USER MOD reduce.3.24.130724 H: found=0, std=0, add=833, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 837 hydrogens (34 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 80 MET CE :methyl 149:sc= -5.01! (180deg=-2.76!) USER MOD Set 1.2: C 81 MET CE :methyl 135:sc= -2.31 (180deg=-3.13) USER MOD Single : C 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 1 MET N :NH3+ 180:sc= 0 (180deg=0) 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= -0.0449 K(o=-0.045,f=-0.83) USER MOD Single : C 13 THR OG1 : rot -170:sc= 0.0123 USER MOD Single : C 16 GLN : amide:sc= -9.96! C(o=-10!,f=-10!) USER MOD Single : C 17 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00146) USER MOD Single : C 18 ASN : amide:sc= -1.59 K(o=-1.6,f=-3.5!) USER MOD Single : C 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 35 CYS SG : rot 101:sc= 0.253 USER MOD Single : C 37 SER OG : rot 180:sc= -0.648 USER MOD Single : C 38 THR OG1 : rot 180:sc= -0.0173 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 -154:sc= -3.23! (180deg=-4.84!) USER MOD Single : C 47 MET CE :methyl -121:sc= -5.33! (180deg=-9.95!) USER MOD Single : C 50 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : C 51 ASN : amide:sc= -1.38! X(o=-1.4!,f=-1) USER MOD Single : C 53 THR OG1 : rot 180:sc= 0 USER MOD Single : C 58 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : C 60 MET CE :methyl -160:sc= -3.48 (180deg=-4.88!) USER MOD Single : C 71 THR OG1 : rot -160:sc= -0.875 USER MOD Single : C 84 CYS SG : rot 94:sc= -0.583 USER MOD Single : C 85 MET CE :methyl 155:sc= -1.34 (180deg=-2.33!) USER MOD Single : C 86 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0263) USER MOD Single : C 89 SER OG : rot 180:sc= 0 USER MOD Single : I 149 SER OG : rot 180:sc= 0 USER MOD Single : I 153 MET CE :methyl 178:sc= -2.63 (180deg=-2.76) USER MOD Single : I 154 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : I 155 GLN : amide:sc= -0.759 K(o=-0.76,f=-0.015) USER MOD Single : I 163 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET C 1 90.052 -20.521 -4.571 1.00 0.00 N ATOM 2 CA MET C 1 89.106 -19.994 -5.595 1.00 0.00 C ATOM 3 C MET C 1 87.869 -19.437 -4.898 1.00 0.00 C ATOM 4 O MET C 1 86.813 -20.070 -4.880 1.00 0.00 O ATOM 5 CB MET C 1 88.696 -21.125 -6.540 1.00 0.00 C ATOM 6 CG MET C 1 89.417 -20.956 -7.878 1.00 0.00 C ATOM 7 SD MET C 1 88.221 -21.090 -9.229 1.00 0.00 S ATOM 8 CE MET C 1 88.208 -22.896 -9.343 1.00 0.00 C ATOM 0 H1 MET C 1 90.897 -20.902 -5.042 1.00 0.00 H new ATOM 0 H2 MET C 1 90.331 -19.753 -3.928 1.00 0.00 H new ATOM 0 H3 MET C 1 89.589 -21.277 -4.027 1.00 0.00 H new ATOM 0 HA MET C 1 89.589 -19.202 -6.168 1.00 0.00 H new ATOM 0 HB2 MET C 1 88.946 -22.090 -6.099 1.00 0.00 H new ATOM 0 HB3 MET C 1 87.617 -21.113 -6.692 1.00 0.00 H new ATOM 0 HG2 MET C 1 89.916 -19.988 -7.915 1.00 0.00 H new ATOM 0 HG3 MET C 1 90.190 -21.717 -7.985 1.00 0.00 H new ATOM 0 HE1 MET C 1 87.522 -23.206 -10.131 1.00 0.00 H new ATOM 0 HE2 MET C 1 89.211 -23.253 -9.575 1.00 0.00 H new ATOM 0 HE3 MET C 1 87.883 -23.318 -8.392 1.00 0.00 H new ATOM 20 N ASP C 2 88.020 -18.247 -4.319 1.00 0.00 N ATOM 21 CA ASP C 2 86.918 -17.598 -3.608 1.00 0.00 C ATOM 22 C ASP C 2 86.892 -18.049 -2.152 1.00 0.00 C ATOM 23 O ASP C 2 86.704 -17.244 -1.240 1.00 0.00 O ATOM 24 CB ASP C 2 85.574 -17.933 -4.260 1.00 0.00 C ATOM 25 CG ASP C 2 84.673 -16.703 -4.234 1.00 0.00 C ATOM 26 OD1 ASP C 2 85.111 -15.682 -3.730 1.00 0.00 O ATOM 27 OD2 ASP C 2 83.558 -16.801 -4.720 1.00 0.00 O ATOM 0 H ASP C 2 88.890 -17.714 -4.327 1.00 0.00 H new ATOM 0 HA ASP C 2 87.077 -16.521 -3.657 1.00 0.00 H new ATOM 0 HB2 ASP C 2 85.729 -18.261 -5.288 1.00 0.00 H new ATOM 0 HB3 ASP C 2 85.097 -18.757 -3.730 1.00 0.00 H new ATOM 32 N ASP C 3 87.089 -19.348 -1.944 1.00 0.00 N ATOM 33 CA ASP C 3 87.092 -19.900 -0.593 1.00 0.00 C ATOM 34 C ASP C 3 87.929 -19.022 0.329 1.00 0.00 C ATOM 35 O ASP C 3 87.410 -18.370 1.235 1.00 0.00 O ATOM 36 CB ASP C 3 87.676 -21.314 -0.596 1.00 0.00 C ATOM 37 CG ASP C 3 86.804 -22.224 -1.455 1.00 0.00 C ATOM 38 OD1 ASP C 3 85.630 -21.924 -1.600 1.00 0.00 O ATOM 39 OD2 ASP C 3 87.324 -23.208 -1.957 1.00 0.00 O ATOM 0 H ASP C 3 87.247 -20.031 -2.685 1.00 0.00 H new ATOM 0 HA ASP C 3 86.063 -19.933 -0.236 1.00 0.00 H new ATOM 0 HB2 ASP C 3 88.695 -21.297 -0.984 1.00 0.00 H new ATOM 0 HB3 ASP C 3 87.729 -21.699 0.422 1.00 0.00 H new ATOM 44 N ILE C 4 89.234 -19.013 0.081 1.00 0.00 N ATOM 45 CA ILE C 4 90.150 -18.212 0.886 1.00 0.00 C ATOM 46 C ILE C 4 89.506 -16.879 1.249 1.00 0.00 C ATOM 47 O ILE C 4 89.760 -16.320 2.316 1.00 0.00 O ATOM 48 CB ILE C 4 91.444 -17.957 0.111 1.00 0.00 C ATOM 49 CG1 ILE C 4 91.172 -16.936 -1.005 1.00 0.00 C ATOM 50 CG2 ILE C 4 91.931 -19.279 -0.491 1.00 0.00 C ATOM 51 CD1 ILE C 4 92.201 -17.092 -2.130 1.00 0.00 C ATOM 0 H ILE C 4 89.679 -19.547 -0.665 1.00 0.00 H new ATOM 0 HA ILE C 4 90.378 -18.760 1.800 1.00 0.00 H new ATOM 0 HB ILE C 4 92.210 -17.560 0.777 1.00 0.00 H new ATOM 0 HG12 ILE C 4 90.166 -17.078 -1.400 1.00 0.00 H new ATOM 0 HG13 ILE C 4 91.215 -15.925 -0.601 1.00 0.00 H new ATOM 0 HG21 ILE C 4 92.853 -19.108 -1.046 1.00 0.00 H new ATOM 0 HG22 ILE C 4 92.116 -19.997 0.308 1.00 0.00 H new ATOM 0 HG23 ILE C 4 91.170 -19.674 -1.164 1.00 0.00 H new ATOM 0 HD11 ILE C 4 91.997 -16.363 -2.914 1.00 0.00 H new ATOM 0 HD12 ILE C 4 93.202 -16.927 -1.733 1.00 0.00 H new ATOM 0 HD13 ILE C 4 92.137 -18.098 -2.545 1.00 0.00 H new ATOM 63 N TYR C 5 88.662 -16.379 0.350 1.00 0.00 N ATOM 64 CA TYR C 5 87.977 -15.112 0.585 1.00 0.00 C ATOM 65 C TYR C 5 86.709 -15.345 1.399 1.00 0.00 C ATOM 66 O TYR C 5 86.398 -14.590 2.321 1.00 0.00 O ATOM 67 CB TYR C 5 87.612 -14.441 -0.740 1.00 0.00 C ATOM 68 CG TYR C 5 88.875 -14.004 -1.443 1.00 0.00 C ATOM 69 CD1 TYR C 5 89.461 -12.772 -1.129 1.00 0.00 C ATOM 70 CD2 TYR C 5 89.461 -14.833 -2.408 1.00 0.00 C ATOM 71 CE1 TYR C 5 90.634 -12.368 -1.779 1.00 0.00 C ATOM 72 CE2 TYR C 5 90.634 -14.430 -3.058 1.00 0.00 C ATOM 73 CZ TYR C 5 91.220 -13.198 -2.743 1.00 0.00 C ATOM 74 OH TYR C 5 92.377 -12.801 -3.383 1.00 0.00 O ATOM 0 H TYR C 5 88.438 -16.827 -0.539 1.00 0.00 H new ATOM 0 HA TYR C 5 88.651 -14.459 1.139 1.00 0.00 H new ATOM 0 HB2 TYR C 5 87.053 -15.133 -1.369 1.00 0.00 H new ATOM 0 HB3 TYR C 5 86.966 -13.581 -0.560 1.00 0.00 H new ATOM 0 HD1 TYR C 5 89.008 -12.133 -0.385 1.00 0.00 H new ATOM 0 HD2 TYR C 5 89.008 -15.783 -2.651 1.00 0.00 H new ATOM 0 HE1 TYR C 5 91.086 -11.417 -1.537 1.00 0.00 H new ATOM 0 HE2 TYR C 5 91.086 -15.069 -3.802 1.00 0.00 H new ATOM 0 HH TYR C 5 92.652 -13.492 -4.021 1.00 0.00 H new ATOM 84 N LYS C 6 85.984 -16.407 1.055 1.00 0.00 N ATOM 85 CA LYS C 6 84.756 -16.738 1.770 1.00 0.00 C ATOM 86 C LYS C 6 84.998 -16.672 3.273 1.00 0.00 C ATOM 87 O LYS C 6 84.214 -16.087 4.021 1.00 0.00 O ATOM 88 CB LYS C 6 84.282 -18.146 1.403 1.00 0.00 C ATOM 89 CG LYS C 6 83.663 -18.129 0.005 1.00 0.00 C ATOM 90 CD LYS C 6 82.252 -17.543 0.079 1.00 0.00 C ATOM 91 CE LYS C 6 81.232 -18.680 0.161 1.00 0.00 C ATOM 92 NZ LYS C 6 79.862 -18.110 0.294 1.00 0.00 N ATOM 0 H LYS C 6 86.222 -17.045 0.296 1.00 0.00 H new ATOM 0 HA LYS C 6 83.990 -16.017 1.485 1.00 0.00 H new ATOM 0 HB2 LYS C 6 85.120 -18.842 1.432 1.00 0.00 H new ATOM 0 HB3 LYS C 6 83.551 -18.496 2.132 1.00 0.00 H new ATOM 0 HG2 LYS C 6 84.280 -17.536 -0.670 1.00 0.00 H new ATOM 0 HG3 LYS C 6 83.628 -19.140 -0.401 1.00 0.00 H new ATOM 0 HD2 LYS C 6 82.161 -16.895 0.951 1.00 0.00 H new ATOM 0 HD3 LYS C 6 82.056 -16.927 -0.798 1.00 0.00 H new ATOM 0 HE2 LYS C 6 81.293 -19.303 -0.731 1.00 0.00 H new ATOM 0 HE3 LYS C 6 81.455 -19.322 1.013 1.00 0.00 H new ATOM 0 HZ1 LYS C 6 79.168 -18.883 0.350 1.00 0.00 H new ATOM 0 HZ2 LYS C 6 79.808 -17.533 1.158 1.00 0.00 H new ATOM 0 HZ3 LYS C 6 79.652 -17.515 -0.533 1.00 0.00 H new ATOM 106 N ALA C 7 86.102 -17.278 3.705 1.00 0.00 N ATOM 107 CA ALA C 7 86.453 -17.281 5.121 1.00 0.00 C ATOM 108 C ALA C 7 86.652 -15.853 5.614 1.00 0.00 C ATOM 109 O ALA C 7 85.927 -15.376 6.487 1.00 0.00 O ATOM 110 CB ALA C 7 87.740 -18.074 5.354 1.00 0.00 C ATOM 0 H ALA C 7 86.762 -17.768 3.101 1.00 0.00 H new ATOM 0 HA ALA C 7 85.638 -17.750 5.672 1.00 0.00 H new ATOM 0 HB1 ALA C 7 87.986 -18.065 6.416 1.00 0.00 H new ATOM 0 HB2 ALA C 7 87.598 -19.103 5.023 1.00 0.00 H new ATOM 0 HB3 ALA C 7 88.554 -17.620 4.789 1.00 0.00 H new ATOM 116 N ALA C 8 87.640 -15.172 5.039 1.00 0.00 N ATOM 117 CA ALA C 8 87.918 -13.793 5.424 1.00 0.00 C ATOM 118 C ALA C 8 86.621 -12.992 5.473 1.00 0.00 C ATOM 119 O ALA C 8 86.474 -12.066 6.272 1.00 0.00 O ATOM 120 CB ALA C 8 88.873 -13.137 4.425 1.00 0.00 C ATOM 0 H ALA C 8 88.253 -15.547 4.315 1.00 0.00 H new ATOM 0 HA ALA C 8 88.382 -13.802 6.410 1.00 0.00 H new ATOM 0 HB1 ALA C 8 89.068 -12.109 4.730 1.00 0.00 H new ATOM 0 HB2 ALA C 8 89.811 -13.692 4.400 1.00 0.00 H new ATOM 0 HB3 ALA C 8 88.422 -13.142 3.433 1.00 0.00 H new ATOM 126 N VAL C 9 85.681 -13.365 4.608 1.00 0.00 N ATOM 127 CA VAL C 9 84.390 -12.684 4.555 1.00 0.00 C ATOM 128 C VAL C 9 83.423 -13.304 5.558 1.00 0.00 C ATOM 129 O VAL C 9 82.458 -12.672 5.986 1.00 0.00 O ATOM 130 CB VAL C 9 83.783 -12.786 3.154 1.00 0.00 C ATOM 131 CG1 VAL C 9 82.353 -12.246 3.178 1.00 0.00 C ATOM 132 CG2 VAL C 9 84.619 -11.965 2.169 1.00 0.00 C ATOM 0 H VAL C 9 85.787 -14.128 3.940 1.00 0.00 H new ATOM 0 HA VAL C 9 84.554 -11.635 4.802 1.00 0.00 H new ATOM 0 HB VAL C 9 83.775 -13.830 2.840 1.00 0.00 H new ATOM 0 HG11 VAL C 9 81.920 -12.318 2.180 1.00 0.00 H new ATOM 0 HG12 VAL C 9 81.755 -12.831 3.877 1.00 0.00 H new ATOM 0 HG13 VAL C 9 82.363 -11.203 3.494 1.00 0.00 H new ATOM 0 HG21 VAL C 9 84.184 -12.040 1.172 1.00 0.00 H new ATOM 0 HG22 VAL C 9 84.630 -10.921 2.483 1.00 0.00 H new ATOM 0 HG23 VAL C 9 85.639 -12.349 2.150 1.00 0.00 H new ATOM 142 N GLU C 10 83.700 -14.550 5.931 1.00 0.00 N ATOM 143 CA GLU C 10 82.856 -15.255 6.891 1.00 0.00 C ATOM 144 C GLU C 10 83.306 -14.924 8.306 1.00 0.00 C ATOM 145 O GLU C 10 82.492 -14.652 9.189 1.00 0.00 O ATOM 146 CB GLU C 10 82.944 -16.767 6.677 1.00 0.00 C ATOM 147 CG GLU C 10 81.992 -17.178 5.553 1.00 0.00 C ATOM 148 CD GLU C 10 80.744 -17.818 6.153 1.00 0.00 C ATOM 149 OE1 GLU C 10 80.615 -17.794 7.366 1.00 0.00 O ATOM 150 OE2 GLU C 10 79.936 -18.321 5.391 1.00 0.00 O ATOM 0 H GLU C 10 84.495 -15.089 5.587 1.00 0.00 H new ATOM 0 HA GLU C 10 81.824 -14.936 6.744 1.00 0.00 H new ATOM 0 HB2 GLU C 10 83.966 -17.051 6.425 1.00 0.00 H new ATOM 0 HB3 GLU C 10 82.686 -17.291 7.597 1.00 0.00 H new ATOM 0 HG2 GLU C 10 81.717 -16.307 4.958 1.00 0.00 H new ATOM 0 HG3 GLU C 10 82.487 -17.880 4.881 1.00 0.00 H new ATOM 157 N GLN C 11 84.619 -14.937 8.502 1.00 0.00 N ATOM 158 CA GLN C 11 85.190 -14.623 9.804 1.00 0.00 C ATOM 159 C GLN C 11 84.507 -13.392 10.382 1.00 0.00 C ATOM 160 O GLN C 11 84.349 -13.259 11.596 1.00 0.00 O ATOM 161 CB GLN C 11 86.685 -14.338 9.667 1.00 0.00 C ATOM 162 CG GLN C 11 87.393 -15.571 9.093 1.00 0.00 C ATOM 163 CD GLN C 11 87.587 -16.612 10.191 1.00 0.00 C ATOM 164 OE1 GLN C 11 87.936 -16.274 11.322 1.00 0.00 O ATOM 165 NE2 GLN C 11 87.381 -17.873 9.922 1.00 0.00 N ATOM 0 H GLN C 11 85.304 -15.160 7.780 1.00 0.00 H new ATOM 0 HA GLN C 11 85.040 -15.476 10.465 1.00 0.00 H new ATOM 0 HB2 GLN C 11 86.843 -13.479 9.015 1.00 0.00 H new ATOM 0 HB3 GLN C 11 87.107 -14.083 10.639 1.00 0.00 H new ATOM 0 HG2 GLN C 11 86.805 -15.993 8.278 1.00 0.00 H new ATOM 0 HG3 GLN C 11 88.358 -15.286 8.675 1.00 0.00 H new ATOM 0 HE21 GLN C 11 87.092 -18.154 8.985 1.00 0.00 H new ATOM 0 HE22 GLN C 11 87.509 -18.577 10.649 1.00 0.00 H new ATOM 174 N LEU C 12 84.106 -12.491 9.491 1.00 0.00 N ATOM 175 CA LEU C 12 83.441 -11.264 9.907 1.00 0.00 C ATOM 176 C LEU C 12 82.036 -11.565 10.421 1.00 0.00 C ATOM 177 O LEU C 12 81.169 -12.016 9.673 1.00 0.00 O ATOM 178 CB LEU C 12 83.343 -10.288 8.735 1.00 0.00 C ATOM 179 CG LEU C 12 84.692 -10.216 8.020 1.00 0.00 C ATOM 180 CD1 LEU C 12 84.674 -9.070 7.007 1.00 0.00 C ATOM 181 CD2 LEU C 12 85.795 -9.967 9.051 1.00 0.00 C ATOM 0 H LEU C 12 84.229 -12.587 8.483 1.00 0.00 H new ATOM 0 HA LEU C 12 84.031 -10.816 10.706 1.00 0.00 H new ATOM 0 HB2 LEU C 12 82.568 -10.613 8.041 1.00 0.00 H new ATOM 0 HB3 LEU C 12 83.056 -9.300 9.094 1.00 0.00 H new ATOM 0 HG LEU C 12 84.880 -11.155 7.500 1.00 0.00 H new ATOM 0 HD11 LEU C 12 85.636 -9.019 6.498 1.00 0.00 H new ATOM 0 HD12 LEU C 12 83.885 -9.243 6.275 1.00 0.00 H new ATOM 0 HD13 LEU C 12 84.488 -8.129 7.525 1.00 0.00 H new ATOM 0 HD21 LEU C 12 86.760 -9.915 8.546 1.00 0.00 H new ATOM 0 HD22 LEU C 12 85.604 -9.026 9.568 1.00 0.00 H new ATOM 0 HD23 LEU C 12 85.808 -10.782 9.774 1.00 0.00 H new ATOM 193 N THR C 13 81.822 -11.309 11.708 1.00 0.00 N ATOM 194 CA THR C 13 80.517 -11.554 12.315 1.00 0.00 C ATOM 195 C THR C 13 79.547 -10.434 11.957 1.00 0.00 C ATOM 196 O THR C 13 79.904 -9.483 11.261 1.00 0.00 O ATOM 197 CB THR C 13 80.642 -11.637 13.838 1.00 0.00 C ATOM 198 OG1 THR C 13 81.409 -10.537 14.309 1.00 0.00 O ATOM 199 CG2 THR C 13 81.333 -12.946 14.225 1.00 0.00 C ATOM 0 H THR C 13 82.526 -10.936 12.345 1.00 0.00 H new ATOM 0 HA THR C 13 80.138 -12.501 11.930 1.00 0.00 H new ATOM 0 HB THR C 13 79.649 -11.607 14.287 1.00 0.00 H new ATOM 0 HG1 THR C 13 81.624 -10.670 15.256 1.00 0.00 H new ATOM 0 HG21 THR C 13 81.421 -13.004 15.310 1.00 0.00 H new ATOM 0 HG22 THR C 13 80.744 -13.789 13.863 1.00 0.00 H new ATOM 0 HG23 THR C 13 82.326 -12.979 13.778 1.00 0.00 H new ATOM 207 N GLU C 14 78.316 -10.556 12.441 1.00 0.00 N ATOM 208 CA GLU C 14 77.298 -9.546 12.167 1.00 0.00 C ATOM 209 C GLU C 14 77.702 -8.207 12.776 1.00 0.00 C ATOM 210 O GLU C 14 77.136 -7.164 12.450 1.00 0.00 O ATOM 211 CB GLU C 14 75.952 -9.973 12.752 1.00 0.00 C ATOM 212 CG GLU C 14 75.212 -10.850 11.741 1.00 0.00 C ATOM 213 CD GLU C 14 73.708 -10.675 11.916 1.00 0.00 C ATOM 214 OE1 GLU C 14 73.316 -9.788 12.657 1.00 0.00 O ATOM 215 OE2 GLU C 14 72.969 -11.432 11.307 1.00 0.00 O ATOM 0 H GLU C 14 78.000 -11.335 13.019 1.00 0.00 H new ATOM 0 HA GLU C 14 77.207 -9.442 11.086 1.00 0.00 H new ATOM 0 HB2 GLU C 14 76.105 -10.521 13.682 1.00 0.00 H new ATOM 0 HB3 GLU C 14 75.354 -9.095 12.994 1.00 0.00 H new ATOM 0 HG2 GLU C 14 75.504 -10.579 10.727 1.00 0.00 H new ATOM 0 HG3 GLU C 14 75.485 -11.896 11.883 1.00 0.00 H new ATOM 222 N GLU C 15 78.688 -8.251 13.669 1.00 0.00 N ATOM 223 CA GLU C 15 79.163 -7.036 14.326 1.00 0.00 C ATOM 224 C GLU C 15 79.840 -6.112 13.321 1.00 0.00 C ATOM 225 O GLU C 15 79.331 -5.037 13.003 1.00 0.00 O ATOM 226 CB GLU C 15 80.163 -7.382 15.430 1.00 0.00 C ATOM 227 CG GLU C 15 79.556 -8.437 16.356 1.00 0.00 C ATOM 228 CD GLU C 15 80.015 -8.182 17.788 1.00 0.00 C ATOM 229 OE1 GLU C 15 79.442 -7.315 18.428 1.00 0.00 O ATOM 230 OE2 GLU C 15 80.933 -8.857 18.224 1.00 0.00 O ATOM 0 H GLU C 15 79.169 -9.105 13.952 1.00 0.00 H new ATOM 0 HA GLU C 15 78.299 -6.531 14.759 1.00 0.00 H new ATOM 0 HB2 GLU C 15 81.089 -7.756 14.993 1.00 0.00 H new ATOM 0 HB3 GLU C 15 80.418 -6.487 15.998 1.00 0.00 H new ATOM 0 HG2 GLU C 15 78.468 -8.403 16.300 1.00 0.00 H new ATOM 0 HG3 GLU C 15 79.860 -9.434 16.037 1.00 0.00 H new ATOM 237 N GLN C 16 81.001 -6.539 12.830 1.00 0.00 N ATOM 238 CA GLN C 16 81.747 -5.737 11.866 1.00 0.00 C ATOM 239 C GLN C 16 80.902 -5.519 10.610 1.00 0.00 C ATOM 240 O GLN C 16 80.805 -4.405 10.096 1.00 0.00 O ATOM 241 CB GLN C 16 83.096 -6.421 11.531 1.00 0.00 C ATOM 242 CG GLN C 16 83.224 -6.739 10.033 1.00 0.00 C ATOM 243 CD GLN C 16 84.690 -6.990 9.695 1.00 0.00 C ATOM 244 OE1 GLN C 16 85.416 -7.611 10.472 1.00 0.00 O ATOM 245 NE2 GLN C 16 85.174 -6.535 8.572 1.00 0.00 N ATOM 0 H GLN C 16 81.441 -7.425 13.080 1.00 0.00 H new ATOM 0 HA GLN C 16 81.969 -4.762 12.299 1.00 0.00 H new ATOM 0 HB2 GLN C 16 83.917 -5.772 11.835 1.00 0.00 H new ATOM 0 HB3 GLN C 16 83.188 -7.342 12.106 1.00 0.00 H new ATOM 0 HG2 GLN C 16 82.626 -7.615 9.783 1.00 0.00 H new ATOM 0 HG3 GLN C 16 82.839 -5.910 9.439 1.00 0.00 H new ATOM 0 HE21 GLN C 16 84.572 -6.021 7.929 1.00 0.00 H new ATOM 0 HE22 GLN C 16 86.154 -6.694 8.338 1.00 0.00 H new ATOM 254 N LYS C 17 80.289 -6.595 10.126 1.00 0.00 N ATOM 255 CA LYS C 17 79.452 -6.504 8.934 1.00 0.00 C ATOM 256 C LYS C 17 78.531 -5.294 9.033 1.00 0.00 C ATOM 257 O LYS C 17 78.341 -4.560 8.064 1.00 0.00 O ATOM 258 CB LYS C 17 78.603 -7.766 8.773 1.00 0.00 C ATOM 259 CG LYS C 17 78.949 -8.445 7.446 1.00 0.00 C ATOM 260 CD LYS C 17 80.094 -9.436 7.663 1.00 0.00 C ATOM 261 CE LYS C 17 79.955 -10.598 6.678 1.00 0.00 C ATOM 262 NZ LYS C 17 80.322 -10.135 5.310 1.00 0.00 N ATOM 0 H LYS C 17 80.354 -7.528 10.534 1.00 0.00 H new ATOM 0 HA LYS C 17 80.106 -6.400 8.068 1.00 0.00 H new ATOM 0 HB2 LYS C 17 78.786 -8.449 9.602 1.00 0.00 H new ATOM 0 HB3 LYS C 17 77.544 -7.511 8.798 1.00 0.00 H new ATOM 0 HG2 LYS C 17 78.075 -8.964 7.052 1.00 0.00 H new ATOM 0 HG3 LYS C 17 79.236 -7.697 6.707 1.00 0.00 H new ATOM 0 HD2 LYS C 17 81.053 -8.937 7.521 1.00 0.00 H new ATOM 0 HD3 LYS C 17 80.077 -9.809 8.687 1.00 0.00 H new ATOM 0 HE2 LYS C 17 80.600 -11.424 6.979 1.00 0.00 H new ATOM 0 HE3 LYS C 17 78.932 -10.974 6.684 1.00 0.00 H new ATOM 0 HZ1 LYS C 17 80.244 -10.929 4.642 1.00 0.00 H new ATOM 0 HZ2 LYS C 17 79.679 -9.372 5.017 1.00 0.00 H new ATOM 0 HZ3 LYS C 17 81.300 -9.781 5.314 1.00 0.00 H new ATOM 276 N ASN C 18 77.966 -5.091 10.221 1.00 0.00 N ATOM 277 CA ASN C 18 77.070 -3.961 10.441 1.00 0.00 C ATOM 278 C ASN C 18 77.810 -2.653 10.190 1.00 0.00 C ATOM 279 O ASN C 18 77.646 -2.019 9.148 1.00 0.00 O ATOM 280 CB ASN C 18 76.538 -3.967 11.875 1.00 0.00 C ATOM 281 CG ASN C 18 75.445 -5.020 12.007 1.00 0.00 C ATOM 282 OD1 ASN C 18 74.859 -5.444 11.012 1.00 0.00 O ATOM 283 ND2 ASN C 18 75.132 -5.474 13.191 1.00 0.00 N ATOM 0 H ASN C 18 78.111 -5.687 11.036 1.00 0.00 H new ATOM 0 HA ASN C 18 76.233 -4.050 9.749 1.00 0.00 H new ATOM 0 HB2 ASN C 18 77.348 -4.178 12.574 1.00 0.00 H new ATOM 0 HB3 ASN C 18 76.144 -2.984 12.132 1.00 0.00 H new ATOM 0 HD21 ASN C 18 74.402 -6.180 13.290 1.00 0.00 H new ATOM 0 HD22 ASN C 18 75.617 -5.123 14.017 1.00 0.00 H new ATOM 290 N GLU C 19 78.636 -2.260 11.156 1.00 0.00 N ATOM 291 CA GLU C 19 79.407 -1.029 11.026 1.00 0.00 C ATOM 292 C GLU C 19 79.911 -0.878 9.595 1.00 0.00 C ATOM 293 O GLU C 19 80.075 0.233 9.092 1.00 0.00 O ATOM 294 CB GLU C 19 80.604 -1.036 11.980 1.00 0.00 C ATOM 295 CG GLU C 19 81.283 -2.406 11.947 1.00 0.00 C ATOM 296 CD GLU C 19 81.978 -2.656 13.281 1.00 0.00 C ATOM 297 OE1 GLU C 19 81.283 -2.902 14.252 1.00 0.00 O ATOM 298 OE2 GLU C 19 83.196 -2.599 13.311 1.00 0.00 O ATOM 0 H GLU C 19 78.787 -2.769 12.027 1.00 0.00 H new ATOM 0 HA GLU C 19 78.755 -0.192 11.278 1.00 0.00 H new ATOM 0 HB2 GLU C 19 81.314 -0.261 11.693 1.00 0.00 H new ATOM 0 HB3 GLU C 19 80.275 -0.807 12.994 1.00 0.00 H new ATOM 0 HG2 GLU C 19 80.546 -3.186 11.756 1.00 0.00 H new ATOM 0 HG3 GLU C 19 82.007 -2.446 11.133 1.00 0.00 H new ATOM 305 N PHE C 20 80.149 -2.014 8.944 1.00 0.00 N ATOM 306 CA PHE C 20 80.627 -2.004 7.566 1.00 0.00 C ATOM 307 C PHE C 20 79.524 -1.519 6.634 1.00 0.00 C ATOM 308 O PHE C 20 79.628 -0.454 6.025 1.00 0.00 O ATOM 309 CB PHE C 20 81.062 -3.406 7.136 1.00 0.00 C ATOM 310 CG PHE C 20 82.383 -3.322 6.412 1.00 0.00 C ATOM 311 CD1 PHE C 20 82.665 -2.219 5.597 1.00 0.00 C ATOM 312 CD2 PHE C 20 83.326 -4.347 6.555 1.00 0.00 C ATOM 313 CE1 PHE C 20 83.891 -2.141 4.925 1.00 0.00 C ATOM 314 CE2 PHE C 20 84.551 -4.269 5.883 1.00 0.00 C ATOM 315 CZ PHE C 20 84.834 -3.166 5.068 1.00 0.00 C ATOM 0 H PHE C 20 80.020 -2.943 9.344 1.00 0.00 H new ATOM 0 HA PHE C 20 81.482 -1.330 7.508 1.00 0.00 H new ATOM 0 HB2 PHE C 20 81.153 -4.054 8.008 1.00 0.00 H new ATOM 0 HB3 PHE C 20 80.307 -3.850 6.487 1.00 0.00 H new ATOM 0 HD1 PHE C 20 81.937 -1.429 5.487 1.00 0.00 H new ATOM 0 HD2 PHE C 20 83.108 -5.198 7.184 1.00 0.00 H new ATOM 0 HE1 PHE C 20 84.109 -1.290 4.296 1.00 0.00 H new ATOM 0 HE2 PHE C 20 85.278 -5.060 5.993 1.00 0.00 H new ATOM 0 HZ PHE C 20 85.780 -3.106 4.550 1.00 0.00 H new ATOM 325 N LYS C 21 78.461 -2.313 6.532 1.00 0.00 N ATOM 326 CA LYS C 21 77.341 -1.954 5.675 1.00 0.00 C ATOM 327 C LYS C 21 77.007 -0.477 5.839 1.00 0.00 C ATOM 328 O LYS C 21 76.541 0.175 4.907 1.00 0.00 O ATOM 329 CB LYS C 21 76.112 -2.794 6.021 1.00 0.00 C ATOM 330 CG LYS C 21 76.485 -4.276 5.966 1.00 0.00 C ATOM 331 CD LYS C 21 75.440 -5.038 5.148 1.00 0.00 C ATOM 332 CE LYS C 21 74.908 -6.214 5.969 1.00 0.00 C ATOM 333 NZ LYS C 21 73.931 -5.715 6.977 1.00 0.00 N ATOM 0 H LYS C 21 78.354 -3.198 7.027 1.00 0.00 H new ATOM 0 HA LYS C 21 77.625 -2.148 4.641 1.00 0.00 H new ATOM 0 HB2 LYS C 21 75.748 -2.535 7.015 1.00 0.00 H new ATOM 0 HB3 LYS C 21 75.304 -2.584 5.320 1.00 0.00 H new ATOM 0 HG2 LYS C 21 77.471 -4.397 5.518 1.00 0.00 H new ATOM 0 HG3 LYS C 21 76.541 -4.685 6.975 1.00 0.00 H new ATOM 0 HD2 LYS C 21 74.622 -4.373 4.873 1.00 0.00 H new ATOM 0 HD3 LYS C 21 75.882 -5.399 4.220 1.00 0.00 H new ATOM 0 HE2 LYS C 21 74.430 -6.942 5.314 1.00 0.00 H new ATOM 0 HE3 LYS C 21 75.732 -6.725 6.467 1.00 0.00 H new ATOM 0 HZ1 LYS C 21 73.569 -6.514 7.535 1.00 0.00 H new ATOM 0 HZ2 LYS C 21 74.401 -5.036 7.609 1.00 0.00 H new ATOM 0 HZ3 LYS C 21 73.140 -5.246 6.491 1.00 0.00 H new ATOM 347 N ALA C 22 77.265 0.046 7.035 1.00 0.00 N ATOM 348 CA ALA C 22 77.000 1.456 7.308 1.00 0.00 C ATOM 349 C ALA C 22 77.746 2.323 6.300 1.00 0.00 C ATOM 350 O ALA C 22 77.138 3.026 5.492 1.00 0.00 O ATOM 351 CB ALA C 22 77.454 1.829 8.721 1.00 0.00 C ATOM 0 H ALA C 22 77.652 -0.477 7.821 1.00 0.00 H new ATOM 0 HA ALA C 22 75.927 1.626 7.225 1.00 0.00 H new ATOM 0 HB1 ALA C 22 77.247 2.884 8.903 1.00 0.00 H new ATOM 0 HB2 ALA C 22 76.915 1.223 9.448 1.00 0.00 H new ATOM 0 HB3 ALA C 22 78.524 1.647 8.819 1.00 0.00 H new ATOM 357 N ALA C 23 79.073 2.252 6.347 1.00 0.00 N ATOM 358 CA ALA C 23 79.898 3.022 5.422 1.00 0.00 C ATOM 359 C ALA C 23 79.617 2.576 3.992 1.00 0.00 C ATOM 360 O ALA C 23 79.615 3.380 3.061 1.00 0.00 O ATOM 361 CB ALA C 23 81.381 2.825 5.732 1.00 0.00 C ATOM 0 H ALA C 23 79.595 1.676 7.007 1.00 0.00 H new ATOM 0 HA ALA C 23 79.652 4.078 5.535 1.00 0.00 H new ATOM 0 HB1 ALA C 23 81.980 3.407 5.031 1.00 0.00 H new ATOM 0 HB2 ALA C 23 81.587 3.158 6.749 1.00 0.00 H new ATOM 0 HB3 ALA C 23 81.636 1.769 5.637 1.00 0.00 H new ATOM 367 N PHE C 24 79.361 1.280 3.835 1.00 0.00 N ATOM 368 CA PHE C 24 79.057 0.728 2.520 1.00 0.00 C ATOM 369 C PHE C 24 77.715 1.281 2.043 1.00 0.00 C ATOM 370 O PHE C 24 77.459 1.392 0.844 1.00 0.00 O ATOM 371 CB PHE C 24 79.018 -0.811 2.588 1.00 0.00 C ATOM 372 CG PHE C 24 78.063 -1.376 1.556 1.00 0.00 C ATOM 373 CD1 PHE C 24 78.176 -0.996 0.213 1.00 0.00 C ATOM 374 CD2 PHE C 24 77.066 -2.279 1.947 1.00 0.00 C ATOM 375 CE1 PHE C 24 77.292 -1.518 -0.739 1.00 0.00 C ATOM 376 CE2 PHE C 24 76.182 -2.801 0.994 1.00 0.00 C ATOM 377 CZ PHE C 24 76.295 -2.420 -0.348 1.00 0.00 C ATOM 0 H PHE C 24 79.358 0.599 4.594 1.00 0.00 H new ATOM 0 HA PHE C 24 79.834 1.017 1.812 1.00 0.00 H new ATOM 0 HB2 PHE C 24 80.018 -1.211 2.421 1.00 0.00 H new ATOM 0 HB3 PHE C 24 78.710 -1.127 3.585 1.00 0.00 H new ATOM 0 HD1 PHE C 24 78.945 -0.300 -0.088 1.00 0.00 H new ATOM 0 HD2 PHE C 24 76.979 -2.573 2.983 1.00 0.00 H new ATOM 0 HE1 PHE C 24 77.379 -1.225 -1.775 1.00 0.00 H new ATOM 0 HE2 PHE C 24 75.413 -3.497 1.295 1.00 0.00 H new ATOM 0 HZ PHE C 24 75.613 -2.822 -1.082 1.00 0.00 H new ATOM 387 N ASP C 25 76.868 1.640 3.005 1.00 0.00 N ATOM 388 CA ASP C 25 75.557 2.197 2.687 1.00 0.00 C ATOM 389 C ASP C 25 75.692 3.664 2.287 1.00 0.00 C ATOM 390 O ASP C 25 74.714 4.312 1.916 1.00 0.00 O ATOM 391 CB ASP C 25 74.621 2.097 3.893 1.00 0.00 C ATOM 392 CG ASP C 25 73.504 1.104 3.592 1.00 0.00 C ATOM 393 OD1 ASP C 25 73.753 0.167 2.851 1.00 0.00 O ATOM 394 OD2 ASP C 25 72.414 1.294 4.107 1.00 0.00 O ATOM 0 H ASP C 25 77.064 1.556 4.002 1.00 0.00 H new ATOM 0 HA ASP C 25 75.140 1.625 1.858 1.00 0.00 H new ATOM 0 HB2 ASP C 25 75.178 1.777 4.773 1.00 0.00 H new ATOM 0 HB3 ASP C 25 74.199 3.076 4.121 1.00 0.00 H new ATOM 399 N ILE C 26 76.919 4.179 2.360 1.00 0.00 N ATOM 400 CA ILE C 26 77.173 5.569 1.996 1.00 0.00 C ATOM 401 C ILE C 26 77.609 5.649 0.539 1.00 0.00 C ATOM 402 O ILE C 26 77.082 6.442 -0.241 1.00 0.00 O ATOM 403 CB ILE C 26 78.271 6.178 2.873 1.00 0.00 C ATOM 404 CG1 ILE C 26 78.249 5.540 4.268 1.00 0.00 C ATOM 405 CG2 ILE C 26 78.040 7.685 3.000 1.00 0.00 C ATOM 406 CD1 ILE C 26 77.030 6.036 5.045 1.00 0.00 C ATOM 0 H ILE C 26 77.743 3.660 2.664 1.00 0.00 H new ATOM 0 HA ILE C 26 76.250 6.129 2.146 1.00 0.00 H new ATOM 0 HB ILE C 26 79.240 5.990 2.412 1.00 0.00 H new ATOM 0 HG12 ILE C 26 78.219 4.454 4.181 1.00 0.00 H new ATOM 0 HG13 ILE C 26 79.162 5.791 4.807 1.00 0.00 H new ATOM 0 HG21 ILE C 26 78.820 8.121 3.624 1.00 0.00 H new ATOM 0 HG22 ILE C 26 78.068 8.142 2.011 1.00 0.00 H new ATOM 0 HG23 ILE C 26 77.067 7.867 3.456 1.00 0.00 H new ATOM 0 HD11 ILE C 26 77.019 5.580 6.035 1.00 0.00 H new ATOM 0 HD12 ILE C 26 77.079 7.120 5.146 1.00 0.00 H new ATOM 0 HD13 ILE C 26 76.121 5.762 4.509 1.00 0.00 H new ATOM 418 N PHE C 27 78.575 4.808 0.181 1.00 0.00 N ATOM 419 CA PHE C 27 79.076 4.780 -1.189 1.00 0.00 C ATOM 420 C PHE C 27 77.908 4.691 -2.164 1.00 0.00 C ATOM 421 O PHE C 27 77.968 5.202 -3.282 1.00 0.00 O ATOM 422 CB PHE C 27 79.998 3.576 -1.401 1.00 0.00 C ATOM 423 CG PHE C 27 80.894 3.404 -0.196 1.00 0.00 C ATOM 424 CD1 PHE C 27 81.423 4.527 0.449 1.00 0.00 C ATOM 425 CD2 PHE C 27 81.195 2.120 0.274 1.00 0.00 C ATOM 426 CE1 PHE C 27 82.254 4.367 1.565 1.00 0.00 C ATOM 427 CE2 PHE C 27 82.026 1.960 1.390 1.00 0.00 C ATOM 428 CZ PHE C 27 82.556 3.083 2.035 1.00 0.00 C ATOM 0 H PHE C 27 79.022 4.144 0.813 1.00 0.00 H new ATOM 0 HA PHE C 27 79.639 5.696 -1.367 1.00 0.00 H new ATOM 0 HB2 PHE C 27 79.405 2.675 -1.558 1.00 0.00 H new ATOM 0 HB3 PHE C 27 80.601 3.721 -2.297 1.00 0.00 H new ATOM 0 HD1 PHE C 27 81.191 5.517 0.086 1.00 0.00 H new ATOM 0 HD2 PHE C 27 80.786 1.253 -0.224 1.00 0.00 H new ATOM 0 HE1 PHE C 27 82.662 5.234 2.063 1.00 0.00 H new ATOM 0 HE2 PHE C 27 82.258 0.970 1.753 1.00 0.00 H new ATOM 0 HZ PHE C 27 83.198 2.959 2.895 1.00 0.00 H new ATOM 438 N VAL C 28 76.841 4.035 -1.718 1.00 0.00 N ATOM 439 CA VAL C 28 75.649 3.876 -2.543 1.00 0.00 C ATOM 440 C VAL C 28 74.439 4.479 -1.837 1.00 0.00 C ATOM 441 O VAL C 28 73.343 3.919 -1.859 1.00 0.00 O ATOM 442 CB VAL C 28 75.382 2.395 -2.815 1.00 0.00 C ATOM 443 CG1 VAL C 28 76.537 1.809 -3.629 1.00 0.00 C ATOM 444 CG2 VAL C 28 75.267 1.649 -1.483 1.00 0.00 C ATOM 0 H VAL C 28 76.778 3.607 -0.794 1.00 0.00 H new ATOM 0 HA VAL C 28 75.816 4.392 -3.489 1.00 0.00 H new ATOM 0 HB VAL C 28 74.453 2.288 -3.376 1.00 0.00 H new ATOM 0 HG11 VAL C 28 76.347 0.753 -3.823 1.00 0.00 H new ATOM 0 HG12 VAL C 28 76.622 2.342 -4.576 1.00 0.00 H new ATOM 0 HG13 VAL C 28 77.466 1.913 -3.069 1.00 0.00 H new ATOM 0 HG21 VAL C 28 75.077 0.593 -1.673 1.00 0.00 H new ATOM 0 HG22 VAL C 28 76.197 1.755 -0.925 1.00 0.00 H new ATOM 0 HG23 VAL C 28 74.445 2.067 -0.902 1.00 0.00 H new ATOM 454 N LEU C 29 74.657 5.628 -1.203 1.00 0.00 N ATOM 455 CA LEU C 29 73.585 6.308 -0.479 1.00 0.00 C ATOM 456 C LEU C 29 72.610 6.975 -1.448 1.00 0.00 C ATOM 457 O LEU C 29 71.625 7.587 -1.033 1.00 0.00 O ATOM 458 CB LEU C 29 74.169 7.369 0.458 1.00 0.00 C ATOM 459 CG LEU C 29 74.623 8.582 -0.358 1.00 0.00 C ATOM 460 CD1 LEU C 29 73.516 9.637 -0.365 1.00 0.00 C ATOM 461 CD2 LEU C 29 75.887 9.174 0.270 1.00 0.00 C ATOM 0 H LEU C 29 75.558 6.105 -1.175 1.00 0.00 H new ATOM 0 HA LEU C 29 73.048 5.560 0.104 1.00 0.00 H new ATOM 0 HB2 LEU C 29 73.422 7.671 1.192 1.00 0.00 H new ATOM 0 HB3 LEU C 29 75.011 6.955 1.012 1.00 0.00 H new ATOM 0 HG LEU C 29 74.835 8.272 -1.381 1.00 0.00 H new ATOM 0 HD11 LEU C 29 73.840 10.500 -0.946 1.00 0.00 H new ATOM 0 HD12 LEU C 29 72.615 9.216 -0.812 1.00 0.00 H new ATOM 0 HD13 LEU C 29 73.303 9.947 0.658 1.00 0.00 H new ATOM 0 HD21 LEU C 29 76.211 10.038 -0.310 1.00 0.00 H new ATOM 0 HD22 LEU C 29 75.674 9.483 1.293 1.00 0.00 H new ATOM 0 HD23 LEU C 29 76.677 8.423 0.275 1.00 0.00 H new ATOM 473 N GLY C 30 72.891 6.852 -2.741 1.00 0.00 N ATOM 474 CA GLY C 30 72.028 7.447 -3.757 1.00 0.00 C ATOM 475 C GLY C 30 72.294 6.823 -5.121 1.00 0.00 C ATOM 476 O GLY C 30 72.186 7.482 -6.155 1.00 0.00 O ATOM 0 H GLY C 30 73.700 6.352 -3.108 1.00 0.00 H new ATOM 0 HA2 GLY C 30 70.983 7.303 -3.483 1.00 0.00 H new ATOM 0 HA3 GLY C 30 72.200 8.522 -3.803 1.00 0.00 H new ATOM 480 N ALA C 31 72.646 5.541 -5.110 1.00 0.00 N ATOM 481 CA ALA C 31 72.930 4.829 -6.352 1.00 0.00 C ATOM 482 C ALA C 31 71.686 4.101 -6.846 1.00 0.00 C ATOM 483 O ALA C 31 70.582 4.310 -6.343 1.00 0.00 O ATOM 484 CB ALA C 31 74.052 3.810 -6.141 1.00 0.00 C ATOM 0 H ALA C 31 72.741 4.978 -4.264 1.00 0.00 H new ATOM 0 HA ALA C 31 73.241 5.563 -7.096 1.00 0.00 H new ATOM 0 HB1 ALA C 31 74.251 3.288 -7.077 1.00 0.00 H new ATOM 0 HB2 ALA C 31 74.955 4.326 -5.814 1.00 0.00 H new ATOM 0 HB3 ALA C 31 73.751 3.089 -5.381 1.00 0.00 H new ATOM 490 N GLU C 32 71.882 3.243 -7.842 1.00 0.00 N ATOM 491 CA GLU C 32 70.777 2.481 -8.411 1.00 0.00 C ATOM 492 C GLU C 32 70.727 1.078 -7.812 1.00 0.00 C ATOM 493 O GLU C 32 69.785 0.321 -8.049 1.00 0.00 O ATOM 494 CB GLU C 32 70.938 2.371 -9.927 1.00 0.00 C ATOM 495 CG GLU C 32 69.559 2.319 -10.588 1.00 0.00 C ATOM 496 CD GLU C 32 69.087 0.871 -10.669 1.00 0.00 C ATOM 497 OE1 GLU C 32 69.774 0.078 -11.292 1.00 0.00 O ATOM 498 OE2 GLU C 32 68.043 0.576 -10.109 1.00 0.00 O ATOM 0 H GLU C 32 72.790 3.059 -8.269 1.00 0.00 H new ATOM 0 HA GLU C 32 69.850 3.004 -8.178 1.00 0.00 H new ATOM 0 HB2 GLU C 32 71.502 3.224 -10.306 1.00 0.00 H new ATOM 0 HB3 GLU C 32 71.507 1.476 -10.178 1.00 0.00 H new ATOM 0 HG2 GLU C 32 68.847 2.913 -10.015 1.00 0.00 H new ATOM 0 HG3 GLU C 32 69.606 2.754 -11.587 1.00 0.00 H new ATOM 505 N ASP C 33 71.750 0.739 -7.031 1.00 0.00 N ATOM 506 CA ASP C 33 71.811 -0.578 -6.402 1.00 0.00 C ATOM 507 C ASP C 33 72.782 -0.561 -5.225 1.00 0.00 C ATOM 508 O ASP C 33 72.392 -0.305 -4.085 1.00 0.00 O ATOM 509 CB ASP C 33 72.262 -1.646 -7.406 1.00 0.00 C ATOM 510 CG ASP C 33 73.043 -0.996 -8.544 1.00 0.00 C ATOM 511 OD1 ASP C 33 73.835 -0.112 -8.263 1.00 0.00 O ATOM 512 OD2 ASP C 33 72.837 -1.392 -9.679 1.00 0.00 O ATOM 0 H ASP C 33 72.539 1.350 -6.820 1.00 0.00 H new ATOM 0 HA ASP C 33 70.809 -0.822 -6.048 1.00 0.00 H new ATOM 0 HB2 ASP C 33 72.883 -2.388 -6.905 1.00 0.00 H new ATOM 0 HB3 ASP C 33 71.394 -2.172 -7.804 1.00 0.00 H new ATOM 517 N GLY C 34 74.051 -0.838 -5.511 1.00 0.00 N ATOM 518 CA GLY C 34 75.070 -0.851 -4.465 1.00 0.00 C ATOM 519 C GLY C 34 76.457 -0.632 -5.059 1.00 0.00 C ATOM 520 O GLY C 34 77.468 -1.017 -4.472 1.00 0.00 O ATOM 0 H GLY C 34 74.396 -1.054 -6.446 1.00 0.00 H new ATOM 0 HA2 GLY C 34 74.856 -0.073 -3.733 1.00 0.00 H new ATOM 0 HA3 GLY C 34 75.042 -1.803 -3.936 1.00 0.00 H new ATOM 524 N CYS C 35 76.492 -0.009 -6.234 1.00 0.00 N ATOM 525 CA CYS C 35 77.761 0.258 -6.907 1.00 0.00 C ATOM 526 C CYS C 35 78.341 1.592 -6.446 1.00 0.00 C ATOM 527 O CYS C 35 77.608 2.527 -6.124 1.00 0.00 O ATOM 528 CB CYS C 35 77.564 0.297 -8.423 1.00 0.00 C ATOM 529 SG CYS C 35 76.408 -1.007 -8.916 1.00 0.00 S ATOM 0 H CYS C 35 75.666 0.318 -6.736 1.00 0.00 H new ATOM 0 HA CYS C 35 78.452 -0.545 -6.651 1.00 0.00 H new ATOM 0 HB2 CYS C 35 77.180 1.271 -8.726 1.00 0.00 H new ATOM 0 HB3 CYS C 35 78.520 0.160 -8.928 1.00 0.00 H new ATOM 0 HG CYS C 35 75.232 -0.491 -9.119 1.00 0.00 H new ATOM 535 N ILE C 36 79.669 1.666 -6.416 1.00 0.00 N ATOM 536 CA ILE C 36 80.348 2.888 -5.991 1.00 0.00 C ATOM 537 C ILE C 36 81.035 3.561 -7.175 1.00 0.00 C ATOM 538 O ILE C 36 81.766 2.923 -7.932 1.00 0.00 O ATOM 539 CB ILE C 36 81.399 2.569 -4.927 1.00 0.00 C ATOM 540 CG1 ILE C 36 80.782 1.668 -3.855 1.00 0.00 C ATOM 541 CG2 ILE C 36 81.887 3.868 -4.282 1.00 0.00 C ATOM 542 CD1 ILE C 36 81.832 1.349 -2.791 1.00 0.00 C ATOM 0 H ILE C 36 80.292 0.902 -6.678 1.00 0.00 H new ATOM 0 HA ILE C 36 79.597 3.561 -5.577 1.00 0.00 H new ATOM 0 HB ILE C 36 82.241 2.057 -5.392 1.00 0.00 H new ATOM 0 HG12 ILE C 36 79.925 2.163 -3.398 1.00 0.00 H new ATOM 0 HG13 ILE C 36 80.415 0.746 -4.307 1.00 0.00 H new ATOM 0 HG21 ILE C 36 82.636 3.639 -3.524 1.00 0.00 H new ATOM 0 HG22 ILE C 36 82.327 4.510 -5.045 1.00 0.00 H new ATOM 0 HG23 ILE C 36 81.046 4.382 -3.817 1.00 0.00 H new ATOM 0 HD11 ILE C 36 81.393 0.707 -2.027 1.00 0.00 H new ATOM 0 HD12 ILE C 36 82.675 0.837 -3.254 1.00 0.00 H new ATOM 0 HD13 ILE C 36 82.178 2.275 -2.332 1.00 0.00 H new ATOM 554 N SER C 37 80.796 4.862 -7.321 1.00 0.00 N ATOM 555 CA SER C 37 81.401 5.620 -8.412 1.00 0.00 C ATOM 556 C SER C 37 82.432 6.602 -7.863 1.00 0.00 C ATOM 557 O SER C 37 82.623 6.709 -6.652 1.00 0.00 O ATOM 558 CB SER C 37 80.333 6.396 -9.183 1.00 0.00 C ATOM 559 OG SER C 37 79.969 5.664 -10.346 1.00 0.00 O ATOM 0 H SER C 37 80.194 5.408 -6.705 1.00 0.00 H new ATOM 0 HA SER C 37 81.889 4.915 -9.085 1.00 0.00 H new ATOM 0 HB2 SER C 37 79.459 6.558 -8.553 1.00 0.00 H new ATOM 0 HB3 SER C 37 80.712 7.379 -9.462 1.00 0.00 H new ATOM 0 HG SER C 37 79.283 6.158 -10.842 1.00 0.00 H new ATOM 565 N THR C 38 83.095 7.318 -8.767 1.00 0.00 N ATOM 566 CA THR C 38 84.107 8.289 -8.360 1.00 0.00 C ATOM 567 C THR C 38 83.449 9.513 -7.730 1.00 0.00 C ATOM 568 O THR C 38 84.017 10.157 -6.849 1.00 0.00 O ATOM 569 CB THR C 38 84.940 8.734 -9.563 1.00 0.00 C ATOM 570 OG1 THR C 38 84.261 9.778 -10.246 1.00 0.00 O ATOM 571 CG2 THR C 38 85.144 7.551 -10.509 1.00 0.00 C ATOM 0 H THR C 38 82.953 7.246 -9.774 1.00 0.00 H new ATOM 0 HA THR C 38 84.757 7.809 -7.628 1.00 0.00 H new ATOM 0 HB THR C 38 85.910 9.094 -9.221 1.00 0.00 H new ATOM 0 HG1 THR C 38 84.794 10.066 -11.016 1.00 0.00 H new ATOM 0 HG21 THR C 38 85.738 7.869 -11.366 1.00 0.00 H new ATOM 0 HG22 THR C 38 85.665 6.751 -9.984 1.00 0.00 H new ATOM 0 HG23 THR C 38 84.175 7.189 -10.853 1.00 0.00 H new ATOM 579 N LYS C 39 82.242 9.826 -8.192 1.00 0.00 N ATOM 580 CA LYS C 39 81.512 10.977 -7.666 1.00 0.00 C ATOM 581 C LYS C 39 80.738 10.587 -6.411 1.00 0.00 C ATOM 582 O LYS C 39 80.549 11.398 -5.505 1.00 0.00 O ATOM 583 CB LYS C 39 80.532 11.516 -8.711 1.00 0.00 C ATOM 584 CG LYS C 39 81.232 12.572 -9.572 1.00 0.00 C ATOM 585 CD LYS C 39 80.190 13.523 -10.166 1.00 0.00 C ATOM 586 CE LYS C 39 80.831 14.353 -11.281 1.00 0.00 C ATOM 587 NZ LYS C 39 80.040 14.197 -12.535 1.00 0.00 N ATOM 0 H LYS C 39 81.753 9.306 -8.921 1.00 0.00 H new ATOM 0 HA LYS C 39 82.238 11.752 -7.420 1.00 0.00 H new ATOM 0 HB2 LYS C 39 80.169 10.702 -9.339 1.00 0.00 H new ATOM 0 HB3 LYS C 39 79.662 11.951 -8.219 1.00 0.00 H new ATOM 0 HG2 LYS C 39 81.948 13.131 -8.969 1.00 0.00 H new ATOM 0 HG3 LYS C 39 81.796 12.089 -10.370 1.00 0.00 H new ATOM 0 HD2 LYS C 39 79.347 12.955 -10.560 1.00 0.00 H new ATOM 0 HD3 LYS C 39 79.797 14.180 -9.390 1.00 0.00 H new ATOM 0 HE2 LYS C 39 80.869 15.403 -10.991 1.00 0.00 H new ATOM 0 HE3 LYS C 39 81.859 14.030 -11.444 1.00 0.00 H new ATOM 0 HZ1 LYS C 39 80.476 14.761 -13.293 1.00 0.00 H new ATOM 0 HZ2 LYS C 39 80.025 13.195 -12.814 1.00 0.00 H new ATOM 0 HZ3 LYS C 39 79.067 14.526 -12.375 1.00 0.00 H new ATOM 601 N GLU C 40 80.293 9.334 -6.368 1.00 0.00 N ATOM 602 CA GLU C 40 79.540 8.842 -5.218 1.00 0.00 C ATOM 603 C GLU C 40 80.480 8.544 -4.054 1.00 0.00 C ATOM 604 O GLU C 40 80.099 8.642 -2.888 1.00 0.00 O ATOM 605 CB GLU C 40 78.777 7.567 -5.583 1.00 0.00 C ATOM 606 CG GLU C 40 77.272 7.822 -5.476 1.00 0.00 C ATOM 607 CD GLU C 40 76.863 8.897 -6.477 1.00 0.00 C ATOM 608 OE1 GLU C 40 76.694 8.564 -7.638 1.00 0.00 O ATOM 609 OE2 GLU C 40 76.724 10.038 -6.068 1.00 0.00 O ATOM 0 H GLU C 40 80.439 8.647 -7.108 1.00 0.00 H new ATOM 0 HA GLU C 40 78.831 9.616 -4.923 1.00 0.00 H new ATOM 0 HB2 GLU C 40 79.032 7.256 -6.596 1.00 0.00 H new ATOM 0 HB3 GLU C 40 79.067 6.754 -4.917 1.00 0.00 H new ATOM 0 HG2 GLU C 40 76.722 6.901 -5.671 1.00 0.00 H new ATOM 0 HG3 GLU C 40 77.017 8.137 -4.464 1.00 0.00 H new ATOM 616 N LEU C 41 81.715 8.178 -4.385 1.00 0.00 N ATOM 617 CA LEU C 41 82.710 7.866 -3.361 1.00 0.00 C ATOM 618 C LEU C 41 83.282 9.150 -2.769 1.00 0.00 C ATOM 619 O LEU C 41 83.295 9.338 -1.552 1.00 0.00 O ATOM 620 CB LEU C 41 83.851 7.038 -3.961 1.00 0.00 C ATOM 621 CG LEU C 41 85.017 6.970 -2.972 1.00 0.00 C ATOM 622 CD1 LEU C 41 84.499 6.546 -1.596 1.00 0.00 C ATOM 623 CD2 LEU C 41 86.042 5.948 -3.466 1.00 0.00 C ATOM 0 H LEU C 41 82.050 8.090 -5.345 1.00 0.00 H new ATOM 0 HA LEU C 41 82.220 7.291 -2.575 1.00 0.00 H new ATOM 0 HB2 LEU C 41 83.500 6.033 -4.193 1.00 0.00 H new ATOM 0 HB3 LEU C 41 84.183 7.484 -4.898 1.00 0.00 H new ATOM 0 HG LEU C 41 85.486 7.951 -2.896 1.00 0.00 H new ATOM 0 HD11 LEU C 41 85.331 6.498 -0.893 1.00 0.00 H new ATOM 0 HD12 LEU C 41 83.767 7.272 -1.243 1.00 0.00 H new ATOM 0 HD13 LEU C 41 84.030 5.565 -1.670 1.00 0.00 H new ATOM 0 HD21 LEU C 41 86.874 5.898 -2.763 1.00 0.00 H new ATOM 0 HD22 LEU C 41 85.571 4.968 -3.542 1.00 0.00 H new ATOM 0 HD23 LEU C 41 86.413 6.249 -4.446 1.00 0.00 H new ATOM 635 N GLY C 42 83.757 10.029 -3.645 1.00 0.00 N ATOM 636 CA GLY C 42 84.332 11.295 -3.200 1.00 0.00 C ATOM 637 C GLY C 42 83.525 11.878 -2.046 1.00 0.00 C ATOM 638 O GLY C 42 84.071 12.525 -1.152 1.00 0.00 O ATOM 0 H GLY C 42 83.756 9.892 -4.656 1.00 0.00 H new ATOM 0 HA2 GLY C 42 85.365 11.141 -2.887 1.00 0.00 H new ATOM 0 HA3 GLY C 42 84.353 12.002 -4.029 1.00 0.00 H new ATOM 642 N LYS C 43 82.216 11.643 -2.076 1.00 0.00 N ATOM 643 CA LYS C 43 81.336 12.150 -1.027 1.00 0.00 C ATOM 644 C LYS C 43 81.762 11.611 0.335 1.00 0.00 C ATOM 645 O LYS C 43 82.097 12.372 1.243 1.00 0.00 O ATOM 646 CB LYS C 43 79.887 11.736 -1.297 1.00 0.00 C ATOM 647 CG LYS C 43 79.388 12.418 -2.572 1.00 0.00 C ATOM 648 CD LYS C 43 79.117 13.897 -2.288 1.00 0.00 C ATOM 649 CE LYS C 43 77.693 14.060 -1.753 1.00 0.00 C ATOM 650 NZ LYS C 43 76.900 14.898 -2.696 1.00 0.00 N ATOM 0 H LYS C 43 81.745 11.110 -2.807 1.00 0.00 H new ATOM 0 HA LYS C 43 81.408 13.238 -1.025 1.00 0.00 H new ATOM 0 HB2 LYS C 43 79.821 10.653 -1.402 1.00 0.00 H new ATOM 0 HB3 LYS C 43 79.256 12.013 -0.453 1.00 0.00 H new ATOM 0 HG2 LYS C 43 80.130 12.319 -3.364 1.00 0.00 H new ATOM 0 HG3 LYS C 43 78.478 11.932 -2.925 1.00 0.00 H new ATOM 0 HD2 LYS C 43 79.836 14.277 -1.562 1.00 0.00 H new ATOM 0 HD3 LYS C 43 79.244 14.483 -3.198 1.00 0.00 H new ATOM 0 HE2 LYS C 43 77.224 13.083 -1.635 1.00 0.00 H new ATOM 0 HE3 LYS C 43 77.715 14.524 -0.767 1.00 0.00 H new ATOM 0 HZ1 LYS C 43 75.932 15.009 -2.332 1.00 0.00 H new ATOM 0 HZ2 LYS C 43 77.345 15.834 -2.787 1.00 0.00 H new ATOM 0 HZ3 LYS C 43 76.869 14.437 -3.628 1.00 0.00 H new ATOM 664 N VAL C 44 81.744 10.287 0.467 1.00 0.00 N ATOM 665 CA VAL C 44 82.129 9.651 1.725 1.00 0.00 C ATOM 666 C VAL C 44 83.474 10.184 2.203 1.00 0.00 C ATOM 667 O VAL C 44 83.586 10.731 3.300 1.00 0.00 O ATOM 668 CB VAL C 44 82.229 8.134 1.550 1.00 0.00 C ATOM 669 CG1 VAL C 44 82.847 7.508 2.805 1.00 0.00 C ATOM 670 CG2 VAL C 44 80.830 7.558 1.331 1.00 0.00 C ATOM 0 H VAL C 44 81.470 9.640 -0.272 1.00 0.00 H new ATOM 0 HA VAL C 44 81.363 9.882 2.465 1.00 0.00 H new ATOM 0 HB VAL C 44 82.858 7.909 0.689 1.00 0.00 H new ATOM 0 HG11 VAL C 44 82.916 6.428 2.676 1.00 0.00 H new ATOM 0 HG12 VAL C 44 83.844 7.919 2.964 1.00 0.00 H new ATOM 0 HG13 VAL C 44 82.221 7.731 3.669 1.00 0.00 H new ATOM 0 HG21 VAL C 44 80.897 6.477 1.206 1.00 0.00 H new ATOM 0 HG22 VAL C 44 80.204 7.785 2.194 1.00 0.00 H new ATOM 0 HG23 VAL C 44 80.390 8.000 0.437 1.00 0.00 H new ATOM 680 N MET C 45 84.496 10.013 1.372 1.00 0.00 N ATOM 681 CA MET C 45 85.831 10.478 1.727 1.00 0.00 C ATOM 682 C MET C 45 85.752 11.838 2.412 1.00 0.00 C ATOM 683 O MET C 45 86.437 12.091 3.403 1.00 0.00 O ATOM 684 CB MET C 45 86.717 10.589 0.483 1.00 0.00 C ATOM 685 CG MET C 45 86.677 9.275 -0.308 1.00 0.00 C ATOM 686 SD MET C 45 86.844 7.859 0.815 1.00 0.00 S ATOM 687 CE MET C 45 88.224 8.492 1.803 1.00 0.00 C ATOM 0 H MET C 45 84.428 9.562 0.460 1.00 0.00 H new ATOM 0 HA MET C 45 86.269 9.751 2.411 1.00 0.00 H new ATOM 0 HB2 MET C 45 86.375 11.412 -0.145 1.00 0.00 H new ATOM 0 HB3 MET C 45 87.742 10.816 0.776 1.00 0.00 H new ATOM 0 HG2 MET C 45 85.739 9.202 -0.859 1.00 0.00 H new ATOM 0 HG3 MET C 45 87.481 9.261 -1.044 1.00 0.00 H new ATOM 0 HE1 MET C 45 88.783 7.657 2.225 1.00 0.00 H new ATOM 0 HE2 MET C 45 88.883 9.086 1.170 1.00 0.00 H new ATOM 0 HE3 MET C 45 87.838 9.115 2.610 1.00 0.00 H new ATOM 697 N ARG C 46 84.904 12.711 1.875 1.00 0.00 N ATOM 698 CA ARG C 46 84.739 14.043 2.449 1.00 0.00 C ATOM 699 C ARG C 46 84.350 13.938 3.921 1.00 0.00 C ATOM 700 O ARG C 46 84.844 14.687 4.764 1.00 0.00 O ATOM 701 CB ARG C 46 83.654 14.822 1.700 1.00 0.00 C ATOM 702 CG ARG C 46 84.049 16.298 1.620 1.00 0.00 C ATOM 703 CD ARG C 46 82.867 17.117 1.096 1.00 0.00 C ATOM 704 NE ARG C 46 83.312 18.432 0.641 1.00 0.00 N ATOM 705 CZ ARG C 46 82.434 19.381 0.323 1.00 0.00 C ATOM 706 NH1 ARG C 46 81.154 19.146 0.414 1.00 0.00 N ATOM 707 NH2 ARG C 46 82.855 20.549 -0.079 1.00 0.00 N ATOM 0 H ARG C 46 84.328 12.524 1.054 1.00 0.00 H new ATOM 0 HA ARG C 46 85.688 14.571 2.357 1.00 0.00 H new ATOM 0 HB2 ARG C 46 83.525 14.414 0.697 1.00 0.00 H new ATOM 0 HB3 ARG C 46 82.697 14.718 2.212 1.00 0.00 H new ATOM 0 HG2 ARG C 46 84.347 16.659 2.604 1.00 0.00 H new ATOM 0 HG3 ARG C 46 84.909 16.420 0.962 1.00 0.00 H new ATOM 0 HD2 ARG C 46 82.386 16.586 0.275 1.00 0.00 H new ATOM 0 HD3 ARG C 46 82.121 17.232 1.882 1.00 0.00 H new ATOM 0 HE ARG C 46 84.311 18.626 0.566 1.00 0.00 H new ATOM 0 HH11 ARG C 46 80.824 18.234 0.729 1.00 0.00 H new ATOM 0 HH12 ARG C 46 80.483 19.875 0.170 1.00 0.00 H new ATOM 0 HH21 ARG C 46 83.856 20.734 -0.149 1.00 0.00 H new ATOM 0 HH22 ARG C 46 82.183 21.277 -0.323 1.00 0.00 H new ATOM 721 N MET C 47 83.460 12.995 4.218 1.00 0.00 N ATOM 722 CA MET C 47 83.010 12.789 5.593 1.00 0.00 C ATOM 723 C MET C 47 84.194 12.445 6.491 1.00 0.00 C ATOM 724 O MET C 47 84.359 13.009 7.573 1.00 0.00 O ATOM 725 CB MET C 47 81.991 11.649 5.657 1.00 0.00 C ATOM 726 CG MET C 47 80.653 12.185 6.171 1.00 0.00 C ATOM 727 SD MET C 47 79.357 11.844 4.954 1.00 0.00 S ATOM 728 CE MET C 47 79.696 10.078 4.750 1.00 0.00 C ATOM 0 H MET C 47 83.039 12.367 3.533 1.00 0.00 H new ATOM 0 HA MET C 47 82.544 13.712 5.938 1.00 0.00 H new ATOM 0 HB2 MET C 47 81.862 11.207 4.669 1.00 0.00 H new ATOM 0 HB3 MET C 47 82.355 10.859 6.314 1.00 0.00 H new ATOM 0 HG2 MET C 47 80.404 11.718 7.124 1.00 0.00 H new ATOM 0 HG3 MET C 47 80.724 13.258 6.351 1.00 0.00 H new ATOM 0 HE1 MET C 47 79.933 9.871 3.706 1.00 0.00 H new ATOM 0 HE2 MET C 47 80.541 9.795 5.377 1.00 0.00 H new ATOM 0 HE3 MET C 47 78.818 9.503 5.043 1.00 0.00 H new ATOM 738 N LEU C 48 85.017 11.509 6.027 1.00 0.00 N ATOM 739 CA LEU C 48 86.189 11.086 6.789 1.00 0.00 C ATOM 740 C LEU C 48 87.128 12.264 7.029 1.00 0.00 C ATOM 741 O LEU C 48 87.854 12.304 8.023 1.00 0.00 O ATOM 742 CB LEU C 48 86.947 9.990 6.034 1.00 0.00 C ATOM 743 CG LEU C 48 86.403 8.612 6.426 1.00 0.00 C ATOM 744 CD1 LEU C 48 84.873 8.650 6.474 1.00 0.00 C ATOM 745 CD2 LEU C 48 86.850 7.580 5.388 1.00 0.00 C ATOM 0 H LEU C 48 84.896 11.032 5.134 1.00 0.00 H new ATOM 0 HA LEU C 48 85.845 10.699 7.748 1.00 0.00 H new ATOM 0 HB2 LEU C 48 86.843 10.139 4.959 1.00 0.00 H new ATOM 0 HB3 LEU C 48 88.011 10.049 6.263 1.00 0.00 H new ATOM 0 HG LEU C 48 86.787 8.340 7.409 1.00 0.00 H new ATOM 0 HD11 LEU C 48 84.493 7.667 6.753 1.00 0.00 H new ATOM 0 HD12 LEU C 48 84.550 9.386 7.210 1.00 0.00 H new ATOM 0 HD13 LEU C 48 84.485 8.924 5.493 1.00 0.00 H new ATOM 0 HD21 LEU C 48 86.465 6.598 5.663 1.00 0.00 H new ATOM 0 HD22 LEU C 48 86.465 7.860 4.408 1.00 0.00 H new ATOM 0 HD23 LEU C 48 87.939 7.547 5.354 1.00 0.00 H new ATOM 757 N GLY C 49 87.108 13.222 6.107 1.00 0.00 N ATOM 758 CA GLY C 49 87.965 14.398 6.226 1.00 0.00 C ATOM 759 C GLY C 49 88.882 14.528 5.013 1.00 0.00 C ATOM 760 O GLY C 49 89.755 15.394 4.967 1.00 0.00 O ATOM 0 H GLY C 49 86.515 13.209 5.277 1.00 0.00 H new ATOM 0 HA2 GLY C 49 87.350 15.293 6.320 1.00 0.00 H new ATOM 0 HA3 GLY C 49 88.564 14.326 7.134 1.00 0.00 H new ATOM 764 N GLN C 50 88.671 13.658 4.027 1.00 0.00 N ATOM 765 CA GLN C 50 89.482 13.685 2.813 1.00 0.00 C ATOM 766 C GLN C 50 88.630 14.125 1.627 1.00 0.00 C ATOM 767 O GLN C 50 87.558 13.574 1.378 1.00 0.00 O ATOM 768 CB GLN C 50 90.064 12.300 2.522 1.00 0.00 C ATOM 769 CG GLN C 50 90.827 11.794 3.749 1.00 0.00 C ATOM 770 CD GLN C 50 92.314 12.082 3.576 1.00 0.00 C ATOM 771 OE1 GLN C 50 92.790 13.158 3.935 1.00 0.00 O ATOM 772 NE2 GLN C 50 93.084 11.173 3.042 1.00 0.00 N ATOM 0 H GLN C 50 87.953 12.933 4.044 1.00 0.00 H new ATOM 0 HA GLN C 50 90.298 14.391 2.965 1.00 0.00 H new ATOM 0 HB2 GLN C 50 89.264 11.605 2.267 1.00 0.00 H new ATOM 0 HB3 GLN C 50 90.731 12.348 1.661 1.00 0.00 H new ATOM 0 HG2 GLN C 50 90.453 12.281 4.650 1.00 0.00 H new ATOM 0 HG3 GLN C 50 90.665 10.724 3.875 1.00 0.00 H new ATOM 0 HE21 GLN C 50 92.689 10.281 2.744 1.00 0.00 H new ATOM 0 HE22 GLN C 50 94.080 11.355 2.922 1.00 0.00 H new ATOM 781 N ASN C 51 89.116 15.127 0.902 1.00 0.00 N ATOM 782 CA ASN C 51 88.383 15.637 -0.254 1.00 0.00 C ATOM 783 C ASN C 51 89.160 15.388 -1.543 1.00 0.00 C ATOM 784 O ASN C 51 89.919 16.242 -2.002 1.00 0.00 O ATOM 785 CB ASN C 51 88.128 17.139 -0.106 1.00 0.00 C ATOM 786 CG ASN C 51 87.574 17.693 -1.414 1.00 0.00 C ATOM 787 OD1 ASN C 51 86.361 17.712 -1.624 1.00 0.00 O ATOM 788 ND2 ASN C 51 88.401 18.147 -2.317 1.00 0.00 N ATOM 0 H ASN C 51 90.001 15.597 1.089 1.00 0.00 H new ATOM 0 HA ASN C 51 87.431 15.108 -0.303 1.00 0.00 H new ATOM 0 HB2 ASN C 51 87.423 17.321 0.705 1.00 0.00 H new ATOM 0 HB3 ASN C 51 89.054 17.652 0.155 1.00 0.00 H new ATOM 0 HD21 ASN C 51 88.042 18.518 -3.197 1.00 0.00 H new ATOM 0 HD22 ASN C 51 89.406 18.131 -2.142 1.00 0.00 H new ATOM 795 N PRO C 52 88.963 14.217 -2.141 1.00 0.00 N ATOM 796 CA PRO C 52 89.635 13.848 -3.398 1.00 0.00 C ATOM 797 C PRO C 52 88.946 14.460 -4.616 1.00 0.00 C ATOM 798 O PRO C 52 88.194 15.428 -4.498 1.00 0.00 O ATOM 799 CB PRO C 52 89.502 12.331 -3.400 1.00 0.00 C ATOM 800 CG PRO C 52 88.306 11.987 -2.518 1.00 0.00 C ATOM 801 CD PRO C 52 88.056 13.187 -1.599 1.00 0.00 C ATOM 0 HA PRO C 52 90.663 14.205 -3.455 1.00 0.00 H new ATOM 0 HB2 PRO C 52 89.354 11.958 -4.413 1.00 0.00 H new ATOM 0 HB3 PRO C 52 90.410 11.864 -3.018 1.00 0.00 H new ATOM 0 HG2 PRO C 52 87.426 11.780 -3.127 1.00 0.00 H new ATOM 0 HG3 PRO C 52 88.506 11.090 -1.932 1.00 0.00 H new ATOM 0 HD2 PRO C 52 87.015 13.509 -1.631 1.00 0.00 H new ATOM 0 HD3 PRO C 52 88.286 12.954 -0.559 1.00 0.00 H new ATOM 809 N THR C 53 89.207 13.887 -5.785 1.00 0.00 N ATOM 810 CA THR C 53 88.601 14.389 -7.015 1.00 0.00 C ATOM 811 C THR C 53 87.971 13.244 -7.800 1.00 0.00 C ATOM 812 O THR C 53 88.133 12.074 -7.455 1.00 0.00 O ATOM 813 CB THR C 53 89.652 15.077 -7.889 1.00 0.00 C ATOM 814 OG1 THR C 53 90.948 14.779 -7.391 1.00 0.00 O ATOM 815 CG2 THR C 53 89.428 16.590 -7.862 1.00 0.00 C ATOM 0 H THR C 53 89.825 13.085 -5.908 1.00 0.00 H new ATOM 0 HA THR C 53 87.831 15.111 -6.742 1.00 0.00 H new ATOM 0 HB THR C 53 89.565 14.717 -8.914 1.00 0.00 H new ATOM 0 HG1 THR C 53 91.622 15.218 -7.951 1.00 0.00 H new ATOM 0 HG21 THR C 53 90.177 17.080 -8.485 1.00 0.00 H new ATOM 0 HG22 THR C 53 88.433 16.817 -8.244 1.00 0.00 H new ATOM 0 HG23 THR C 53 89.515 16.952 -6.838 1.00 0.00 H new ATOM 823 N PRO C 54 87.255 13.577 -8.868 1.00 0.00 N ATOM 824 CA PRO C 54 86.599 12.573 -9.722 1.00 0.00 C ATOM 825 C PRO C 54 87.589 11.888 -10.656 1.00 0.00 C ATOM 826 O PRO C 54 87.314 10.828 -11.216 1.00 0.00 O ATOM 827 CB PRO C 54 85.594 13.413 -10.500 1.00 0.00 C ATOM 828 CG PRO C 54 86.114 14.845 -10.492 1.00 0.00 C ATOM 829 CD PRO C 54 87.061 14.977 -9.295 1.00 0.00 C ATOM 0 HA PRO C 54 86.146 11.758 -9.157 1.00 0.00 H new ATOM 0 HB2 PRO C 54 85.491 13.045 -11.521 1.00 0.00 H new ATOM 0 HB3 PRO C 54 84.607 13.358 -10.041 1.00 0.00 H new ATOM 0 HG2 PRO C 54 86.636 15.070 -11.422 1.00 0.00 H new ATOM 0 HG3 PRO C 54 85.289 15.553 -10.410 1.00 0.00 H new ATOM 0 HD2 PRO C 54 88.003 15.447 -9.576 1.00 0.00 H new ATOM 0 HD3 PRO C 54 86.626 15.584 -8.501 1.00 0.00 H new ATOM 837 N GLU C 55 88.754 12.510 -10.802 1.00 0.00 N ATOM 838 CA GLU C 55 89.802 11.963 -11.653 1.00 0.00 C ATOM 839 C GLU C 55 90.646 10.973 -10.859 1.00 0.00 C ATOM 840 O GLU C 55 91.079 9.943 -11.377 1.00 0.00 O ATOM 841 CB GLU C 55 90.701 13.082 -12.177 1.00 0.00 C ATOM 842 CG GLU C 55 89.895 13.982 -13.116 1.00 0.00 C ATOM 843 CD GLU C 55 90.480 13.904 -14.521 1.00 0.00 C ATOM 844 OE1 GLU C 55 91.678 13.703 -14.632 1.00 0.00 O ATOM 845 OE2 GLU C 55 89.721 14.045 -15.465 1.00 0.00 O ATOM 0 H GLU C 55 88.995 13.389 -10.344 1.00 0.00 H new ATOM 0 HA GLU C 55 89.334 11.456 -12.497 1.00 0.00 H new ATOM 0 HB2 GLU C 55 91.096 13.666 -11.346 1.00 0.00 H new ATOM 0 HB3 GLU C 55 91.556 12.660 -12.705 1.00 0.00 H new ATOM 0 HG2 GLU C 55 88.850 13.671 -13.128 1.00 0.00 H new ATOM 0 HG3 GLU C 55 89.917 15.011 -12.758 1.00 0.00 H new ATOM 852 N GLU C 56 90.867 11.299 -9.589 1.00 0.00 N ATOM 853 CA GLU C 56 91.654 10.435 -8.715 1.00 0.00 C ATOM 854 C GLU C 56 90.838 9.210 -8.318 1.00 0.00 C ATOM 855 O GLU C 56 91.280 8.072 -8.476 1.00 0.00 O ATOM 856 CB GLU C 56 92.070 11.188 -7.449 1.00 0.00 C ATOM 857 CG GLU C 56 93.474 11.767 -7.635 1.00 0.00 C ATOM 858 CD GLU C 56 94.223 11.720 -6.308 1.00 0.00 C ATOM 859 OE1 GLU C 56 94.410 10.630 -5.794 1.00 0.00 O ATOM 860 OE2 GLU C 56 94.599 12.776 -5.824 1.00 0.00 O ATOM 0 H GLU C 56 90.516 12.147 -9.145 1.00 0.00 H new ATOM 0 HA GLU C 56 92.546 10.123 -9.258 1.00 0.00 H new ATOM 0 HB2 GLU C 56 91.360 11.988 -7.240 1.00 0.00 H new ATOM 0 HB3 GLU C 56 92.054 10.515 -6.592 1.00 0.00 H new ATOM 0 HG2 GLU C 56 94.016 11.199 -8.391 1.00 0.00 H new ATOM 0 HG3 GLU C 56 93.411 12.795 -7.993 1.00 0.00 H new ATOM 867 N LEU C 57 89.635 9.458 -7.805 1.00 0.00 N ATOM 868 CA LEU C 57 88.756 8.369 -7.391 1.00 0.00 C ATOM 869 C LEU C 57 88.594 7.367 -8.528 1.00 0.00 C ATOM 870 O LEU C 57 88.376 6.177 -8.302 1.00 0.00 O ATOM 871 CB LEU C 57 87.381 8.909 -6.996 1.00 0.00 C ATOM 872 CG LEU C 57 87.487 9.630 -5.652 1.00 0.00 C ATOM 873 CD1 LEU C 57 86.335 10.626 -5.516 1.00 0.00 C ATOM 874 CD2 LEU C 57 87.411 8.606 -4.517 1.00 0.00 C ATOM 0 H LEU C 57 89.250 10.393 -7.667 1.00 0.00 H new ATOM 0 HA LEU C 57 89.206 7.876 -6.530 1.00 0.00 H new ATOM 0 HB2 LEU C 57 87.013 9.593 -7.761 1.00 0.00 H new ATOM 0 HB3 LEU C 57 86.663 8.092 -6.927 1.00 0.00 H new ATOM 0 HG LEU C 57 88.437 10.162 -5.599 1.00 0.00 H new ATOM 0 HD11 LEU C 57 86.410 11.140 -4.558 1.00 0.00 H new ATOM 0 HD12 LEU C 57 86.387 11.355 -6.324 1.00 0.00 H new ATOM 0 HD13 LEU C 57 85.385 10.093 -5.569 1.00 0.00 H new ATOM 0 HD21 LEU C 57 87.487 9.119 -3.558 1.00 0.00 H new ATOM 0 HD22 LEU C 57 86.461 8.074 -4.570 1.00 0.00 H new ATOM 0 HD23 LEU C 57 88.231 7.895 -4.613 1.00 0.00 H new ATOM 886 N GLN C 58 88.710 7.865 -9.756 1.00 0.00 N ATOM 887 CA GLN C 58 88.585 7.007 -10.930 1.00 0.00 C ATOM 888 C GLN C 58 89.635 5.904 -10.882 1.00 0.00 C ATOM 889 O GLN C 58 89.405 4.785 -11.341 1.00 0.00 O ATOM 890 CB GLN C 58 88.771 7.824 -12.212 1.00 0.00 C ATOM 891 CG GLN C 58 88.754 6.893 -13.427 1.00 0.00 C ATOM 892 CD GLN C 58 87.362 6.892 -14.050 1.00 0.00 C ATOM 893 OE1 GLN C 58 87.015 7.793 -14.813 1.00 0.00 O ATOM 894 NE2 GLN C 58 86.537 5.921 -13.769 1.00 0.00 N ATOM 0 H GLN C 58 88.888 8.848 -9.963 1.00 0.00 H new ATOM 0 HA GLN C 58 87.589 6.565 -10.929 1.00 0.00 H new ATOM 0 HB2 GLN C 58 87.977 8.566 -12.300 1.00 0.00 H new ATOM 0 HB3 GLN C 58 89.714 8.369 -12.173 1.00 0.00 H new ATOM 0 HG2 GLN C 58 89.491 7.221 -14.160 1.00 0.00 H new ATOM 0 HG3 GLN C 58 89.030 5.882 -13.127 1.00 0.00 H new ATOM 0 HE21 GLN C 58 86.825 5.174 -13.137 1.00 0.00 H new ATOM 0 HE22 GLN C 58 85.604 5.909 -14.182 1.00 0.00 H new ATOM 903 N GLU C 59 90.792 6.234 -10.316 1.00 0.00 N ATOM 904 CA GLU C 59 91.879 5.267 -10.205 1.00 0.00 C ATOM 905 C GLU C 59 91.544 4.214 -9.155 1.00 0.00 C ATOM 906 O GLU C 59 92.137 3.135 -9.125 1.00 0.00 O ATOM 907 CB GLU C 59 93.181 5.967 -9.813 1.00 0.00 C ATOM 908 CG GLU C 59 93.441 7.131 -10.771 1.00 0.00 C ATOM 909 CD GLU C 59 94.918 7.504 -10.729 1.00 0.00 C ATOM 910 OE1 GLU C 59 95.662 6.820 -10.046 1.00 0.00 O ATOM 911 OE2 GLU C 59 95.284 8.468 -11.381 1.00 0.00 O ATOM 0 H GLU C 59 91.000 7.155 -9.930 1.00 0.00 H new ATOM 0 HA GLU C 59 92.006 4.787 -11.175 1.00 0.00 H new ATOM 0 HB2 GLU C 59 93.116 6.333 -8.788 1.00 0.00 H new ATOM 0 HB3 GLU C 59 94.011 5.261 -9.847 1.00 0.00 H new ATOM 0 HG2 GLU C 59 93.154 6.852 -11.785 1.00 0.00 H new ATOM 0 HG3 GLU C 59 92.830 7.989 -10.491 1.00 0.00 H new ATOM 918 N MET C 60 90.584 4.540 -8.295 1.00 0.00 N ATOM 919 CA MET C 60 90.171 3.614 -7.244 1.00 0.00 C ATOM 920 C MET C 60 89.294 2.511 -7.825 1.00 0.00 C ATOM 921 O MET C 60 89.512 1.326 -7.576 1.00 0.00 O ATOM 922 CB MET C 60 89.383 4.352 -6.159 1.00 0.00 C ATOM 923 CG MET C 60 90.119 4.233 -4.823 1.00 0.00 C ATOM 924 SD MET C 60 90.961 5.793 -4.458 1.00 0.00 S ATOM 925 CE MET C 60 90.208 6.080 -2.838 1.00 0.00 C ATOM 0 H MET C 60 90.082 5.428 -8.303 1.00 0.00 H new ATOM 0 HA MET C 60 91.069 3.177 -6.808 1.00 0.00 H new ATOM 0 HB2 MET C 60 89.266 5.401 -6.430 1.00 0.00 H new ATOM 0 HB3 MET C 60 88.381 3.932 -6.073 1.00 0.00 H new ATOM 0 HG2 MET C 60 89.414 3.993 -4.027 1.00 0.00 H new ATOM 0 HG3 MET C 60 90.842 3.418 -4.865 1.00 0.00 H new ATOM 0 HE1 MET C 60 90.297 7.135 -2.577 1.00 0.00 H new ATOM 0 HE2 MET C 60 89.154 5.803 -2.872 1.00 0.00 H new ATOM 0 HE3 MET C 60 90.718 5.476 -2.088 1.00 0.00 H new ATOM 935 N ILE C 61 88.297 2.919 -8.604 1.00 0.00 N ATOM 936 CA ILE C 61 87.382 1.966 -9.224 1.00 0.00 C ATOM 937 C ILE C 61 88.139 1.057 -10.192 1.00 0.00 C ATOM 938 O ILE C 61 87.982 -0.161 -10.169 1.00 0.00 O ATOM 939 CB ILE C 61 86.270 2.720 -9.971 1.00 0.00 C ATOM 940 CG1 ILE C 61 85.205 3.196 -8.970 1.00 0.00 C ATOM 941 CG2 ILE C 61 85.608 1.802 -11.004 1.00 0.00 C ATOM 942 CD1 ILE C 61 85.872 3.681 -7.678 1.00 0.00 C ATOM 0 H ILE C 61 88.102 3.897 -8.820 1.00 0.00 H new ATOM 0 HA ILE C 61 86.934 1.350 -8.444 1.00 0.00 H new ATOM 0 HB ILE C 61 86.711 3.577 -10.480 1.00 0.00 H new ATOM 0 HG12 ILE C 61 84.617 4.002 -9.409 1.00 0.00 H new ATOM 0 HG13 ILE C 61 84.515 2.382 -8.748 1.00 0.00 H new ATOM 0 HG21 ILE C 61 84.822 2.348 -11.526 1.00 0.00 H new ATOM 0 HG22 ILE C 61 86.355 1.465 -11.723 1.00 0.00 H new ATOM 0 HG23 ILE C 61 85.175 0.938 -10.499 1.00 0.00 H new ATOM 0 HD11 ILE C 61 85.107 4.016 -6.977 1.00 0.00 H new ATOM 0 HD12 ILE C 61 86.440 2.864 -7.233 1.00 0.00 H new ATOM 0 HD13 ILE C 61 86.544 4.509 -7.904 1.00 0.00 H new ATOM 954 N ASP C 62 88.960 1.666 -11.040 1.00 0.00 N ATOM 955 CA ASP C 62 89.737 0.905 -12.016 1.00 0.00 C ATOM 956 C ASP C 62 90.234 -0.404 -11.409 1.00 0.00 C ATOM 957 O ASP C 62 90.095 -1.472 -12.004 1.00 0.00 O ATOM 958 CB ASP C 62 90.943 1.720 -12.489 1.00 0.00 C ATOM 959 CG ASP C 62 90.655 2.310 -13.865 1.00 0.00 C ATOM 960 OD1 ASP C 62 90.828 1.599 -14.841 1.00 0.00 O ATOM 961 OD2 ASP C 62 90.266 3.465 -13.922 1.00 0.00 O ATOM 0 H ASP C 62 89.105 2.675 -11.073 1.00 0.00 H new ATOM 0 HA ASP C 62 89.086 0.686 -12.862 1.00 0.00 H new ATOM 0 HB2 ASP C 62 91.157 2.518 -11.778 1.00 0.00 H new ATOM 0 HB3 ASP C 62 91.829 1.086 -12.532 1.00 0.00 H new ATOM 966 N GLU C 63 90.818 -0.308 -10.220 1.00 0.00 N ATOM 967 CA GLU C 63 91.339 -1.494 -9.541 1.00 0.00 C ATOM 968 C GLU C 63 90.259 -2.565 -9.441 1.00 0.00 C ATOM 969 O GLU C 63 90.393 -3.660 -9.987 1.00 0.00 O ATOM 970 CB GLU C 63 91.820 -1.149 -8.129 1.00 0.00 C ATOM 971 CG GLU C 63 92.451 0.244 -8.123 1.00 0.00 C ATOM 972 CD GLU C 63 93.652 0.256 -7.185 1.00 0.00 C ATOM 973 OE1 GLU C 63 94.198 -0.808 -6.940 1.00 0.00 O ATOM 974 OE2 GLU C 63 94.009 1.327 -6.724 1.00 0.00 O ATOM 0 H GLU C 63 90.943 0.566 -9.709 1.00 0.00 H new ATOM 0 HA GLU C 63 92.179 -1.867 -10.127 1.00 0.00 H new ATOM 0 HB2 GLU C 63 90.983 -1.182 -7.431 1.00 0.00 H new ATOM 0 HB3 GLU C 63 92.546 -1.889 -7.791 1.00 0.00 H new ATOM 0 HG2 GLU C 63 92.761 0.518 -9.131 1.00 0.00 H new ATOM 0 HG3 GLU C 63 91.719 0.985 -7.802 1.00 0.00 H new ATOM 981 N VAL C 64 89.188 -2.233 -8.729 1.00 0.00 N ATOM 982 CA VAL C 64 88.082 -3.166 -8.546 1.00 0.00 C ATOM 983 C VAL C 64 87.328 -3.375 -9.857 1.00 0.00 C ATOM 984 O VAL C 64 86.609 -4.360 -10.024 1.00 0.00 O ATOM 985 CB VAL C 64 87.112 -2.631 -7.494 1.00 0.00 C ATOM 986 CG1 VAL C 64 87.749 -2.743 -6.108 1.00 0.00 C ATOM 987 CG2 VAL C 64 86.800 -1.163 -7.793 1.00 0.00 C ATOM 0 H VAL C 64 89.062 -1.330 -8.271 1.00 0.00 H new ATOM 0 HA VAL C 64 88.496 -4.119 -8.216 1.00 0.00 H new ATOM 0 HB VAL C 64 86.191 -3.213 -7.518 1.00 0.00 H new ATOM 0 HG11 VAL C 64 87.057 -2.361 -5.358 1.00 0.00 H new ATOM 0 HG12 VAL C 64 87.975 -3.788 -5.895 1.00 0.00 H new ATOM 0 HG13 VAL C 64 88.670 -2.160 -6.082 1.00 0.00 H new ATOM 0 HG21 VAL C 64 86.108 -0.778 -7.044 1.00 0.00 H new ATOM 0 HG22 VAL C 64 87.722 -0.582 -7.767 1.00 0.00 H new ATOM 0 HG23 VAL C 64 86.347 -1.081 -8.781 1.00 0.00 H new ATOM 997 N ASP C 65 87.498 -2.438 -10.786 1.00 0.00 N ATOM 998 CA ASP C 65 86.826 -2.533 -12.078 1.00 0.00 C ATOM 999 C ASP C 65 87.539 -3.540 -12.972 1.00 0.00 C ATOM 1000 O ASP C 65 88.115 -3.182 -14.000 1.00 0.00 O ATOM 1001 CB ASP C 65 86.806 -1.170 -12.774 1.00 0.00 C ATOM 1002 CG ASP C 65 85.371 -0.660 -12.856 1.00 0.00 C ATOM 1003 OD1 ASP C 65 84.602 -0.966 -11.961 1.00 0.00 O ATOM 1004 OD2 ASP C 65 85.064 0.031 -13.814 1.00 0.00 O ATOM 0 H ASP C 65 88.088 -1.614 -10.671 1.00 0.00 H new ATOM 0 HA ASP C 65 85.802 -2.863 -11.903 1.00 0.00 H new ATOM 0 HB2 ASP C 65 87.424 -0.460 -12.224 1.00 0.00 H new ATOM 0 HB3 ASP C 65 87.231 -1.255 -13.774 1.00 0.00 H new ATOM 1009 N GLU C 66 87.494 -4.807 -12.567 1.00 0.00 N ATOM 1010 CA GLU C 66 88.139 -5.866 -13.337 1.00 0.00 C ATOM 1011 C GLU C 66 87.288 -6.234 -14.549 1.00 0.00 C ATOM 1012 O GLU C 66 87.809 -6.584 -15.608 1.00 0.00 O ATOM 1013 CB GLU C 66 88.343 -7.112 -12.471 1.00 0.00 C ATOM 1014 CG GLU C 66 89.669 -6.998 -11.715 1.00 0.00 C ATOM 1015 CD GLU C 66 90.452 -8.298 -11.859 1.00 0.00 C ATOM 1016 OE1 GLU C 66 89.895 -9.247 -12.387 1.00 0.00 O ATOM 1017 OE2 GLU C 66 91.597 -8.327 -11.438 1.00 0.00 O ATOM 0 H GLU C 66 87.023 -5.123 -11.719 1.00 0.00 H new ATOM 0 HA GLU C 66 89.109 -5.497 -13.672 1.00 0.00 H new ATOM 0 HB2 GLU C 66 87.518 -7.217 -11.766 1.00 0.00 H new ATOM 0 HB3 GLU C 66 88.344 -8.005 -13.095 1.00 0.00 H new ATOM 0 HG2 GLU C 66 90.252 -6.165 -12.107 1.00 0.00 H new ATOM 0 HG3 GLU C 66 89.482 -6.789 -10.662 1.00 0.00 H new ATOM 1024 N ASP C 67 85.971 -6.149 -14.380 1.00 0.00 N ATOM 1025 CA ASP C 67 85.050 -6.473 -15.467 1.00 0.00 C ATOM 1026 C ASP C 67 84.870 -5.269 -16.385 1.00 0.00 C ATOM 1027 O ASP C 67 84.588 -5.413 -17.575 1.00 0.00 O ATOM 1028 CB ASP C 67 83.684 -6.885 -14.913 1.00 0.00 C ATOM 1029 CG ASP C 67 82.994 -5.669 -14.304 1.00 0.00 C ATOM 1030 OD1 ASP C 67 83.440 -5.220 -13.261 1.00 0.00 O ATOM 1031 OD2 ASP C 67 82.030 -5.204 -14.889 1.00 0.00 O ATOM 0 H ASP C 67 85.521 -5.862 -13.511 1.00 0.00 H new ATOM 0 HA ASP C 67 85.475 -7.303 -16.031 1.00 0.00 H new ATOM 0 HB2 ASP C 67 83.069 -7.305 -15.709 1.00 0.00 H new ATOM 0 HB3 ASP C 67 83.805 -7.663 -14.159 1.00 0.00 H new ATOM 1036 N GLY C 68 85.035 -4.079 -15.816 1.00 0.00 N ATOM 1037 CA GLY C 68 84.888 -2.850 -16.589 1.00 0.00 C ATOM 1038 C GLY C 68 83.470 -2.303 -16.467 1.00 0.00 C ATOM 1039 O GLY C 68 82.996 -1.566 -17.331 1.00 0.00 O ATOM 0 H GLY C 68 85.268 -3.939 -14.833 1.00 0.00 H new ATOM 0 HA2 GLY C 68 85.602 -2.105 -16.237 1.00 0.00 H new ATOM 0 HA3 GLY C 68 85.120 -3.043 -17.636 1.00 0.00 H new ATOM 1043 N SER C 69 82.797 -2.675 -15.381 1.00 0.00 N ATOM 1044 CA SER C 69 81.428 -2.219 -15.150 1.00 0.00 C ATOM 1045 C SER C 69 81.380 -0.696 -15.068 1.00 0.00 C ATOM 1046 O SER C 69 80.405 -0.069 -15.484 1.00 0.00 O ATOM 1047 CB SER C 69 80.880 -2.807 -13.850 1.00 0.00 C ATOM 1048 OG SER C 69 81.909 -2.821 -12.869 1.00 0.00 O ATOM 0 H SER C 69 83.172 -3.284 -14.654 1.00 0.00 H new ATOM 0 HA SER C 69 80.815 -2.557 -15.986 1.00 0.00 H new ATOM 0 HB2 SER C 69 80.035 -2.216 -13.498 1.00 0.00 H new ATOM 0 HB3 SER C 69 80.512 -3.819 -14.022 1.00 0.00 H new ATOM 1054 N GLY C 70 82.445 -0.108 -14.530 1.00 0.00 N ATOM 1055 CA GLY C 70 82.517 1.345 -14.401 1.00 0.00 C ATOM 1056 C GLY C 70 82.239 1.783 -12.966 1.00 0.00 C ATOM 1057 O GLY C 70 82.347 2.963 -12.631 1.00 0.00 O ATOM 0 H GLY C 70 83.262 -0.608 -14.180 1.00 0.00 H new ATOM 0 HA2 GLY C 70 83.504 1.692 -14.706 1.00 0.00 H new ATOM 0 HA3 GLY C 70 81.795 1.809 -15.073 1.00 0.00 H new ATOM 1061 N THR C 71 81.881 0.821 -12.120 1.00 0.00 N ATOM 1062 CA THR C 71 81.590 1.121 -10.720 1.00 0.00 C ATOM 1063 C THR C 71 82.042 -0.028 -9.825 1.00 0.00 C ATOM 1064 O THR C 71 82.663 -0.986 -10.285 1.00 0.00 O ATOM 1065 CB THR C 71 80.091 1.353 -10.521 1.00 0.00 C ATOM 1066 OG1 THR C 71 79.374 0.215 -10.980 1.00 0.00 O ATOM 1067 CG2 THR C 71 79.653 2.587 -11.310 1.00 0.00 C ATOM 0 H THR C 71 81.786 -0.162 -12.374 1.00 0.00 H new ATOM 0 HA THR C 71 82.133 2.026 -10.449 1.00 0.00 H new ATOM 0 HB THR C 71 79.885 1.512 -9.463 1.00 0.00 H new ATOM 0 HG1 THR C 71 78.442 0.464 -11.154 1.00 0.00 H new ATOM 0 HG21 THR C 71 78.585 2.750 -11.167 1.00 0.00 H new ATOM 0 HG22 THR C 71 80.204 3.459 -10.957 1.00 0.00 H new ATOM 0 HG23 THR C 71 79.858 2.433 -12.369 1.00 0.00 H new ATOM 1075 N VAL C 72 81.725 0.082 -8.538 1.00 0.00 N ATOM 1076 CA VAL C 72 82.107 -0.953 -7.580 1.00 0.00 C ATOM 1077 C VAL C 72 80.885 -1.453 -6.814 1.00 0.00 C ATOM 1078 O VAL C 72 80.393 -0.792 -5.900 1.00 0.00 O ATOM 1079 CB VAL C 72 83.130 -0.409 -6.581 1.00 0.00 C ATOM 1080 CG1 VAL C 72 84.021 -1.551 -6.087 1.00 0.00 C ATOM 1081 CG2 VAL C 72 83.993 0.654 -7.266 1.00 0.00 C ATOM 0 H VAL C 72 81.211 0.867 -8.137 1.00 0.00 H new ATOM 0 HA VAL C 72 82.548 -1.778 -8.139 1.00 0.00 H new ATOM 0 HB VAL C 72 82.609 0.036 -5.733 1.00 0.00 H new ATOM 0 HG11 VAL C 72 84.749 -1.162 -5.375 1.00 0.00 H new ATOM 0 HG12 VAL C 72 83.406 -2.308 -5.600 1.00 0.00 H new ATOM 0 HG13 VAL C 72 84.543 -1.997 -6.933 1.00 0.00 H new ATOM 0 HG21 VAL C 72 84.723 1.043 -6.556 1.00 0.00 H new ATOM 0 HG22 VAL C 72 84.513 0.209 -8.114 1.00 0.00 H new ATOM 0 HG23 VAL C 72 83.358 1.468 -7.616 1.00 0.00 H new ATOM 1091 N ASP C 73 80.407 -2.634 -7.197 1.00 0.00 N ATOM 1092 CA ASP C 73 79.243 -3.229 -6.543 1.00 0.00 C ATOM 1093 C ASP C 73 79.532 -3.471 -5.061 1.00 0.00 C ATOM 1094 O ASP C 73 80.526 -2.986 -4.521 1.00 0.00 O ATOM 1095 CB ASP C 73 78.886 -4.558 -7.214 1.00 0.00 C ATOM 1096 CG ASP C 73 80.129 -5.438 -7.293 1.00 0.00 C ATOM 1097 OD1 ASP C 73 80.501 -5.996 -6.275 1.00 0.00 O ATOM 1098 OD2 ASP C 73 80.690 -5.541 -8.371 1.00 0.00 O ATOM 0 H ASP C 73 80.803 -3.195 -7.951 1.00 0.00 H new ATOM 0 HA ASP C 73 78.405 -2.539 -6.636 1.00 0.00 H new ATOM 0 HB2 ASP C 73 78.104 -5.065 -6.648 1.00 0.00 H new ATOM 0 HB3 ASP C 73 78.491 -4.378 -8.214 1.00 0.00 H new ATOM 1103 N PHE C 74 78.647 -4.223 -4.410 1.00 0.00 N ATOM 1104 CA PHE C 74 78.808 -4.522 -2.988 1.00 0.00 C ATOM 1105 C PHE C 74 79.713 -5.740 -2.787 1.00 0.00 C ATOM 1106 O PHE C 74 79.867 -6.241 -1.673 1.00 0.00 O ATOM 1107 CB PHE C 74 77.441 -4.798 -2.354 1.00 0.00 C ATOM 1108 CG PHE C 74 77.618 -5.310 -0.944 1.00 0.00 C ATOM 1109 CD1 PHE C 74 78.325 -4.550 -0.004 1.00 0.00 C ATOM 1110 CD2 PHE C 74 77.076 -6.548 -0.578 1.00 0.00 C ATOM 1111 CE1 PHE C 74 78.489 -5.028 1.301 1.00 0.00 C ATOM 1112 CE2 PHE C 74 77.240 -7.026 0.728 1.00 0.00 C ATOM 1113 CZ PHE C 74 77.946 -6.266 1.667 1.00 0.00 C ATOM 0 H PHE C 74 77.818 -4.634 -4.839 1.00 0.00 H new ATOM 0 HA PHE C 74 79.269 -3.658 -2.509 1.00 0.00 H new ATOM 0 HB2 PHE C 74 76.844 -3.886 -2.346 1.00 0.00 H new ATOM 0 HB3 PHE C 74 76.896 -5.530 -2.950 1.00 0.00 H new ATOM 0 HD1 PHE C 74 78.744 -3.595 -0.286 1.00 0.00 H new ATOM 0 HD2 PHE C 74 76.531 -7.134 -1.303 1.00 0.00 H new ATOM 0 HE1 PHE C 74 79.034 -4.442 2.026 1.00 0.00 H new ATOM 0 HE2 PHE C 74 76.822 -7.981 1.010 1.00 0.00 H new ATOM 0 HZ PHE C 74 78.072 -6.634 2.674 1.00 0.00 H new ATOM 1123 N ASP C 75 80.310 -6.215 -3.875 1.00 0.00 N ATOM 1124 CA ASP C 75 81.192 -7.377 -3.795 1.00 0.00 C ATOM 1125 C ASP C 75 82.658 -6.958 -3.891 1.00 0.00 C ATOM 1126 O ASP C 75 83.372 -6.914 -2.889 1.00 0.00 O ATOM 1127 CB ASP C 75 80.883 -8.362 -4.925 1.00 0.00 C ATOM 1128 CG ASP C 75 80.447 -9.698 -4.333 1.00 0.00 C ATOM 1129 OD1 ASP C 75 81.228 -10.281 -3.600 1.00 0.00 O ATOM 1130 OD2 ASP C 75 79.338 -10.118 -4.621 1.00 0.00 O ATOM 0 H ASP C 75 80.203 -5.822 -4.810 1.00 0.00 H new ATOM 0 HA ASP C 75 81.019 -7.857 -2.832 1.00 0.00 H new ATOM 0 HB2 ASP C 75 80.096 -7.962 -5.565 1.00 0.00 H new ATOM 0 HB3 ASP C 75 81.764 -8.500 -5.552 1.00 0.00 H new ATOM 1135 N GLU C 76 83.101 -6.666 -5.111 1.00 0.00 N ATOM 1136 CA GLU C 76 84.491 -6.266 -5.335 1.00 0.00 C ATOM 1137 C GLU C 76 84.965 -5.296 -4.255 1.00 0.00 C ATOM 1138 O GLU C 76 86.141 -5.281 -3.890 1.00 0.00 O ATOM 1139 CB GLU C 76 84.652 -5.599 -6.706 1.00 0.00 C ATOM 1140 CG GLU C 76 83.477 -4.652 -6.968 1.00 0.00 C ATOM 1141 CD GLU C 76 83.574 -4.100 -8.387 1.00 0.00 C ATOM 1142 OE1 GLU C 76 84.678 -3.809 -8.817 1.00 0.00 O ATOM 1143 OE2 GLU C 76 82.541 -3.980 -9.025 1.00 0.00 O ATOM 0 H GLU C 76 82.526 -6.698 -5.953 1.00 0.00 H new ATOM 0 HA GLU C 76 85.098 -7.171 -5.296 1.00 0.00 H new ATOM 0 HB2 GLU C 76 85.591 -5.046 -6.743 1.00 0.00 H new ATOM 0 HB3 GLU C 76 84.699 -6.359 -7.486 1.00 0.00 H new ATOM 0 HG2 GLU C 76 82.533 -5.181 -6.836 1.00 0.00 H new ATOM 0 HG3 GLU C 76 83.487 -3.835 -6.247 1.00 0.00 H new ATOM 1150 N PHE C 77 84.042 -4.488 -3.744 1.00 0.00 N ATOM 1151 CA PHE C 77 84.385 -3.520 -2.704 1.00 0.00 C ATOM 1152 C PHE C 77 85.021 -4.229 -1.507 1.00 0.00 C ATOM 1153 O PHE C 77 86.243 -4.262 -1.363 1.00 0.00 O ATOM 1154 CB PHE C 77 83.130 -2.764 -2.248 1.00 0.00 C ATOM 1155 CG PHE C 77 83.392 -2.056 -0.938 1.00 0.00 C ATOM 1156 CD1 PHE C 77 84.582 -1.342 -0.750 1.00 0.00 C ATOM 1157 CD2 PHE C 77 82.442 -2.115 0.089 1.00 0.00 C ATOM 1158 CE1 PHE C 77 84.821 -0.689 0.465 1.00 0.00 C ATOM 1159 CE2 PHE C 77 82.681 -1.462 1.304 1.00 0.00 C ATOM 1160 CZ PHE C 77 83.871 -0.749 1.492 1.00 0.00 C ATOM 0 H PHE C 77 83.062 -4.482 -4.027 1.00 0.00 H new ATOM 0 HA PHE C 77 85.100 -2.809 -3.117 1.00 0.00 H new ATOM 0 HB2 PHE C 77 82.837 -2.040 -3.008 1.00 0.00 H new ATOM 0 HB3 PHE C 77 82.299 -3.460 -2.133 1.00 0.00 H new ATOM 0 HD1 PHE C 77 85.315 -1.295 -1.542 1.00 0.00 H new ATOM 0 HD2 PHE C 77 81.524 -2.665 -0.056 1.00 0.00 H new ATOM 0 HE1 PHE C 77 85.739 -0.139 0.610 1.00 0.00 H new ATOM 0 HE2 PHE C 77 81.948 -1.508 2.096 1.00 0.00 H new ATOM 0 HZ PHE C 77 84.056 -0.245 2.429 1.00 0.00 H new ATOM 1170 N LEU C 78 84.173 -4.791 -0.651 1.00 0.00 N ATOM 1171 CA LEU C 78 84.649 -5.497 0.538 1.00 0.00 C ATOM 1172 C LEU C 78 85.951 -6.241 0.250 1.00 0.00 C ATOM 1173 O LEU C 78 86.930 -6.116 0.986 1.00 0.00 O ATOM 1174 CB LEU C 78 83.602 -6.505 1.014 1.00 0.00 C ATOM 1175 CG LEU C 78 82.653 -5.829 2.004 1.00 0.00 C ATOM 1176 CD1 LEU C 78 81.275 -6.488 1.922 1.00 0.00 C ATOM 1177 CD2 LEU C 78 83.209 -5.980 3.422 1.00 0.00 C ATOM 0 H LEU C 78 83.159 -4.773 -0.756 1.00 0.00 H new ATOM 0 HA LEU C 78 84.826 -4.752 1.313 1.00 0.00 H new ATOM 0 HB2 LEU C 78 83.041 -6.891 0.163 1.00 0.00 H new ATOM 0 HB3 LEU C 78 84.091 -7.357 1.487 1.00 0.00 H new ATOM 0 HG LEU C 78 82.562 -4.771 1.759 1.00 0.00 H new ATOM 0 HD11 LEU C 78 80.599 -6.006 2.628 1.00 0.00 H new ATOM 0 HD12 LEU C 78 80.881 -6.382 0.911 1.00 0.00 H new ATOM 0 HD13 LEU C 78 81.363 -7.546 2.168 1.00 0.00 H new ATOM 0 HD21 LEU C 78 82.535 -5.499 4.130 1.00 0.00 H new ATOM 0 HD22 LEU C 78 83.298 -7.038 3.667 1.00 0.00 H new ATOM 0 HD23 LEU C 78 84.191 -5.510 3.480 1.00 0.00 H new ATOM 1189 N VAL C 79 85.946 -7.025 -0.823 1.00 0.00 N ATOM 1190 CA VAL C 79 87.127 -7.800 -1.200 1.00 0.00 C ATOM 1191 C VAL C 79 88.346 -6.896 -1.369 1.00 0.00 C ATOM 1192 O VAL C 79 89.418 -7.171 -0.830 1.00 0.00 O ATOM 1193 CB VAL C 79 86.875 -8.554 -2.508 1.00 0.00 C ATOM 1194 CG1 VAL C 79 88.183 -9.173 -3.006 1.00 0.00 C ATOM 1195 CG2 VAL C 79 85.847 -9.662 -2.263 1.00 0.00 C ATOM 0 H VAL C 79 85.145 -7.142 -1.444 1.00 0.00 H new ATOM 0 HA VAL C 79 87.324 -8.513 -0.399 1.00 0.00 H new ATOM 0 HB VAL C 79 86.496 -7.861 -3.259 1.00 0.00 H new ATOM 0 HG11 VAL C 79 88.000 -9.709 -3.937 1.00 0.00 H new ATOM 0 HG12 VAL C 79 88.916 -8.385 -3.179 1.00 0.00 H new ATOM 0 HG13 VAL C 79 88.566 -9.867 -2.257 1.00 0.00 H new ATOM 0 HG21 VAL C 79 85.665 -10.201 -3.193 1.00 0.00 H new ATOM 0 HG22 VAL C 79 86.229 -10.353 -1.511 1.00 0.00 H new ATOM 0 HG23 VAL C 79 84.914 -9.222 -1.910 1.00 0.00 H new ATOM 1205 N MET C 80 88.174 -5.817 -2.127 1.00 0.00 N ATOM 1206 CA MET C 80 89.273 -4.884 -2.364 1.00 0.00 C ATOM 1207 C MET C 80 89.987 -4.544 -1.058 1.00 0.00 C ATOM 1208 O MET C 80 91.211 -4.417 -1.019 1.00 0.00 O ATOM 1209 CB MET C 80 88.754 -3.591 -2.995 1.00 0.00 C ATOM 1210 CG MET C 80 89.892 -2.571 -3.072 1.00 0.00 C ATOM 1211 SD MET C 80 89.411 -1.213 -4.166 1.00 0.00 S ATOM 1212 CE MET C 80 89.779 0.140 -3.023 1.00 0.00 C ATOM 0 H MET C 80 87.296 -5.568 -2.583 1.00 0.00 H new ATOM 0 HA MET C 80 89.975 -5.367 -3.044 1.00 0.00 H new ATOM 0 HB2 MET C 80 88.363 -3.792 -3.992 1.00 0.00 H new ATOM 0 HB3 MET C 80 87.931 -3.190 -2.404 1.00 0.00 H new ATOM 0 HG2 MET C 80 90.119 -2.188 -2.077 1.00 0.00 H new ATOM 0 HG3 MET C 80 90.798 -3.049 -3.444 1.00 0.00 H new ATOM 0 HE1 MET C 80 90.089 1.019 -3.588 1.00 0.00 H new ATOM 0 HE2 MET C 80 88.888 0.377 -2.441 1.00 0.00 H new ATOM 0 HE3 MET C 80 90.582 -0.160 -2.350 1.00 0.00 H new ATOM 1222 N MET C 81 89.210 -4.392 0.009 1.00 0.00 N ATOM 1223 CA MET C 81 89.780 -4.060 1.313 1.00 0.00 C ATOM 1224 C MET C 81 90.295 -5.315 2.011 1.00 0.00 C ATOM 1225 O MET C 81 91.421 -5.351 2.508 1.00 0.00 O ATOM 1226 CB MET C 81 88.725 -3.399 2.202 1.00 0.00 C ATOM 1227 CG MET C 81 89.128 -1.950 2.478 1.00 0.00 C ATOM 1228 SD MET C 81 87.946 -0.834 1.684 1.00 0.00 S ATOM 1229 CE MET C 81 88.826 -0.655 0.114 1.00 0.00 C ATOM 0 H MET C 81 88.195 -4.492 -0.000 1.00 0.00 H new ATOM 0 HA MET C 81 90.608 -3.371 1.150 1.00 0.00 H new ATOM 0 HB2 MET C 81 87.751 -3.430 1.714 1.00 0.00 H new ATOM 0 HB3 MET C 81 88.629 -3.946 3.140 1.00 0.00 H new ATOM 0 HG2 MET C 81 89.153 -1.766 3.552 1.00 0.00 H new ATOM 0 HG3 MET C 81 90.133 -1.762 2.099 1.00 0.00 H new ATOM 0 HE1 MET C 81 88.120 -0.748 -0.711 1.00 0.00 H new ATOM 0 HE2 MET C 81 89.304 0.324 0.074 1.00 0.00 H new ATOM 0 HE3 MET C 81 89.585 -1.433 0.032 1.00 0.00 H new ATOM 1239 N VAL C 82 89.451 -6.339 2.050 1.00 0.00 N ATOM 1240 CA VAL C 82 89.812 -7.597 2.699 1.00 0.00 C ATOM 1241 C VAL C 82 91.127 -8.146 2.149 1.00 0.00 C ATOM 1242 O VAL C 82 91.897 -8.779 2.870 1.00 0.00 O ATOM 1243 CB VAL C 82 88.712 -8.635 2.487 1.00 0.00 C ATOM 1244 CG1 VAL C 82 89.140 -9.967 3.104 1.00 0.00 C ATOM 1245 CG2 VAL C 82 87.425 -8.151 3.160 1.00 0.00 C ATOM 0 H VAL C 82 88.516 -6.325 1.643 1.00 0.00 H new ATOM 0 HA VAL C 82 89.932 -7.396 3.764 1.00 0.00 H new ATOM 0 HB VAL C 82 88.539 -8.771 1.419 1.00 0.00 H new ATOM 0 HG11 VAL C 82 88.354 -10.707 2.952 1.00 0.00 H new ATOM 0 HG12 VAL C 82 90.059 -10.310 2.628 1.00 0.00 H new ATOM 0 HG13 VAL C 82 89.312 -9.835 4.172 1.00 0.00 H new ATOM 0 HG21 VAL C 82 86.637 -8.889 3.011 1.00 0.00 H new ATOM 0 HG22 VAL C 82 87.601 -8.018 4.227 1.00 0.00 H new ATOM 0 HG23 VAL C 82 87.120 -7.201 2.721 1.00 0.00 H new ATOM 1255 N ARG C 83 91.376 -7.904 0.864 1.00 0.00 N ATOM 1256 CA ARG C 83 92.603 -8.390 0.235 1.00 0.00 C ATOM 1257 C ARG C 83 93.788 -7.504 0.609 1.00 0.00 C ATOM 1258 O ARG C 83 94.915 -7.979 0.754 1.00 0.00 O ATOM 1259 CB ARG C 83 92.457 -8.409 -1.289 1.00 0.00 C ATOM 1260 CG ARG C 83 92.493 -6.977 -1.826 1.00 0.00 C ATOM 1261 CD ARG C 83 92.385 -7.003 -3.351 1.00 0.00 C ATOM 1262 NE ARG C 83 92.801 -5.724 -3.919 1.00 0.00 N ATOM 1263 CZ ARG C 83 94.068 -5.323 -3.849 1.00 0.00 C ATOM 1264 NH1 ARG C 83 94.958 -6.075 -3.263 1.00 0.00 N ATOM 1265 NH2 ARG C 83 94.419 -4.177 -4.367 1.00 0.00 N ATOM 0 H ARG C 83 90.755 -7.382 0.245 1.00 0.00 H new ATOM 0 HA ARG C 83 92.781 -9.403 0.595 1.00 0.00 H new ATOM 0 HB2 ARG C 83 93.261 -8.995 -1.734 1.00 0.00 H new ATOM 0 HB3 ARG C 83 91.519 -8.890 -1.569 1.00 0.00 H new ATOM 0 HG2 ARG C 83 91.673 -6.397 -1.402 1.00 0.00 H new ATOM 0 HG3 ARG C 83 93.419 -6.487 -1.524 1.00 0.00 H new ATOM 0 HD2 ARG C 83 93.007 -7.804 -3.751 1.00 0.00 H new ATOM 0 HD3 ARG C 83 91.358 -7.220 -3.644 1.00 0.00 H new ATOM 0 HE ARG C 83 92.110 -5.129 -4.376 1.00 0.00 H new ATOM 0 HH11 ARG C 83 94.683 -6.970 -2.859 1.00 0.00 H new ATOM 0 HH12 ARG C 83 95.929 -5.768 -3.209 1.00 0.00 H new ATOM 0 HH21 ARG C 83 93.722 -3.590 -4.825 1.00 0.00 H new ATOM 0 HH22 ARG C 83 95.390 -3.869 -4.314 1.00 0.00 H new ATOM 1279 N CYS C 84 93.522 -6.211 0.758 1.00 0.00 N ATOM 1280 CA CYS C 84 94.576 -5.263 1.110 1.00 0.00 C ATOM 1281 C CYS C 84 94.848 -5.289 2.611 1.00 0.00 C ATOM 1282 O CYS C 84 95.992 -5.424 3.046 1.00 0.00 O ATOM 1283 CB CYS C 84 94.176 -3.845 0.699 1.00 0.00 C ATOM 1284 SG CYS C 84 94.169 -3.722 -1.106 1.00 0.00 S ATOM 0 H CYS C 84 92.597 -5.797 0.642 1.00 0.00 H new ATOM 0 HA CYS C 84 95.480 -5.556 0.577 1.00 0.00 H new ATOM 0 HB2 CYS C 84 93.189 -3.605 1.095 1.00 0.00 H new ATOM 0 HB3 CYS C 84 94.874 -3.122 1.121 1.00 0.00 H new ATOM 0 HG CYS C 84 92.970 -3.951 -1.552 1.00 0.00 H new ATOM 1290 N MET C 85 93.784 -5.156 3.398 1.00 0.00 N ATOM 1291 CA MET C 85 93.915 -5.163 4.853 1.00 0.00 C ATOM 1292 C MET C 85 94.965 -6.179 5.292 1.00 0.00 C ATOM 1293 O MET C 85 95.814 -5.890 6.135 1.00 0.00 O ATOM 1294 CB MET C 85 92.579 -5.513 5.510 1.00 0.00 C ATOM 1295 CG MET C 85 91.544 -4.445 5.156 1.00 0.00 C ATOM 1296 SD MET C 85 90.906 -3.698 6.676 1.00 0.00 S ATOM 1297 CE MET C 85 89.427 -2.943 5.956 1.00 0.00 C ATOM 0 H MET C 85 92.829 -5.043 3.057 1.00 0.00 H new ATOM 0 HA MET C 85 94.223 -4.165 5.165 1.00 0.00 H new ATOM 0 HB2 MET C 85 92.239 -6.491 5.170 1.00 0.00 H new ATOM 0 HB3 MET C 85 92.698 -5.575 6.592 1.00 0.00 H new ATOM 0 HG2 MET C 85 91.996 -3.680 4.524 1.00 0.00 H new ATOM 0 HG3 MET C 85 90.728 -4.889 4.586 1.00 0.00 H new ATOM 0 HE1 MET C 85 88.670 -2.815 6.730 1.00 0.00 H new ATOM 0 HE2 MET C 85 89.683 -1.971 5.535 1.00 0.00 H new ATOM 0 HE3 MET C 85 89.036 -3.588 5.169 1.00 0.00 H new ATOM 1307 N LYS C 86 94.894 -7.374 4.712 1.00 0.00 N ATOM 1308 CA LYS C 86 95.843 -8.432 5.051 1.00 0.00 C ATOM 1309 C LYS C 86 97.222 -8.116 4.481 1.00 0.00 C ATOM 1310 O LYS C 86 97.756 -8.859 3.658 1.00 0.00 O ATOM 1311 CB LYS C 86 95.370 -9.776 4.492 1.00 0.00 C ATOM 1312 CG LYS C 86 94.876 -10.661 5.638 1.00 0.00 C ATOM 1313 CD LYS C 86 93.376 -10.915 5.476 1.00 0.00 C ATOM 1314 CE LYS C 86 93.139 -12.397 5.187 1.00 0.00 C ATOM 1315 NZ LYS C 86 93.643 -12.722 3.823 1.00 0.00 N ATOM 0 H LYS C 86 94.198 -7.633 4.013 1.00 0.00 H new ATOM 0 HA LYS C 86 95.904 -8.491 6.138 1.00 0.00 H new ATOM 0 HB2 LYS C 86 94.570 -9.619 3.769 1.00 0.00 H new ATOM 0 HB3 LYS C 86 96.186 -10.269 3.963 1.00 0.00 H new ATOM 0 HG2 LYS C 86 95.418 -11.607 5.641 1.00 0.00 H new ATOM 0 HG3 LYS C 86 95.073 -10.178 6.595 1.00 0.00 H new ATOM 0 HD2 LYS C 86 92.846 -10.621 6.382 1.00 0.00 H new ATOM 0 HD3 LYS C 86 92.979 -10.307 4.663 1.00 0.00 H new ATOM 0 HE2 LYS C 86 93.649 -13.010 5.931 1.00 0.00 H new ATOM 0 HE3 LYS C 86 92.076 -12.627 5.258 1.00 0.00 H new ATOM 0 HZ1 LYS C 86 93.422 -13.713 3.598 1.00 0.00 H new ATOM 0 HZ2 LYS C 86 93.187 -12.099 3.127 1.00 0.00 H new ATOM 0 HZ3 LYS C 86 94.673 -12.581 3.791 1.00 0.00 H new ATOM 1329 N ASP C 87 97.795 -7.003 4.930 1.00 0.00 N ATOM 1330 CA ASP C 87 99.116 -6.594 4.460 1.00 0.00 C ATOM 1331 C ASP C 87 99.035 -6.076 3.026 1.00 0.00 C ATOM 1332 O ASP C 87 99.061 -6.849 2.068 1.00 0.00 O ATOM 1333 CB ASP C 87 100.094 -7.769 4.510 1.00 0.00 C ATOM 1334 CG ASP C 87 100.035 -8.423 5.886 1.00 0.00 C ATOM 1335 OD1 ASP C 87 99.489 -7.811 6.789 1.00 0.00 O ATOM 1336 OD2 ASP C 87 100.538 -9.527 6.018 1.00 0.00 O ATOM 0 H ASP C 87 97.371 -6.374 5.612 1.00 0.00 H new ATOM 0 HA ASP C 87 99.473 -5.799 5.115 1.00 0.00 H new ATOM 0 HB2 ASP C 87 99.843 -8.497 3.739 1.00 0.00 H new ATOM 0 HB3 ASP C 87 101.107 -7.422 4.304 1.00 0.00 H new ATOM 1341 N ASP C 88 98.937 -4.757 2.893 1.00 0.00 N ATOM 1342 CA ASP C 88 98.853 -4.135 1.574 1.00 0.00 C ATOM 1343 C ASP C 88 99.821 -4.803 0.602 1.00 0.00 C ATOM 1344 O ASP C 88 100.817 -5.401 1.007 1.00 0.00 O ATOM 1345 CB ASP C 88 99.190 -2.646 1.662 1.00 0.00 C ATOM 1346 CG ASP C 88 98.521 -1.905 0.510 1.00 0.00 C ATOM 1347 OD1 ASP C 88 98.228 -2.543 -0.487 1.00 0.00 O ATOM 1348 OD2 ASP C 88 98.312 -0.710 0.642 1.00 0.00 O ATOM 0 H ASP C 88 98.914 -4.102 3.675 1.00 0.00 H new ATOM 0 HA ASP C 88 97.832 -4.258 1.212 1.00 0.00 H new ATOM 0 HB2 ASP C 88 98.850 -2.241 2.615 1.00 0.00 H new ATOM 0 HB3 ASP C 88 100.270 -2.504 1.622 1.00 0.00 H new ATOM 1353 N SER C 89 99.516 -4.692 -0.688 1.00 0.00 N ATOM 1354 CA SER C 89 100.366 -5.286 -1.715 1.00 0.00 C ATOM 1355 C SER C 89 100.548 -6.779 -1.455 1.00 0.00 C ATOM 1356 O SER C 89 99.575 -7.504 -1.584 1.00 0.00 O ATOM 1357 CB SER C 89 101.737 -4.606 -1.733 1.00 0.00 C ATOM 1358 OG SER C 89 101.859 -3.825 -2.914 1.00 0.00 O ATOM 1359 OXT SER C 89 101.655 -7.175 -1.130 1.00 0.00 O ATOM 0 H SER C 89 98.696 -4.202 -1.044 1.00 0.00 H new ATOM 0 HA SER C 89 99.881 -5.144 -2.681 1.00 0.00 H new ATOM 0 HB2 SER C 89 101.854 -3.975 -0.852 1.00 0.00 H new ATOM 0 HB3 SER C 89 102.528 -5.355 -1.696 1.00 0.00 H new ATOM 0 HG SER C 89 102.736 -3.387 -2.927 1.00 0.00 H new TER 1365 SER C 89 ATOM 1366 N ARG I 147 95.163 1.088 2.924 1.00 0.00 N ATOM 1367 CA ARG I 147 95.620 0.910 4.331 1.00 0.00 C ATOM 1368 C ARG I 147 94.581 1.496 5.282 1.00 0.00 C ATOM 1369 O ARG I 147 94.883 2.377 6.087 1.00 0.00 O ATOM 1370 CB ARG I 147 96.955 1.631 4.529 1.00 0.00 C ATOM 1371 CG ARG I 147 97.518 1.290 5.910 1.00 0.00 C ATOM 1372 CD ARG I 147 99.046 1.331 5.867 1.00 0.00 C ATOM 1373 NE ARG I 147 99.612 0.333 6.771 1.00 0.00 N ATOM 1374 CZ ARG I 147 99.429 -0.967 6.560 1.00 0.00 C ATOM 1375 NH1 ARG I 147 98.740 -1.372 5.529 1.00 0.00 N ATOM 1376 NH2 ARG I 147 99.942 -1.839 7.384 1.00 0.00 N ATOM 0 HA ARG I 147 95.746 -0.152 4.540 1.00 0.00 H new ATOM 0 HB2 ARG I 147 97.660 1.333 3.753 1.00 0.00 H new ATOM 0 HB3 ARG I 147 96.816 2.708 4.437 1.00 0.00 H new ATOM 0 HG2 ARG I 147 97.146 1.998 6.650 1.00 0.00 H new ATOM 0 HG3 ARG I 147 97.179 0.301 6.217 1.00 0.00 H new ATOM 0 HD2 ARG I 147 99.392 1.146 4.850 1.00 0.00 H new ATOM 0 HD3 ARG I 147 99.397 2.324 6.147 1.00 0.00 H new ATOM 0 HE ARG I 147 100.157 0.638 7.578 1.00 0.00 H new ATOM 0 HH11 ARG I 147 98.341 -0.691 4.883 1.00 0.00 H new ATOM 0 HH12 ARG I 147 98.601 -2.370 5.369 1.00 0.00 H new ATOM 0 HH21 ARG I 147 100.483 -1.523 8.189 1.00 0.00 H new ATOM 0 HH22 ARG I 147 99.802 -2.836 7.223 1.00 0.00 H new ATOM 1392 N ILE I 148 93.352 0.996 5.182 1.00 0.00 N ATOM 1393 CA ILE I 148 92.275 1.477 6.042 1.00 0.00 C ATOM 1394 C ILE I 148 91.810 0.369 6.978 1.00 0.00 C ATOM 1395 O ILE I 148 91.571 -0.763 6.556 1.00 0.00 O ATOM 1396 CB ILE I 148 91.084 1.952 5.208 1.00 0.00 C ATOM 1397 CG1 ILE I 148 91.584 2.804 4.038 1.00 0.00 C ATOM 1398 CG2 ILE I 148 90.152 2.790 6.085 1.00 0.00 C ATOM 1399 CD1 ILE I 148 90.729 2.522 2.801 1.00 0.00 C ATOM 0 H ILE I 148 93.079 0.267 4.523 1.00 0.00 H new ATOM 0 HA ILE I 148 92.663 2.313 6.624 1.00 0.00 H new ATOM 0 HB ILE I 148 90.544 1.088 4.822 1.00 0.00 H new ATOM 0 HG12 ILE I 148 91.532 3.862 4.296 1.00 0.00 H new ATOM 0 HG13 ILE I 148 92.630 2.578 3.830 1.00 0.00 H new ATOM 0 HG21 ILE I 148 89.302 3.130 5.492 1.00 0.00 H new ATOM 0 HG22 ILE I 148 89.795 2.185 6.918 1.00 0.00 H new ATOM 0 HG23 ILE I 148 90.694 3.654 6.470 1.00 0.00 H new ATOM 0 HD11 ILE I 148 91.084 3.128 1.967 1.00 0.00 H new ATOM 0 HD12 ILE I 148 90.804 1.466 2.540 1.00 0.00 H new ATOM 0 HD13 ILE I 148 89.689 2.770 3.013 1.00 0.00 H new ATOM 1411 N SER I 149 91.684 0.708 8.257 1.00 0.00 N ATOM 1412 CA SER I 149 91.245 -0.266 9.252 1.00 0.00 C ATOM 1413 C SER I 149 89.747 -0.128 9.504 1.00 0.00 C ATOM 1414 O SER I 149 88.975 -1.057 9.271 1.00 0.00 O ATOM 1415 CB SER I 149 91.996 -0.059 10.568 1.00 0.00 C ATOM 1416 OG SER I 149 93.388 0.054 10.300 1.00 0.00 O ATOM 0 H SER I 149 91.877 1.639 8.627 1.00 0.00 H new ATOM 0 HA SER I 149 91.458 -1.264 8.867 1.00 0.00 H new ATOM 0 HB2 SER I 149 91.636 0.840 11.068 1.00 0.00 H new ATOM 0 HB3 SER I 149 91.810 -0.895 11.242 1.00 0.00 H new ATOM 0 HG SER I 149 93.873 0.189 11.141 1.00 0.00 H new ATOM 1422 N ALA I 150 89.348 1.048 9.983 1.00 0.00 N ATOM 1423 CA ALA I 150 87.939 1.311 10.266 1.00 0.00 C ATOM 1424 C ALA I 150 87.779 2.684 10.910 1.00 0.00 C ATOM 1425 O ALA I 150 86.779 3.371 10.705 1.00 0.00 O ATOM 1426 CB ALA I 150 87.372 0.250 11.212 1.00 0.00 C ATOM 0 H ALA I 150 89.974 1.828 10.182 1.00 0.00 H new ATOM 0 HA ALA I 150 87.394 1.281 9.322 1.00 0.00 H new ATOM 0 HB1 ALA I 150 86.322 0.463 11.411 1.00 0.00 H new ATOM 0 HB2 ALA I 150 87.462 -0.734 10.751 1.00 0.00 H new ATOM 0 HB3 ALA I 150 87.928 0.263 12.149 1.00 0.00 H new ATOM 1432 N ASP I 151 88.780 3.072 11.694 1.00 0.00 N ATOM 1433 CA ASP I 151 88.754 4.364 12.373 1.00 0.00 C ATOM 1434 C ASP I 151 88.151 5.437 11.470 1.00 0.00 C ATOM 1435 O ASP I 151 87.208 6.130 11.852 1.00 0.00 O ATOM 1436 CB ASP I 151 90.170 4.783 12.771 1.00 0.00 C ATOM 1437 CG ASP I 151 90.787 3.709 13.661 1.00 0.00 C ATOM 1438 OD1 ASP I 151 90.125 2.711 13.897 1.00 0.00 O ATOM 1439 OD2 ASP I 151 91.911 3.899 14.094 1.00 0.00 O ATOM 0 H ASP I 151 89.615 2.514 11.875 1.00 0.00 H new ATOM 0 HA ASP I 151 88.138 4.261 13.267 1.00 0.00 H new ATOM 0 HB2 ASP I 151 90.782 4.928 11.880 1.00 0.00 H new ATOM 0 HB3 ASP I 151 90.144 5.737 13.298 1.00 0.00 H new ATOM 1444 N ALA I 152 88.708 5.568 10.269 1.00 0.00 N ATOM 1445 CA ALA I 152 88.217 6.564 9.318 1.00 0.00 C ATOM 1446 C ALA I 152 86.930 6.084 8.656 1.00 0.00 C ATOM 1447 O ALA I 152 85.943 6.817 8.579 1.00 0.00 O ATOM 1448 CB ALA I 152 89.264 6.835 8.234 1.00 0.00 C ATOM 0 H ALA I 152 89.490 5.005 9.933 1.00 0.00 H new ATOM 0 HA ALA I 152 88.020 7.483 9.870 1.00 0.00 H new ATOM 0 HB1 ALA I 152 88.880 7.579 7.536 1.00 0.00 H new ATOM 0 HB2 ALA I 152 90.178 7.208 8.696 1.00 0.00 H new ATOM 0 HB3 ALA I 152 89.480 5.911 7.698 1.00 0.00 H new ATOM 1454 N MET I 153 86.953 4.844 8.178 1.00 0.00 N ATOM 1455 CA MET I 153 85.783 4.270 7.519 1.00 0.00 C ATOM 1456 C MET I 153 84.539 4.451 8.383 1.00 0.00 C ATOM 1457 O MET I 153 83.433 4.631 7.874 1.00 0.00 O ATOM 1458 CB MET I 153 85.997 2.777 7.256 1.00 0.00 C ATOM 1459 CG MET I 153 84.753 2.187 6.589 1.00 0.00 C ATOM 1460 SD MET I 153 84.295 3.199 5.160 1.00 0.00 S ATOM 1461 CE MET I 153 85.237 2.282 3.915 1.00 0.00 C ATOM 0 H MET I 153 87.760 4.222 8.233 1.00 0.00 H new ATOM 0 HA MET I 153 85.642 4.789 6.571 1.00 0.00 H new ATOM 0 HB2 MET I 153 86.868 2.632 6.617 1.00 0.00 H new ATOM 0 HB3 MET I 153 86.200 2.258 8.193 1.00 0.00 H new ATOM 0 HG2 MET I 153 84.948 1.162 6.274 1.00 0.00 H new ATOM 0 HG3 MET I 153 83.929 2.150 7.301 1.00 0.00 H new ATOM 0 HE1 MET I 153 85.067 2.723 2.933 1.00 0.00 H new ATOM 0 HE2 MET I 153 86.299 2.329 4.155 1.00 0.00 H new ATOM 0 HE3 MET I 153 84.913 1.241 3.907 1.00 0.00 H new ATOM 1471 N MET I 154 84.732 4.401 9.698 1.00 0.00 N ATOM 1472 CA MET I 154 83.615 4.561 10.625 1.00 0.00 C ATOM 1473 C MET I 154 83.250 6.034 10.770 1.00 0.00 C ATOM 1474 O MET I 154 82.135 6.376 11.166 1.00 0.00 O ATOM 1475 CB MET I 154 83.971 3.998 12.002 1.00 0.00 C ATOM 1476 CG MET I 154 82.933 2.949 12.407 1.00 0.00 C ATOM 1477 SD MET I 154 82.079 3.489 13.908 1.00 0.00 S ATOM 1478 CE MET I 154 80.633 2.414 13.745 1.00 0.00 C ATOM 0 H MET I 154 85.638 4.253 10.142 1.00 0.00 H new ATOM 0 HA MET I 154 82.764 4.013 10.220 1.00 0.00 H new ATOM 0 HB2 MET I 154 84.965 3.552 11.978 1.00 0.00 H new ATOM 0 HB3 MET I 154 83.999 4.801 12.739 1.00 0.00 H new ATOM 0 HG2 MET I 154 82.215 2.803 11.600 1.00 0.00 H new ATOM 0 HG3 MET I 154 83.419 1.989 12.579 1.00 0.00 H new ATOM 0 HE1 MET I 154 79.957 2.584 14.583 1.00 0.00 H new ATOM 0 HE2 MET I 154 80.117 2.638 12.811 1.00 0.00 H new ATOM 0 HE3 MET I 154 80.953 1.372 13.742 1.00 0.00 H new ATOM 1488 N GLN I 155 84.201 6.904 10.441 1.00 0.00 N ATOM 1489 CA GLN I 155 83.969 8.342 10.536 1.00 0.00 C ATOM 1490 C GLN I 155 82.904 8.772 9.531 1.00 0.00 C ATOM 1491 O GLN I 155 82.242 9.795 9.704 1.00 0.00 O ATOM 1492 CB GLN I 155 85.259 9.115 10.259 1.00 0.00 C ATOM 1493 CG GLN I 155 85.336 10.329 11.187 1.00 0.00 C ATOM 1494 CD GLN I 155 86.319 10.044 12.317 1.00 0.00 C ATOM 1495 OE1 GLN I 155 87.519 9.903 12.082 1.00 0.00 O ATOM 1496 NE2 GLN I 155 85.880 9.951 13.542 1.00 0.00 N ATOM 0 H GLN I 155 85.130 6.643 10.110 1.00 0.00 H new ATOM 0 HA GLN I 155 83.628 8.563 11.547 1.00 0.00 H new ATOM 0 HB2 GLN I 155 86.123 8.469 10.415 1.00 0.00 H new ATOM 0 HB3 GLN I 155 85.286 9.437 9.218 1.00 0.00 H new ATOM 0 HG2 GLN I 155 85.654 11.208 10.627 1.00 0.00 H new ATOM 0 HG3 GLN I 155 84.350 10.551 11.596 1.00 0.00 H new ATOM 0 HE21 GLN I 155 84.886 10.068 13.738 1.00 0.00 H new ATOM 0 HE22 GLN I 155 86.531 9.762 14.304 1.00 0.00 H new ATOM 1505 N ALA I 156 82.746 7.972 8.480 1.00 0.00 N ATOM 1506 CA ALA I 156 81.755 8.269 7.448 1.00 0.00 C ATOM 1507 C ALA I 156 80.350 7.938 7.943 1.00 0.00 C ATOM 1508 O ALA I 156 79.359 8.193 7.258 1.00 0.00 O ATOM 1509 CB ALA I 156 82.042 7.461 6.181 1.00 0.00 C ATOM 0 H ALA I 156 83.285 7.121 8.320 1.00 0.00 H new ATOM 0 HA ALA I 156 81.817 9.333 7.221 1.00 0.00 H new ATOM 0 HB1 ALA I 156 81.294 7.695 5.423 1.00 0.00 H new ATOM 0 HB2 ALA I 156 83.033 7.715 5.804 1.00 0.00 H new ATOM 0 HB3 ALA I 156 82.004 6.396 6.412 1.00 0.00 H new ATOM 1515 N LEU I 157 80.274 7.369 9.144 1.00 0.00 N ATOM 1516 CA LEU I 157 78.986 7.010 9.728 1.00 0.00 C ATOM 1517 C LEU I 157 78.866 7.619 11.119 1.00 0.00 C ATOM 1518 O LEU I 157 77.851 8.224 11.465 1.00 0.00 O ATOM 1519 CB LEU I 157 78.838 5.487 9.833 1.00 0.00 C ATOM 1520 CG LEU I 157 79.428 4.811 8.590 1.00 0.00 C ATOM 1521 CD1 LEU I 157 78.956 5.537 7.328 1.00 0.00 C ATOM 1522 CD2 LEU I 157 80.957 4.853 8.662 1.00 0.00 C ATOM 0 H LEU I 157 81.082 7.149 9.727 1.00 0.00 H new ATOM 0 HA LEU I 157 78.199 7.396 9.081 1.00 0.00 H new ATOM 0 HB2 LEU I 157 79.345 5.126 10.728 1.00 0.00 H new ATOM 0 HB3 LEU I 157 77.785 5.223 9.935 1.00 0.00 H new ATOM 0 HG LEU I 157 79.092 3.775 8.553 1.00 0.00 H new ATOM 0 HD11 LEU I 157 79.379 5.051 6.449 1.00 0.00 H new ATOM 0 HD12 LEU I 157 77.868 5.502 7.273 1.00 0.00 H new ATOM 0 HD13 LEU I 157 79.284 6.576 7.362 1.00 0.00 H new ATOM 0 HD21 LEU I 157 81.376 4.372 7.778 1.00 0.00 H new ATOM 0 HD22 LEU I 157 81.291 5.890 8.704 1.00 0.00 H new ATOM 0 HD23 LEU I 157 81.294 4.327 9.555 1.00 0.00 H new ATOM 1534 N LEU I 158 79.924 7.461 11.909 1.00 0.00 N ATOM 1535 CA LEU I 158 79.940 8.007 13.259 1.00 0.00 C ATOM 1536 C LEU I 158 79.411 9.436 13.243 1.00 0.00 C ATOM 1537 O LEU I 158 79.977 10.316 12.594 1.00 0.00 O ATOM 1538 CB LEU I 158 81.367 8.002 13.817 1.00 0.00 C ATOM 1539 CG LEU I 158 81.421 8.824 15.105 1.00 0.00 C ATOM 1540 CD1 LEU I 158 81.838 7.924 16.269 1.00 0.00 C ATOM 1541 CD2 LEU I 158 82.440 9.954 14.943 1.00 0.00 C ATOM 0 H LEU I 158 80.773 6.964 11.640 1.00 0.00 H new ATOM 0 HA LEU I 158 79.306 7.388 13.893 1.00 0.00 H new ATOM 0 HB2 LEU I 158 81.687 6.979 14.014 1.00 0.00 H new ATOM 0 HB3 LEU I 158 82.057 8.416 13.081 1.00 0.00 H new ATOM 0 HG LEU I 158 80.437 9.246 15.309 1.00 0.00 H new ATOM 0 HD11 LEU I 158 81.876 8.511 17.187 1.00 0.00 H new ATOM 0 HD12 LEU I 158 81.113 7.118 16.383 1.00 0.00 H new ATOM 0 HD13 LEU I 158 82.822 7.501 16.067 1.00 0.00 H new ATOM 0 HD21 LEU I 158 82.480 10.542 15.860 1.00 0.00 H new ATOM 0 HD22 LEU I 158 83.424 9.531 14.740 1.00 0.00 H new ATOM 0 HD23 LEU I 158 82.143 10.596 14.114 1.00 0.00 H new ATOM 1553 N GLY I 159 78.313 9.658 13.958 1.00 0.00 N ATOM 1554 CA GLY I 159 77.712 10.986 14.011 1.00 0.00 C ATOM 1555 C GLY I 159 77.481 11.522 12.603 1.00 0.00 C ATOM 1556 O GLY I 159 77.450 12.732 12.379 1.00 0.00 O ATOM 0 H GLY I 159 77.826 8.946 14.502 1.00 0.00 H new ATOM 0 HA2 GLY I 159 76.766 10.942 14.550 1.00 0.00 H new ATOM 0 HA3 GLY I 159 78.362 11.665 14.563 1.00 0.00 H new ATOM 1560 N ALA I 160 77.324 10.603 11.654 1.00 0.00 N ATOM 1561 CA ALA I 160 77.099 10.985 10.262 1.00 0.00 C ATOM 1562 C ALA I 160 75.682 11.522 10.076 1.00 0.00 C ATOM 1563 O ALA I 160 74.728 10.759 9.923 1.00 0.00 O ATOM 1564 CB ALA I 160 77.301 9.783 9.337 1.00 0.00 C ATOM 0 H ALA I 160 77.348 9.597 11.820 1.00 0.00 H new ATOM 0 HA ALA I 160 77.818 11.764 10.008 1.00 0.00 H new ATOM 0 HB1 ALA I 160 77.129 10.086 8.304 1.00 0.00 H new ATOM 0 HB2 ALA I 160 78.320 9.411 9.441 1.00 0.00 H new ATOM 0 HB3 ALA I 160 76.598 8.995 9.606 1.00 0.00 H new ATOM 1570 N ARG I 161 75.558 12.847 10.088 1.00 0.00 N ATOM 1571 CA ARG I 161 74.254 13.483 9.916 1.00 0.00 C ATOM 1572 C ARG I 161 73.275 12.997 10.980 1.00 0.00 C ATOM 1573 O ARG I 161 72.071 12.900 10.738 1.00 0.00 O ATOM 1574 CB ARG I 161 73.684 13.165 8.532 1.00 0.00 C ATOM 1575 CG ARG I 161 73.902 14.361 7.603 1.00 0.00 C ATOM 1576 CD ARG I 161 73.340 14.043 6.217 1.00 0.00 C ATOM 1577 NE ARG I 161 73.658 15.114 5.275 1.00 0.00 N ATOM 1578 CZ ARG I 161 72.960 15.273 4.153 1.00 0.00 C ATOM 1579 NH1 ARG I 161 71.976 14.461 3.875 1.00 0.00 N ATOM 1580 NH2 ARG I 161 73.260 16.240 3.330 1.00 0.00 N ATOM 0 H ARG I 161 76.335 13.495 10.214 1.00 0.00 H new ATOM 0 HA ARG I 161 74.390 14.560 10.016 1.00 0.00 H new ATOM 0 HB2 ARG I 161 74.169 12.279 8.122 1.00 0.00 H new ATOM 0 HB3 ARG I 161 72.620 12.939 8.608 1.00 0.00 H new ATOM 0 HG2 ARG I 161 73.412 15.245 8.011 1.00 0.00 H new ATOM 0 HG3 ARG I 161 74.965 14.590 7.532 1.00 0.00 H new ATOM 0 HD2 ARG I 161 73.754 13.101 5.858 1.00 0.00 H new ATOM 0 HD3 ARG I 161 72.259 13.914 6.278 1.00 0.00 H new ATOM 0 HE ARG I 161 74.428 15.751 5.481 1.00 0.00 H new ATOM 0 HH11 ARG I 161 71.742 13.704 4.518 1.00 0.00 H new ATOM 0 HH12 ARG I 161 71.441 14.583 3.015 1.00 0.00 H new ATOM 0 HH21 ARG I 161 74.029 16.874 3.547 1.00 0.00 H new ATOM 0 HH22 ARG I 161 72.725 16.362 2.470 1.00 0.00 H new ATOM 1594 N ALA I 162 73.803 12.693 12.163 1.00 0.00 N ATOM 1595 CA ALA I 162 72.963 12.218 13.259 1.00 0.00 C ATOM 1596 C ALA I 162 71.922 13.270 13.623 1.00 0.00 C ATOM 1597 O ALA I 162 72.237 14.295 14.229 1.00 0.00 O ATOM 1598 CB ALA I 162 73.812 11.910 14.493 1.00 0.00 C ATOM 0 H ALA I 162 74.796 12.766 12.386 1.00 0.00 H new ATOM 0 HA ALA I 162 72.463 11.308 12.929 1.00 0.00 H new ATOM 0 HB1 ALA I 162 73.168 11.557 15.299 1.00 0.00 H new ATOM 0 HB2 ALA I 162 74.543 11.139 14.249 1.00 0.00 H new ATOM 0 HB3 ALA I 162 74.331 12.814 14.812 1.00 0.00 H new ATOM 1604 N LYS I 163 70.675 13.006 13.245 1.00 0.00 N ATOM 1605 CA LYS I 163 69.588 13.937 13.534 1.00 0.00 C ATOM 1606 C LYS I 163 69.162 13.825 14.994 1.00 0.00 C ATOM 1607 O LYS I 163 69.835 13.129 15.736 1.00 0.00 O ATOM 1608 CB LYS I 163 68.381 13.646 12.639 1.00 0.00 C ATOM 1609 CG LYS I 163 67.997 14.912 11.870 1.00 0.00 C ATOM 1610 CD LYS I 163 68.205 14.684 10.372 1.00 0.00 C ATOM 1611 CE LYS I 163 67.329 15.658 9.582 1.00 0.00 C ATOM 1612 NZ LYS I 163 68.063 16.109 8.367 1.00 0.00 N ATOM 1613 OXT LYS I 163 68.168 14.438 15.349 1.00 0.00 O ATOM 0 H LYS I 163 70.393 12.164 12.743 1.00 0.00 H new ATOM 0 HA LYS I 163 69.950 14.946 13.338 1.00 0.00 H new ATOM 0 HB2 LYS I 163 68.618 12.842 11.942 1.00 0.00 H new ATOM 0 HB3 LYS I 163 67.540 13.306 13.244 1.00 0.00 H new ATOM 0 HG2 LYS I 163 66.956 15.169 12.068 1.00 0.00 H new ATOM 0 HG3 LYS I 163 68.603 15.753 12.208 1.00 0.00 H new ATOM 0 HD2 LYS I 163 69.254 14.829 10.113 1.00 0.00 H new ATOM 0 HD3 LYS I 163 67.952 13.656 10.111 1.00 0.00 H new ATOM 0 HE2 LYS I 163 66.394 15.175 9.297 1.00 0.00 H new ATOM 0 HE3 LYS I 163 67.069 16.516 10.202 1.00 0.00 H new ATOM 0 HZ1 LYS I 163 67.469 16.771 7.828 1.00 0.00 H new ATOM 0 HZ2 LYS I 163 68.943 16.585 8.650 1.00 0.00 H new ATOM 0 HZ3 LYS I 163 68.290 15.286 7.773 1.00 0.00 H new TER 1627 LYS I 163 HETATM 1628 CA CA C 93 83.710 -3.265 -11.292 1.00 0.00 CA HETATM 1629 C1 BEP C 92 91.345 2.612 -1.336 1.00 0.00 C HETATM 1630 C2 BEP C 92 90.393 3.366 -0.404 1.00 0.00 C HETATM 1631 C3 BEP C 92 89.024 3.653 -1.117 1.00 0.00 C HETATM 1632 O1 BEP C 92 92.231 1.774 -0.552 1.00 0.00 O HETATM 1633 N2 BEP C 92 91.016 4.639 0.050 1.00 0.00 N HETATM 1634 N3 BEP C 92 88.083 2.506 -0.977 1.00 0.00 N HETATM 1635 C4 BEP C 92 93.643 2.088 -0.666 1.00 0.00 C HETATM 1636 C5 BEP C 92 94.364 0.918 -1.338 1.00 0.00 C HETATM 1637 C6 BEP C 92 95.570 0.506 -0.491 1.00 0.00 C HETATM 1638 C7 BEP C 92 94.839 1.346 -2.728 1.00 0.00 C HETATM 1639 C8 BEP C 92 90.252 5.502 0.991 1.00 0.00 C HETATM 1640 C9 BEP C 92 91.299 6.085 1.954 1.00 0.00 C HETATM 1641 C10 BEP C 92 92.631 5.903 1.210 1.00 0.00 C HETATM 1642 C11 BEP C 92 92.444 4.610 0.442 1.00 0.00 C HETATM 1643 C12 BEP C 92 87.530 2.218 0.378 1.00 0.00 C HETATM 1644 C13 BEP C 92 86.929 3.415 1.160 1.00 0.00 C HETATM 1645 C14 BEP C 92 87.548 3.866 2.334 1.00 0.00 C HETATM 1646 C15 BEP C 92 87.005 4.946 3.042 1.00 0.00 C HETATM 1647 C16 BEP C 92 85.844 5.576 2.576 1.00 0.00 C HETATM 1648 C17 BEP C 92 85.225 5.125 1.402 1.00 0.00 C HETATM 1649 C18 BEP C 92 85.768 4.045 0.694 1.00 0.00 C HETATM 1650 C19 BEP C 92 87.193 2.229 -2.129 1.00 0.00 C HETATM 1651 C20 BEP C 92 86.444 1.045 -2.162 1.00 0.00 C HETATM 1652 C21 BEP C 92 85.602 0.778 -3.249 1.00 0.00 C HETATM 1653 C22 BEP C 92 85.506 1.696 -4.302 1.00 0.00 C HETATM 1654 C23 BEP C 92 86.253 2.879 -4.270 1.00 0.00 C HETATM 1655 C24 BEP C 92 87.095 3.148 -3.184 1.00 0.00 C HETATM 0 H241 BEP C 92 87.674 4.071 -3.159 1.00 0.00 H new HETATM 0 H231 BEP C 92 86.179 3.592 -5.091 1.00 0.00 H new HETATM 0 H221 BEP C 92 84.849 1.489 -5.147 1.00 0.00 H new HETATM 0 H211 BEP C 92 85.022 -0.144 -3.275 1.00 0.00 H new HETATM 0 H201 BEP C 92 86.517 0.331 -1.341 1.00 0.00 H new HETATM 0 H181 BEP C 92 85.287 3.695 -0.219 1.00 0.00 H new HETATM 0 H171 BEP C 92 84.321 5.615 1.040 1.00 0.00 H new HETATM 0 H161 BEP C 92 85.422 6.417 3.126 1.00 0.00 H new HETATM 0 H151 BEP C 92 87.486 5.296 3.955 1.00 0.00 H new HETATM 0 H141 BEP C 92 88.452 3.376 2.696 1.00 0.00 H new HETATM 0 H122 BEP C 92 86.756 1.458 0.274 1.00 0.00 H new HETATM 0 H121 BEP C 92 88.325 1.782 0.983 1.00 0.00 H new HETATM 0 H112 BEP C 92 92.672 3.741 1.059 1.00 0.00 H new HETATM 0 H111 BEP C 92 93.098 4.563 -0.429 1.00 0.00 H new HETATM 0 H102 BEP C 92 92.833 6.740 0.541 1.00 0.00 H new HETATM 0 H101 BEP C 92 93.470 5.839 1.903 1.00 0.00 H new HETATM 0 H92 BEP C 92 91.102 7.135 2.169 1.00 0.00 H new HETATM 0 H91 BEP C 92 91.300 5.559 2.909 1.00 0.00 H new HETATM 0 H82 BEP C 92 89.725 6.293 0.458 1.00 0.00 H new HETATM 0 H81 BEP C 92 89.500 4.926 1.530 1.00 0.00 H new HETATM 0 H73 BEP C 92 93.980 1.640 -3.332 1.00 0.00 H new HETATM 0 H72 BEP C 92 95.523 2.190 -2.635 1.00 0.00 H new HETATM 0 H71 BEP C 92 95.353 0.514 -3.209 1.00 0.00 H new HETATM 0 H63 BEP C 92 96.255 1.349 -0.399 1.00 0.00 H new HETATM 0 H62 BEP C 92 95.232 0.203 0.500 1.00 0.00 H new HETATM 0 H61 BEP C 92 96.083 -0.328 -0.970 1.00 0.00 H new HETATM 0 H51 BEP C 92 93.681 0.074 -1.430 1.00 0.00 H new HETATM 0 H42 BEP C 92 93.780 2.999 -1.249 1.00 0.00 H new HETATM 0 H41 BEP C 92 94.067 2.275 0.320 1.00 0.00 H new HETATM 0 H32 BEP C 92 88.572 4.549 -0.692 1.00 0.00 H new HETATM 0 H31 BEP C 92 89.198 3.855 -2.174 1.00 0.00 H new HETATM 0 H21 BEP C 92 90.199 2.739 0.467 1.00 0.00 H new HETATM 0 H12 BEP C 92 90.776 2.001 -2.037 1.00 0.00 H new HETATM 0 H11 BEP C 92 91.926 3.319 -1.928 1.00 0.00 H new