USER MOD reduce.3.24.130724 H: found=0, std=0, add=803, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 803 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: C 69 SER OG : rot -61:sc= 0.365! USER MOD Set 1.2: C 71 THR OG1 : rot 180:sc= 0 USER MOD Single : C 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 1 MET N :NH3+ 178:sc= -0.114 (180deg=-0.12) USER MOD Single : C 5 TYR OH : rot 180:sc= 0 USER MOD Single : C 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 11 GLN : amide:sc= -1.85 K(o=-1.9,f=-4.5!) USER MOD Single : C 13 THR OG1 : rot 180:sc= 0.0166 USER MOD Single : C 16 GLN : amide:sc= -0.776 K(o=-0.78,f=-2.2!) USER MOD Single : C 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 18 ASN : amide:sc= -2.82! X(o=-2.8!,f=-2.8) USER MOD Single : C 21 LYS NZ :NH3+ -164:sc= 0 (180deg=-0.136) USER MOD Single : C 35 CYS SG : rot 180:sc= -0.024 USER MOD Single : C 37 SER OG : rot -40:sc= -1.41! USER MOD Single : C 38 THR OG1 : rot -83:sc= -0.178 USER MOD Single : C 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 45 MET CE :methyl -105:sc= -6.5! (180deg=-8.26!) USER MOD Single : C 47 MET CE :methyl -169:sc= -2.48! (180deg=-3.09!) USER MOD Single : C 50 GLN : amide:sc= -2.81! C(o=-2.8!,f=-3.3!) USER MOD Single : C 51 ASN : amide:sc= -0.0117 X(o=-0.012,f=-0.03) USER MOD Single : C 53 THR OG1 : rot -94:sc= 0.181 USER MOD Single : C 58 GLN : amide:sc= -0.401 K(o=-0.4,f=-1.1) USER MOD Single : C 60 MET CE :methyl 139:sc= -5.9! (180deg=-8.96!) USER MOD Single : C 80 MET CE :methyl -144:sc= -0.484 (180deg=-2.11!) USER MOD Single : C 81 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 84 CYS SG : rot -13:sc= -1.28 USER MOD Single : C 85 MET CE :methyl -143:sc= -0.785 (180deg=-3.17!) USER MOD Single : C 86 LYS NZ :NH3+ -126:sc= 0 (180deg=-0.0327) USER MOD Single : C 89 SER OG : rot 180:sc= 0 USER MOD Single : I 1 ARG N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : I 3 SER OG : rot -138:sc= 0.368 USER MOD Single : I 7 MET CE :methyl 160:sc= -4.81 (180deg=-7.46!) USER MOD Single : I 8 MET CE :methyl -126:sc= -5.09! (180deg=-9.33!) USER MOD Single : I 9 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : I 17 LYS NZ :NH3+ -118:sc= 0 (180deg=-0.138) USER MOD ----------------------------------------------------------------- ATOM 1 N MET C 1 61.910 -10.654 17.002 1.00 0.00 N ATOM 2 CA MET C 1 62.787 -11.858 16.936 1.00 0.00 C ATOM 3 C MET C 1 61.990 -13.070 16.445 1.00 0.00 C ATOM 4 O MET C 1 62.530 -14.138 16.242 1.00 0.00 O ATOM 5 CB MET C 1 63.265 -12.077 18.373 1.00 0.00 C ATOM 6 CG MET C 1 64.683 -11.524 18.533 1.00 0.00 C ATOM 7 SD MET C 1 65.390 -12.120 20.089 1.00 0.00 S ATOM 8 CE MET C 1 66.843 -11.040 20.110 1.00 0.00 C ATOM 0 H1 MET C 1 62.455 -9.847 17.369 1.00 0.00 H new ATOM 0 H2 MET C 1 61.557 -10.429 16.050 1.00 0.00 H new ATOM 0 H3 MET C 1 61.106 -10.844 17.634 1.00 0.00 H new ATOM 0 HA MET C 1 63.619 -11.725 16.244 1.00 0.00 H new ATOM 0 HB2 MET C 1 62.590 -11.582 19.071 1.00 0.00 H new ATOM 0 HB3 MET C 1 63.249 -13.140 18.614 1.00 0.00 H new ATOM 0 HG2 MET C 1 65.304 -11.839 17.695 1.00 0.00 H new ATOM 0 HG3 MET C 1 64.663 -10.434 18.524 1.00 0.00 H new ATOM 0 HE1 MET C 1 67.434 -11.243 21.003 1.00 0.00 H new ATOM 0 HE2 MET C 1 67.449 -11.228 19.224 1.00 0.00 H new ATOM 0 HE3 MET C 1 66.522 -9.998 20.116 1.00 0.00 H new ATOM 20 N ASP C 2 60.707 -12.912 16.252 1.00 0.00 N ATOM 21 CA ASP C 2 59.878 -14.057 15.775 1.00 0.00 C ATOM 22 C ASP C 2 59.183 -13.699 14.457 1.00 0.00 C ATOM 23 O ASP C 2 59.502 -12.712 13.825 1.00 0.00 O ATOM 24 CB ASP C 2 58.847 -14.287 16.880 1.00 0.00 C ATOM 25 CG ASP C 2 58.376 -15.743 16.844 1.00 0.00 C ATOM 26 OD1 ASP C 2 59.217 -16.615 16.700 1.00 0.00 O ATOM 27 OD2 ASP C 2 57.181 -15.960 16.962 1.00 0.00 O ATOM 0 H ASP C 2 60.198 -12.041 16.404 1.00 0.00 H new ATOM 0 HA ASP C 2 60.477 -14.947 15.584 1.00 0.00 H new ATOM 0 HB2 ASP C 2 59.283 -14.059 17.852 1.00 0.00 H new ATOM 0 HB3 ASP C 2 57.999 -13.616 16.746 1.00 0.00 H new ATOM 32 N ASP C 3 58.238 -14.497 14.038 1.00 0.00 N ATOM 33 CA ASP C 3 57.524 -14.207 12.760 1.00 0.00 C ATOM 34 C ASP C 3 56.349 -13.255 13.008 1.00 0.00 C ATOM 35 O ASP C 3 55.199 -13.634 12.906 1.00 0.00 O ATOM 36 CB ASP C 3 57.016 -15.566 12.274 1.00 0.00 C ATOM 37 CG ASP C 3 56.063 -16.158 13.316 1.00 0.00 C ATOM 38 OD1 ASP C 3 56.426 -16.174 14.481 1.00 0.00 O ATOM 39 OD2 ASP C 3 54.988 -16.585 12.930 1.00 0.00 O ATOM 0 H ASP C 3 57.929 -15.338 14.526 1.00 0.00 H new ATOM 0 HA ASP C 3 58.172 -13.725 12.028 1.00 0.00 H new ATOM 0 HB2 ASP C 3 56.503 -15.454 11.319 1.00 0.00 H new ATOM 0 HB3 ASP C 3 57.855 -16.242 12.108 1.00 0.00 H new ATOM 44 N ILE C 4 56.630 -12.022 13.326 1.00 0.00 N ATOM 45 CA ILE C 4 55.530 -11.047 13.574 1.00 0.00 C ATOM 46 C ILE C 4 55.339 -10.158 12.343 1.00 0.00 C ATOM 47 O ILE C 4 54.273 -9.627 12.103 1.00 0.00 O ATOM 48 CB ILE C 4 55.997 -10.218 14.770 1.00 0.00 C ATOM 49 CG1 ILE C 4 54.975 -9.116 15.058 1.00 0.00 C ATOM 50 CG2 ILE C 4 57.354 -9.584 14.457 1.00 0.00 C ATOM 51 CD1 ILE C 4 53.808 -9.697 15.859 1.00 0.00 C ATOM 0 H ILE C 4 57.573 -11.647 13.425 1.00 0.00 H new ATOM 0 HA ILE C 4 54.575 -11.535 13.770 1.00 0.00 H new ATOM 0 HB ILE C 4 56.092 -10.865 15.642 1.00 0.00 H new ATOM 0 HG12 ILE C 4 55.445 -8.306 15.616 1.00 0.00 H new ATOM 0 HG13 ILE C 4 54.611 -8.690 14.123 1.00 0.00 H new ATOM 0 HG21 ILE C 4 57.685 -8.993 15.311 1.00 0.00 H new ATOM 0 HG22 ILE C 4 58.083 -10.368 14.253 1.00 0.00 H new ATOM 0 HG23 ILE C 4 57.261 -8.939 13.584 1.00 0.00 H new ATOM 0 HD11 ILE C 4 53.080 -8.912 16.064 1.00 0.00 H new ATOM 0 HD12 ILE C 4 53.332 -10.492 15.284 1.00 0.00 H new ATOM 0 HD13 ILE C 4 54.179 -10.102 16.800 1.00 0.00 H new ATOM 63 N TYR C 5 56.369 -9.998 11.560 1.00 0.00 N ATOM 64 CA TYR C 5 56.262 -9.151 10.339 1.00 0.00 C ATOM 65 C TYR C 5 56.552 -9.998 9.100 1.00 0.00 C ATOM 66 O TYR C 5 55.868 -9.914 8.100 1.00 0.00 O ATOM 67 CB TYR C 5 57.329 -8.072 10.514 1.00 0.00 C ATOM 68 CG TYR C 5 56.959 -7.178 11.674 1.00 0.00 C ATOM 69 CD1 TYR C 5 55.870 -6.305 11.566 1.00 0.00 C ATOM 70 CD2 TYR C 5 57.706 -7.221 12.858 1.00 0.00 C ATOM 71 CE1 TYR C 5 55.527 -5.476 12.641 1.00 0.00 C ATOM 72 CE2 TYR C 5 57.363 -6.391 13.933 1.00 0.00 C ATOM 73 CZ TYR C 5 56.273 -5.518 13.825 1.00 0.00 C ATOM 74 OH TYR C 5 55.934 -4.701 14.885 1.00 0.00 O ATOM 0 H TYR C 5 57.285 -10.420 11.714 1.00 0.00 H new ATOM 0 HA TYR C 5 55.269 -8.720 10.211 1.00 0.00 H new ATOM 0 HB2 TYR C 5 58.301 -8.533 10.692 1.00 0.00 H new ATOM 0 HB3 TYR C 5 57.418 -7.483 9.601 1.00 0.00 H new ATOM 0 HD1 TYR C 5 55.294 -6.271 10.653 1.00 0.00 H new ATOM 0 HD2 TYR C 5 58.546 -7.894 12.942 1.00 0.00 H new ATOM 0 HE1 TYR C 5 54.686 -4.804 12.557 1.00 0.00 H new ATOM 0 HE2 TYR C 5 57.939 -6.424 14.846 1.00 0.00 H new ATOM 0 HH TYR C 5 56.553 -4.857 15.629 1.00 0.00 H new ATOM 84 N LYS C 6 57.564 -10.820 9.165 1.00 0.00 N ATOM 85 CA LYS C 6 57.901 -11.684 7.999 1.00 0.00 C ATOM 86 C LYS C 6 56.738 -12.631 7.704 1.00 0.00 C ATOM 87 O LYS C 6 56.579 -13.119 6.602 1.00 0.00 O ATOM 88 CB LYS C 6 59.136 -12.472 8.438 1.00 0.00 C ATOM 89 CG LYS C 6 58.859 -13.147 9.782 1.00 0.00 C ATOM 90 CD LYS C 6 59.247 -14.625 9.703 1.00 0.00 C ATOM 91 CE LYS C 6 60.768 -14.761 9.815 1.00 0.00 C ATOM 92 NZ LYS C 6 61.108 -15.953 8.988 1.00 0.00 N ATOM 0 H LYS C 6 58.172 -10.930 9.976 1.00 0.00 H new ATOM 0 HA LYS C 6 58.087 -11.110 7.091 1.00 0.00 H new ATOM 0 HB2 LYS C 6 59.388 -13.221 7.688 1.00 0.00 H new ATOM 0 HB3 LYS C 6 59.994 -11.806 8.524 1.00 0.00 H new ATOM 0 HG2 LYS C 6 59.425 -12.654 10.572 1.00 0.00 H new ATOM 0 HG3 LYS C 6 57.804 -13.051 10.038 1.00 0.00 H new ATOM 0 HD2 LYS C 6 58.762 -15.183 10.504 1.00 0.00 H new ATOM 0 HD3 LYS C 6 58.901 -15.053 8.762 1.00 0.00 H new ATOM 0 HE2 LYS C 6 61.273 -13.868 9.447 1.00 0.00 H new ATOM 0 HE3 LYS C 6 61.077 -14.898 10.851 1.00 0.00 H new ATOM 0 HZ1 LYS C 6 62.135 -16.112 9.014 1.00 0.00 H new ATOM 0 HZ2 LYS C 6 60.618 -16.789 9.366 1.00 0.00 H new ATOM 0 HZ3 LYS C 6 60.808 -15.791 8.006 1.00 0.00 H new ATOM 106 N ALA C 7 55.921 -12.893 8.687 1.00 0.00 N ATOM 107 CA ALA C 7 54.762 -13.809 8.475 1.00 0.00 C ATOM 108 C ALA C 7 53.697 -13.120 7.620 1.00 0.00 C ATOM 109 O ALA C 7 53.158 -13.697 6.697 1.00 0.00 O ATOM 110 CB ALA C 7 54.222 -14.094 9.878 1.00 0.00 C ATOM 0 H ALA C 7 56.005 -12.512 9.630 1.00 0.00 H new ATOM 0 HA ALA C 7 55.046 -14.723 7.954 1.00 0.00 H new ATOM 0 HB1 ALA C 7 53.365 -14.763 9.809 1.00 0.00 H new ATOM 0 HB2 ALA C 7 55.001 -14.563 10.479 1.00 0.00 H new ATOM 0 HB3 ALA C 7 53.915 -13.159 10.347 1.00 0.00 H new ATOM 116 N ALA C 8 53.389 -11.888 7.920 1.00 0.00 N ATOM 117 CA ALA C 8 52.358 -11.162 7.124 1.00 0.00 C ATOM 118 C ALA C 8 52.763 -11.123 5.649 1.00 0.00 C ATOM 119 O ALA C 8 51.928 -11.094 4.766 1.00 0.00 O ATOM 120 CB ALA C 8 52.328 -9.751 7.709 1.00 0.00 C ATOM 0 H ALA C 8 53.806 -11.353 8.681 1.00 0.00 H new ATOM 0 HA ALA C 8 51.382 -11.644 7.173 1.00 0.00 H new ATOM 0 HB1 ALA C 8 51.591 -9.151 7.175 1.00 0.00 H new ATOM 0 HB2 ALA C 8 52.060 -9.800 8.764 1.00 0.00 H new ATOM 0 HB3 ALA C 8 53.312 -9.293 7.605 1.00 0.00 H new ATOM 126 N VAL C 9 54.038 -11.123 5.375 1.00 0.00 N ATOM 127 CA VAL C 9 54.496 -11.087 3.958 1.00 0.00 C ATOM 128 C VAL C 9 54.197 -12.424 3.276 1.00 0.00 C ATOM 129 O VAL C 9 53.456 -12.489 2.316 1.00 0.00 O ATOM 130 CB VAL C 9 56.003 -10.846 4.034 1.00 0.00 C ATOM 131 CG1 VAL C 9 56.561 -10.653 2.624 1.00 0.00 C ATOM 132 CG2 VAL C 9 56.278 -9.590 4.864 1.00 0.00 C ATOM 0 H VAL C 9 54.783 -11.146 6.071 1.00 0.00 H new ATOM 0 HA VAL C 9 53.991 -10.314 3.378 1.00 0.00 H new ATOM 0 HB VAL C 9 56.484 -11.705 4.502 1.00 0.00 H new ATOM 0 HG11 VAL C 9 57.636 -10.481 2.678 1.00 0.00 H new ATOM 0 HG12 VAL C 9 56.366 -11.546 2.030 1.00 0.00 H new ATOM 0 HG13 VAL C 9 56.079 -9.794 2.157 1.00 0.00 H new ATOM 0 HG21 VAL C 9 57.353 -9.418 4.918 1.00 0.00 H new ATOM 0 HG22 VAL C 9 55.796 -8.732 4.396 1.00 0.00 H new ATOM 0 HG23 VAL C 9 55.881 -9.725 5.870 1.00 0.00 H new ATOM 142 N GLU C 10 54.766 -13.489 3.767 1.00 0.00 N ATOM 143 CA GLU C 10 54.509 -14.821 3.147 1.00 0.00 C ATOM 144 C GLU C 10 53.005 -15.032 2.957 1.00 0.00 C ATOM 145 O GLU C 10 52.576 -15.790 2.110 1.00 0.00 O ATOM 146 CB GLU C 10 55.073 -15.835 4.144 1.00 0.00 C ATOM 147 CG GLU C 10 56.013 -16.797 3.414 1.00 0.00 C ATOM 148 CD GLU C 10 55.230 -18.034 2.970 1.00 0.00 C ATOM 149 OE1 GLU C 10 54.270 -18.375 3.641 1.00 0.00 O ATOM 150 OE2 GLU C 10 55.604 -18.618 1.967 1.00 0.00 O ATOM 0 H GLU C 10 55.397 -13.496 4.569 1.00 0.00 H new ATOM 0 HA GLU C 10 54.969 -14.917 2.164 1.00 0.00 H new ATOM 0 HB2 GLU C 10 55.610 -15.319 4.940 1.00 0.00 H new ATOM 0 HB3 GLU C 10 54.261 -16.389 4.614 1.00 0.00 H new ATOM 0 HG2 GLU C 10 56.456 -16.304 2.549 1.00 0.00 H new ATOM 0 HG3 GLU C 10 56.834 -17.088 4.070 1.00 0.00 H new ATOM 157 N GLN C 11 52.200 -14.365 3.740 1.00 0.00 N ATOM 158 CA GLN C 11 50.723 -14.522 3.606 1.00 0.00 C ATOM 159 C GLN C 11 50.208 -13.683 2.434 1.00 0.00 C ATOM 160 O GLN C 11 49.047 -13.738 2.081 1.00 0.00 O ATOM 161 CB GLN C 11 50.151 -14.008 4.927 1.00 0.00 C ATOM 162 CG GLN C 11 50.012 -15.173 5.909 1.00 0.00 C ATOM 163 CD GLN C 11 50.511 -14.742 7.289 1.00 0.00 C ATOM 164 OE1 GLN C 11 50.468 -13.574 7.626 1.00 0.00 O ATOM 165 NE2 GLN C 11 50.987 -15.639 8.107 1.00 0.00 N ATOM 0 H GLN C 11 52.502 -13.717 4.468 1.00 0.00 H new ATOM 0 HA GLN C 11 50.431 -15.554 3.410 1.00 0.00 H new ATOM 0 HB2 GLN C 11 50.804 -13.242 5.345 1.00 0.00 H new ATOM 0 HB3 GLN C 11 49.180 -13.542 4.759 1.00 0.00 H new ATOM 0 HG2 GLN C 11 48.970 -15.488 5.970 1.00 0.00 H new ATOM 0 HG3 GLN C 11 50.585 -16.030 5.555 1.00 0.00 H new ATOM 0 HE21 GLN C 11 51.023 -16.619 7.825 1.00 0.00 H new ATOM 0 HE22 GLN C 11 51.323 -15.361 9.029 1.00 0.00 H new ATOM 174 N LEU C 12 51.064 -12.906 1.830 1.00 0.00 N ATOM 175 CA LEU C 12 50.625 -12.062 0.682 1.00 0.00 C ATOM 176 C LEU C 12 50.412 -12.927 -0.563 1.00 0.00 C ATOM 177 O LEU C 12 50.760 -14.091 -0.591 1.00 0.00 O ATOM 178 CB LEU C 12 51.771 -11.078 0.452 1.00 0.00 C ATOM 179 CG LEU C 12 51.914 -10.163 1.669 1.00 0.00 C ATOM 180 CD1 LEU C 12 53.150 -9.278 1.499 1.00 0.00 C ATOM 181 CD2 LEU C 12 50.669 -9.280 1.791 1.00 0.00 C ATOM 0 H LEU C 12 52.049 -12.819 2.081 1.00 0.00 H new ATOM 0 HA LEU C 12 49.682 -11.555 0.884 1.00 0.00 H new ATOM 0 HB2 LEU C 12 52.701 -11.621 0.281 1.00 0.00 H new ATOM 0 HB3 LEU C 12 51.580 -10.484 -0.442 1.00 0.00 H new ATOM 0 HG LEU C 12 52.021 -10.769 2.569 1.00 0.00 H new ATOM 0 HD11 LEU C 12 53.252 -8.626 2.366 1.00 0.00 H new ATOM 0 HD12 LEU C 12 54.037 -9.905 1.410 1.00 0.00 H new ATOM 0 HD13 LEU C 12 53.042 -8.672 0.600 1.00 0.00 H new ATOM 0 HD21 LEU C 12 50.769 -8.627 2.658 1.00 0.00 H new ATOM 0 HD22 LEU C 12 50.563 -8.674 0.891 1.00 0.00 H new ATOM 0 HD23 LEU C 12 49.787 -9.909 1.911 1.00 0.00 H new ATOM 193 N THR C 13 49.851 -12.361 -1.595 1.00 0.00 N ATOM 194 CA THR C 13 49.622 -13.141 -2.844 1.00 0.00 C ATOM 195 C THR C 13 50.380 -12.493 -4.007 1.00 0.00 C ATOM 196 O THR C 13 51.024 -11.476 -3.847 1.00 0.00 O ATOM 197 CB THR C 13 48.112 -13.075 -3.081 1.00 0.00 C ATOM 198 OG1 THR C 13 47.574 -11.960 -2.384 1.00 0.00 O ATOM 199 CG2 THR C 13 47.456 -14.361 -2.574 1.00 0.00 C ATOM 0 H THR C 13 49.540 -11.390 -1.628 1.00 0.00 H new ATOM 0 HA THR C 13 49.974 -14.170 -2.765 1.00 0.00 H new ATOM 0 HB THR C 13 47.916 -12.967 -4.148 1.00 0.00 H new ATOM 0 HG1 THR C 13 46.607 -11.915 -2.536 1.00 0.00 H new ATOM 0 HG21 THR C 13 46.380 -14.312 -2.744 1.00 0.00 H new ATOM 0 HG22 THR C 13 47.869 -15.216 -3.109 1.00 0.00 H new ATOM 0 HG23 THR C 13 47.650 -14.472 -1.507 1.00 0.00 H new ATOM 207 N GLU C 14 50.310 -13.071 -5.174 1.00 0.00 N ATOM 208 CA GLU C 14 51.030 -12.482 -6.339 1.00 0.00 C ATOM 209 C GLU C 14 50.505 -11.074 -6.630 1.00 0.00 C ATOM 210 O GLU C 14 51.262 -10.137 -6.773 1.00 0.00 O ATOM 211 CB GLU C 14 50.730 -13.421 -7.508 1.00 0.00 C ATOM 212 CG GLU C 14 52.044 -13.883 -8.141 1.00 0.00 C ATOM 213 CD GLU C 14 51.750 -14.891 -9.252 1.00 0.00 C ATOM 214 OE1 GLU C 14 51.265 -15.966 -8.936 1.00 0.00 O ATOM 215 OE2 GLU C 14 52.015 -14.574 -10.400 1.00 0.00 O ATOM 0 H GLU C 14 49.787 -13.924 -5.372 1.00 0.00 H new ATOM 0 HA GLU C 14 52.101 -12.388 -6.158 1.00 0.00 H new ATOM 0 HB2 GLU C 14 50.159 -14.282 -7.160 1.00 0.00 H new ATOM 0 HB3 GLU C 14 50.116 -12.911 -8.250 1.00 0.00 H new ATOM 0 HG2 GLU C 14 52.585 -13.028 -8.546 1.00 0.00 H new ATOM 0 HG3 GLU C 14 52.684 -14.336 -7.384 1.00 0.00 H new ATOM 222 N GLU C 15 49.212 -10.919 -6.718 1.00 0.00 N ATOM 223 CA GLU C 15 48.641 -9.570 -6.998 1.00 0.00 C ATOM 224 C GLU C 15 49.116 -8.568 -5.941 1.00 0.00 C ATOM 225 O GLU C 15 49.355 -7.413 -6.231 1.00 0.00 O ATOM 226 CB GLU C 15 47.126 -9.756 -6.921 1.00 0.00 C ATOM 227 CG GLU C 15 46.443 -8.828 -7.927 1.00 0.00 C ATOM 228 CD GLU C 15 45.188 -9.508 -8.479 1.00 0.00 C ATOM 229 OE1 GLU C 15 44.881 -10.598 -8.025 1.00 0.00 O ATOM 230 OE2 GLU C 15 44.557 -8.927 -9.347 1.00 0.00 O ATOM 0 H GLU C 15 48.527 -11.667 -6.608 1.00 0.00 H new ATOM 0 HA GLU C 15 48.953 -9.181 -7.967 1.00 0.00 H new ATOM 0 HB2 GLU C 15 46.866 -10.793 -7.133 1.00 0.00 H new ATOM 0 HB3 GLU C 15 46.774 -9.538 -5.913 1.00 0.00 H new ATOM 0 HG2 GLU C 15 46.178 -7.886 -7.447 1.00 0.00 H new ATOM 0 HG3 GLU C 15 47.128 -8.589 -8.741 1.00 0.00 H new ATOM 237 N GLN C 16 49.255 -9.003 -4.719 1.00 0.00 N ATOM 238 CA GLN C 16 49.715 -8.077 -3.645 1.00 0.00 C ATOM 239 C GLN C 16 51.225 -7.855 -3.752 1.00 0.00 C ATOM 240 O GLN C 16 51.698 -6.736 -3.792 1.00 0.00 O ATOM 241 CB GLN C 16 49.370 -8.785 -2.335 1.00 0.00 C ATOM 242 CG GLN C 16 49.860 -7.945 -1.154 1.00 0.00 C ATOM 243 CD GLN C 16 48.663 -7.521 -0.299 1.00 0.00 C ATOM 244 OE1 GLN C 16 47.678 -8.227 -0.222 1.00 0.00 O ATOM 245 NE2 GLN C 16 48.707 -6.390 0.350 1.00 0.00 N ATOM 0 H GLN C 16 49.070 -9.960 -4.417 1.00 0.00 H new ATOM 0 HA GLN C 16 49.243 -7.097 -3.715 1.00 0.00 H new ATOM 0 HB2 GLN C 16 48.293 -8.937 -2.264 1.00 0.00 H new ATOM 0 HB3 GLN C 16 49.833 -9.771 -2.310 1.00 0.00 H new ATOM 0 HG2 GLN C 16 50.565 -8.519 -0.553 1.00 0.00 H new ATOM 0 HG3 GLN C 16 50.392 -7.065 -1.516 1.00 0.00 H new ATOM 0 HE21 GLN C 16 49.534 -5.797 0.285 1.00 0.00 H new ATOM 0 HE22 GLN C 16 47.914 -6.099 0.922 1.00 0.00 H new ATOM 254 N LYS C 17 51.987 -8.913 -3.804 1.00 0.00 N ATOM 255 CA LYS C 17 53.465 -8.762 -3.913 1.00 0.00 C ATOM 256 C LYS C 17 53.816 -8.076 -5.239 1.00 0.00 C ATOM 257 O LYS C 17 54.896 -7.542 -5.406 1.00 0.00 O ATOM 258 CB LYS C 17 54.009 -10.198 -3.855 1.00 0.00 C ATOM 259 CG LYS C 17 55.311 -10.308 -4.655 1.00 0.00 C ATOM 260 CD LYS C 17 54.976 -10.513 -6.133 1.00 0.00 C ATOM 261 CE LYS C 17 55.968 -9.731 -6.998 1.00 0.00 C ATOM 262 NZ LYS C 17 56.756 -10.773 -7.714 1.00 0.00 N ATOM 0 H LYS C 17 51.650 -9.875 -3.776 1.00 0.00 H new ATOM 0 HA LYS C 17 53.894 -8.145 -3.123 1.00 0.00 H new ATOM 0 HB2 LYS C 17 54.186 -10.485 -2.819 1.00 0.00 H new ATOM 0 HB3 LYS C 17 53.269 -10.891 -4.256 1.00 0.00 H new ATOM 0 HG2 LYS C 17 55.908 -9.405 -4.527 1.00 0.00 H new ATOM 0 HG3 LYS C 17 55.909 -11.141 -4.286 1.00 0.00 H new ATOM 0 HD2 LYS C 17 55.018 -11.573 -6.382 1.00 0.00 H new ATOM 0 HD3 LYS C 17 53.959 -10.178 -6.336 1.00 0.00 H new ATOM 0 HE2 LYS C 17 55.450 -9.076 -7.699 1.00 0.00 H new ATOM 0 HE3 LYS C 17 56.612 -9.099 -6.387 1.00 0.00 H new ATOM 0 HZ1 LYS C 17 57.459 -10.315 -8.329 1.00 0.00 H new ATOM 0 HZ2 LYS C 17 57.243 -11.377 -7.021 1.00 0.00 H new ATOM 0 HZ3 LYS C 17 56.117 -11.355 -8.292 1.00 0.00 H new ATOM 276 N ASN C 18 52.911 -8.081 -6.177 1.00 0.00 N ATOM 277 CA ASN C 18 53.192 -7.423 -7.485 1.00 0.00 C ATOM 278 C ASN C 18 53.111 -5.904 -7.328 1.00 0.00 C ATOM 279 O ASN C 18 53.764 -5.159 -8.032 1.00 0.00 O ATOM 280 CB ASN C 18 52.098 -7.928 -8.428 1.00 0.00 C ATOM 281 CG ASN C 18 52.563 -9.222 -9.099 1.00 0.00 C ATOM 282 OD1 ASN C 18 53.709 -9.343 -9.483 1.00 0.00 O ATOM 283 ND2 ASN C 18 51.716 -10.202 -9.255 1.00 0.00 N ATOM 0 H ASN C 18 51.990 -8.511 -6.096 1.00 0.00 H new ATOM 0 HA ASN C 18 54.188 -7.654 -7.864 1.00 0.00 H new ATOM 0 HB2 ASN C 18 51.177 -8.104 -7.873 1.00 0.00 H new ATOM 0 HB3 ASN C 18 51.876 -7.173 -9.183 1.00 0.00 H new ATOM 0 HD21 ASN C 18 52.016 -11.070 -9.699 1.00 0.00 H new ATOM 0 HD22 ASN C 18 50.754 -10.101 -8.933 1.00 0.00 H new ATOM 290 N GLU C 19 52.316 -5.439 -6.402 1.00 0.00 N ATOM 291 CA GLU C 19 52.196 -3.969 -6.191 1.00 0.00 C ATOM 292 C GLU C 19 53.424 -3.446 -5.441 1.00 0.00 C ATOM 293 O GLU C 19 54.018 -2.455 -5.816 1.00 0.00 O ATOM 294 CB GLU C 19 50.934 -3.791 -5.344 1.00 0.00 C ATOM 295 CG GLU C 19 49.696 -3.994 -6.219 1.00 0.00 C ATOM 296 CD GLU C 19 48.437 -3.754 -5.384 1.00 0.00 C ATOM 297 OE1 GLU C 19 48.344 -4.327 -4.311 1.00 0.00 O ATOM 298 OE2 GLU C 19 47.587 -3.002 -5.831 1.00 0.00 O ATOM 0 H GLU C 19 51.745 -6.014 -5.783 1.00 0.00 H new ATOM 0 HA GLU C 19 52.136 -3.419 -7.130 1.00 0.00 H new ATOM 0 HB2 GLU C 19 50.932 -4.506 -4.522 1.00 0.00 H new ATOM 0 HB3 GLU C 19 50.919 -2.795 -4.900 1.00 0.00 H new ATOM 0 HG2 GLU C 19 49.720 -3.308 -7.066 1.00 0.00 H new ATOM 0 HG3 GLU C 19 49.688 -5.005 -6.627 1.00 0.00 H new ATOM 305 N PHE C 20 53.809 -4.109 -4.384 1.00 0.00 N ATOM 306 CA PHE C 20 54.999 -3.654 -3.610 1.00 0.00 C ATOM 307 C PHE C 20 56.270 -3.812 -4.450 1.00 0.00 C ATOM 308 O PHE C 20 57.236 -3.097 -4.272 1.00 0.00 O ATOM 309 CB PHE C 20 55.049 -4.569 -2.386 1.00 0.00 C ATOM 310 CG PHE C 20 53.806 -4.363 -1.554 1.00 0.00 C ATOM 311 CD1 PHE C 20 53.411 -3.071 -1.191 1.00 0.00 C ATOM 312 CD2 PHE C 20 53.047 -5.467 -1.147 1.00 0.00 C ATOM 313 CE1 PHE C 20 52.258 -2.881 -0.420 1.00 0.00 C ATOM 314 CE2 PHE C 20 51.894 -5.278 -0.377 1.00 0.00 C ATOM 315 CZ PHE C 20 51.500 -3.984 -0.013 1.00 0.00 C ATOM 0 H PHE C 20 53.351 -4.946 -4.023 1.00 0.00 H new ATOM 0 HA PHE C 20 54.932 -2.602 -3.331 1.00 0.00 H new ATOM 0 HB2 PHE C 20 55.121 -5.610 -2.700 1.00 0.00 H new ATOM 0 HB3 PHE C 20 55.937 -4.352 -1.792 1.00 0.00 H new ATOM 0 HD1 PHE C 20 53.996 -2.219 -1.506 1.00 0.00 H new ATOM 0 HD2 PHE C 20 53.352 -6.465 -1.427 1.00 0.00 H new ATOM 0 HE1 PHE C 20 51.954 -1.883 -0.140 1.00 0.00 H new ATOM 0 HE2 PHE C 20 51.308 -6.129 -0.063 1.00 0.00 H new ATOM 0 HZ PHE C 20 50.611 -3.838 0.582 1.00 0.00 H new ATOM 325 N LYS C 21 56.276 -4.742 -5.366 1.00 0.00 N ATOM 326 CA LYS C 21 57.487 -4.938 -6.214 1.00 0.00 C ATOM 327 C LYS C 21 57.764 -3.670 -7.028 1.00 0.00 C ATOM 328 O LYS C 21 58.889 -3.385 -7.388 1.00 0.00 O ATOM 329 CB LYS C 21 57.152 -6.127 -7.126 1.00 0.00 C ATOM 330 CG LYS C 21 56.351 -5.653 -8.343 1.00 0.00 C ATOM 331 CD LYS C 21 57.307 -5.397 -9.510 1.00 0.00 C ATOM 332 CE LYS C 21 56.720 -4.322 -10.427 1.00 0.00 C ATOM 333 NZ LYS C 21 55.555 -4.974 -11.085 1.00 0.00 N ATOM 0 H LYS C 21 55.499 -5.372 -5.564 1.00 0.00 H new ATOM 0 HA LYS C 21 58.384 -5.133 -5.626 1.00 0.00 H new ATOM 0 HB2 LYS C 21 58.071 -6.613 -7.454 1.00 0.00 H new ATOM 0 HB3 LYS C 21 56.579 -6.870 -6.571 1.00 0.00 H new ATOM 0 HG2 LYS C 21 55.612 -6.404 -8.621 1.00 0.00 H new ATOM 0 HG3 LYS C 21 55.803 -4.742 -8.100 1.00 0.00 H new ATOM 0 HD2 LYS C 21 58.279 -5.078 -9.134 1.00 0.00 H new ATOM 0 HD3 LYS C 21 57.469 -6.318 -10.070 1.00 0.00 H new ATOM 0 HE2 LYS C 21 56.413 -3.444 -9.860 1.00 0.00 H new ATOM 0 HE3 LYS C 21 57.452 -3.987 -11.162 1.00 0.00 H new ATOM 0 HZ1 LYS C 21 55.266 -4.415 -11.913 1.00 0.00 H new ATOM 0 HZ2 LYS C 21 55.820 -5.932 -11.390 1.00 0.00 H new ATOM 0 HZ3 LYS C 21 54.764 -5.031 -10.413 1.00 0.00 H new ATOM 347 N ALA C 22 56.747 -2.904 -7.315 1.00 0.00 N ATOM 348 CA ALA C 22 56.954 -1.653 -8.096 1.00 0.00 C ATOM 349 C ALA C 22 57.730 -0.637 -7.253 1.00 0.00 C ATOM 350 O ALA C 22 58.763 -0.141 -7.656 1.00 0.00 O ATOM 351 CB ALA C 22 55.548 -1.134 -8.404 1.00 0.00 C ATOM 0 H ALA C 22 55.782 -3.091 -7.042 1.00 0.00 H new ATOM 0 HA ALA C 22 57.529 -1.823 -9.007 1.00 0.00 H new ATOM 0 HB1 ALA C 22 55.619 -0.211 -8.979 1.00 0.00 H new ATOM 0 HB2 ALA C 22 55.003 -1.881 -8.982 1.00 0.00 H new ATOM 0 HB3 ALA C 22 55.019 -0.940 -7.471 1.00 0.00 H new ATOM 357 N ALA C 23 57.241 -0.332 -6.082 1.00 0.00 N ATOM 358 CA ALA C 23 57.954 0.645 -5.210 1.00 0.00 C ATOM 359 C ALA C 23 59.419 0.234 -5.058 1.00 0.00 C ATOM 360 O ALA C 23 60.320 0.978 -5.391 1.00 0.00 O ATOM 361 CB ALA C 23 57.235 0.572 -3.863 1.00 0.00 C ATOM 0 H ALA C 23 56.380 -0.716 -5.692 1.00 0.00 H new ATOM 0 HA ALA C 23 57.944 1.654 -5.621 1.00 0.00 H new ATOM 0 HB1 ALA C 23 57.702 1.265 -3.163 1.00 0.00 H new ATOM 0 HB2 ALA C 23 56.187 0.841 -3.995 1.00 0.00 H new ATOM 0 HB3 ALA C 23 57.302 -0.442 -3.469 1.00 0.00 H new ATOM 367 N PHE C 24 59.662 -0.949 -4.563 1.00 0.00 N ATOM 368 CA PHE C 24 61.068 -1.411 -4.395 1.00 0.00 C ATOM 369 C PHE C 24 61.884 -1.068 -5.644 1.00 0.00 C ATOM 370 O PHE C 24 62.991 -0.574 -5.557 1.00 0.00 O ATOM 371 CB PHE C 24 60.967 -2.926 -4.216 1.00 0.00 C ATOM 372 CG PHE C 24 62.335 -3.545 -4.367 1.00 0.00 C ATOM 373 CD1 PHE C 24 63.385 -3.135 -3.536 1.00 0.00 C ATOM 374 CD2 PHE C 24 62.554 -4.530 -5.337 1.00 0.00 C ATOM 375 CE1 PHE C 24 64.654 -3.710 -3.677 1.00 0.00 C ATOM 376 CE2 PHE C 24 63.823 -5.104 -5.478 1.00 0.00 C ATOM 377 CZ PHE C 24 64.872 -4.695 -4.647 1.00 0.00 C ATOM 0 H PHE C 24 58.948 -1.615 -4.268 1.00 0.00 H new ATOM 0 HA PHE C 24 61.565 -0.935 -3.550 1.00 0.00 H new ATOM 0 HB2 PHE C 24 60.557 -3.160 -3.233 1.00 0.00 H new ATOM 0 HB3 PHE C 24 60.283 -3.345 -4.954 1.00 0.00 H new ATOM 0 HD1 PHE C 24 63.216 -2.376 -2.787 1.00 0.00 H new ATOM 0 HD2 PHE C 24 61.744 -4.847 -5.977 1.00 0.00 H new ATOM 0 HE1 PHE C 24 65.464 -3.393 -3.037 1.00 0.00 H new ATOM 0 HE2 PHE C 24 63.992 -5.862 -6.228 1.00 0.00 H new ATOM 0 HZ PHE C 24 65.850 -5.140 -4.754 1.00 0.00 H new ATOM 387 N ASP C 25 61.344 -1.321 -6.806 1.00 0.00 N ATOM 388 CA ASP C 25 62.090 -1.004 -8.057 1.00 0.00 C ATOM 389 C ASP C 25 62.452 0.484 -8.087 1.00 0.00 C ATOM 390 O ASP C 25 63.588 0.851 -8.315 1.00 0.00 O ATOM 391 CB ASP C 25 61.125 -1.348 -9.193 1.00 0.00 C ATOM 392 CG ASP C 25 61.676 -2.532 -9.989 1.00 0.00 C ATOM 393 OD1 ASP C 25 62.857 -2.517 -10.294 1.00 0.00 O ATOM 394 OD2 ASP C 25 60.908 -3.434 -10.281 1.00 0.00 O ATOM 0 H ASP C 25 60.421 -1.733 -6.943 1.00 0.00 H new ATOM 0 HA ASP C 25 63.024 -1.561 -8.137 1.00 0.00 H new ATOM 0 HB2 ASP C 25 60.143 -1.593 -8.789 1.00 0.00 H new ATOM 0 HB3 ASP C 25 60.994 -0.486 -9.847 1.00 0.00 H new ATOM 399 N ILE C 26 61.496 1.343 -7.854 1.00 0.00 N ATOM 400 CA ILE C 26 61.792 2.805 -7.864 1.00 0.00 C ATOM 401 C ILE C 26 62.822 3.139 -6.781 1.00 0.00 C ATOM 402 O ILE C 26 63.688 3.970 -6.967 1.00 0.00 O ATOM 403 CB ILE C 26 60.458 3.483 -7.556 1.00 0.00 C ATOM 404 CG1 ILE C 26 59.559 3.430 -8.793 1.00 0.00 C ATOM 405 CG2 ILE C 26 60.703 4.944 -7.172 1.00 0.00 C ATOM 406 CD1 ILE C 26 58.651 2.204 -8.706 1.00 0.00 C ATOM 0 H ILE C 26 60.526 1.097 -7.658 1.00 0.00 H new ATOM 0 HA ILE C 26 62.207 3.136 -8.816 1.00 0.00 H new ATOM 0 HB ILE C 26 59.973 2.964 -6.729 1.00 0.00 H new ATOM 0 HG12 ILE C 26 58.959 4.337 -8.859 1.00 0.00 H new ATOM 0 HG13 ILE C 26 60.167 3.383 -9.697 1.00 0.00 H new ATOM 0 HG21 ILE C 26 59.751 5.427 -6.952 1.00 0.00 H new ATOM 0 HG22 ILE C 26 61.343 4.986 -6.291 1.00 0.00 H new ATOM 0 HG23 ILE C 26 61.190 5.461 -7.999 1.00 0.00 H new ATOM 0 HD11 ILE C 26 58.009 2.163 -9.586 1.00 0.00 H new ATOM 0 HD12 ILE C 26 59.261 1.302 -8.660 1.00 0.00 H new ATOM 0 HD13 ILE C 26 58.034 2.271 -7.810 1.00 0.00 H new ATOM 418 N PHE C 27 62.729 2.496 -5.649 1.00 0.00 N ATOM 419 CA PHE C 27 63.695 2.773 -4.548 1.00 0.00 C ATOM 420 C PHE C 27 65.109 2.346 -4.958 1.00 0.00 C ATOM 421 O PHE C 27 66.090 2.841 -4.440 1.00 0.00 O ATOM 422 CB PHE C 27 63.195 1.934 -3.369 1.00 0.00 C ATOM 423 CG PHE C 27 62.106 2.687 -2.636 1.00 0.00 C ATOM 424 CD1 PHE C 27 61.379 3.687 -3.293 1.00 0.00 C ATOM 425 CD2 PHE C 27 61.826 2.384 -1.298 1.00 0.00 C ATOM 426 CE1 PHE C 27 60.371 4.383 -2.613 1.00 0.00 C ATOM 427 CE2 PHE C 27 60.818 3.080 -0.618 1.00 0.00 C ATOM 428 CZ PHE C 27 60.091 4.079 -1.276 1.00 0.00 C ATOM 0 H PHE C 27 62.024 1.789 -5.439 1.00 0.00 H new ATOM 0 HA PHE C 27 63.750 3.833 -4.301 1.00 0.00 H new ATOM 0 HB2 PHE C 27 62.813 0.978 -3.726 1.00 0.00 H new ATOM 0 HB3 PHE C 27 64.019 1.714 -2.690 1.00 0.00 H new ATOM 0 HD1 PHE C 27 61.595 3.922 -4.325 1.00 0.00 H new ATOM 0 HD2 PHE C 27 62.387 1.614 -0.790 1.00 0.00 H new ATOM 0 HE1 PHE C 27 59.810 5.154 -3.121 1.00 0.00 H new ATOM 0 HE2 PHE C 27 60.602 2.846 0.414 1.00 0.00 H new ATOM 0 HZ PHE C 27 59.314 4.615 -0.752 1.00 0.00 H new ATOM 438 N VAL C 28 65.221 1.434 -5.884 1.00 0.00 N ATOM 439 CA VAL C 28 66.572 0.982 -6.325 1.00 0.00 C ATOM 440 C VAL C 28 66.785 1.315 -7.804 1.00 0.00 C ATOM 441 O VAL C 28 67.594 0.705 -8.473 1.00 0.00 O ATOM 442 CB VAL C 28 66.567 -0.532 -6.118 1.00 0.00 C ATOM 443 CG1 VAL C 28 66.157 -0.853 -4.680 1.00 0.00 C ATOM 444 CG2 VAL C 28 65.571 -1.174 -7.089 1.00 0.00 C ATOM 0 H VAL C 28 64.437 0.982 -6.354 1.00 0.00 H new ATOM 0 HA VAL C 28 67.372 1.471 -5.769 1.00 0.00 H new ATOM 0 HB VAL C 28 67.566 -0.927 -6.305 1.00 0.00 H new ATOM 0 HG11 VAL C 28 66.154 -1.933 -4.535 1.00 0.00 H new ATOM 0 HG12 VAL C 28 66.865 -0.396 -3.989 1.00 0.00 H new ATOM 0 HG13 VAL C 28 65.159 -0.459 -4.490 1.00 0.00 H new ATOM 0 HG21 VAL C 28 65.566 -2.254 -6.943 1.00 0.00 H new ATOM 0 HG22 VAL C 28 64.573 -0.778 -6.902 1.00 0.00 H new ATOM 0 HG23 VAL C 28 65.865 -0.948 -8.114 1.00 0.00 H new ATOM 454 N LEU C 29 66.060 2.274 -8.319 1.00 0.00 N ATOM 455 CA LEU C 29 66.222 2.639 -9.757 1.00 0.00 C ATOM 456 C LEU C 29 67.706 2.643 -10.133 1.00 0.00 C ATOM 457 O LEU C 29 68.456 3.508 -9.728 1.00 0.00 O ATOM 458 CB LEU C 29 65.634 4.045 -9.879 1.00 0.00 C ATOM 459 CG LEU C 29 65.182 4.286 -11.321 1.00 0.00 C ATOM 460 CD1 LEU C 29 64.765 5.748 -11.489 1.00 0.00 C ATOM 461 CD2 LEU C 29 66.337 3.972 -12.276 1.00 0.00 C ATOM 0 H LEU C 29 65.365 2.818 -7.808 1.00 0.00 H new ATOM 0 HA LEU C 29 65.726 1.933 -10.422 1.00 0.00 H new ATOM 0 HB2 LEU C 29 64.790 4.158 -9.198 1.00 0.00 H new ATOM 0 HB3 LEU C 29 66.378 4.788 -9.591 1.00 0.00 H new ATOM 0 HG LEU C 29 64.335 3.639 -11.549 1.00 0.00 H new ATOM 0 HD11 LEU C 29 64.443 5.919 -12.516 1.00 0.00 H new ATOM 0 HD12 LEU C 29 63.943 5.972 -10.809 1.00 0.00 H new ATOM 0 HD13 LEU C 29 65.611 6.396 -11.261 1.00 0.00 H new ATOM 0 HD21 LEU C 29 66.016 4.143 -13.304 1.00 0.00 H new ATOM 0 HD22 LEU C 29 67.184 4.619 -12.048 1.00 0.00 H new ATOM 0 HD23 LEU C 29 66.634 2.930 -12.158 1.00 0.00 H new ATOM 473 N GLY C 30 68.136 1.677 -10.898 1.00 0.00 N ATOM 474 CA GLY C 30 69.572 1.626 -11.288 1.00 0.00 C ATOM 475 C GLY C 30 70.435 1.722 -10.029 1.00 0.00 C ATOM 476 O GLY C 30 71.355 2.511 -9.952 1.00 0.00 O ATOM 0 H GLY C 30 67.557 0.924 -11.268 1.00 0.00 H new ATOM 0 HA2 GLY C 30 69.785 0.699 -11.820 1.00 0.00 H new ATOM 0 HA3 GLY C 30 69.806 2.445 -11.968 1.00 0.00 H new ATOM 480 N ALA C 31 70.139 0.926 -9.036 1.00 0.00 N ATOM 481 CA ALA C 31 70.937 0.974 -7.776 1.00 0.00 C ATOM 482 C ALA C 31 72.158 0.055 -7.881 1.00 0.00 C ATOM 483 O ALA C 31 72.687 -0.405 -6.889 1.00 0.00 O ATOM 484 CB ALA C 31 69.986 0.478 -6.686 1.00 0.00 C ATOM 0 H ALA C 31 69.380 0.245 -9.043 1.00 0.00 H new ATOM 0 HA ALA C 31 71.313 1.975 -7.566 1.00 0.00 H new ATOM 0 HB1 ALA C 31 70.500 0.483 -5.725 1.00 0.00 H new ATOM 0 HB2 ALA C 31 69.116 1.133 -6.636 1.00 0.00 H new ATOM 0 HB3 ALA C 31 69.663 -0.537 -6.919 1.00 0.00 H new ATOM 490 N GLU C 32 72.611 -0.213 -9.075 1.00 0.00 N ATOM 491 CA GLU C 32 73.798 -1.099 -9.239 1.00 0.00 C ATOM 492 C GLU C 32 73.484 -2.511 -8.734 1.00 0.00 C ATOM 493 O GLU C 32 73.326 -3.436 -9.506 1.00 0.00 O ATOM 494 CB GLU C 32 74.891 -0.455 -8.386 1.00 0.00 C ATOM 495 CG GLU C 32 76.076 -0.072 -9.275 1.00 0.00 C ATOM 496 CD GLU C 32 76.831 -1.336 -9.692 1.00 0.00 C ATOM 497 OE1 GLU C 32 76.320 -2.057 -10.534 1.00 0.00 O ATOM 498 OE2 GLU C 32 77.907 -1.562 -9.162 1.00 0.00 O ATOM 0 H GLU C 32 72.211 0.143 -9.943 1.00 0.00 H new ATOM 0 HA GLU C 32 74.098 -1.198 -10.282 1.00 0.00 H new ATOM 0 HB2 GLU C 32 74.500 0.429 -7.883 1.00 0.00 H new ATOM 0 HB3 GLU C 32 75.215 -1.147 -7.609 1.00 0.00 H new ATOM 0 HG2 GLU C 32 75.724 0.462 -10.158 1.00 0.00 H new ATOM 0 HG3 GLU C 32 76.743 0.603 -8.739 1.00 0.00 H new ATOM 505 N ASP C 33 73.394 -2.682 -7.443 1.00 0.00 N ATOM 506 CA ASP C 33 73.093 -4.034 -6.890 1.00 0.00 C ATOM 507 C ASP C 33 71.580 -4.281 -6.884 1.00 0.00 C ATOM 508 O ASP C 33 71.126 -5.407 -6.898 1.00 0.00 O ATOM 509 CB ASP C 33 73.637 -4.008 -5.461 1.00 0.00 C ATOM 510 CG ASP C 33 73.677 -5.432 -4.904 1.00 0.00 C ATOM 511 OD1 ASP C 33 72.622 -5.947 -4.572 1.00 0.00 O ATOM 512 OD2 ASP C 33 74.762 -5.983 -4.816 1.00 0.00 O ATOM 0 H ASP C 33 73.516 -1.945 -6.748 1.00 0.00 H new ATOM 0 HA ASP C 33 73.542 -4.831 -7.483 1.00 0.00 H new ATOM 0 HB2 ASP C 33 74.636 -3.573 -5.449 1.00 0.00 H new ATOM 0 HB3 ASP C 33 73.008 -3.378 -4.832 1.00 0.00 H new ATOM 517 N GLY C 34 70.799 -3.235 -6.864 1.00 0.00 N ATOM 518 CA GLY C 34 69.319 -3.411 -6.858 1.00 0.00 C ATOM 519 C GLY C 34 68.786 -3.222 -5.437 1.00 0.00 C ATOM 520 O GLY C 34 67.724 -3.701 -5.092 1.00 0.00 O ATOM 0 H GLY C 34 71.122 -2.267 -6.852 1.00 0.00 H new ATOM 0 HA2 GLY C 34 68.854 -2.690 -7.531 1.00 0.00 H new ATOM 0 HA3 GLY C 34 69.059 -4.404 -7.226 1.00 0.00 H new ATOM 524 N CYS C 35 69.515 -2.527 -4.607 1.00 0.00 N ATOM 525 CA CYS C 35 69.048 -2.308 -3.208 1.00 0.00 C ATOM 526 C CYS C 35 68.738 -0.825 -2.986 1.00 0.00 C ATOM 527 O CYS C 35 68.499 -0.087 -3.921 1.00 0.00 O ATOM 528 CB CYS C 35 70.213 -2.751 -2.324 1.00 0.00 C ATOM 529 SG CYS C 35 71.712 -1.857 -2.803 1.00 0.00 S ATOM 0 H CYS C 35 70.413 -2.102 -4.837 1.00 0.00 H new ATOM 0 HA CYS C 35 68.137 -2.863 -2.984 1.00 0.00 H new ATOM 0 HB2 CYS C 35 69.982 -2.558 -1.276 1.00 0.00 H new ATOM 0 HB3 CYS C 35 70.370 -3.825 -2.423 1.00 0.00 H new ATOM 0 HG CYS C 35 72.701 -2.233 -2.049 1.00 0.00 H new ATOM 535 N ILE C 36 68.739 -0.382 -1.758 1.00 0.00 N ATOM 536 CA ILE C 36 68.443 1.055 -1.493 1.00 0.00 C ATOM 537 C ILE C 36 69.564 1.696 -0.676 1.00 0.00 C ATOM 538 O ILE C 36 70.311 1.032 0.016 1.00 0.00 O ATOM 539 CB ILE C 36 67.140 1.062 -0.697 1.00 0.00 C ATOM 540 CG1 ILE C 36 66.088 0.228 -1.430 1.00 0.00 C ATOM 541 CG2 ILE C 36 66.641 2.502 -0.557 1.00 0.00 C ATOM 542 CD1 ILE C 36 64.815 0.153 -0.585 1.00 0.00 C ATOM 0 H ILE C 36 68.931 -0.949 -0.932 1.00 0.00 H new ATOM 0 HA ILE C 36 68.360 1.624 -2.419 1.00 0.00 H new ATOM 0 HB ILE C 36 67.314 0.637 0.291 1.00 0.00 H new ATOM 0 HG12 ILE C 36 65.867 0.673 -2.400 1.00 0.00 H new ATOM 0 HG13 ILE C 36 66.471 -0.775 -1.619 1.00 0.00 H new ATOM 0 HG21 ILE C 36 65.711 2.511 0.011 1.00 0.00 H new ATOM 0 HG22 ILE C 36 67.390 3.098 -0.036 1.00 0.00 H new ATOM 0 HG23 ILE C 36 66.466 2.924 -1.547 1.00 0.00 H new ATOM 0 HD11 ILE C 36 64.066 -0.441 -1.108 1.00 0.00 H new ATOM 0 HD12 ILE C 36 65.042 -0.312 0.374 1.00 0.00 H new ATOM 0 HD13 ILE C 36 64.429 1.159 -0.419 1.00 0.00 H new ATOM 554 N SER C 37 69.677 2.990 -0.753 1.00 0.00 N ATOM 555 CA SER C 37 70.735 3.708 0.010 1.00 0.00 C ATOM 556 C SER C 37 70.323 5.169 0.175 1.00 0.00 C ATOM 557 O SER C 37 71.149 6.052 0.266 1.00 0.00 O ATOM 558 CB SER C 37 71.980 3.607 -0.860 1.00 0.00 C ATOM 559 OG SER C 37 72.807 2.554 -0.381 1.00 0.00 O ATOM 0 H SER C 37 69.075 3.589 -1.318 1.00 0.00 H new ATOM 0 HA SER C 37 70.900 3.292 1.004 1.00 0.00 H new ATOM 0 HB2 SER C 37 71.699 3.420 -1.896 1.00 0.00 H new ATOM 0 HB3 SER C 37 72.527 4.550 -0.843 1.00 0.00 H new ATOM 0 HG SER C 37 72.810 2.561 0.599 1.00 0.00 H new ATOM 565 N THR C 38 69.042 5.415 0.184 1.00 0.00 N ATOM 566 CA THR C 38 68.516 6.812 0.311 1.00 0.00 C ATOM 567 C THR C 38 68.752 7.566 -0.998 1.00 0.00 C ATOM 568 O THR C 38 67.837 8.120 -1.576 1.00 0.00 O ATOM 569 CB THR C 38 69.269 7.478 1.475 1.00 0.00 C ATOM 570 OG1 THR C 38 70.454 8.094 0.991 1.00 0.00 O ATOM 571 CG2 THR C 38 69.623 6.440 2.545 1.00 0.00 C ATOM 0 H THR C 38 68.322 4.697 0.108 1.00 0.00 H new ATOM 0 HA THR C 38 67.444 6.819 0.509 1.00 0.00 H new ATOM 0 HB THR C 38 68.625 8.235 1.922 1.00 0.00 H new ATOM 0 HG1 THR C 38 71.166 7.424 0.920 1.00 0.00 H new ATOM 0 HG21 THR C 38 70.156 6.927 3.362 1.00 0.00 H new ATOM 0 HG22 THR C 38 68.709 5.985 2.927 1.00 0.00 H new ATOM 0 HG23 THR C 38 70.257 5.668 2.108 1.00 0.00 H new ATOM 579 N LYS C 39 69.964 7.580 -1.488 1.00 0.00 N ATOM 580 CA LYS C 39 70.225 8.287 -2.772 1.00 0.00 C ATOM 581 C LYS C 39 69.156 7.886 -3.791 1.00 0.00 C ATOM 582 O LYS C 39 68.762 8.670 -4.631 1.00 0.00 O ATOM 583 CB LYS C 39 71.612 7.818 -3.221 1.00 0.00 C ATOM 584 CG LYS C 39 71.679 6.290 -3.199 1.00 0.00 C ATOM 585 CD LYS C 39 73.062 5.848 -2.713 1.00 0.00 C ATOM 586 CE LYS C 39 74.141 6.569 -3.524 1.00 0.00 C ATOM 587 NZ LYS C 39 75.295 5.626 -3.549 1.00 0.00 N ATOM 0 H LYS C 39 70.776 7.137 -1.058 1.00 0.00 H new ATOM 0 HA LYS C 39 70.192 9.372 -2.672 1.00 0.00 H new ATOM 0 HB2 LYS C 39 71.822 8.185 -4.226 1.00 0.00 H new ATOM 0 HB3 LYS C 39 72.376 8.233 -2.564 1.00 0.00 H new ATOM 0 HG2 LYS C 39 70.906 5.891 -2.542 1.00 0.00 H new ATOM 0 HG3 LYS C 39 71.487 5.892 -4.196 1.00 0.00 H new ATOM 0 HD2 LYS C 39 73.176 6.074 -1.653 1.00 0.00 H new ATOM 0 HD3 LYS C 39 73.170 4.769 -2.822 1.00 0.00 H new ATOM 0 HE2 LYS C 39 73.793 6.795 -4.532 1.00 0.00 H new ATOM 0 HE3 LYS C 39 74.415 7.517 -3.062 1.00 0.00 H new ATOM 0 HZ1 LYS C 39 76.077 6.049 -4.088 1.00 0.00 H new ATOM 0 HZ2 LYS C 39 75.608 5.435 -2.576 1.00 0.00 H new ATOM 0 HZ3 LYS C 39 75.006 4.735 -4.001 1.00 0.00 H new ATOM 601 N GLU C 40 68.668 6.676 -3.709 1.00 0.00 N ATOM 602 CA GLU C 40 67.607 6.236 -4.657 1.00 0.00 C ATOM 603 C GLU C 40 66.239 6.483 -4.025 1.00 0.00 C ATOM 604 O GLU C 40 65.236 6.601 -4.700 1.00 0.00 O ATOM 605 CB GLU C 40 67.830 4.735 -4.857 1.00 0.00 C ATOM 606 CG GLU C 40 69.289 4.463 -5.224 1.00 0.00 C ATOM 607 CD GLU C 40 69.570 4.970 -6.641 1.00 0.00 C ATOM 608 OE1 GLU C 40 68.888 5.886 -7.069 1.00 0.00 O ATOM 609 OE2 GLU C 40 70.465 4.433 -7.272 1.00 0.00 O ATOM 0 H GLU C 40 68.959 5.976 -3.027 1.00 0.00 H new ATOM 0 HA GLU C 40 67.646 6.775 -5.604 1.00 0.00 H new ATOM 0 HB2 GLU C 40 67.570 4.197 -3.946 1.00 0.00 H new ATOM 0 HB3 GLU C 40 67.174 4.364 -5.644 1.00 0.00 H new ATOM 0 HG2 GLU C 40 69.951 4.958 -4.513 1.00 0.00 H new ATOM 0 HG3 GLU C 40 69.496 3.395 -5.162 1.00 0.00 H new ATOM 616 N LEU C 41 66.199 6.558 -2.724 1.00 0.00 N ATOM 617 CA LEU C 41 64.910 6.794 -2.021 1.00 0.00 C ATOM 618 C LEU C 41 64.571 8.288 -2.022 1.00 0.00 C ATOM 619 O LEU C 41 63.573 8.709 -2.574 1.00 0.00 O ATOM 620 CB LEU C 41 65.153 6.294 -0.597 1.00 0.00 C ATOM 621 CG LEU C 41 63.817 5.967 0.063 1.00 0.00 C ATOM 622 CD1 LEU C 41 62.887 7.171 -0.061 1.00 0.00 C ATOM 623 CD2 LEU C 41 63.187 4.759 -0.634 1.00 0.00 C ATOM 0 H LEU C 41 67.011 6.465 -2.114 1.00 0.00 H new ATOM 0 HA LEU C 41 64.073 6.285 -2.498 1.00 0.00 H new ATOM 0 HB2 LEU C 41 65.788 5.408 -0.615 1.00 0.00 H new ATOM 0 HB3 LEU C 41 65.680 7.053 -0.019 1.00 0.00 H new ATOM 0 HG LEU C 41 63.975 5.735 1.116 1.00 0.00 H new ATOM 0 HD11 LEU C 41 61.931 6.942 0.409 1.00 0.00 H new ATOM 0 HD12 LEU C 41 63.338 8.031 0.434 1.00 0.00 H new ATOM 0 HD13 LEU C 41 62.727 7.401 -1.115 1.00 0.00 H new ATOM 0 HD21 LEU C 41 62.232 4.524 -0.163 1.00 0.00 H new ATOM 0 HD22 LEU C 41 63.025 4.990 -1.687 1.00 0.00 H new ATOM 0 HD23 LEU C 41 63.854 3.901 -0.549 1.00 0.00 H new ATOM 635 N GLY C 42 65.396 9.092 -1.408 1.00 0.00 N ATOM 636 CA GLY C 42 65.122 10.558 -1.372 1.00 0.00 C ATOM 637 C GLY C 42 64.701 11.038 -2.761 1.00 0.00 C ATOM 638 O GLY C 42 63.955 11.987 -2.902 1.00 0.00 O ATOM 0 H GLY C 42 66.248 8.798 -0.930 1.00 0.00 H new ATOM 0 HA2 GLY C 42 64.336 10.773 -0.649 1.00 0.00 H new ATOM 0 HA3 GLY C 42 66.012 11.096 -1.045 1.00 0.00 H new ATOM 642 N LYS C 43 65.175 10.392 -3.791 1.00 0.00 N ATOM 643 CA LYS C 43 64.806 10.811 -5.174 1.00 0.00 C ATOM 644 C LYS C 43 63.284 10.861 -5.327 1.00 0.00 C ATOM 645 O LYS C 43 62.748 11.720 -6.000 1.00 0.00 O ATOM 646 CB LYS C 43 65.403 9.739 -6.085 1.00 0.00 C ATOM 647 CG LYS C 43 66.339 10.395 -7.103 1.00 0.00 C ATOM 648 CD LYS C 43 67.489 9.444 -7.428 1.00 0.00 C ATOM 649 CE LYS C 43 68.822 10.171 -7.243 1.00 0.00 C ATOM 650 NZ LYS C 43 69.767 9.488 -8.168 1.00 0.00 N ATOM 0 H LYS C 43 65.803 9.590 -3.735 1.00 0.00 H new ATOM 0 HA LYS C 43 65.179 11.806 -5.416 1.00 0.00 H new ATOM 0 HB2 LYS C 43 65.950 9.007 -5.492 1.00 0.00 H new ATOM 0 HB3 LYS C 43 64.607 9.201 -6.601 1.00 0.00 H new ATOM 0 HG2 LYS C 43 65.789 10.641 -8.012 1.00 0.00 H new ATOM 0 HG3 LYS C 43 66.729 11.331 -6.703 1.00 0.00 H new ATOM 0 HD2 LYS C 43 67.446 8.570 -6.778 1.00 0.00 H new ATOM 0 HD3 LYS C 43 67.398 9.084 -8.453 1.00 0.00 H new ATOM 0 HE2 LYS C 43 68.730 11.230 -7.484 1.00 0.00 H new ATOM 0 HE3 LYS C 43 69.166 10.108 -6.211 1.00 0.00 H new ATOM 0 HZ1 LYS C 43 70.705 9.932 -8.097 1.00 0.00 H new ATOM 0 HZ2 LYS C 43 69.840 8.483 -7.910 1.00 0.00 H new ATOM 0 HZ3 LYS C 43 69.418 9.571 -9.144 1.00 0.00 H new ATOM 664 N VAL C 44 62.583 9.951 -4.710 1.00 0.00 N ATOM 665 CA VAL C 44 61.099 9.957 -4.827 1.00 0.00 C ATOM 666 C VAL C 44 60.492 10.889 -3.777 1.00 0.00 C ATOM 667 O VAL C 44 59.453 11.483 -3.988 1.00 0.00 O ATOM 668 CB VAL C 44 60.672 8.514 -4.573 1.00 0.00 C ATOM 669 CG1 VAL C 44 59.161 8.467 -4.345 1.00 0.00 C ATOM 670 CG2 VAL C 44 61.032 7.655 -5.787 1.00 0.00 C ATOM 0 H VAL C 44 62.972 9.206 -4.132 1.00 0.00 H new ATOM 0 HA VAL C 44 60.764 10.313 -5.801 1.00 0.00 H new ATOM 0 HB VAL C 44 61.186 8.130 -3.692 1.00 0.00 H new ATOM 0 HG11 VAL C 44 58.852 7.438 -4.163 1.00 0.00 H new ATOM 0 HG12 VAL C 44 58.904 9.081 -3.482 1.00 0.00 H new ATOM 0 HG13 VAL C 44 58.648 8.849 -5.227 1.00 0.00 H new ATOM 0 HG21 VAL C 44 60.727 6.624 -5.606 1.00 0.00 H new ATOM 0 HG22 VAL C 44 60.517 8.037 -6.668 1.00 0.00 H new ATOM 0 HG23 VAL C 44 62.109 7.692 -5.952 1.00 0.00 H new ATOM 680 N MET C 45 61.131 11.022 -2.646 1.00 0.00 N ATOM 681 CA MET C 45 60.587 11.920 -1.586 1.00 0.00 C ATOM 682 C MET C 45 60.091 13.223 -2.215 1.00 0.00 C ATOM 683 O MET C 45 58.938 13.584 -2.089 1.00 0.00 O ATOM 684 CB MET C 45 61.764 12.185 -0.647 1.00 0.00 C ATOM 685 CG MET C 45 62.132 10.893 0.083 1.00 0.00 C ATOM 686 SD MET C 45 60.691 10.274 0.984 1.00 0.00 S ATOM 687 CE MET C 45 60.143 9.080 -0.261 1.00 0.00 C ATOM 0 H MET C 45 62.004 10.549 -2.410 1.00 0.00 H new ATOM 0 HA MET C 45 59.742 11.479 -1.057 1.00 0.00 H new ATOM 0 HB2 MET C 45 62.620 12.552 -1.213 1.00 0.00 H new ATOM 0 HB3 MET C 45 61.502 12.960 0.073 1.00 0.00 H new ATOM 0 HG2 MET C 45 62.476 10.145 -0.631 1.00 0.00 H new ATOM 0 HG3 MET C 45 62.955 11.076 0.774 1.00 0.00 H new ATOM 0 HE1 MET C 45 59.265 9.469 -0.777 1.00 0.00 H new ATOM 0 HE2 MET C 45 60.943 8.913 -0.982 1.00 0.00 H new ATOM 0 HE3 MET C 45 59.890 8.138 0.225 1.00 0.00 H new ATOM 697 N ARG C 46 60.951 13.928 -2.900 1.00 0.00 N ATOM 698 CA ARG C 46 60.519 15.199 -3.544 1.00 0.00 C ATOM 699 C ARG C 46 59.428 14.906 -4.575 1.00 0.00 C ATOM 700 O ARG C 46 58.676 15.776 -4.967 1.00 0.00 O ATOM 701 CB ARG C 46 61.772 15.747 -4.229 1.00 0.00 C ATOM 702 CG ARG C 46 62.322 16.927 -3.425 1.00 0.00 C ATOM 703 CD ARG C 46 62.048 18.230 -4.180 1.00 0.00 C ATOM 704 NE ARG C 46 63.223 18.408 -5.079 1.00 0.00 N ATOM 705 CZ ARG C 46 64.004 19.442 -4.935 1.00 0.00 C ATOM 706 NH1 ARG C 46 63.497 20.644 -4.915 1.00 0.00 N ATOM 707 NH2 ARG C 46 65.293 19.276 -4.811 1.00 0.00 N ATOM 0 H ARG C 46 61.930 13.679 -3.040 1.00 0.00 H new ATOM 0 HA ARG C 46 60.108 15.912 -2.829 1.00 0.00 H new ATOM 0 HB2 ARG C 46 62.527 14.965 -4.308 1.00 0.00 H new ATOM 0 HB3 ARG C 46 61.534 16.065 -5.244 1.00 0.00 H new ATOM 0 HG2 ARG C 46 61.855 16.959 -2.441 1.00 0.00 H new ATOM 0 HG3 ARG C 46 63.393 16.805 -3.266 1.00 0.00 H new ATOM 0 HD2 ARG C 46 61.121 18.169 -4.750 1.00 0.00 H new ATOM 0 HD3 ARG C 46 61.945 19.070 -3.493 1.00 0.00 H new ATOM 0 HE ARG C 46 63.416 17.721 -5.807 1.00 0.00 H new ATOM 0 HH11 ARG C 46 62.490 20.774 -5.012 1.00 0.00 H new ATOM 0 HH12 ARG C 46 64.108 21.453 -4.802 1.00 0.00 H new ATOM 0 HH21 ARG C 46 65.690 18.337 -4.827 1.00 0.00 H new ATOM 0 HH22 ARG C 46 65.903 20.086 -4.698 1.00 0.00 H new ATOM 721 N MET C 47 59.337 13.679 -5.013 1.00 0.00 N ATOM 722 CA MET C 47 58.295 13.319 -6.016 1.00 0.00 C ATOM 723 C MET C 47 56.938 13.146 -5.328 1.00 0.00 C ATOM 724 O MET C 47 55.917 13.564 -5.838 1.00 0.00 O ATOM 725 CB MET C 47 58.765 11.993 -6.617 1.00 0.00 C ATOM 726 CG MET C 47 58.776 12.100 -8.143 1.00 0.00 C ATOM 727 SD MET C 47 57.246 11.398 -8.808 1.00 0.00 S ATOM 728 CE MET C 47 57.622 9.662 -8.466 1.00 0.00 C ATOM 0 H MET C 47 59.940 12.910 -4.719 1.00 0.00 H new ATOM 0 HA MET C 47 58.170 14.089 -6.777 1.00 0.00 H new ATOM 0 HB2 MET C 47 59.763 11.749 -6.252 1.00 0.00 H new ATOM 0 HB3 MET C 47 58.104 11.185 -6.303 1.00 0.00 H new ATOM 0 HG2 MET C 47 58.871 13.143 -8.444 1.00 0.00 H new ATOM 0 HG3 MET C 47 59.638 11.571 -8.549 1.00 0.00 H new ATOM 0 HE1 MET C 47 56.895 9.026 -8.972 1.00 0.00 H new ATOM 0 HE2 MET C 47 58.623 9.428 -8.828 1.00 0.00 H new ATOM 0 HE3 MET C 47 57.574 9.484 -7.392 1.00 0.00 H new ATOM 738 N LEU C 48 56.915 12.535 -4.172 1.00 0.00 N ATOM 739 CA LEU C 48 55.618 12.344 -3.460 1.00 0.00 C ATOM 740 C LEU C 48 55.195 13.646 -2.775 1.00 0.00 C ATOM 741 O LEU C 48 54.046 13.830 -2.426 1.00 0.00 O ATOM 742 CB LEU C 48 55.875 11.250 -2.421 1.00 0.00 C ATOM 743 CG LEU C 48 56.532 10.038 -3.086 1.00 0.00 C ATOM 744 CD1 LEU C 48 57.197 9.175 -2.012 1.00 0.00 C ATOM 745 CD2 LEU C 48 55.471 9.207 -3.817 1.00 0.00 C ATOM 0 H LEU C 48 57.734 12.162 -3.693 1.00 0.00 H new ATOM 0 HA LEU C 48 54.816 12.066 -4.144 1.00 0.00 H new ATOM 0 HB2 LEU C 48 56.518 11.633 -1.629 1.00 0.00 H new ATOM 0 HB3 LEU C 48 54.936 10.954 -1.953 1.00 0.00 H new ATOM 0 HG LEU C 48 57.278 10.380 -3.803 1.00 0.00 H new ATOM 0 HD11 LEU C 48 57.667 8.310 -2.480 1.00 0.00 H new ATOM 0 HD12 LEU C 48 57.954 9.761 -1.491 1.00 0.00 H new ATOM 0 HD13 LEU C 48 56.445 8.838 -1.299 1.00 0.00 H new ATOM 0 HD21 LEU C 48 55.945 8.346 -4.288 1.00 0.00 H new ATOM 0 HD22 LEU C 48 54.722 8.864 -3.103 1.00 0.00 H new ATOM 0 HD23 LEU C 48 54.991 9.820 -4.580 1.00 0.00 H new ATOM 757 N GLY C 49 56.114 14.552 -2.581 1.00 0.00 N ATOM 758 CA GLY C 49 55.759 15.840 -1.920 1.00 0.00 C ATOM 759 C GLY C 49 56.501 15.955 -0.588 1.00 0.00 C ATOM 760 O GLY C 49 56.047 16.609 0.332 1.00 0.00 O ATOM 0 H GLY C 49 57.093 14.457 -2.851 1.00 0.00 H new ATOM 0 HA2 GLY C 49 56.021 16.677 -2.567 1.00 0.00 H new ATOM 0 HA3 GLY C 49 54.683 15.891 -1.754 1.00 0.00 H new ATOM 764 N GLN C 50 57.638 15.326 -0.472 1.00 0.00 N ATOM 765 CA GLN C 50 58.407 15.402 0.803 1.00 0.00 C ATOM 766 C GLN C 50 59.911 15.419 0.513 1.00 0.00 C ATOM 767 O GLN C 50 60.334 15.329 -0.623 1.00 0.00 O ATOM 768 CB GLN C 50 58.019 14.140 1.573 1.00 0.00 C ATOM 769 CG GLN C 50 56.522 14.175 1.889 1.00 0.00 C ATOM 770 CD GLN C 50 56.216 15.381 2.777 1.00 0.00 C ATOM 771 OE1 GLN C 50 55.280 16.114 2.526 1.00 0.00 O ATOM 772 NE2 GLN C 50 56.971 15.620 3.814 1.00 0.00 N ATOM 0 H GLN C 50 58.068 14.762 -1.205 1.00 0.00 H new ATOM 0 HA GLN C 50 58.185 16.307 1.368 1.00 0.00 H new ATOM 0 HB2 GLN C 50 58.257 13.254 0.984 1.00 0.00 H new ATOM 0 HB3 GLN C 50 58.595 14.073 2.496 1.00 0.00 H new ATOM 0 HG2 GLN C 50 55.946 14.235 0.966 1.00 0.00 H new ATOM 0 HG3 GLN C 50 56.224 13.255 2.392 1.00 0.00 H new ATOM 0 HE21 GLN C 50 57.757 15.005 4.025 1.00 0.00 H new ATOM 0 HE22 GLN C 50 56.775 16.422 4.413 1.00 0.00 H new ATOM 781 N ASN C 51 60.722 15.536 1.530 1.00 0.00 N ATOM 782 CA ASN C 51 62.197 15.561 1.307 1.00 0.00 C ATOM 783 C ASN C 51 62.938 15.397 2.637 1.00 0.00 C ATOM 784 O ASN C 51 63.247 16.367 3.300 1.00 0.00 O ATOM 785 CB ASN C 51 62.479 16.937 0.701 1.00 0.00 C ATOM 786 CG ASN C 51 63.984 17.100 0.478 1.00 0.00 C ATOM 787 OD1 ASN C 51 64.643 17.821 1.202 1.00 0.00 O ATOM 788 ND2 ASN C 51 64.561 16.457 -0.500 1.00 0.00 N ATOM 0 H ASN C 51 60.428 15.615 2.504 1.00 0.00 H new ATOM 0 HA ASN C 51 62.531 14.752 0.658 1.00 0.00 H new ATOM 0 HB2 ASN C 51 61.947 17.045 -0.244 1.00 0.00 H new ATOM 0 HB3 ASN C 51 62.112 17.720 1.365 1.00 0.00 H new ATOM 0 HD21 ASN C 51 65.564 16.560 -0.656 1.00 0.00 H new ATOM 0 HD22 ASN C 51 64.009 15.852 -1.108 1.00 0.00 H new ATOM 795 N PRO C 52 63.195 14.165 2.982 1.00 0.00 N ATOM 796 CA PRO C 52 63.907 13.857 4.245 1.00 0.00 C ATOM 797 C PRO C 52 65.410 14.115 4.096 1.00 0.00 C ATOM 798 O PRO C 52 65.993 13.861 3.060 1.00 0.00 O ATOM 799 CB PRO C 52 63.636 12.370 4.453 1.00 0.00 C ATOM 800 CG PRO C 52 63.369 11.822 3.084 1.00 0.00 C ATOM 801 CD PRO C 52 62.848 12.954 2.232 1.00 0.00 C ATOM 0 HA PRO C 52 63.575 14.472 5.081 1.00 0.00 H new ATOM 0 HB2 PRO C 52 64.490 11.875 4.915 1.00 0.00 H new ATOM 0 HB3 PRO C 52 62.782 12.214 5.113 1.00 0.00 H new ATOM 0 HG2 PRO C 52 64.280 11.407 2.653 1.00 0.00 H new ATOM 0 HG3 PRO C 52 62.641 11.012 3.131 1.00 0.00 H new ATOM 0 HD2 PRO C 52 63.309 12.953 1.244 1.00 0.00 H new ATOM 0 HD3 PRO C 52 61.771 12.875 2.081 1.00 0.00 H new ATOM 809 N THR C 53 66.042 14.613 5.124 1.00 0.00 N ATOM 810 CA THR C 53 67.507 14.882 5.043 1.00 0.00 C ATOM 811 C THR C 53 68.280 13.566 4.911 1.00 0.00 C ATOM 812 O THR C 53 67.703 12.499 4.962 1.00 0.00 O ATOM 813 CB THR C 53 67.852 15.581 6.359 1.00 0.00 C ATOM 814 OG1 THR C 53 66.813 15.356 7.303 1.00 0.00 O ATOM 815 CG2 THR C 53 68.003 17.083 6.115 1.00 0.00 C ATOM 0 H THR C 53 65.607 14.845 6.017 1.00 0.00 H new ATOM 0 HA THR C 53 67.770 15.490 4.178 1.00 0.00 H new ATOM 0 HB THR C 53 68.788 15.180 6.748 1.00 0.00 H new ATOM 0 HG1 THR C 53 66.177 16.101 7.273 1.00 0.00 H new ATOM 0 HG21 THR C 53 68.249 17.581 7.053 1.00 0.00 H new ATOM 0 HG22 THR C 53 68.801 17.256 5.392 1.00 0.00 H new ATOM 0 HG23 THR C 53 67.067 17.484 5.726 1.00 0.00 H new ATOM 823 N PRO C 54 69.571 13.690 4.746 1.00 0.00 N ATOM 824 CA PRO C 54 70.440 12.495 4.603 1.00 0.00 C ATOM 825 C PRO C 54 70.547 11.743 5.934 1.00 0.00 C ATOM 826 O PRO C 54 70.961 10.602 5.980 1.00 0.00 O ATOM 827 CB PRO C 54 71.790 13.083 4.198 1.00 0.00 C ATOM 828 CG PRO C 54 71.771 14.483 4.717 1.00 0.00 C ATOM 829 CD PRO C 54 70.336 14.941 4.676 1.00 0.00 C ATOM 0 HA PRO C 54 70.060 11.773 3.881 1.00 0.00 H new ATOM 0 HB2 PRO C 54 72.614 12.513 4.628 1.00 0.00 H new ATOM 0 HB3 PRO C 54 71.920 13.065 3.116 1.00 0.00 H new ATOM 0 HG2 PRO C 54 72.161 14.524 5.734 1.00 0.00 H new ATOM 0 HG3 PRO C 54 72.401 15.130 4.107 1.00 0.00 H new ATOM 0 HD2 PRO C 54 70.102 15.601 5.511 1.00 0.00 H new ATOM 0 HD3 PRO C 54 70.118 15.494 3.762 1.00 0.00 H new ATOM 837 N GLU C 55 70.176 12.371 7.016 1.00 0.00 N ATOM 838 CA GLU C 55 70.257 11.686 8.339 1.00 0.00 C ATOM 839 C GLU C 55 69.019 10.811 8.556 1.00 0.00 C ATOM 840 O GLU C 55 69.119 9.633 8.838 1.00 0.00 O ATOM 841 CB GLU C 55 70.300 12.811 9.371 1.00 0.00 C ATOM 842 CG GLU C 55 71.417 13.792 9.012 1.00 0.00 C ATOM 843 CD GLU C 55 71.331 15.016 9.925 1.00 0.00 C ATOM 844 OE1 GLU C 55 71.411 14.839 11.129 1.00 0.00 O ATOM 845 OE2 GLU C 55 71.185 16.110 9.403 1.00 0.00 O ATOM 0 H GLU C 55 69.821 13.327 7.042 1.00 0.00 H new ATOM 0 HA GLU C 55 71.128 11.034 8.411 1.00 0.00 H new ATOM 0 HB2 GLU C 55 69.342 13.330 9.399 1.00 0.00 H new ATOM 0 HB3 GLU C 55 70.469 12.399 10.366 1.00 0.00 H new ATOM 0 HG2 GLU C 55 72.388 13.310 9.122 1.00 0.00 H new ATOM 0 HG3 GLU C 55 71.328 14.096 7.969 1.00 0.00 H new ATOM 852 N GLU C 56 67.853 11.380 8.429 1.00 0.00 N ATOM 853 CA GLU C 56 66.605 10.587 8.629 1.00 0.00 C ATOM 854 C GLU C 56 66.422 9.593 7.480 1.00 0.00 C ATOM 855 O GLU C 56 65.802 8.559 7.635 1.00 0.00 O ATOM 856 CB GLU C 56 65.479 11.619 8.629 1.00 0.00 C ATOM 857 CG GLU C 56 64.572 11.390 9.839 1.00 0.00 C ATOM 858 CD GLU C 56 65.184 12.062 11.070 1.00 0.00 C ATOM 859 OE1 GLU C 56 66.352 12.412 11.011 1.00 0.00 O ATOM 860 OE2 GLU C 56 64.475 12.215 12.051 1.00 0.00 O ATOM 0 H GLU C 56 67.709 12.362 8.195 1.00 0.00 H new ATOM 0 HA GLU C 56 66.626 10.006 9.551 1.00 0.00 H new ATOM 0 HB2 GLU C 56 65.895 12.626 8.659 1.00 0.00 H new ATOM 0 HB3 GLU C 56 64.901 11.541 7.708 1.00 0.00 H new ATOM 0 HG2 GLU C 56 63.580 11.797 9.645 1.00 0.00 H new ATOM 0 HG3 GLU C 56 64.449 10.322 10.018 1.00 0.00 H new ATOM 867 N LEU C 57 66.953 9.898 6.328 1.00 0.00 N ATOM 868 CA LEU C 57 66.805 8.970 5.171 1.00 0.00 C ATOM 869 C LEU C 57 67.295 7.569 5.550 1.00 0.00 C ATOM 870 O LEU C 57 66.579 6.596 5.423 1.00 0.00 O ATOM 871 CB LEU C 57 67.683 9.567 4.071 1.00 0.00 C ATOM 872 CG LEU C 57 66.814 9.950 2.874 1.00 0.00 C ATOM 873 CD1 LEU C 57 67.703 10.468 1.742 1.00 0.00 C ATOM 874 CD2 LEU C 57 66.040 8.721 2.391 1.00 0.00 C ATOM 0 H LEU C 57 67.483 10.749 6.138 1.00 0.00 H new ATOM 0 HA LEU C 57 65.767 8.867 4.853 1.00 0.00 H new ATOM 0 HB2 LEU C 57 68.209 10.445 4.447 1.00 0.00 H new ATOM 0 HB3 LEU C 57 68.442 8.847 3.767 1.00 0.00 H new ATOM 0 HG LEU C 57 66.112 10.729 3.171 1.00 0.00 H new ATOM 0 HD11 LEU C 57 67.083 10.741 0.888 1.00 0.00 H new ATOM 0 HD12 LEU C 57 68.255 11.343 2.084 1.00 0.00 H new ATOM 0 HD13 LEU C 57 68.406 9.689 1.446 1.00 0.00 H new ATOM 0 HD21 LEU C 57 65.420 8.994 1.537 1.00 0.00 H new ATOM 0 HD22 LEU C 57 66.742 7.942 2.095 1.00 0.00 H new ATOM 0 HD23 LEU C 57 65.406 8.351 3.196 1.00 0.00 H new ATOM 886 N GLN C 58 68.511 7.460 6.011 1.00 0.00 N ATOM 887 CA GLN C 58 69.047 6.122 6.394 1.00 0.00 C ATOM 888 C GLN C 58 68.070 5.409 7.333 1.00 0.00 C ATOM 889 O GLN C 58 68.006 4.197 7.370 1.00 0.00 O ATOM 890 CB GLN C 58 70.366 6.413 7.110 1.00 0.00 C ATOM 891 CG GLN C 58 71.443 5.451 6.605 1.00 0.00 C ATOM 892 CD GLN C 58 71.758 4.423 7.695 1.00 0.00 C ATOM 893 OE1 GLN C 58 71.866 4.765 8.855 1.00 0.00 O ATOM 894 NE2 GLN C 58 71.912 3.168 7.367 1.00 0.00 N ATOM 0 H GLN C 58 69.157 8.239 6.139 1.00 0.00 H new ATOM 0 HA GLN C 58 69.188 5.471 5.531 1.00 0.00 H new ATOM 0 HB2 GLN C 58 70.670 7.444 6.929 1.00 0.00 H new ATOM 0 HB3 GLN C 58 70.240 6.302 8.187 1.00 0.00 H new ATOM 0 HG2 GLN C 58 71.101 4.946 5.702 1.00 0.00 H new ATOM 0 HG3 GLN C 58 72.344 6.004 6.339 1.00 0.00 H new ATOM 0 HE21 GLN C 58 71.821 2.881 6.393 1.00 0.00 H new ATOM 0 HE22 GLN C 58 72.123 2.475 8.085 1.00 0.00 H new ATOM 903 N GLU C 59 67.310 6.149 8.091 1.00 0.00 N ATOM 904 CA GLU C 59 66.340 5.506 9.023 1.00 0.00 C ATOM 905 C GLU C 59 65.367 4.620 8.240 1.00 0.00 C ATOM 906 O GLU C 59 65.150 3.473 8.578 1.00 0.00 O ATOM 907 CB GLU C 59 65.599 6.662 9.693 1.00 0.00 C ATOM 908 CG GLU C 59 65.553 6.428 11.204 1.00 0.00 C ATOM 909 CD GLU C 59 64.946 7.651 11.894 1.00 0.00 C ATOM 910 OE1 GLU C 59 65.653 8.633 12.046 1.00 0.00 O ATOM 911 OE2 GLU C 59 63.784 7.584 12.259 1.00 0.00 O ATOM 0 H GLU C 59 67.318 7.169 8.106 1.00 0.00 H new ATOM 0 HA GLU C 59 66.833 4.867 9.755 1.00 0.00 H new ATOM 0 HB2 GLU C 59 66.100 7.605 9.475 1.00 0.00 H new ATOM 0 HB3 GLU C 59 64.587 6.739 9.295 1.00 0.00 H new ATOM 0 HG2 GLU C 59 64.961 5.541 11.427 1.00 0.00 H new ATOM 0 HG3 GLU C 59 66.558 6.244 11.585 1.00 0.00 H new ATOM 918 N MET C 60 64.785 5.137 7.193 1.00 0.00 N ATOM 919 CA MET C 60 63.834 4.315 6.391 1.00 0.00 C ATOM 920 C MET C 60 64.470 2.964 6.057 1.00 0.00 C ATOM 921 O MET C 60 63.805 1.950 5.995 1.00 0.00 O ATOM 922 CB MET C 60 63.585 5.124 5.117 1.00 0.00 C ATOM 923 CG MET C 60 62.240 5.845 5.224 1.00 0.00 C ATOM 924 SD MET C 60 62.117 7.086 3.910 1.00 0.00 S ATOM 925 CE MET C 60 61.356 6.018 2.662 1.00 0.00 C ATOM 0 H MET C 60 64.926 6.090 6.858 1.00 0.00 H new ATOM 0 HA MET C 60 62.907 4.110 6.926 1.00 0.00 H new ATOM 0 HB2 MET C 60 64.387 5.848 4.971 1.00 0.00 H new ATOM 0 HB3 MET C 60 63.588 4.465 4.249 1.00 0.00 H new ATOM 0 HG2 MET C 60 61.423 5.128 5.140 1.00 0.00 H new ATOM 0 HG3 MET C 60 62.147 6.322 6.200 1.00 0.00 H new ATOM 0 HE1 MET C 60 60.579 6.571 2.134 1.00 0.00 H new ATOM 0 HE2 MET C 60 62.115 5.691 1.951 1.00 0.00 H new ATOM 0 HE3 MET C 60 60.915 5.148 3.148 1.00 0.00 H new ATOM 935 N ILE C 61 65.758 2.946 5.845 1.00 0.00 N ATOM 936 CA ILE C 61 66.444 1.664 5.517 1.00 0.00 C ATOM 937 C ILE C 61 66.778 0.906 6.806 1.00 0.00 C ATOM 938 O ILE C 61 66.414 -0.241 6.973 1.00 0.00 O ATOM 939 CB ILE C 61 67.724 2.077 4.788 1.00 0.00 C ATOM 940 CG1 ILE C 61 67.379 2.492 3.355 1.00 0.00 C ATOM 941 CG2 ILE C 61 68.700 0.899 4.758 1.00 0.00 C ATOM 942 CD1 ILE C 61 67.048 3.985 3.320 1.00 0.00 C ATOM 0 H ILE C 61 66.365 3.765 5.885 1.00 0.00 H new ATOM 0 HA ILE C 61 65.826 1.003 4.909 1.00 0.00 H new ATOM 0 HB ILE C 61 68.186 2.915 5.310 1.00 0.00 H new ATOM 0 HG12 ILE C 61 68.218 2.279 2.692 1.00 0.00 H new ATOM 0 HG13 ILE C 61 66.530 1.912 2.992 1.00 0.00 H new ATOM 0 HG21 ILE C 61 69.611 1.195 4.238 1.00 0.00 H new ATOM 0 HG22 ILE C 61 68.944 0.603 5.778 1.00 0.00 H new ATOM 0 HG23 ILE C 61 68.241 0.059 4.236 1.00 0.00 H new ATOM 0 HD11 ILE C 61 66.803 4.279 2.300 1.00 0.00 H new ATOM 0 HD12 ILE C 61 66.196 4.184 3.970 1.00 0.00 H new ATOM 0 HD13 ILE C 61 67.909 4.557 3.665 1.00 0.00 H new ATOM 954 N ASP C 62 67.464 1.539 7.717 1.00 0.00 N ATOM 955 CA ASP C 62 67.816 0.854 8.993 1.00 0.00 C ATOM 956 C ASP C 62 66.560 0.255 9.628 1.00 0.00 C ATOM 957 O ASP C 62 66.632 -0.644 10.444 1.00 0.00 O ATOM 958 CB ASP C 62 68.395 1.954 9.885 1.00 0.00 C ATOM 959 CG ASP C 62 69.921 1.938 9.793 1.00 0.00 C ATOM 960 OD1 ASP C 62 70.457 0.938 9.344 1.00 0.00 O ATOM 961 OD2 ASP C 62 70.529 2.925 10.174 1.00 0.00 O ATOM 0 H ASP C 62 67.796 2.500 7.634 1.00 0.00 H new ATOM 0 HA ASP C 62 68.521 0.036 8.845 1.00 0.00 H new ATOM 0 HB2 ASP C 62 68.012 2.926 9.576 1.00 0.00 H new ATOM 0 HB3 ASP C 62 68.081 1.802 10.918 1.00 0.00 H new ATOM 966 N GLU C 63 65.409 0.747 9.261 1.00 0.00 N ATOM 967 CA GLU C 63 64.147 0.207 9.842 1.00 0.00 C ATOM 968 C GLU C 63 64.015 -1.287 9.536 1.00 0.00 C ATOM 969 O GLU C 63 63.339 -2.016 10.234 1.00 0.00 O ATOM 970 CB GLU C 63 63.028 0.994 9.159 1.00 0.00 C ATOM 971 CG GLU C 63 61.754 0.912 10.004 1.00 0.00 C ATOM 972 CD GLU C 63 61.375 2.311 10.494 1.00 0.00 C ATOM 973 OE1 GLU C 63 62.269 3.043 10.883 1.00 0.00 O ATOM 974 OE2 GLU C 63 60.196 2.624 10.472 1.00 0.00 O ATOM 0 H GLU C 63 65.287 1.500 8.584 1.00 0.00 H new ATOM 0 HA GLU C 63 64.117 0.311 10.927 1.00 0.00 H new ATOM 0 HB2 GLU C 63 63.326 2.035 9.032 1.00 0.00 H new ATOM 0 HB3 GLU C 63 62.842 0.592 8.163 1.00 0.00 H new ATOM 0 HG2 GLU C 63 60.941 0.489 9.414 1.00 0.00 H new ATOM 0 HG3 GLU C 63 61.911 0.248 10.854 1.00 0.00 H new ATOM 981 N VAL C 64 64.656 -1.752 8.498 1.00 0.00 N ATOM 982 CA VAL C 64 64.560 -3.200 8.154 1.00 0.00 C ATOM 983 C VAL C 64 65.914 -3.725 7.665 1.00 0.00 C ATOM 984 O VAL C 64 65.989 -4.505 6.736 1.00 0.00 O ATOM 985 CB VAL C 64 63.517 -3.273 7.039 1.00 0.00 C ATOM 986 CG1 VAL C 64 62.206 -2.653 7.526 1.00 0.00 C ATOM 987 CG2 VAL C 64 64.021 -2.500 5.818 1.00 0.00 C ATOM 0 H VAL C 64 65.240 -1.194 7.875 1.00 0.00 H new ATOM 0 HA VAL C 64 64.281 -3.810 9.013 1.00 0.00 H new ATOM 0 HB VAL C 64 63.349 -4.315 6.767 1.00 0.00 H new ATOM 0 HG11 VAL C 64 61.462 -2.705 6.731 1.00 0.00 H new ATOM 0 HG12 VAL C 64 61.846 -3.201 8.397 1.00 0.00 H new ATOM 0 HG13 VAL C 64 62.375 -1.611 7.797 1.00 0.00 H new ATOM 0 HG21 VAL C 64 63.278 -2.552 5.022 1.00 0.00 H new ATOM 0 HG22 VAL C 64 64.189 -1.458 6.091 1.00 0.00 H new ATOM 0 HG23 VAL C 64 64.956 -2.939 5.470 1.00 0.00 H new ATOM 997 N ASP C 65 66.984 -3.307 8.285 1.00 0.00 N ATOM 998 CA ASP C 65 68.331 -3.787 7.858 1.00 0.00 C ATOM 999 C ASP C 65 68.873 -4.803 8.869 1.00 0.00 C ATOM 1000 O ASP C 65 69.624 -4.463 9.761 1.00 0.00 O ATOM 1001 CB ASP C 65 69.210 -2.536 7.830 1.00 0.00 C ATOM 1002 CG ASP C 65 70.075 -2.546 6.569 1.00 0.00 C ATOM 1003 OD1 ASP C 65 70.181 -3.595 5.954 1.00 0.00 O ATOM 1004 OD2 ASP C 65 70.619 -1.504 6.238 1.00 0.00 O ATOM 0 H ASP C 65 66.984 -2.654 9.069 1.00 0.00 H new ATOM 0 HA ASP C 65 68.304 -4.285 6.889 1.00 0.00 H new ATOM 0 HB2 ASP C 65 68.588 -1.641 7.849 1.00 0.00 H new ATOM 0 HB3 ASP C 65 69.843 -2.504 8.717 1.00 0.00 H new ATOM 1009 N GLU C 66 68.496 -6.046 8.737 1.00 0.00 N ATOM 1010 CA GLU C 66 68.990 -7.080 9.693 1.00 0.00 C ATOM 1011 C GLU C 66 70.112 -7.902 9.054 1.00 0.00 C ATOM 1012 O GLU C 66 70.210 -9.096 9.253 1.00 0.00 O ATOM 1013 CB GLU C 66 67.776 -7.966 9.981 1.00 0.00 C ATOM 1014 CG GLU C 66 67.873 -8.521 11.403 1.00 0.00 C ATOM 1015 CD GLU C 66 67.731 -10.045 11.370 1.00 0.00 C ATOM 1016 OE1 GLU C 66 67.200 -10.549 10.395 1.00 0.00 O ATOM 1017 OE2 GLU C 66 68.155 -10.680 12.322 1.00 0.00 O ATOM 0 H GLU C 66 67.869 -6.390 8.010 1.00 0.00 H new ATOM 0 HA GLU C 66 69.399 -6.638 10.602 1.00 0.00 H new ATOM 0 HB2 GLU C 66 66.857 -7.391 9.866 1.00 0.00 H new ATOM 0 HB3 GLU C 66 67.731 -8.784 9.262 1.00 0.00 H new ATOM 0 HG2 GLU C 66 68.829 -8.244 11.848 1.00 0.00 H new ATOM 0 HG3 GLU C 66 67.093 -8.086 12.028 1.00 0.00 H new ATOM 1024 N ASP C 67 70.959 -7.273 8.287 1.00 0.00 N ATOM 1025 CA ASP C 67 72.074 -8.021 7.637 1.00 0.00 C ATOM 1026 C ASP C 67 73.392 -7.262 7.808 1.00 0.00 C ATOM 1027 O ASP C 67 74.425 -7.677 7.324 1.00 0.00 O ATOM 1028 CB ASP C 67 71.688 -8.100 6.159 1.00 0.00 C ATOM 1029 CG ASP C 67 71.532 -6.686 5.597 1.00 0.00 C ATOM 1030 OD1 ASP C 67 71.973 -5.757 6.253 1.00 0.00 O ATOM 1031 OD2 ASP C 67 70.971 -6.557 4.521 1.00 0.00 O ATOM 0 H ASP C 67 70.928 -6.274 8.082 1.00 0.00 H new ATOM 0 HA ASP C 67 72.219 -9.009 8.074 1.00 0.00 H new ATOM 0 HB2 ASP C 67 72.451 -8.642 5.601 1.00 0.00 H new ATOM 0 HB3 ASP C 67 70.756 -8.653 6.045 1.00 0.00 H new ATOM 1036 N GLY C 68 73.363 -6.151 8.493 1.00 0.00 N ATOM 1037 CA GLY C 68 74.614 -5.368 8.692 1.00 0.00 C ATOM 1038 C GLY C 68 75.144 -4.901 7.336 1.00 0.00 C ATOM 1039 O GLY C 68 76.335 -4.879 7.099 1.00 0.00 O ATOM 0 H GLY C 68 72.528 -5.753 8.923 1.00 0.00 H new ATOM 0 HA2 GLY C 68 74.420 -4.509 9.334 1.00 0.00 H new ATOM 0 HA3 GLY C 68 75.362 -5.980 9.196 1.00 0.00 H new ATOM 1043 N SER C 69 74.269 -4.527 6.444 1.00 0.00 N ATOM 1044 CA SER C 69 74.724 -4.060 5.102 1.00 0.00 C ATOM 1045 C SER C 69 74.591 -2.539 5.001 1.00 0.00 C ATOM 1046 O SER C 69 75.570 -1.827 4.893 1.00 0.00 O ATOM 1047 CB SER C 69 73.790 -4.748 4.106 1.00 0.00 C ATOM 1048 OG SER C 69 72.472 -4.244 4.273 1.00 0.00 O ATOM 0 H SER C 69 73.259 -4.524 6.585 1.00 0.00 H new ATOM 0 HA SER C 69 75.770 -4.301 4.912 1.00 0.00 H new ATOM 0 HB2 SER C 69 74.133 -4.571 3.087 1.00 0.00 H new ATOM 0 HB3 SER C 69 73.802 -5.826 4.264 1.00 0.00 H new ATOM 0 HG SER C 69 72.158 -4.444 5.179 1.00 0.00 H new ATOM 1054 N GLY C 70 73.388 -2.034 5.038 1.00 0.00 N ATOM 1055 CA GLY C 70 73.195 -0.560 4.946 1.00 0.00 C ATOM 1056 C GLY C 70 72.163 -0.242 3.863 1.00 0.00 C ATOM 1057 O GLY C 70 71.749 0.889 3.700 1.00 0.00 O ATOM 0 H GLY C 70 72.531 -2.579 5.128 1.00 0.00 H new ATOM 0 HA2 GLY C 70 72.862 -0.167 5.906 1.00 0.00 H new ATOM 0 HA3 GLY C 70 74.142 -0.073 4.714 1.00 0.00 H new ATOM 1061 N THR C 71 71.741 -1.229 3.121 1.00 0.00 N ATOM 1062 CA THR C 71 70.734 -0.976 2.049 1.00 0.00 C ATOM 1063 C THR C 71 69.520 -1.890 2.238 1.00 0.00 C ATOM 1064 O THR C 71 69.564 -2.852 2.979 1.00 0.00 O ATOM 1065 CB THR C 71 71.456 -1.306 0.742 1.00 0.00 C ATOM 1066 OG1 THR C 71 71.915 -2.650 0.781 1.00 0.00 O ATOM 1067 CG2 THR C 71 72.646 -0.363 0.563 1.00 0.00 C ATOM 0 H THR C 71 72.048 -2.198 3.209 1.00 0.00 H new ATOM 0 HA THR C 71 70.364 0.049 2.063 1.00 0.00 H new ATOM 0 HB THR C 71 70.768 -1.182 -0.094 1.00 0.00 H new ATOM 0 HG1 THR C 71 72.376 -2.863 -0.057 1.00 0.00 H new ATOM 0 HG21 THR C 71 73.160 -0.599 -0.369 1.00 0.00 H new ATOM 0 HG22 THR C 71 72.292 0.667 0.531 1.00 0.00 H new ATOM 0 HG23 THR C 71 73.335 -0.484 1.399 1.00 0.00 H new ATOM 1075 N VAL C 72 68.436 -1.598 1.572 1.00 0.00 N ATOM 1076 CA VAL C 72 67.222 -2.453 1.716 1.00 0.00 C ATOM 1077 C VAL C 72 67.033 -3.322 0.468 1.00 0.00 C ATOM 1078 O VAL C 72 67.413 -2.950 -0.625 1.00 0.00 O ATOM 1079 CB VAL C 72 66.061 -1.469 1.875 1.00 0.00 C ATOM 1080 CG1 VAL C 72 64.736 -2.183 1.592 1.00 0.00 C ATOM 1081 CG2 VAL C 72 66.048 -0.931 3.307 1.00 0.00 C ATOM 0 H VAL C 72 68.338 -0.807 0.936 1.00 0.00 H new ATOM 0 HA VAL C 72 67.294 -3.135 2.563 1.00 0.00 H new ATOM 0 HB VAL C 72 66.186 -0.646 1.172 1.00 0.00 H new ATOM 0 HG11 VAL C 72 63.912 -1.479 1.706 1.00 0.00 H new ATOM 0 HG12 VAL C 72 64.743 -2.572 0.574 1.00 0.00 H new ATOM 0 HG13 VAL C 72 64.609 -3.007 2.294 1.00 0.00 H new ATOM 0 HG21 VAL C 72 65.222 -0.229 3.425 1.00 0.00 H new ATOM 0 HG22 VAL C 72 65.923 -1.758 4.005 1.00 0.00 H new ATOM 0 HG23 VAL C 72 66.989 -0.421 3.513 1.00 0.00 H new ATOM 1091 N ASP C 73 66.446 -4.477 0.624 1.00 0.00 N ATOM 1092 CA ASP C 73 66.229 -5.372 -0.549 1.00 0.00 C ATOM 1093 C ASP C 73 64.747 -5.741 -0.657 1.00 0.00 C ATOM 1094 O ASP C 73 63.965 -5.461 0.230 1.00 0.00 O ATOM 1095 CB ASP C 73 67.077 -6.613 -0.262 1.00 0.00 C ATOM 1096 CG ASP C 73 68.454 -6.186 0.250 1.00 0.00 C ATOM 1097 OD1 ASP C 73 68.513 -5.630 1.335 1.00 0.00 O ATOM 1098 OD2 ASP C 73 69.424 -6.422 -0.450 1.00 0.00 O ATOM 0 H ASP C 73 66.107 -4.840 1.515 1.00 0.00 H new ATOM 0 HA ASP C 73 66.509 -4.901 -1.491 1.00 0.00 H new ATOM 0 HB2 ASP C 73 66.581 -7.241 0.478 1.00 0.00 H new ATOM 0 HB3 ASP C 73 67.184 -7.210 -1.167 1.00 0.00 H new ATOM 1103 N PHE C 74 64.351 -6.367 -1.732 1.00 0.00 N ATOM 1104 CA PHE C 74 62.916 -6.747 -1.881 1.00 0.00 C ATOM 1105 C PHE C 74 62.463 -7.568 -0.672 1.00 0.00 C ATOM 1106 O PHE C 74 61.286 -7.688 -0.396 1.00 0.00 O ATOM 1107 CB PHE C 74 62.855 -7.590 -3.156 1.00 0.00 C ATOM 1108 CG PHE C 74 61.437 -8.058 -3.383 1.00 0.00 C ATOM 1109 CD1 PHE C 74 60.462 -7.153 -3.822 1.00 0.00 C ATOM 1110 CD2 PHE C 74 61.096 -9.398 -3.156 1.00 0.00 C ATOM 1111 CE1 PHE C 74 59.148 -7.587 -4.031 1.00 0.00 C ATOM 1112 CE2 PHE C 74 59.782 -9.831 -3.366 1.00 0.00 C ATOM 1113 CZ PHE C 74 58.808 -8.925 -3.804 1.00 0.00 C ATOM 0 H PHE C 74 64.955 -6.631 -2.510 1.00 0.00 H new ATOM 0 HA PHE C 74 62.262 -5.877 -1.940 1.00 0.00 H new ATOM 0 HB2 PHE C 74 63.197 -7.004 -4.009 1.00 0.00 H new ATOM 0 HB3 PHE C 74 63.523 -8.447 -3.070 1.00 0.00 H new ATOM 0 HD1 PHE C 74 60.724 -6.120 -3.999 1.00 0.00 H new ATOM 0 HD2 PHE C 74 61.847 -10.097 -2.819 1.00 0.00 H new ATOM 0 HE1 PHE C 74 58.396 -6.889 -4.368 1.00 0.00 H new ATOM 0 HE2 PHE C 74 59.519 -10.864 -3.190 1.00 0.00 H new ATOM 0 HZ PHE C 74 57.794 -9.259 -3.967 1.00 0.00 H new ATOM 1123 N ASP C 75 63.389 -8.134 0.052 1.00 0.00 N ATOM 1124 CA ASP C 75 63.012 -8.947 1.245 1.00 0.00 C ATOM 1125 C ASP C 75 62.722 -8.031 2.436 1.00 0.00 C ATOM 1126 O ASP C 75 61.640 -8.041 2.991 1.00 0.00 O ATOM 1127 CB ASP C 75 64.231 -9.826 1.526 1.00 0.00 C ATOM 1128 CG ASP C 75 63.767 -11.214 1.970 1.00 0.00 C ATOM 1129 OD1 ASP C 75 62.687 -11.305 2.531 1.00 0.00 O ATOM 1130 OD2 ASP C 75 64.499 -12.162 1.741 1.00 0.00 O ATOM 0 H ASP C 75 64.391 -8.069 -0.130 1.00 0.00 H new ATOM 0 HA ASP C 75 62.114 -9.541 1.075 1.00 0.00 H new ATOM 0 HB2 ASP C 75 64.849 -9.906 0.632 1.00 0.00 H new ATOM 0 HB3 ASP C 75 64.849 -9.372 2.301 1.00 0.00 H new ATOM 1135 N GLU C 76 63.679 -7.239 2.836 1.00 0.00 N ATOM 1136 CA GLU C 76 63.455 -6.324 3.990 1.00 0.00 C ATOM 1137 C GLU C 76 62.440 -5.240 3.614 1.00 0.00 C ATOM 1138 O GLU C 76 61.673 -4.781 4.437 1.00 0.00 O ATOM 1139 CB GLU C 76 64.823 -5.701 4.271 1.00 0.00 C ATOM 1140 CG GLU C 76 65.839 -6.809 4.557 1.00 0.00 C ATOM 1141 CD GLU C 76 67.255 -6.242 4.442 1.00 0.00 C ATOM 1142 OE1 GLU C 76 67.425 -5.064 4.708 1.00 0.00 O ATOM 1143 OE2 GLU C 76 68.148 -6.998 4.090 1.00 0.00 O ATOM 0 H GLU C 76 64.606 -7.186 2.413 1.00 0.00 H new ATOM 0 HA GLU C 76 63.057 -6.845 4.861 1.00 0.00 H new ATOM 0 HB2 GLU C 76 65.147 -5.108 3.416 1.00 0.00 H new ATOM 0 HB3 GLU C 76 64.758 -5.024 5.123 1.00 0.00 H new ATOM 0 HG2 GLU C 76 65.678 -7.216 5.555 1.00 0.00 H new ATOM 0 HG3 GLU C 76 65.706 -7.630 3.853 1.00 0.00 H new ATOM 1150 N PHE C 77 62.432 -4.827 2.376 1.00 0.00 N ATOM 1151 CA PHE C 77 61.469 -3.772 1.946 1.00 0.00 C ATOM 1152 C PHE C 77 60.031 -4.226 2.204 1.00 0.00 C ATOM 1153 O PHE C 77 59.201 -3.465 2.661 1.00 0.00 O ATOM 1154 CB PHE C 77 61.715 -3.599 0.448 1.00 0.00 C ATOM 1155 CG PHE C 77 60.702 -2.637 -0.119 1.00 0.00 C ATOM 1156 CD1 PHE C 77 59.469 -3.111 -0.583 1.00 0.00 C ATOM 1157 CD2 PHE C 77 60.994 -1.269 -0.183 1.00 0.00 C ATOM 1158 CE1 PHE C 77 58.528 -2.218 -1.110 1.00 0.00 C ATOM 1159 CE2 PHE C 77 60.052 -0.376 -0.709 1.00 0.00 C ATOM 1160 CZ PHE C 77 58.820 -0.851 -1.173 1.00 0.00 C ATOM 0 H PHE C 77 63.051 -5.174 1.643 1.00 0.00 H new ATOM 0 HA PHE C 77 61.609 -2.840 2.494 1.00 0.00 H new ATOM 0 HB2 PHE C 77 62.724 -3.225 0.275 1.00 0.00 H new ATOM 0 HB3 PHE C 77 61.641 -4.562 -0.057 1.00 0.00 H new ATOM 0 HD1 PHE C 77 59.244 -4.166 -0.534 1.00 0.00 H new ATOM 0 HD2 PHE C 77 61.945 -0.903 0.173 1.00 0.00 H new ATOM 0 HE1 PHE C 77 57.577 -2.584 -1.468 1.00 0.00 H new ATOM 0 HE2 PHE C 77 60.276 0.679 -0.757 1.00 0.00 H new ATOM 0 HZ PHE C 77 58.094 -0.162 -1.580 1.00 0.00 H new ATOM 1170 N LEU C 78 59.728 -5.462 1.914 1.00 0.00 N ATOM 1171 CA LEU C 78 58.342 -5.962 2.142 1.00 0.00 C ATOM 1172 C LEU C 78 57.996 -5.897 3.631 1.00 0.00 C ATOM 1173 O LEU C 78 56.843 -5.848 4.008 1.00 0.00 O ATOM 1174 CB LEU C 78 58.359 -7.413 1.660 1.00 0.00 C ATOM 1175 CG LEU C 78 57.497 -7.544 0.403 1.00 0.00 C ATOM 1176 CD1 LEU C 78 57.613 -8.966 -0.149 1.00 0.00 C ATOM 1177 CD2 LEU C 78 56.038 -7.251 0.755 1.00 0.00 C ATOM 0 H LEU C 78 60.379 -6.147 1.530 1.00 0.00 H new ATOM 0 HA LEU C 78 57.597 -5.366 1.615 1.00 0.00 H new ATOM 0 HB2 LEU C 78 59.382 -7.724 1.447 1.00 0.00 H new ATOM 0 HB3 LEU C 78 57.982 -8.072 2.442 1.00 0.00 H new ATOM 0 HG LEU C 78 57.840 -6.834 -0.349 1.00 0.00 H new ATOM 0 HD11 LEU C 78 56.999 -9.060 -1.045 1.00 0.00 H new ATOM 0 HD12 LEU C 78 58.653 -9.176 -0.399 1.00 0.00 H new ATOM 0 HD13 LEU C 78 57.270 -9.677 0.602 1.00 0.00 H new ATOM 0 HD21 LEU C 78 55.422 -7.344 -0.140 1.00 0.00 H new ATOM 0 HD22 LEU C 78 55.695 -7.962 1.507 1.00 0.00 H new ATOM 0 HD23 LEU C 78 55.955 -6.238 1.149 1.00 0.00 H new ATOM 1189 N VAL C 79 58.987 -5.901 4.480 1.00 0.00 N ATOM 1190 CA VAL C 79 58.717 -5.844 5.945 1.00 0.00 C ATOM 1191 C VAL C 79 58.427 -4.404 6.380 1.00 0.00 C ATOM 1192 O VAL C 79 57.864 -4.164 7.429 1.00 0.00 O ATOM 1193 CB VAL C 79 60.002 -6.352 6.599 1.00 0.00 C ATOM 1194 CG1 VAL C 79 59.886 -6.227 8.119 1.00 0.00 C ATOM 1195 CG2 VAL C 79 60.217 -7.820 6.225 1.00 0.00 C ATOM 0 H VAL C 79 59.973 -5.941 4.222 1.00 0.00 H new ATOM 0 HA VAL C 79 57.848 -6.438 6.228 1.00 0.00 H new ATOM 0 HB VAL C 79 60.847 -5.758 6.249 1.00 0.00 H new ATOM 0 HG11 VAL C 79 60.802 -6.589 8.585 1.00 0.00 H new ATOM 0 HG12 VAL C 79 59.731 -5.182 8.387 1.00 0.00 H new ATOM 0 HG13 VAL C 79 59.042 -6.821 8.469 1.00 0.00 H new ATOM 0 HG21 VAL C 79 61.133 -8.184 6.691 1.00 0.00 H new ATOM 0 HG22 VAL C 79 59.372 -8.412 6.576 1.00 0.00 H new ATOM 0 HG23 VAL C 79 60.300 -7.911 5.142 1.00 0.00 H new ATOM 1205 N MET C 80 58.811 -3.444 5.583 1.00 0.00 N ATOM 1206 CA MET C 80 58.560 -2.021 5.954 1.00 0.00 C ATOM 1207 C MET C 80 57.074 -1.682 5.800 1.00 0.00 C ATOM 1208 O MET C 80 56.555 -0.809 6.467 1.00 0.00 O ATOM 1209 CB MET C 80 59.398 -1.201 4.972 1.00 0.00 C ATOM 1210 CG MET C 80 59.780 0.132 5.618 1.00 0.00 C ATOM 1211 SD MET C 80 58.902 1.480 4.786 1.00 0.00 S ATOM 1212 CE MET C 80 59.547 1.178 3.121 1.00 0.00 C ATOM 0 H MET C 80 59.287 -3.583 4.692 1.00 0.00 H new ATOM 0 HA MET C 80 58.826 -1.816 6.991 1.00 0.00 H new ATOM 0 HB2 MET C 80 60.296 -1.753 4.694 1.00 0.00 H new ATOM 0 HB3 MET C 80 58.835 -1.025 4.055 1.00 0.00 H new ATOM 0 HG2 MET C 80 59.528 0.120 6.678 1.00 0.00 H new ATOM 0 HG3 MET C 80 60.857 0.287 5.548 1.00 0.00 H new ATOM 0 HE1 MET C 80 59.696 2.129 2.611 1.00 0.00 H new ATOM 0 HE2 MET C 80 60.498 0.650 3.189 1.00 0.00 H new ATOM 0 HE3 MET C 80 58.835 0.573 2.559 1.00 0.00 H new ATOM 1222 N MET C 81 56.386 -2.361 4.924 1.00 0.00 N ATOM 1223 CA MET C 81 54.937 -2.072 4.728 1.00 0.00 C ATOM 1224 C MET C 81 54.095 -2.841 5.752 1.00 0.00 C ATOM 1225 O MET C 81 52.920 -2.584 5.919 1.00 0.00 O ATOM 1226 CB MET C 81 54.627 -2.550 3.311 1.00 0.00 C ATOM 1227 CG MET C 81 55.293 -1.618 2.300 1.00 0.00 C ATOM 1228 SD MET C 81 54.020 -0.739 1.361 1.00 0.00 S ATOM 1229 CE MET C 81 54.781 0.902 1.432 1.00 0.00 C ATOM 0 H MET C 81 56.764 -3.103 4.335 1.00 0.00 H new ATOM 0 HA MET C 81 54.707 -1.015 4.862 1.00 0.00 H new ATOM 0 HB2 MET C 81 54.987 -3.570 3.173 1.00 0.00 H new ATOM 0 HB3 MET C 81 53.549 -2.568 3.150 1.00 0.00 H new ATOM 0 HG2 MET C 81 55.937 -0.905 2.815 1.00 0.00 H new ATOM 0 HG3 MET C 81 55.928 -2.191 1.624 1.00 0.00 H new ATOM 0 HE1 MET C 81 54.151 1.618 0.904 1.00 0.00 H new ATOM 0 HE2 MET C 81 54.886 1.209 2.472 1.00 0.00 H new ATOM 0 HE3 MET C 81 55.764 0.868 0.962 1.00 0.00 H new ATOM 1239 N VAL C 82 54.685 -3.783 6.435 1.00 0.00 N ATOM 1240 CA VAL C 82 53.912 -4.565 7.442 1.00 0.00 C ATOM 1241 C VAL C 82 53.884 -3.826 8.783 1.00 0.00 C ATOM 1242 O VAL C 82 52.864 -3.753 9.441 1.00 0.00 O ATOM 1243 CB VAL C 82 54.660 -5.890 7.579 1.00 0.00 C ATOM 1244 CG1 VAL C 82 53.790 -6.892 8.337 1.00 0.00 C ATOM 1245 CG2 VAL C 82 54.977 -6.442 6.187 1.00 0.00 C ATOM 0 H VAL C 82 55.666 -4.045 6.340 1.00 0.00 H new ATOM 0 HA VAL C 82 52.875 -4.711 7.138 1.00 0.00 H new ATOM 0 HB VAL C 82 55.588 -5.728 8.127 1.00 0.00 H new ATOM 0 HG11 VAL C 82 54.324 -7.837 8.434 1.00 0.00 H new ATOM 0 HG12 VAL C 82 53.563 -6.500 9.328 1.00 0.00 H new ATOM 0 HG13 VAL C 82 52.862 -7.055 7.790 1.00 0.00 H new ATOM 0 HG21 VAL C 82 55.511 -7.387 6.283 1.00 0.00 H new ATOM 0 HG22 VAL C 82 54.048 -6.604 5.640 1.00 0.00 H new ATOM 0 HG23 VAL C 82 55.598 -5.728 5.645 1.00 0.00 H new ATOM 1255 N ARG C 83 54.994 -3.281 9.197 1.00 0.00 N ATOM 1256 CA ARG C 83 55.026 -2.551 10.497 1.00 0.00 C ATOM 1257 C ARG C 83 54.067 -1.357 10.457 1.00 0.00 C ATOM 1258 O ARG C 83 53.313 -1.125 11.380 1.00 0.00 O ATOM 1259 CB ARG C 83 56.471 -2.081 10.653 1.00 0.00 C ATOM 1260 CG ARG C 83 57.389 -3.299 10.781 1.00 0.00 C ATOM 1261 CD ARG C 83 58.847 -2.862 10.620 1.00 0.00 C ATOM 1262 NE ARG C 83 59.647 -3.979 11.198 1.00 0.00 N ATOM 1263 CZ ARG C 83 60.615 -3.724 12.034 1.00 0.00 C ATOM 1264 NH1 ARG C 83 61.753 -3.260 11.593 1.00 0.00 N ATOM 1265 NH2 ARG C 83 60.449 -3.934 13.310 1.00 0.00 N ATOM 0 H ARG C 83 55.880 -3.309 8.693 1.00 0.00 H new ATOM 0 HA ARG C 83 54.713 -3.178 11.332 1.00 0.00 H new ATOM 0 HB2 ARG C 83 56.764 -1.479 9.793 1.00 0.00 H new ATOM 0 HB3 ARG C 83 56.566 -1.446 11.534 1.00 0.00 H new ATOM 0 HG2 ARG C 83 57.246 -3.774 11.752 1.00 0.00 H new ATOM 0 HG3 ARG C 83 57.135 -4.040 10.023 1.00 0.00 H new ATOM 0 HD2 ARG C 83 59.097 -2.698 9.572 1.00 0.00 H new ATOM 0 HD3 ARG C 83 59.039 -1.926 11.144 1.00 0.00 H new ATOM 0 HE ARG C 83 59.437 -4.943 10.940 1.00 0.00 H new ATOM 0 HH11 ARG C 83 61.885 -3.097 10.595 1.00 0.00 H new ATOM 0 HH12 ARG C 83 62.510 -3.061 12.247 1.00 0.00 H new ATOM 0 HH21 ARG C 83 59.561 -4.298 13.656 1.00 0.00 H new ATOM 0 HH22 ARG C 83 61.207 -3.734 13.963 1.00 0.00 H new ATOM 1279 N CYS C 84 54.087 -0.601 9.395 1.00 0.00 N ATOM 1280 CA CYS C 84 53.172 0.573 9.301 1.00 0.00 C ATOM 1281 C CYS C 84 51.730 0.099 9.098 1.00 0.00 C ATOM 1282 O CYS C 84 50.802 0.884 9.100 1.00 0.00 O ATOM 1283 CB CYS C 84 53.656 1.358 8.082 1.00 0.00 C ATOM 1284 SG CYS C 84 53.390 0.374 6.586 1.00 0.00 S ATOM 0 H CYS C 84 54.696 -0.744 8.589 1.00 0.00 H new ATOM 0 HA CYS C 84 53.184 1.181 10.205 1.00 0.00 H new ATOM 0 HB2 CYS C 84 53.119 2.304 8.008 1.00 0.00 H new ATOM 0 HB3 CYS C 84 54.714 1.599 8.188 1.00 0.00 H new ATOM 0 HG CYS C 84 53.119 -0.854 6.917 1.00 0.00 H new ATOM 1290 N MET C 85 51.538 -1.180 8.923 1.00 0.00 N ATOM 1291 CA MET C 85 50.157 -1.705 8.720 1.00 0.00 C ATOM 1292 C MET C 85 49.646 -2.365 10.003 1.00 0.00 C ATOM 1293 O MET C 85 50.383 -2.562 10.948 1.00 0.00 O ATOM 1294 CB MET C 85 50.287 -2.739 7.601 1.00 0.00 C ATOM 1295 CG MET C 85 49.538 -2.249 6.361 1.00 0.00 C ATOM 1296 SD MET C 85 48.092 -3.300 6.075 1.00 0.00 S ATOM 1297 CE MET C 85 48.957 -4.888 6.109 1.00 0.00 C ATOM 0 H MET C 85 52.276 -1.884 8.912 1.00 0.00 H new ATOM 0 HA MET C 85 49.449 -0.916 8.467 1.00 0.00 H new ATOM 0 HB2 MET C 85 51.338 -2.902 7.363 1.00 0.00 H new ATOM 0 HB3 MET C 85 49.882 -3.697 7.928 1.00 0.00 H new ATOM 0 HG2 MET C 85 49.227 -1.213 6.497 1.00 0.00 H new ATOM 0 HG3 MET C 85 50.196 -2.273 5.492 1.00 0.00 H new ATOM 0 HE1 MET C 85 48.514 -5.559 5.373 1.00 0.00 H new ATOM 0 HE2 MET C 85 50.010 -4.734 5.873 1.00 0.00 H new ATOM 0 HE3 MET C 85 48.869 -5.329 7.102 1.00 0.00 H new ATOM 1307 N LYS C 86 48.387 -2.710 10.042 1.00 0.00 N ATOM 1308 CA LYS C 86 47.829 -3.359 11.264 1.00 0.00 C ATOM 1309 C LYS C 86 48.257 -4.828 11.324 1.00 0.00 C ATOM 1310 O LYS C 86 48.304 -5.512 10.321 1.00 0.00 O ATOM 1311 CB LYS C 86 46.311 -3.248 11.112 1.00 0.00 C ATOM 1312 CG LYS C 86 45.688 -2.876 12.458 1.00 0.00 C ATOM 1313 CD LYS C 86 45.619 -4.117 13.349 1.00 0.00 C ATOM 1314 CE LYS C 86 46.466 -3.894 14.604 1.00 0.00 C ATOM 1315 NZ LYS C 86 45.654 -2.983 15.457 1.00 0.00 N ATOM 0 H LYS C 86 47.721 -2.571 9.282 1.00 0.00 H new ATOM 0 HA LYS C 86 48.182 -2.888 12.181 1.00 0.00 H new ATOM 0 HB2 LYS C 86 46.064 -2.494 10.365 1.00 0.00 H new ATOM 0 HB3 LYS C 86 45.900 -4.194 10.758 1.00 0.00 H new ATOM 0 HG2 LYS C 86 46.280 -2.100 12.943 1.00 0.00 H new ATOM 0 HG3 LYS C 86 44.689 -2.467 12.308 1.00 0.00 H new ATOM 0 HD2 LYS C 86 44.585 -4.321 13.627 1.00 0.00 H new ATOM 0 HD3 LYS C 86 45.980 -4.989 12.804 1.00 0.00 H new ATOM 0 HE2 LYS C 86 46.671 -4.835 15.115 1.00 0.00 H new ATOM 0 HE3 LYS C 86 47.430 -3.449 14.356 1.00 0.00 H new ATOM 0 HZ1 LYS C 86 46.222 -2.150 15.714 1.00 0.00 H new ATOM 0 HZ2 LYS C 86 44.809 -2.678 14.933 1.00 0.00 H new ATOM 0 HZ3 LYS C 86 45.363 -3.484 16.321 1.00 0.00 H new ATOM 1329 N ASP C 87 48.567 -5.319 12.493 1.00 0.00 N ATOM 1330 CA ASP C 87 48.990 -6.743 12.613 1.00 0.00 C ATOM 1331 C ASP C 87 47.966 -7.531 13.435 1.00 0.00 C ATOM 1332 O ASP C 87 47.820 -7.327 14.624 1.00 0.00 O ATOM 1333 CB ASP C 87 50.337 -6.699 13.334 1.00 0.00 C ATOM 1334 CG ASP C 87 50.145 -6.128 14.740 1.00 0.00 C ATOM 1335 OD1 ASP C 87 50.005 -4.922 14.853 1.00 0.00 O ATOM 1336 OD2 ASP C 87 50.139 -6.907 15.679 1.00 0.00 O ATOM 0 H ASP C 87 48.546 -4.796 13.369 1.00 0.00 H new ATOM 0 HA ASP C 87 49.064 -7.234 11.643 1.00 0.00 H new ATOM 0 HB2 ASP C 87 50.763 -7.700 13.392 1.00 0.00 H new ATOM 0 HB3 ASP C 87 51.042 -6.085 12.774 1.00 0.00 H new ATOM 1341 N ASP C 88 47.257 -8.430 12.811 1.00 0.00 N ATOM 1342 CA ASP C 88 46.243 -9.231 13.556 1.00 0.00 C ATOM 1343 C ASP C 88 46.145 -10.637 12.963 1.00 0.00 C ATOM 1344 O ASP C 88 45.177 -10.982 12.313 1.00 0.00 O ATOM 1345 CB ASP C 88 44.926 -8.475 13.373 1.00 0.00 C ATOM 1346 CG ASP C 88 43.817 -9.181 14.156 1.00 0.00 C ATOM 1347 OD1 ASP C 88 44.057 -10.282 14.623 1.00 0.00 O ATOM 1348 OD2 ASP C 88 42.746 -8.608 14.275 1.00 0.00 O ATOM 0 H ASP C 88 47.335 -8.646 11.817 1.00 0.00 H new ATOM 0 HA ASP C 88 46.500 -9.348 14.609 1.00 0.00 H new ATOM 0 HB2 ASP C 88 45.033 -7.448 13.721 1.00 0.00 H new ATOM 0 HB3 ASP C 88 44.666 -8.428 12.316 1.00 0.00 H new ATOM 1353 N SER C 89 47.141 -11.453 13.177 1.00 0.00 N ATOM 1354 CA SER C 89 47.108 -12.836 12.622 1.00 0.00 C ATOM 1355 C SER C 89 47.725 -13.821 13.619 1.00 0.00 C ATOM 1356 O SER C 89 47.112 -14.847 13.864 1.00 0.00 O ATOM 1357 CB SER C 89 47.944 -12.767 11.345 1.00 0.00 C ATOM 1358 OG SER C 89 48.647 -13.992 11.177 1.00 0.00 O ATOM 1359 OXT SER C 89 48.800 -13.532 14.119 1.00 0.00 O ATOM 0 H SER C 89 47.977 -11.221 13.713 1.00 0.00 H new ATOM 0 HA SER C 89 46.093 -13.180 12.426 1.00 0.00 H new ATOM 0 HB2 SER C 89 47.300 -12.583 10.485 1.00 0.00 H new ATOM 0 HB3 SER C 89 48.647 -11.936 11.401 1.00 0.00 H new ATOM 0 HG SER C 89 49.183 -13.952 10.358 1.00 0.00 H new TER 1365 SER C 89 ATOM 1366 N ARG I 1 57.609 6.710 9.389 1.00 0.00 N ATOM 1367 CA ARG I 1 56.140 6.466 9.315 1.00 0.00 C ATOM 1368 C ARG I 1 55.619 6.802 7.914 1.00 0.00 C ATOM 1369 O ARG I 1 55.101 7.873 7.673 1.00 0.00 O ATOM 1370 CB ARG I 1 55.529 7.404 10.356 1.00 0.00 C ATOM 1371 CG ARG I 1 54.108 6.943 10.688 1.00 0.00 C ATOM 1372 CD ARG I 1 53.138 8.115 10.523 1.00 0.00 C ATOM 1373 NE ARG I 1 53.202 8.853 11.815 1.00 0.00 N ATOM 1374 CZ ARG I 1 52.122 9.385 12.317 1.00 0.00 C ATOM 1375 NH1 ARG I 1 51.062 8.647 12.511 1.00 0.00 N ATOM 1376 NH2 ARG I 1 52.098 10.654 12.623 1.00 0.00 N ATOM 0 H1 ARG I 1 57.952 6.479 10.343 1.00 0.00 H new ATOM 0 H2 ARG I 1 58.096 6.111 8.692 1.00 0.00 H new ATOM 0 H3 ARG I 1 57.806 7.710 9.183 1.00 0.00 H new ATOM 0 HA ARG I 1 55.883 5.424 9.507 1.00 0.00 H new ATOM 0 HB2 ARG I 1 56.141 7.411 11.258 1.00 0.00 H new ATOM 0 HB3 ARG I 1 55.512 8.425 9.975 1.00 0.00 H new ATOM 0 HG2 ARG I 1 53.818 6.122 10.032 1.00 0.00 H new ATOM 0 HG3 ARG I 1 54.067 6.564 11.709 1.00 0.00 H new ATOM 0 HD2 ARG I 1 53.429 8.754 9.689 1.00 0.00 H new ATOM 0 HD3 ARG I 1 52.126 7.764 10.318 1.00 0.00 H new ATOM 0 HE ARG I 1 54.091 8.942 12.308 1.00 0.00 H new ATOM 0 HH11 ARG I 1 51.079 7.656 12.270 1.00 0.00 H new ATOM 0 HH12 ARG I 1 50.217 9.062 12.903 1.00 0.00 H new ATOM 0 HH21 ARG I 1 52.925 11.231 12.470 1.00 0.00 H new ATOM 0 HH22 ARG I 1 51.252 11.068 13.015 1.00 0.00 H new ATOM 1392 N ILE I 2 55.755 5.892 6.988 1.00 0.00 N ATOM 1393 CA ILE I 2 55.269 6.157 5.604 1.00 0.00 C ATOM 1394 C ILE I 2 53.809 5.719 5.460 1.00 0.00 C ATOM 1395 O ILE I 2 53.327 4.881 6.196 1.00 0.00 O ATOM 1396 CB ILE I 2 56.170 5.317 4.700 1.00 0.00 C ATOM 1397 CG1 ILE I 2 57.633 5.696 4.945 1.00 0.00 C ATOM 1398 CG2 ILE I 2 55.814 5.581 3.236 1.00 0.00 C ATOM 1399 CD1 ILE I 2 58.545 4.770 4.138 1.00 0.00 C ATOM 0 H ILE I 2 56.182 4.977 7.130 1.00 0.00 H new ATOM 0 HA ILE I 2 55.309 7.216 5.350 1.00 0.00 H new ATOM 0 HB ILE I 2 56.025 4.260 4.924 1.00 0.00 H new ATOM 0 HG12 ILE I 2 57.804 6.733 4.656 1.00 0.00 H new ATOM 0 HG13 ILE I 2 57.866 5.618 6.007 1.00 0.00 H new ATOM 0 HG21 ILE I 2 56.457 4.982 2.591 1.00 0.00 H new ATOM 0 HG22 ILE I 2 54.772 5.312 3.061 1.00 0.00 H new ATOM 0 HG23 ILE I 2 55.959 6.638 3.011 1.00 0.00 H new ATOM 0 HD11 ILE I 2 59.586 5.041 4.314 1.00 0.00 H new ATOM 0 HD12 ILE I 2 58.382 3.738 4.448 1.00 0.00 H new ATOM 0 HD13 ILE I 2 58.318 4.870 3.077 1.00 0.00 H new ATOM 1411 N SER I 3 53.103 6.279 4.517 1.00 0.00 N ATOM 1412 CA SER I 3 51.675 5.895 4.325 1.00 0.00 C ATOM 1413 C SER I 3 51.534 4.988 3.098 1.00 0.00 C ATOM 1414 O SER I 3 52.325 4.090 2.886 1.00 0.00 O ATOM 1415 CB SER I 3 50.937 7.214 4.112 1.00 0.00 C ATOM 1416 OG SER I 3 49.544 6.958 3.985 1.00 0.00 O ATOM 0 H SER I 3 53.453 6.986 3.871 1.00 0.00 H new ATOM 0 HA SER I 3 51.275 5.341 5.174 1.00 0.00 H new ATOM 0 HB2 SER I 3 51.120 7.886 4.951 1.00 0.00 H new ATOM 0 HB3 SER I 3 51.310 7.712 3.217 1.00 0.00 H new ATOM 0 HG SER I 3 49.174 7.511 3.265 1.00 0.00 H new ATOM 1422 N ALA I 4 50.534 5.213 2.287 1.00 0.00 N ATOM 1423 CA ALA I 4 50.351 4.361 1.077 1.00 0.00 C ATOM 1424 C ALA I 4 49.519 5.104 0.028 1.00 0.00 C ATOM 1425 O ALA I 4 49.762 5.000 -1.158 1.00 0.00 O ATOM 1426 CB ALA I 4 49.602 3.124 1.575 1.00 0.00 C ATOM 0 H ALA I 4 49.838 5.948 2.410 1.00 0.00 H new ATOM 0 HA ALA I 4 51.299 4.103 0.606 1.00 0.00 H new ATOM 0 HB1 ALA I 4 49.428 2.444 0.741 1.00 0.00 H new ATOM 0 HB2 ALA I 4 50.198 2.620 2.336 1.00 0.00 H new ATOM 0 HB3 ALA I 4 48.646 3.425 2.003 1.00 0.00 H new ATOM 1432 N ASP I 5 48.540 5.851 0.456 1.00 0.00 N ATOM 1433 CA ASP I 5 47.690 6.599 -0.515 1.00 0.00 C ATOM 1434 C ASP I 5 48.547 7.560 -1.345 1.00 0.00 C ATOM 1435 O ASP I 5 48.482 7.573 -2.557 1.00 0.00 O ATOM 1436 CB ASP I 5 46.694 7.376 0.348 1.00 0.00 C ATOM 1437 CG ASP I 5 45.269 6.970 -0.027 1.00 0.00 C ATOM 1438 OD1 ASP I 5 45.084 5.837 -0.438 1.00 0.00 O ATOM 1439 OD2 ASP I 5 44.383 7.800 0.104 1.00 0.00 O ATOM 0 H ASP I 5 48.291 5.977 1.437 1.00 0.00 H new ATOM 0 HA ASP I 5 47.189 5.935 -1.220 1.00 0.00 H new ATOM 0 HB2 ASP I 5 46.875 7.173 1.403 1.00 0.00 H new ATOM 0 HB3 ASP I 5 46.829 8.448 0.202 1.00 0.00 H new ATOM 1444 N ALA I 6 49.342 8.369 -0.700 1.00 0.00 N ATOM 1445 CA ALA I 6 50.196 9.336 -1.451 1.00 0.00 C ATOM 1446 C ALA I 6 51.180 8.594 -2.362 1.00 0.00 C ATOM 1447 O ALA I 6 51.237 8.834 -3.552 1.00 0.00 O ATOM 1448 CB ALA I 6 50.950 10.115 -0.372 1.00 0.00 C ATOM 0 H ALA I 6 49.438 8.403 0.315 1.00 0.00 H new ATOM 0 HA ALA I 6 49.606 9.989 -2.095 1.00 0.00 H new ATOM 0 HB1 ALA I 6 51.603 10.850 -0.843 1.00 0.00 H new ATOM 0 HB2 ALA I 6 50.236 10.625 0.274 1.00 0.00 H new ATOM 0 HB3 ALA I 6 51.549 9.426 0.223 1.00 0.00 H new ATOM 1454 N MET I 7 51.957 7.703 -1.814 1.00 0.00 N ATOM 1455 CA MET I 7 52.941 6.952 -2.650 1.00 0.00 C ATOM 1456 C MET I 7 52.276 6.436 -3.929 1.00 0.00 C ATOM 1457 O MET I 7 52.732 6.696 -5.025 1.00 0.00 O ATOM 1458 CB MET I 7 53.395 5.784 -1.775 1.00 0.00 C ATOM 1459 CG MET I 7 54.796 5.342 -2.204 1.00 0.00 C ATOM 1460 SD MET I 7 55.088 3.640 -1.663 1.00 0.00 S ATOM 1461 CE MET I 7 56.742 3.458 -2.376 1.00 0.00 C ATOM 0 H MET I 7 51.955 7.460 -0.823 1.00 0.00 H new ATOM 0 HA MET I 7 53.776 7.580 -2.961 1.00 0.00 H new ATOM 0 HB2 MET I 7 53.401 6.082 -0.726 1.00 0.00 H new ATOM 0 HB3 MET I 7 52.695 4.953 -1.867 1.00 0.00 H new ATOM 0 HG2 MET I 7 54.895 5.412 -3.287 1.00 0.00 H new ATOM 0 HG3 MET I 7 55.546 6.005 -1.772 1.00 0.00 H new ATOM 0 HE1 MET I 7 57.263 2.638 -1.882 1.00 0.00 H new ATOM 0 HE2 MET I 7 56.657 3.245 -3.442 1.00 0.00 H new ATOM 0 HE3 MET I 7 57.303 4.382 -2.234 1.00 0.00 H new ATOM 1471 N MET I 8 51.206 5.703 -3.800 1.00 0.00 N ATOM 1472 CA MET I 8 50.521 5.169 -5.012 1.00 0.00 C ATOM 1473 C MET I 8 49.977 6.315 -5.867 1.00 0.00 C ATOM 1474 O MET I 8 49.778 6.174 -7.057 1.00 0.00 O ATOM 1475 CB MET I 8 49.380 4.306 -4.474 1.00 0.00 C ATOM 1476 CG MET I 8 49.876 2.872 -4.286 1.00 0.00 C ATOM 1477 SD MET I 8 51.169 2.842 -3.019 1.00 0.00 S ATOM 1478 CE MET I 8 52.579 3.107 -4.124 1.00 0.00 C ATOM 0 H MET I 8 50.776 5.450 -2.910 1.00 0.00 H new ATOM 0 HA MET I 8 51.197 4.598 -5.649 1.00 0.00 H new ATOM 0 HB2 MET I 8 49.022 4.706 -3.526 1.00 0.00 H new ATOM 0 HB3 MET I 8 48.538 4.324 -5.166 1.00 0.00 H new ATOM 0 HG2 MET I 8 49.049 2.225 -3.992 1.00 0.00 H new ATOM 0 HG3 MET I 8 50.265 2.484 -5.227 1.00 0.00 H new ATOM 0 HE1 MET I 8 53.314 2.317 -3.971 1.00 0.00 H new ATOM 0 HE2 MET I 8 52.238 3.090 -5.159 1.00 0.00 H new ATOM 0 HE3 MET I 8 53.034 4.073 -3.907 1.00 0.00 H new ATOM 1488 N GLN I 9 49.737 7.452 -5.274 1.00 0.00 N ATOM 1489 CA GLN I 9 49.209 8.604 -6.060 1.00 0.00 C ATOM 1490 C GLN I 9 50.359 9.329 -6.761 1.00 0.00 C ATOM 1491 O GLN I 9 50.347 9.521 -7.961 1.00 0.00 O ATOM 1492 CB GLN I 9 48.548 9.520 -5.030 1.00 0.00 C ATOM 1493 CG GLN I 9 47.164 9.933 -5.532 1.00 0.00 C ATOM 1494 CD GLN I 9 46.500 10.853 -4.506 1.00 0.00 C ATOM 1495 OE1 GLN I 9 47.008 11.914 -4.205 1.00 0.00 O ATOM 1496 NE2 GLN I 9 45.376 10.487 -3.951 1.00 0.00 N ATOM 0 H GLN I 9 49.883 7.634 -4.281 1.00 0.00 H new ATOM 0 HA GLN I 9 48.508 8.291 -6.833 1.00 0.00 H new ATOM 0 HB2 GLN I 9 48.461 9.006 -4.073 1.00 0.00 H new ATOM 0 HB3 GLN I 9 49.165 10.403 -4.863 1.00 0.00 H new ATOM 0 HG2 GLN I 9 47.251 10.444 -6.491 1.00 0.00 H new ATOM 0 HG3 GLN I 9 46.547 9.050 -5.696 1.00 0.00 H new ATOM 0 HE21 GLN I 9 44.949 9.596 -4.204 1.00 0.00 H new ATOM 0 HE22 GLN I 9 44.925 11.092 -3.265 1.00 0.00 H new ATOM 1505 N ALA I 10 51.355 9.730 -6.021 1.00 0.00 N ATOM 1506 CA ALA I 10 52.508 10.442 -6.642 1.00 0.00 C ATOM 1507 C ALA I 10 53.522 9.434 -7.184 1.00 0.00 C ATOM 1508 O ALA I 10 53.976 9.535 -8.306 1.00 0.00 O ATOM 1509 CB ALA I 10 53.132 11.246 -5.504 1.00 0.00 C ATOM 0 H ALA I 10 51.421 9.596 -5.012 1.00 0.00 H new ATOM 0 HA ALA I 10 52.200 11.072 -7.476 1.00 0.00 H new ATOM 0 HB1 ALA I 10 53.991 11.801 -5.880 1.00 0.00 H new ATOM 0 HB2 ALA I 10 52.396 11.943 -5.105 1.00 0.00 H new ATOM 0 HB3 ALA I 10 53.455 10.568 -4.714 1.00 0.00 H new ATOM 1515 N LEU I 11 53.886 8.472 -6.386 1.00 0.00 N ATOM 1516 CA LEU I 11 54.882 7.461 -6.839 1.00 0.00 C ATOM 1517 C LEU I 11 54.246 6.487 -7.835 1.00 0.00 C ATOM 1518 O LEU I 11 53.191 5.942 -7.583 1.00 0.00 O ATOM 1519 CB LEU I 11 55.296 6.725 -5.564 1.00 0.00 C ATOM 1520 CG LEU I 11 56.805 6.873 -5.314 1.00 0.00 C ATOM 1521 CD1 LEU I 11 57.268 5.774 -4.357 1.00 0.00 C ATOM 1522 CD2 LEU I 11 57.590 6.756 -6.628 1.00 0.00 C ATOM 0 H LEU I 11 53.537 8.341 -5.437 1.00 0.00 H new ATOM 0 HA LEU I 11 55.730 7.919 -7.348 1.00 0.00 H new ATOM 0 HB2 LEU I 11 54.741 7.121 -4.714 1.00 0.00 H new ATOM 0 HB3 LEU I 11 55.039 5.669 -5.648 1.00 0.00 H new ATOM 0 HG LEU I 11 56.990 7.856 -4.881 1.00 0.00 H new ATOM 0 HD11 LEU I 11 58.338 5.875 -4.177 1.00 0.00 H new ATOM 0 HD12 LEU I 11 56.731 5.864 -3.413 1.00 0.00 H new ATOM 0 HD13 LEU I 11 57.065 4.798 -4.798 1.00 0.00 H new ATOM 0 HD21 LEU I 11 58.656 6.864 -6.426 1.00 0.00 H new ATOM 0 HD22 LEU I 11 57.403 5.781 -7.078 1.00 0.00 H new ATOM 0 HD23 LEU I 11 57.270 7.540 -7.314 1.00 0.00 H new ATOM 1534 N LEU I 12 54.896 6.270 -8.957 1.00 0.00 N ATOM 1535 CA LEU I 12 54.369 5.330 -10.002 1.00 0.00 C ATOM 1536 C LEU I 12 52.846 5.173 -9.908 1.00 0.00 C ATOM 1537 O LEU I 12 52.343 4.162 -9.459 1.00 0.00 O ATOM 1538 CB LEU I 12 55.069 3.991 -9.736 1.00 0.00 C ATOM 1539 CG LEU I 12 55.121 3.712 -8.233 1.00 0.00 C ATOM 1540 CD1 LEU I 12 55.116 2.202 -7.993 1.00 0.00 C ATOM 1541 CD2 LEU I 12 56.403 4.312 -7.650 1.00 0.00 C ATOM 0 H LEU I 12 55.784 6.712 -9.196 1.00 0.00 H new ATOM 0 HA LEU I 12 54.569 5.706 -11.005 1.00 0.00 H new ATOM 0 HB2 LEU I 12 54.537 3.187 -10.244 1.00 0.00 H new ATOM 0 HB3 LEU I 12 56.079 4.013 -10.144 1.00 0.00 H new ATOM 0 HG LEU I 12 54.253 4.160 -7.750 1.00 0.00 H new ATOM 0 HD11 LEU I 12 55.153 2.004 -6.922 1.00 0.00 H new ATOM 0 HD12 LEU I 12 54.207 1.770 -8.411 1.00 0.00 H new ATOM 0 HD13 LEU I 12 55.985 1.754 -8.475 1.00 0.00 H new ATOM 0 HD21 LEU I 12 56.443 4.115 -6.579 1.00 0.00 H new ATOM 0 HD22 LEU I 12 57.269 3.861 -8.134 1.00 0.00 H new ATOM 0 HD23 LEU I 12 56.411 5.388 -7.821 1.00 0.00 H new ATOM 1553 N GLY I 13 52.109 6.166 -10.327 1.00 0.00 N ATOM 1554 CA GLY I 13 50.622 6.072 -10.261 1.00 0.00 C ATOM 1555 C GLY I 13 50.002 7.188 -11.104 1.00 0.00 C ATOM 1556 O GLY I 13 50.607 7.684 -12.033 1.00 0.00 O ATOM 0 H GLY I 13 52.472 7.038 -10.712 1.00 0.00 H new ATOM 0 HA2 GLY I 13 50.292 5.100 -10.626 1.00 0.00 H new ATOM 0 HA3 GLY I 13 50.287 6.154 -9.227 1.00 0.00 H new ATOM 1560 N ALA I 14 48.800 7.589 -10.788 1.00 0.00 N ATOM 1561 CA ALA I 14 48.147 8.675 -11.574 1.00 0.00 C ATOM 1562 C ALA I 14 49.141 9.812 -11.819 1.00 0.00 C ATOM 1563 O ALA I 14 49.299 10.699 -11.005 1.00 0.00 O ATOM 1564 CB ALA I 14 46.987 9.157 -10.702 1.00 0.00 C ATOM 0 H ALA I 14 48.243 7.212 -10.021 1.00 0.00 H new ATOM 0 HA ALA I 14 47.804 8.331 -12.550 1.00 0.00 H new ATOM 0 HB1 ALA I 14 46.456 9.959 -11.214 1.00 0.00 H new ATOM 0 HB2 ALA I 14 46.303 8.329 -10.517 1.00 0.00 H new ATOM 0 HB3 ALA I 14 47.375 9.527 -9.753 1.00 0.00 H new ATOM 1570 N ARG I 15 49.817 9.791 -12.935 1.00 0.00 N ATOM 1571 CA ARG I 15 50.804 10.868 -13.227 1.00 0.00 C ATOM 1572 C ARG I 15 51.111 10.913 -14.727 1.00 0.00 C ATOM 1573 O ARG I 15 51.129 9.900 -15.397 1.00 0.00 O ATOM 1574 CB ARG I 15 52.053 10.479 -12.435 1.00 0.00 C ATOM 1575 CG ARG I 15 52.610 11.711 -11.719 1.00 0.00 C ATOM 1576 CD ARG I 15 51.939 11.854 -10.352 1.00 0.00 C ATOM 1577 NE ARG I 15 51.156 13.119 -10.442 1.00 0.00 N ATOM 1578 CZ ARG I 15 49.881 13.116 -10.167 1.00 0.00 C ATOM 1579 NH1 ARG I 15 49.481 13.092 -8.925 1.00 0.00 N ATOM 1580 NH2 ARG I 15 49.004 13.139 -11.134 1.00 0.00 N ATOM 0 H ARG I 15 49.728 9.075 -13.656 1.00 0.00 H new ATOM 0 HA ARG I 15 50.435 11.856 -12.951 1.00 0.00 H new ATOM 0 HB2 ARG I 15 51.809 9.703 -11.709 1.00 0.00 H new ATOM 0 HB3 ARG I 15 52.806 10.063 -13.105 1.00 0.00 H new ATOM 0 HG2 ARG I 15 53.689 11.617 -11.598 1.00 0.00 H new ATOM 0 HG3 ARG I 15 52.433 12.604 -12.318 1.00 0.00 H new ATOM 0 HD2 ARG I 15 51.292 11.003 -10.138 1.00 0.00 H new ATOM 0 HD3 ARG I 15 52.678 11.902 -9.552 1.00 0.00 H new ATOM 0 HE ARG I 15 51.617 13.986 -10.718 1.00 0.00 H new ATOM 0 HH11 ARG I 15 50.166 13.076 -8.169 1.00 0.00 H new ATOM 0 HH12 ARG I 15 48.484 13.090 -8.710 1.00 0.00 H new ATOM 0 HH21 ARG I 15 49.316 13.159 -12.105 1.00 0.00 H new ATOM 0 HH22 ARG I 15 48.007 13.137 -10.918 1.00 0.00 H new ATOM 1594 N ALA I 16 51.357 12.080 -15.257 1.00 0.00 N ATOM 1595 CA ALA I 16 51.665 12.188 -16.712 1.00 0.00 C ATOM 1596 C ALA I 16 53.165 12.426 -16.918 1.00 0.00 C ATOM 1597 O ALA I 16 53.787 13.181 -16.197 1.00 0.00 O ATOM 1598 CB ALA I 16 50.858 13.392 -17.200 1.00 0.00 C ATOM 0 H ALA I 16 51.358 12.963 -14.746 1.00 0.00 H new ATOM 0 HA ALA I 16 51.410 11.279 -17.257 1.00 0.00 H new ATOM 0 HB1 ALA I 16 51.031 13.538 -18.266 1.00 0.00 H new ATOM 0 HB2 ALA I 16 49.797 13.213 -17.026 1.00 0.00 H new ATOM 0 HB3 ALA I 16 51.170 14.284 -16.656 1.00 0.00 H new ATOM 1604 N LYS I 17 53.748 11.789 -17.897 1.00 0.00 N ATOM 1605 CA LYS I 17 55.206 11.980 -18.147 1.00 0.00 C ATOM 1606 C LYS I 17 55.584 11.418 -19.521 1.00 0.00 C ATOM 1607 O LYS I 17 54.683 11.154 -20.300 1.00 0.00 O ATOM 1608 CB LYS I 17 55.907 11.197 -17.036 1.00 0.00 C ATOM 1609 CG LYS I 17 55.441 9.739 -17.067 1.00 0.00 C ATOM 1610 CD LYS I 17 56.631 8.817 -16.789 1.00 0.00 C ATOM 1611 CE LYS I 17 57.109 8.190 -18.100 1.00 0.00 C ATOM 1612 NZ LYS I 17 56.125 7.111 -18.392 1.00 0.00 N ATOM 1613 OXT LYS I 17 56.768 11.261 -19.769 1.00 0.00 O ATOM 0 H LYS I 17 53.279 11.145 -18.534 1.00 0.00 H new ATOM 0 HA LYS I 17 55.491 13.032 -18.144 1.00 0.00 H new ATOM 0 HB2 LYS I 17 56.988 11.247 -17.167 1.00 0.00 H new ATOM 0 HB3 LYS I 17 55.683 11.641 -16.066 1.00 0.00 H new ATOM 0 HG2 LYS I 17 54.662 9.579 -16.322 1.00 0.00 H new ATOM 0 HG3 LYS I 17 55.006 9.506 -18.039 1.00 0.00 H new ATOM 0 HD2 LYS I 17 57.441 9.381 -16.327 1.00 0.00 H new ATOM 0 HD3 LYS I 17 56.343 8.037 -16.084 1.00 0.00 H new ATOM 0 HE2 LYS I 17 57.137 8.927 -18.903 1.00 0.00 H new ATOM 0 HE3 LYS I 17 58.117 7.788 -18.001 1.00 0.00 H new ATOM 0 HZ1 LYS I 17 56.610 6.191 -18.399 1.00 0.00 H new ATOM 0 HZ2 LYS I 17 55.386 7.107 -17.660 1.00 0.00 H new ATOM 0 HZ3 LYS I 17 55.690 7.280 -19.322 1.00 0.00 H new TER 1627 LYS I 17 HETATM 1628 CA CA C 90 69.843 -4.957 4.103 1.00 0.00 CA