13.985 3.043 4.853 1.00 0.00 H new ATOM 0 HG3 ARG A 105 13.900 3.075 6.603 1.00 0.00 H new ATOM 0 HD2 ARG A 105 14.651 0.586 5.025 1.00 0.00 H new ATOM 0 HD3 ARG A 105 15.834 1.742 5.603 1.00 0.00 H new ATOM 0 HE ARG A 105 14.214 0.998 7.823 1.00 0.00 H new ATOM 0 HH11 ARG A 105 16.550 -0.406 5.578 1.00 0.00 H new ATOM 0 HH12 ARG A 105 17.122 -1.605 6.742 1.00 0.00 H new ATOM 0 HH21 ARG A 105 14.954 -0.546 9.313 1.00 0.00 H new ATOM 0 HH22 ARG A 105 16.223 -1.684 8.849 1.00 0.00 H new ATOM 1590 N VAL A 106 11.788 4.557 3.399 1.00 0.00 N ATOM 1591 CA VAL A 106 12.249 5.127 2.139 1.00 0.00 C ATOM 1592 C VAL A 106 13.722 5.513 2.218 1.00 0.00 C ATOM 1593 O VAL A 106 14.360 5.364 3.260 1.00 0.00 O ATOM 1594 CB VAL A 106 11.424 6.368 1.749 1.00 0.00 C ATOM 1595 CG1 VAL A 106 10.038 5.960 1.275 1.00 0.00 C ATOM 1596 CG2 VAL A 106 11.334 7.336 2.918 1.00 0.00 C ATOM 0 H VAL A 106 11.377 5.233 4.042 1.00 0.00 H new ATOM 0 HA VAL A 106 12.118 4.359 1.377 1.00 0.00 H new ATOM 0 HB VAL A 106 11.928 6.875 0.926 1.00 0.00 H new ATOM 0 HG11 VAL A 106 9.470 6.850 1.004 1.00 0.00 H new ATOM 0 HG12 VAL A 106 10.128 5.308 0.406 1.00 0.00 H new ATOM 0 HG13 VAL A 106 9.521 5.429 2.075 1.00 0.00 H new ATOM 0 HG21 VAL A 106 10.748 8.207 2.625 1.00 0.00 H new ATOM 0 HG22 VAL A 106 10.853 6.843 3.763 1.00 0.00 H new ATOM 0 HG23 VAL A 106 12.336 7.653 3.206 1.00 0.00 H new ATOM 1606 N LYS A 107 14.257 6.012 1.108 1.00 0.00 N ATOM 1607 CA LYS A 107 15.655 6.423 1.050 1.00 0.00 C ATOM 1608 C LYS A 107 15.853 7.775 1.728 1.00 0.00 C ATOM 1609 O LYS A 107 16.504 7.870 2.769 1.00 0.00 O ATOM 1610 CB LYS A 107 16.126 6.495 -0.404 1.00 0.00 C ATOM 1611 CG LYS A 107 17.620 6.275 -0.571 1.00 0.00 C ATOM 1612 CD LYS A 107 18.115 6.804 -1.907 1.00 0.00 C ATOM 1613 CE LYS A 107 18.553 8.257 -1.803 1.00 0.00 C ATOM 1614 NZ LYS A 107 18.773 8.867 -3.144 1.00 0.00 N ATOM 0 H LYS A 107 13.743 6.141 0.236 1.00 0.00 H new ATOM 0 HA LYS A 107 16.249 5.680 1.582 1.00 0.00 H new ATOM 0 HB2 LYS A 107 15.590 5.747 -0.988 1.00 0.00 H new ATOM 0 HB3 LYS A 107 15.863 7.470 -0.815 1.00 0.00 H new ATOM 0 HG2 LYS A 107 18.155 6.771 0.239 1.00 0.00 H new ATOM 0 HG3 LYS A 107 17.843 5.211 -0.495 1.00 0.00 H new ATOM 0 HD2 LYS A 107 18.950 6.195 -2.254 1.00 0.00 H new ATOM 0 HD3 LYS A 107 17.324 6.714 -2.651 1.00 0.00 H new ATOM 0 HE2 LYS A 107 17.796 8.827 -1.264 1.00 0.00 H new ATOM 0 HE3 LYS A 107 19.472 8.318 -1.221 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 19.070 9.857 -3.030 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 19.513 8.339 -3.648 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 17.889 8.832 -3.691 1.00 0.00 H new ATOM 1628 N THR A 108 15.287 8.820 1.132 1.00 0.00 N ATOM 1629 CA THR A 108 15.402 10.166 1.678 1.00 0.00 C ATOM 1630 C THR A 108 14.366 10.406 2.770 1.00 0.00 C ATOM 1631 O THR A 108 13.291 9.807 2.762 1.00 0.00 O ATOM 1632 CB THR A 108 15.232 11.234 0.581 1.00 0.00 C ATOM 1633 OG1 THR A 108 13.935 11.121 -0.016 1.00 0.00 O ATOM 1634 CG2 THR A 108 16.303 11.085 -0.490 1.00 0.00 C ATOM 0 H THR A 108 14.744 8.759 0.271 1.00 0.00 H new ATOM 0 HA THR A 108 16.402 10.250 2.104 1.00 0.00 H new ATOM 0 HB THR A 108 15.335 12.216 1.042 1.00 0.00 H new ATOM 0 HG1 THR A 108 14.030 11.005 -0.984 1.00 0.00 H new ATOM 0 HG21 THR A 108 16.163 11.850 -1.254 1.00 0.00 H new ATOM 0 HG22 THR A 108 17.288 11.200 -0.038 1.00 0.00 H new ATOM 0 HG23 THR A 108 16.226 10.098 -0.946 1.00 0.00 H new ATOM 1642 N SER A 109 14.696 11.288 3.708 1.00 0.00 N ATOM 1643 CA SER A 109 13.794 11.605 4.810 1.00 0.00 C ATOM 1644 C SER A 109 12.539 12.306 4.299 1.00 0.00 C ATOM 1645 O SER A 109 11.422 11.952 4.674 1.00 0.00 O ATOM 1646 CB SER A 109 14.503 12.488 5.839 1.00 0.00 C ATOM 1647 OG SER A 109 15.117 13.603 5.217 1.00 0.00 O ATOM 0 H SER A 109 15.581 11.796 3.727 1.00 0.00 H new ATOM 0 HA SER A 109 13.499 10.670 5.287 1.00 0.00 H new ATOM 0 HB2 SER A 109 13.785 12.832 6.583 1.00 0.00 H new ATOM 0 HB3 SER A 109 15.255 11.903 6.368 1.00 0.00 H new ATOM 0 HG SER A 109 15.562 14.152 5.896 1.00 0.00 H new ATOM 1653 N GLU A 110 12.733 13.304 3.442 1.00 0.00 N ATOM 1654 CA GLU A 110 11.617 14.056 2.881 1.00 0.00 C ATOM 1655 C GLU A 110 10.612 13.122 2.214 1.00 0.00 C ATOM 1656 O GLU A 110 9.419 13.419 2.151 1.00 0.00 O ATOM 1657 CB GLU A 110 12.124 15.084 1.868 1.00 0.00 C ATOM 1658 CG GLU A 110 12.623 14.467 0.572 1.00 0.00 C ATOM 1659 CD GLU A 110 14.110 14.171 0.602 1.00 0.00 C ATOM 1660 OE1 GLU A 110 14.707 14.237 1.697 1.00 0.00 O ATOM 1661 OE2 GLU A 110 14.677 13.872 -0.470 1.00 0.00 O ATOM 0 H GLU A 110 13.652 13.610 3.122 1.00 0.00 H new ATOM 0 HA GLU A 110 11.117 14.577 3.697 1.00 0.00 H new ATOM 0 HB2 GLU A 110 11.321 15.785 1.641 1.00 0.00 H new ATOM 0 HB3 GLU A 110 12.931 15.660 2.321 1.00 0.00 H new ATOM 0 HG2 GLU A 110 12.076 13.544 0.379 1.00 0.00 H new ATOM 0 HG3 GLU A 110 12.408 15.144 -0.255 1.00 0.00 H new ATOM 1668 N ASP A 111 11.103 11.991 1.718 1.00 0.00 N ATOM 1669 CA ASP A 111 10.248 11.012 1.057 1.00 0.00 C ATOM 1670 C ASP A 111 9.271 10.387 2.046 1.00 0.00 C ATOM 1671 O ASP A 111 8.059 10.406 1.833 1.00 0.00 O ATOM 1672 CB ASP A 111 11.098 9.922 0.402 1.00 0.00 C ATOM 1673 CG ASP A 111 11.488 10.268 -1.021 1.00 0.00 C ATOM 1674 OD1 ASP A 111 11.496 11.470 -1.358 1.00 0.00 O ATOM 1675 OD2 ASP A 111 11.783 9.336 -1.799 1.00 0.00 O ATOM 0 H ASP A 111 12.088 11.730 1.761 1.00 0.00 H new ATOM 0 HA ASP A 111 9.675 11.528 0.286 1.00 0.00 H new ATOM 0 HB2 ASP A 111 11.999 9.763 0.994 1.00 0.00 H new ATOM 0 HB3 ASP A 111 10.545 8.983 0.406 1.00 0.00 H new ATOM 1680 N ALA A 112 9.806 9.832 3.129 1.00 0.00 N ATOM 1681 CA ALA A 112 8.981 9.201 4.152 1.00 0.00 C ATOM 1682 C ALA A 112 7.827 10.110 4.563 1.00 0.00 C ATOM 1683 O ALA A 112 6.659 9.738 4.445 1.00 0.00 O ATOM 1684 CB ALA A 112 9.827 8.838 5.363 1.00 0.00 C ATOM 0 H ALA A 112 10.808 9.807 3.320 1.00 0.00 H new ATOM 0 HA ALA A 112 8.559 8.288 3.732 1.00 0.00 H new ATOM 0 HB1 ALA A 112 9.198 8.368 6.119 1.00 0.00 H new ATOM 0 HB2 ALA A 112 10.613 8.145 5.063 1.00 0.00 H new ATOM 0 HB3 ALA A 112 10.277 9.741 5.776 1.00 0.00 H new ATOM 1690 N ASP A 113 8.162 11.301 5.047 1.00 0.00 N ATOM 1691 CA ASP A 113 7.154 12.263 5.476 1.00 0.00 C ATOM 1692 C ASP A 113 6.164 12.551 4.351 1.00 0.00 C ATOM 1693 O ASP A 113 4.958 12.634 4.579 1.00 0.00 O ATOM 1694 CB ASP A 113 7.819 13.562 5.932 1.00 0.00 C ATOM 1695 CG ASP A 113 6.963 14.338 6.913 1.00 0.00 C ATOM 1696 OD1 ASP A 113 6.682 13.804 8.006 1.00 0.00 O ATOM 1697 OD2 ASP A 113 6.572 15.479 6.588 1.00 0.00 O ATOM 0 H ASP A 113 9.124 11.623 5.152 1.00 0.00 H new ATOM 0 HA ASP A 113 6.608 11.830 6.314 1.00 0.00 H new ATOM 0 HB2 ASP A 113 8.779 13.332 6.395 1.00 0.00 H new ATOM 0 HB3 ASP A 113 8.026 14.186 5.062 1.00 0.00 H new ATOM 1702 N GLU A 114 6.685 12.705 3.137 1.00 0.00 N ATOM 1703 CA GLU A 114 5.846 12.986 1.978 1.00 0.00 C ATOM 1704 C GLU A 114 4.784 11.905 1.799 1.00 0.00 C ATOM 1705 O GLU A 114 3.650 12.191 1.411 1.00 0.00 O ATOM 1706 CB GLU A 114 6.703 13.088 0.714 1.00 0.00 C ATOM 1707 CG GLU A 114 5.951 13.633 -0.489 1.00 0.00 C ATOM 1708 CD GLU A 114 6.873 14.251 -1.522 1.00 0.00 C ATOM 1709 OE1 GLU A 114 8.062 13.871 -1.560 1.00 0.00 O ATOM 1710 OE2 GLU A 114 6.405 15.115 -2.293 1.00 0.00 O ATOM 0 H GLU A 114 7.682 12.640 2.931 1.00 0.00 H new ATOM 0 HA GLU A 114 5.344 13.939 2.147 1.00 0.00 H new ATOM 0 HB2 GLU A 114 7.560 13.730 0.917 1.00 0.00 H new ATOM 0 HB3 GLU A 114 7.095 12.101 0.470 1.00 0.00 H new ATOM 0 HG2 GLU A 114 5.381 12.828 -0.952 1.00 0.00 H new ATOM 0 HG3 GLU A 114 5.232 14.381 -0.155 1.00 0.00 H new ATOM 1717 N LEU A 115 5.159 10.663 2.085 1.00 0.00 N ATOM 1718 CA LEU A 115 4.239 9.538 1.956 1.00 0.00 C ATOM 1719 C LEU A 115 3.149 9.601 3.020 1.00 0.00 C ATOM 1720 O LEU A 115 1.959 9.638 2.704 1.00 0.00 O ATOM 1721 CB LEU A 115 5.001 8.216 2.068 1.00 0.00 C ATOM 1722 CG LEU A 115 4.145 6.960 2.233 1.00 0.00 C ATOM 1723 CD1 LEU A 115 3.321 6.707 0.980 1.00 0.00 C ATOM 1724 CD2 LEU A 115 5.020 5.756 2.550 1.00 0.00 C ATOM 0 H LEU A 115 6.093 10.410 2.407 1.00 0.00 H new ATOM 0 HA LEU A 115 3.767 9.597 0.975 1.00 0.00 H new ATOM 0 HB2 LEU A 115 5.616 8.098 1.176 1.00 0.00 H new ATOM 0 HB3 LEU A 115 5.681 8.282 2.917 1.00 0.00 H new ATOM 0 HG LEU A 115 3.461 7.117 3.067 1.00 0.00 H new ATOM 0 HD11 LEU A 115 2.718 5.809 1.116 1.00 0.00 H new ATOM 0 HD12 LEU A 115 2.666 7.559 0.797 1.00 0.00 H new ATOM 0 HD13 LEU A 115 3.987 6.571 0.128 1.00 0.00 H new ATOM 0 HD21 LEU A 115 4.394 4.871 2.664 1.00 0.00 H new ATOM 0 HD22 LEU A 115 5.728 5.597 1.737 1.00 0.00 H new ATOM 0 HD23 LEU A 115 5.565 5.936 3.476 1.00 0.00 H new ATOM 1736 N HIS A 116 3.562 9.615 4.284 1.00 0.00 N ATOM 1737 CA HIS A 116 2.620 9.677 5.396 1.00 0.00 C ATOM 1738 C HIS A 116 1.627 10.820 5.203 1.00 0.00 C ATOM 1739 O HIS A 116 0.430 10.663 5.443 1.00 0.00 O ATOM 1740 CB HIS A 116 3.369 9.854 6.717 1.00 0.00 C ATOM 1741 CG HIS A 116 2.492 10.295 7.848 1.00 0.00 C ATOM 1742 ND1 HIS A 116 2.681 11.479 8.529 1.00 0.00 N ATOM 1743 CD2 HIS A 116 1.415 9.703 8.416 1.00 0.00 C ATOM 1744 CE1 HIS A 116 1.759 11.596 9.468 1.00 0.00 C ATOM 1745 NE2 HIS A 116 0.978 10.531 9.420 1.00 0.00 N ATOM 0 H HIS A 116 4.543 9.584 4.563 1.00 0.00 H new ATOM 0 HA HIS A 116 2.066 8.739 5.424 1.00 0.00 H new ATOM 0 HB2 HIS A 116 3.846 8.911 6.984 1.00 0.00 H new ATOM 0 HB3 HIS A 116 4.165 10.586 6.579 1.00 0.00 H new ATOM 0 HD2 HIS A 116 0.981 8.756 8.132 1.00 0.00 H new ATOM 0 HE1 HIS A 116 1.660 12.421 10.157 1.00 0.00 H new ATOM 0 HE2 HIS A 116 0.180 10.353 10.030 1.00 0.00 H new ATOM 1753 N LYS A 117 2.132 11.970 4.770 1.00 0.00 N ATOM 1754 CA LYS A 117 1.291 13.139 4.545 1.00 0.00 C ATOM 1755 C LYS A 117 0.217 12.844 3.502 1.00 0.00 C ATOM 1756 O LYS A 117 -0.972 12.795 3.819 1.00 0.00 O ATOM 1757 CB LYS A 117 2.143 14.327 4.093 1.00 0.00 C ATOM 1758 CG LYS A 117 1.327 15.505 3.589 1.00 0.00 C ATOM 1759 CD LYS A 117 2.207 16.707 3.293 1.00 0.00 C ATOM 1760 CE LYS A 117 2.356 17.603 4.513 1.00 0.00 C ATOM 1761 NZ LYS A 117 1.278 18.627 4.585 1.00 0.00 N ATOM 0 H LYS A 117 3.121 12.117 4.568 1.00 0.00 H new ATOM 0 HA LYS A 117 0.800 13.389 5.486 1.00 0.00 H new ATOM 0 HB2 LYS A 117 2.764 14.656 4.926 1.00 0.00 H new ATOM 0 HB3 LYS A 117 2.818 13.999 3.303 1.00 0.00 H new ATOM 0 HG2 LYS A 117 0.789 15.216 2.686 1.00 0.00 H new ATOM 0 HG3 LYS A 117 0.579 15.776 4.334 1.00 0.00 H new ATOM 0 HD2 LYS A 117 3.190 16.368 2.967 1.00 0.00 H new ATOM 0 HD3 LYS A 117 1.778 17.279 2.470 1.00 0.00 H new ATOM 0 HE2 LYS A 117 2.338 16.993 5.416 1.00 0.00 H new ATOM 0 HE3 LYS A 117 3.326 18.099 4.483 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 1.416 19.217 5.430 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 1.311 19.226 3.735 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 0.353 18.154 4.640 1.00 0.00 H new ATOM 1775 N ILE A 118 0.645 12.647 2.259 1.00 0.00 N ATOM 1776 CA ILE A 118 -0.280 12.355 1.172 1.00 0.00 C ATOM 1777 C ILE A 118 -1.400 11.429 1.636 1.00 0.00 C ATOM 1778 O ILE A 118 -2.581 11.744 1.490 1.00 0.00 O ATOM 1779 CB ILE A 118 0.443 11.708 -0.024 1.00 0.00 C ATOM 1780 CG1 ILE A 118 1.497 12.663 -0.589 1.00 0.00 C ATOM 1781 CG2 ILE A 118 -0.558 11.318 -1.101 1.00 0.00 C ATOM 1782 CD1 ILE A 118 2.560 11.972 -1.412 1.00 0.00 C ATOM 0 H ILE A 118 1.626 12.684 1.981 1.00 0.00 H new ATOM 0 HA ILE A 118 -0.706 13.307 0.857 1.00 0.00 H new ATOM 0 HB ILE A 118 0.946 10.805 0.321 1.00 0.00 H new ATOM 0 HG12 ILE A 118 1.002 13.413 -1.206 1.00 0.00 H new ATOM 0 HG13 ILE A 118 1.975 13.193 0.235 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -0.031 10.862 -1.939 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -1.274 10.605 -0.691 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -1.087 12.207 -1.445 1.00 0.00 H new ATOM 0 HD11 ILE A 118 3.273 12.710 -1.780 1.00 0.00 H new ATOM 0 HD12 ILE A 118 3.081 11.241 -0.794 1.00 0.00 H new ATOM 0 HD13 ILE A 118 2.094 11.465 -2.257 1.00 0.00 H new ATOM 1794 N LEU A 119 -1.020 10.286 2.197 1.00 0.00 N ATOM 1795 CA LEU A 119 -1.992 9.314 2.685 1.00 0.00 C ATOM 1796 C LEU A 119 -3.094 10.000 3.485 1.00 0.00 C ATOM 1797 O LEU A 119 -4.281 9.830 3.201 1.00 0.00 O ATOM 1798 CB LEU A 119 -1.298 8.261 3.551 1.00 0.00 C ATOM 1799 CG LEU A 119 -0.448 7.232 2.804 1.00 0.00 C ATOM 1800 CD1 LEU A 119 0.625 6.662 3.719 1.00 0.00 C ATOM 1801 CD2 LEU A 119 -1.324 6.119 2.248 1.00 0.00 C ATOM 0 H LEU A 119 -0.046 10.010 2.325 1.00 0.00 H new ATOM 0 HA LEU A 119 -2.445 8.826 1.822 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -0.661 8.774 4.272 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -2.060 7.729 4.121 1.00 0.00 H new ATOM 0 HG LEU A 119 0.043 7.732 1.969 1.00 0.00 H new ATOM 0 HD11 LEU A 119 1.220 5.932 3.171 1.00 0.00 H new ATOM 0 HD12 LEU A 119 1.271 7.468 4.068 1.00 0.00 H new ATOM 0 HD13 LEU A 119 0.154 6.178 4.574 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -0.702 5.396 1.720 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -1.843 5.621 3.067 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -2.055 6.541 1.558 1.00 0.00 H new ATOM 1813 N LEU A 120 -2.695 10.779 4.485 1.00 0.00 N ATOM 1814 CA LEU A 120 -3.649 11.494 5.326 1.00 0.00 C ATOM 1815 C LEU A 120 -4.690 12.216 4.475 1.00 0.00 C ATOM 1816 O LEU A 120 -5.859 12.302 4.850 1.00 0.00 O ATOM 1817 CB LEU A 120 -2.919 12.498 6.220 1.00 0.00 C ATOM 1818 CG LEU A 120 -1.964 11.903 7.255 1.00 0.00 C ATOM 1819 CD1 LEU A 120 -1.032 12.975 7.799 1.00 0.00 C ATOM 1820 CD2 LEU A 120 -2.743 11.248 8.386 1.00 0.00 C ATOM 0 H LEU A 120 -1.717 10.931 4.733 1.00 0.00 H new ATOM 0 HA LEU A 120 -4.161 10.764 5.953 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -2.354 13.178 5.583 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -3.664 13.097 6.744 1.00 0.00 H new ATOM 0 HG LEU A 120 -1.360 11.138 6.766 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -0.359 12.533 8.534 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -0.448 13.399 6.982 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -1.619 13.762 8.271 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -2.047 10.830 9.113 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -3.373 11.993 8.873 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -3.369 10.451 7.983 1.00 0.00 H new ATOM 1832 N GLU A 121 -4.256 12.731 3.329 1.00 0.00 N ATOM 1833 CA GLU A 121 -5.151 13.444 2.425 1.00 0.00 C ATOM 1834 C GLU A 121 -6.064 12.471 1.684 1.00 0.00 C ATOM 1835 O GLU A 121 -7.289 12.576 1.754 1.00 0.00 O ATOM 1836 CB GLU A 121 -4.346 14.270 1.421 1.00 0.00 C ATOM 1837 CG GLU A 121 -3.953 15.644 1.939 1.00 0.00 C ATOM 1838 CD GLU A 121 -3.601 16.609 0.824 1.00 0.00 C ATOM 1839 OE1 GLU A 121 -4.210 16.511 -0.262 1.00 0.00 O ATOM 1840 OE2 GLU A 121 -2.715 17.463 1.037 1.00 0.00 O ATOM 0 H GLU A 121 -3.291 12.668 3.005 1.00 0.00 H new ATOM 0 HA GLU A 121 -5.770 14.114 3.022 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -3.444 13.721 1.152 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -4.931 14.388 0.509 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -4.775 16.056 2.525 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -3.101 15.545 2.611 1.00 0.00 H new ATOM 1847 N LYS A 122 -5.459 11.525 0.974 1.00 0.00 N ATOM 1848 CA LYS A 122 -6.215 10.533 0.220 1.00 0.00 C ATOM 1849 C LYS A 122 -7.276 9.875 1.097 1.00 0.00 C ATOM 1850 O LYS A 122 -8.428 9.727 0.689 1.00 0.00 O ATOM 1851 CB LYS A 122 -5.274 9.467 -0.346 1.00 0.00 C ATOM 1852 CG LYS A 122 -4.714 9.814 -1.714 1.00 0.00 C ATOM 1853 CD LYS A 122 -3.389 10.549 -1.605 1.00 0.00 C ATOM 1854 CE LYS A 122 -3.193 11.520 -2.759 1.00 0.00 C ATOM 1855 NZ LYS A 122 -3.991 12.765 -2.578 1.00 0.00 N ATOM 0 H LYS A 122 -4.446 11.425 0.905 1.00 0.00 H new ATOM 0 HA LYS A 122 -6.715 11.043 -0.604 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -4.447 9.319 0.349 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -5.809 8.520 -0.412 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -4.578 8.901 -2.294 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -5.430 10.432 -2.255 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -3.350 11.092 -0.661 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -2.572 9.828 -1.592 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -2.137 11.775 -2.844 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -3.480 11.037 -3.693 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -4.166 13.203 -3.505 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -4.899 12.533 -2.128 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -3.466 13.430 -1.975 1.00 0.00 H new ATOM 1869 N LYS A 123 -6.880 9.484 2.303 1.00 0.00 N ATOM 1870 CA LYS A 123 -7.797 8.845 3.240 1.00 0.00 C ATOM 1871 C LYS A 123 -8.939 9.785 3.611 1.00 0.00 C ATOM 1872 O LYS A 123 -10.099 9.378 3.665 1.00 0.00 O ATOM 1873 CB LYS A 123 -7.049 8.411 4.502 1.00 0.00 C ATOM 1874 CG LYS A 123 -6.541 9.573 5.338 1.00 0.00 C ATOM 1875 CD LYS A 123 -5.934 9.095 6.646 1.00 0.00 C ATOM 1876 CE LYS A 123 -6.083 10.138 7.743 1.00 0.00 C ATOM 1877 NZ LYS A 123 -5.683 9.604 9.074 1.00 0.00 N ATOM 0 H LYS A 123 -5.930 9.598 2.655 1.00 0.00 H new ATOM 0 HA LYS A 123 -8.218 7.965 2.754 1.00 0.00 H new ATOM 0 HB2 LYS A 123 -7.710 7.797 5.113 1.00 0.00 H new ATOM 0 HB3 LYS A 123 -6.205 7.784 4.216 1.00 0.00 H new ATOM 0 HG2 LYS A 123 -5.795 10.131 4.772 1.00 0.00 H new ATOM 0 HG3 LYS A 123 -7.362 10.259 5.546 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -6.417 8.168 6.955 1.00 0.00 H new ATOM 0 HD3 LYS A 123 -4.878 8.870 6.498 1.00 0.00 H new ATOM 0 HE2 LYS A 123 -5.472 11.008 7.502 1.00 0.00 H new ATOM 0 HE3 LYS A 123 -7.118 10.477 7.784 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 -6.501 9.623 9.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 -5.348 8.625 8.969 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 -4.920 10.190 9.468 1.00 0.00 H new ATOM 1891 N ASP A 124 -8.603 11.045 3.864 1.00 0.00 N ATOM 1892 CA ASP A 124 -9.601 12.045 4.227 1.00 0.00 C ATOM 1893 C ASP A 124 -10.760 12.041 3.236 1.00 0.00 C ATOM 1894 O ASP A 124 -11.926 12.008 3.629 1.00 0.00 O ATOM 1895 CB ASP A 124 -8.965 13.435 4.282 1.00 0.00 C ATOM 1896 CG ASP A 124 -8.355 13.740 5.636 1.00 0.00 C ATOM 1897 OD1 ASP A 124 -8.774 13.111 6.630 1.00 0.00 O ATOM 1898 OD2 ASP A 124 -7.460 14.608 5.702 1.00 0.00 O ATOM 0 H ASP A 124 -7.647 11.399 3.824 1.00 0.00 H new ATOM 0 HA ASP A 124 -9.990 11.793 5.214 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -8.194 13.509 3.515 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -9.720 14.186 4.049 1.00 0.00 H new ATOM 1903 N ALA A 125 -10.431 12.075 1.948 1.00 0.00 N ATOM 1904 CA ALA A 125 -11.445 12.074 0.901 1.00 0.00 C ATOM 1905 C ALA A 125 -11.578 10.694 0.267 1.00 0.00 C ATOM 1906 O ALA A 125 -12.588 10.387 -0.369 1.00 0.00 O ATOM 1907 CB ALA A 125 -11.109 13.113 -0.159 1.00 0.00 C ATOM 0 H ALA A 125 -9.471 12.104 1.605 1.00 0.00 H new ATOM 0 HA ALA A 125 -12.402 12.330 1.356 1.00 0.00 H new ATOM 0 HB1 ALA A 125 -11.874 13.102 -0.935 1.00 0.00 H new ATOM 0 HB2 ALA A 125 -11.071 14.101 0.299 1.00 0.00 H new ATOM 0 HB3 ALA A 125 -10.140 12.881 -0.601 1.00 0.00 H new TER 1913 ALA A 125