USER MOD reduce.3.24.130724 H: found=0, std=0, add=1668, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1666 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 51 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00555) USER MOD Set 1.2: A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -178:sc= 0.123 (180deg=0.117) USER MOD Single : A 7 THR OG1 : rot 112:sc= 0.831 USER MOD Single : A 12 SER OG : rot 68:sc= 0.108 USER MOD Single : A 15 THR OG1 : rot 75:sc= 1.25 USER MOD Single : A 18 THR OG1 : rot -139:sc= 1.05 USER MOD Single : A 19 THR OG1 : rot 65:sc= 1.21 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot 180:sc= -0.0512 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 36 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 THR OG1 : rot 75:sc= 0.946 USER MOD Single : A 44 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 45 GLN : amide:sc= -0.462 K(o=-0.46,f=-4!) USER MOD Single : A 48 HIS : no HD1:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.014) USER MOD Single : A 62 SER OG : rot 86:sc= 0.395 USER MOD Single : A 66 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 67 GLN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : A 69 SER OG : rot -4:sc= 0.985 USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ 153:sc= 0.162 (180deg=-0.0177) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 165:sc=-0.00995 (180deg=-0.155) USER MOD Single : A 97 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.0047) USER MOD Single : A 98 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0246) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ 178:sc= -0.0247 (180deg=-0.0318) USER MOD Single : B 7 THR OG1 : rot 112:sc= 0.45 USER MOD Single : B 12 SER OG : rot 72:sc= 0.218 USER MOD Single : B 15 THR OG1 : rot 78:sc= 1.23 USER MOD Single : B 18 THR OG1 : rot 1:sc= 0.16 USER MOD Single : B 19 THR OG1 : rot 75:sc= 1.24 USER MOD Single : B 22 THR OG1 : rot 180:sc= 0.00239 USER MOD Single : B 26 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 32 SER OG : rot 120:sc= -0.0593 USER MOD Single : B 34 SER OG : rot 180:sc=-0.00015 USER MOD Single : B 36 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 43 THR OG1 : rot 73:sc= 0.411 USER MOD Single : B 44 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 45 GLN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : B 48 HIS : no HD1:sc= 0 X(o=0,f=-0.29) USER MOD Single : B 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 55 SER OG : rot 180:sc= 0 USER MOD Single : B 59 LYS NZ :NH3+ 160:sc= 0.0158 (180deg=0) USER MOD Single : B 60 MET CE :methyl 173:sc= 0 (180deg=-0.0496) USER MOD Single : B 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 62 SER OG : rot 180:sc= 0 USER MOD Single : B 66 ASN : amide:sc= -0.288 K(o=-0.29,f=-4.1!) USER MOD Single : B 67 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 69 SER OG : rot 180:sc= 0 USER MOD Single : B 72 LYS NZ :NH3+ -173:sc=-0.00482 (180deg=-0.0777) USER MOD Single : B 74 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 76 TYR OH : rot 180:sc= 0 USER MOD Single : B 85 LYS NZ :NH3+ 155:sc= 0 (180deg=-0.502) USER MOD Single : B 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 91 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0541) USER MOD Single : B 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 97 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0135) USER MOD Single : B 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 6.902 17.015 7.319 1.00 1.04 N ATOM 2 CA MET A 1 7.632 15.749 6.987 1.00 0.91 C ATOM 3 C MET A 1 7.758 14.804 8.214 1.00 0.73 C ATOM 4 O MET A 1 8.795 14.153 8.403 1.00 0.96 O ATOM 5 CB MET A 1 9.025 16.071 6.381 1.00 1.31 C ATOM 6 CG MET A 1 9.926 16.949 7.257 1.00 1.57 C ATOM 7 SD MET A 1 11.620 17.069 6.639 1.00 2.18 S ATOM 8 CE MET A 1 12.397 18.043 7.926 1.00 2.71 C ATOM 0 H1 MET A 1 6.812 17.599 6.463 1.00 1.04 H new ATOM 0 H2 MET A 1 5.955 16.785 7.682 1.00 1.04 H new ATOM 0 H3 MET A 1 7.431 17.541 8.043 1.00 1.04 H new ATOM 0 HA MET A 1 7.042 15.216 6.241 1.00 0.91 H new ATOM 0 HB2 MET A 1 9.542 15.133 6.180 1.00 1.31 H new ATOM 0 HB3 MET A 1 8.881 16.568 5.422 1.00 1.31 H new ATOM 0 HG2 MET A 1 9.497 17.949 7.320 1.00 1.57 H new ATOM 0 HG3 MET A 1 9.943 16.545 8.269 1.00 1.57 H new ATOM 0 HE1 MET A 1 13.448 18.198 7.681 1.00 2.71 H new ATOM 0 HE2 MET A 1 11.896 19.008 8.004 1.00 2.71 H new ATOM 0 HE3 MET A 1 12.321 17.516 8.877 1.00 2.71 H new ATOM 20 N ALA A 2 6.684 14.718 9.032 1.00 0.77 N ATOM 21 CA ALA A 2 6.655 13.853 10.226 1.00 0.71 C ATOM 22 C ALA A 2 5.295 13.150 10.345 1.00 0.59 C ATOM 23 O ALA A 2 4.250 13.812 10.378 1.00 0.68 O ATOM 24 CB ALA A 2 6.962 14.669 11.480 1.00 1.02 C ATOM 0 H ALA A 2 5.822 15.243 8.882 1.00 0.77 H new ATOM 0 HA ALA A 2 7.423 13.087 10.123 1.00 0.71 H new ATOM 0 HB1 ALA A 2 6.937 14.017 12.353 1.00 1.02 H new ATOM 0 HB2 ALA A 2 7.952 15.117 11.390 1.00 1.02 H new ATOM 0 HB3 ALA A 2 6.217 15.456 11.593 1.00 1.02 H new ATOM 30 N ALA A 3 5.319 11.803 10.419 1.00 0.56 N ATOM 31 CA ALA A 3 4.092 10.993 10.505 1.00 0.54 C ATOM 32 C ALA A 3 3.592 10.868 11.957 1.00 0.55 C ATOM 33 O ALA A 3 4.279 10.293 12.808 1.00 0.70 O ATOM 34 CB ALA A 3 4.331 9.617 9.882 1.00 0.66 C ATOM 0 H ALA A 3 6.179 11.255 10.421 1.00 0.56 H new ATOM 0 HA ALA A 3 3.308 11.501 9.943 1.00 0.54 H new ATOM 0 HB1 ALA A 3 3.419 9.024 9.949 1.00 0.66 H new ATOM 0 HB2 ALA A 3 4.610 9.735 8.835 1.00 0.66 H new ATOM 0 HB3 ALA A 3 5.134 9.110 10.417 1.00 0.66 H new ATOM 40 N GLU A 4 2.379 11.408 12.227 1.00 0.52 N ATOM 41 CA GLU A 4 1.770 11.380 13.574 1.00 0.55 C ATOM 42 C GLU A 4 0.522 10.454 13.597 1.00 0.52 C ATOM 43 O GLU A 4 -0.238 10.441 12.625 1.00 0.50 O ATOM 44 CB GLU A 4 1.383 12.819 13.999 1.00 0.61 C ATOM 45 CG GLU A 4 1.126 12.994 15.500 1.00 0.74 C ATOM 46 CD GLU A 4 0.816 14.431 15.893 1.00 0.86 C ATOM 47 OE1 GLU A 4 -0.372 14.817 15.854 1.00 0.94 O ATOM 48 OE2 GLU A 4 1.760 15.168 16.247 1.00 1.02 O ATOM 0 H GLU A 4 1.802 11.870 11.524 1.00 0.52 H new ATOM 0 HA GLU A 4 2.498 10.981 14.280 1.00 0.55 H new ATOM 0 HB2 GLU A 4 2.180 13.499 13.699 1.00 0.61 H new ATOM 0 HB3 GLU A 4 0.488 13.116 13.453 1.00 0.61 H new ATOM 0 HG2 GLU A 4 0.293 12.356 15.796 1.00 0.74 H new ATOM 0 HG3 GLU A 4 2.001 12.654 16.054 1.00 0.74 H new ATOM 55 N PRO A 5 0.279 9.667 14.706 1.00 0.57 N ATOM 56 CA PRO A 5 -0.892 8.758 14.807 1.00 0.59 C ATOM 57 C PRO A 5 -2.234 9.513 14.945 1.00 0.53 C ATOM 58 O PRO A 5 -2.323 10.479 15.711 1.00 0.59 O ATOM 59 CB PRO A 5 -0.610 7.917 16.074 1.00 0.74 C ATOM 60 CG PRO A 5 0.798 8.221 16.467 1.00 0.73 C ATOM 61 CD PRO A 5 1.108 9.586 15.929 1.00 0.67 C ATOM 0 HA PRO A 5 -1.002 8.159 13.903 1.00 0.59 H new ATOM 0 HB2 PRO A 5 -1.303 8.175 16.875 1.00 0.74 H new ATOM 0 HB3 PRO A 5 -0.737 6.853 15.872 1.00 0.74 H new ATOM 0 HG2 PRO A 5 0.912 8.197 17.551 1.00 0.73 H new ATOM 0 HG3 PRO A 5 1.483 7.479 16.058 1.00 0.73 H new ATOM 0 HD2 PRO A 5 0.849 10.368 16.643 1.00 0.67 H new ATOM 0 HD3 PRO A 5 2.169 9.698 15.704 1.00 0.67 H new ATOM 69 N LEU A 6 -3.277 9.055 14.209 1.00 0.58 N ATOM 70 CA LEU A 6 -4.613 9.688 14.241 1.00 0.67 C ATOM 71 C LEU A 6 -5.737 8.640 14.473 1.00 0.71 C ATOM 72 O LEU A 6 -6.262 8.546 15.584 1.00 1.19 O ATOM 73 CB LEU A 6 -4.860 10.493 12.937 1.00 0.84 C ATOM 74 CG LEU A 6 -3.878 11.658 12.652 1.00 0.91 C ATOM 75 CD1 LEU A 6 -4.121 12.244 11.259 1.00 1.14 C ATOM 76 CD2 LEU A 6 -3.983 12.752 13.721 1.00 1.03 C ATOM 0 H LEU A 6 -3.215 8.249 13.587 1.00 0.58 H new ATOM 0 HA LEU A 6 -4.638 10.379 15.084 1.00 0.67 H new ATOM 0 HB2 LEU A 6 -4.823 9.801 12.096 1.00 0.84 H new ATOM 0 HB3 LEU A 6 -5.871 10.899 12.972 1.00 0.84 H new ATOM 0 HG LEU A 6 -2.867 11.253 12.686 1.00 0.91 H new ATOM 0 HD11 LEU A 6 -3.421 13.060 11.080 1.00 1.14 H new ATOM 0 HD12 LEU A 6 -3.974 11.468 10.507 1.00 1.14 H new ATOM 0 HD13 LEU A 6 -5.142 12.621 11.196 1.00 1.14 H new ATOM 0 HD21 LEU A 6 -3.281 13.554 13.491 1.00 1.03 H new ATOM 0 HD22 LEU A 6 -4.997 13.151 13.735 1.00 1.03 H new ATOM 0 HD23 LEU A 6 -3.745 12.330 14.698 1.00 1.03 H new ATOM 88 N THR A 7 -6.092 7.860 13.425 1.00 0.52 N ATOM 89 CA THR A 7 -7.146 6.819 13.505 1.00 0.52 C ATOM 90 C THR A 7 -6.514 5.418 13.334 1.00 0.49 C ATOM 91 O THR A 7 -5.358 5.321 12.929 1.00 0.56 O ATOM 92 CB THR A 7 -8.239 7.056 12.408 1.00 0.58 C ATOM 93 OG1 THR A 7 -8.447 8.464 12.221 1.00 0.98 O ATOM 94 CG2 THR A 7 -9.580 6.410 12.773 1.00 0.94 C ATOM 0 H THR A 7 -5.659 7.933 12.504 1.00 0.52 H new ATOM 0 HA THR A 7 -7.623 6.879 14.483 1.00 0.52 H new ATOM 0 HB THR A 7 -7.874 6.593 11.491 1.00 0.58 H new ATOM 0 HG1 THR A 7 -8.126 8.727 11.333 1.00 0.98 H new ATOM 0 HG21 THR A 7 -10.304 6.603 11.981 1.00 0.94 H new ATOM 0 HG22 THR A 7 -9.446 5.334 12.889 1.00 0.94 H new ATOM 0 HG23 THR A 7 -9.945 6.833 13.709 1.00 0.94 H new ATOM 102 N GLU A 8 -7.262 4.337 13.656 1.00 0.51 N ATOM 103 CA GLU A 8 -6.754 2.944 13.531 1.00 0.50 C ATOM 104 C GLU A 8 -6.237 2.620 12.105 1.00 0.46 C ATOM 105 O GLU A 8 -5.192 1.979 11.965 1.00 0.48 O ATOM 106 CB GLU A 8 -7.846 1.928 13.942 1.00 0.55 C ATOM 107 CG GLU A 8 -7.347 0.486 14.097 1.00 0.91 C ATOM 108 CD GLU A 8 -8.443 -0.484 14.516 1.00 0.95 C ATOM 109 OE1 GLU A 8 -9.186 -0.958 13.630 1.00 1.14 O ATOM 110 OE2 GLU A 8 -8.554 -0.775 15.727 1.00 1.42 O ATOM 0 H GLU A 8 -8.219 4.399 14.004 1.00 0.51 H new ATOM 0 HA GLU A 8 -5.905 2.860 14.209 1.00 0.50 H new ATOM 0 HB2 GLU A 8 -8.287 2.250 14.885 1.00 0.55 H new ATOM 0 HB3 GLU A 8 -8.640 1.946 13.196 1.00 0.55 H new ATOM 0 HG2 GLU A 8 -6.917 0.153 13.152 1.00 0.91 H new ATOM 0 HG3 GLU A 8 -6.547 0.462 14.837 1.00 0.91 H new ATOM 117 N LEU A 9 -6.966 3.066 11.057 1.00 0.45 N ATOM 118 CA LEU A 9 -6.565 2.813 9.651 1.00 0.44 C ATOM 119 C LEU A 9 -5.392 3.716 9.223 1.00 0.42 C ATOM 120 O LEU A 9 -4.528 3.285 8.456 1.00 0.43 O ATOM 121 CB LEU A 9 -7.758 3.010 8.692 1.00 0.48 C ATOM 122 CG LEU A 9 -8.926 2.012 8.854 1.00 0.56 C ATOM 123 CD1 LEU A 9 -10.131 2.449 8.019 1.00 0.65 C ATOM 124 CD2 LEU A 9 -8.501 0.588 8.474 1.00 0.65 C ATOM 0 H LEU A 9 -7.830 3.600 11.155 1.00 0.45 H new ATOM 0 HA LEU A 9 -6.234 1.776 9.594 1.00 0.44 H new ATOM 0 HB2 LEU A 9 -8.146 4.019 8.829 1.00 0.48 H new ATOM 0 HB3 LEU A 9 -7.390 2.946 7.668 1.00 0.48 H new ATOM 0 HG LEU A 9 -9.213 2.008 9.905 1.00 0.56 H new ATOM 0 HD11 LEU A 9 -10.942 1.732 8.148 1.00 0.65 H new ATOM 0 HD12 LEU A 9 -10.462 3.434 8.346 1.00 0.65 H new ATOM 0 HD13 LEU A 9 -9.848 2.492 6.967 1.00 0.65 H new ATOM 0 HD21 LEU A 9 -9.346 -0.089 8.599 1.00 0.65 H new ATOM 0 HD22 LEU A 9 -8.173 0.571 7.435 1.00 0.65 H new ATOM 0 HD23 LEU A 9 -7.681 0.269 9.118 1.00 0.65 H new ATOM 136 N GLU A 10 -5.377 4.970 9.717 1.00 0.42 N ATOM 137 CA GLU A 10 -4.303 5.936 9.408 1.00 0.44 C ATOM 138 C GLU A 10 -3.029 5.625 10.223 1.00 0.44 C ATOM 139 O GLU A 10 -1.917 5.956 9.795 1.00 0.48 O ATOM 140 CB GLU A 10 -4.765 7.377 9.698 1.00 0.49 C ATOM 141 CG GLU A 10 -6.069 7.771 9.005 1.00 0.54 C ATOM 142 CD GLU A 10 -6.465 9.221 9.252 1.00 0.63 C ATOM 143 OE1 GLU A 10 -5.621 10.118 9.040 1.00 1.03 O ATOM 144 OE2 GLU A 10 -7.623 9.458 9.657 1.00 0.96 O ATOM 0 H GLU A 10 -6.100 5.339 10.335 1.00 0.42 H new ATOM 0 HA GLU A 10 -4.072 5.844 8.347 1.00 0.44 H new ATOM 0 HB2 GLU A 10 -4.889 7.497 10.774 1.00 0.49 H new ATOM 0 HB3 GLU A 10 -3.980 8.067 9.389 1.00 0.49 H new ATOM 0 HG2 GLU A 10 -5.967 7.607 7.932 1.00 0.54 H new ATOM 0 HG3 GLU A 10 -6.870 7.118 9.353 1.00 0.54 H new ATOM 151 N GLU A 11 -3.204 4.998 11.411 1.00 0.44 N ATOM 152 CA GLU A 11 -2.086 4.618 12.290 1.00 0.46 C ATOM 153 C GLU A 11 -1.298 3.430 11.701 1.00 0.45 C ATOM 154 O GLU A 11 -0.085 3.370 11.869 1.00 0.47 O ATOM 155 CB GLU A 11 -2.602 4.287 13.713 1.00 0.52 C ATOM 156 CG GLU A 11 -1.506 4.047 14.757 1.00 0.61 C ATOM 157 CD GLU A 11 -2.065 3.854 16.158 1.00 0.69 C ATOM 158 OE1 GLU A 11 -2.358 2.698 16.529 1.00 0.81 O ATOM 159 OE2 GLU A 11 -2.209 4.858 16.887 1.00 0.79 O ATOM 0 H GLU A 11 -4.121 4.745 11.780 1.00 0.44 H new ATOM 0 HA GLU A 11 -1.406 5.467 12.361 1.00 0.46 H new ATOM 0 HB2 GLU A 11 -3.235 5.106 14.054 1.00 0.52 H new ATOM 0 HB3 GLU A 11 -3.232 3.399 13.658 1.00 0.52 H new ATOM 0 HG2 GLU A 11 -0.928 3.167 14.476 1.00 0.61 H new ATOM 0 HG3 GLU A 11 -0.818 4.893 14.757 1.00 0.61 H new ATOM 166 N SER A 12 -1.989 2.493 11.002 1.00 0.45 N ATOM 167 CA SER A 12 -1.321 1.324 10.379 1.00 0.47 C ATOM 168 C SER A 12 -0.260 1.777 9.352 1.00 0.44 C ATOM 169 O SER A 12 0.897 1.351 9.430 1.00 0.49 O ATOM 170 CB SER A 12 -2.350 0.393 9.717 1.00 0.52 C ATOM 171 OG SER A 12 -3.218 -0.184 10.680 1.00 0.63 O ATOM 0 H SER A 12 -2.998 2.524 10.857 1.00 0.45 H new ATOM 0 HA SER A 12 -0.815 0.768 11.169 1.00 0.47 H new ATOM 0 HB2 SER A 12 -2.934 0.954 8.987 1.00 0.52 H new ATOM 0 HB3 SER A 12 -1.832 -0.396 9.172 1.00 0.52 H new ATOM 0 HG SER A 12 -3.792 0.512 11.061 1.00 0.63 H new ATOM 177 N ILE A 13 -0.659 2.646 8.394 1.00 0.42 N ATOM 178 CA ILE A 13 0.278 3.193 7.379 1.00 0.43 C ATOM 179 C ILE A 13 1.343 4.122 8.024 1.00 0.41 C ATOM 180 O ILE A 13 2.423 4.305 7.460 1.00 0.46 O ATOM 181 CB ILE A 13 -0.451 3.931 6.191 1.00 0.47 C ATOM 182 CG1 ILE A 13 -1.453 5.029 6.676 1.00 0.46 C ATOM 183 CG2 ILE A 13 -1.169 2.907 5.301 1.00 0.56 C ATOM 184 CD1 ILE A 13 -0.855 6.416 6.841 1.00 0.44 C ATOM 0 H ILE A 13 -1.617 2.983 8.301 1.00 0.42 H new ATOM 0 HA ILE A 13 0.783 2.327 6.951 1.00 0.43 H new ATOM 0 HB ILE A 13 0.318 4.446 5.615 1.00 0.47 H new ATOM 0 HG12 ILE A 13 -2.277 5.087 5.965 1.00 0.46 H new ATOM 0 HG13 ILE A 13 -1.877 4.717 7.630 1.00 0.46 H new ATOM 0 HG21 ILE A 13 -1.670 3.424 4.483 1.00 0.56 H new ATOM 0 HG22 ILE A 13 -0.441 2.204 4.895 1.00 0.56 H new ATOM 0 HG23 ILE A 13 -1.906 2.364 5.893 1.00 0.56 H new ATOM 0 HD11 ILE A 13 -1.627 7.107 7.180 1.00 0.44 H new ATOM 0 HD12 ILE A 13 -0.051 6.381 7.576 1.00 0.44 H new ATOM 0 HD13 ILE A 13 -0.457 6.757 5.885 1.00 0.44 H new ATOM 196 N GLU A 14 1.018 4.700 9.204 1.00 0.39 N ATOM 197 CA GLU A 14 1.945 5.572 9.956 1.00 0.40 C ATOM 198 C GLU A 14 2.991 4.729 10.724 1.00 0.41 C ATOM 199 O GLU A 14 4.142 5.153 10.857 1.00 0.44 O ATOM 200 CB GLU A 14 1.141 6.491 10.920 1.00 0.43 C ATOM 201 CG GLU A 14 1.966 7.250 11.973 1.00 0.52 C ATOM 202 CD GLU A 14 2.089 6.488 13.287 1.00 0.61 C ATOM 203 OE1 GLU A 14 1.055 6.300 13.960 1.00 0.93 O ATOM 204 OE2 GLU A 14 3.212 6.067 13.630 1.00 1.00 O ATOM 0 H GLU A 14 0.113 4.575 9.657 1.00 0.39 H new ATOM 0 HA GLU A 14 2.488 6.203 9.252 1.00 0.40 H new ATOM 0 HB2 GLU A 14 0.593 7.220 10.323 1.00 0.43 H new ATOM 0 HB3 GLU A 14 0.400 5.881 11.438 1.00 0.43 H new ATOM 0 HG2 GLU A 14 2.962 7.445 11.576 1.00 0.52 H new ATOM 0 HG3 GLU A 14 1.503 8.219 12.162 1.00 0.52 H new ATOM 211 N THR A 15 2.585 3.541 11.231 1.00 0.42 N ATOM 212 CA THR A 15 3.487 2.644 11.982 1.00 0.45 C ATOM 213 C THR A 15 4.649 2.136 11.096 1.00 0.43 C ATOM 214 O THR A 15 5.782 2.046 11.565 1.00 0.45 O ATOM 215 CB THR A 15 2.718 1.432 12.603 1.00 0.50 C ATOM 216 OG1 THR A 15 1.544 1.893 13.287 1.00 0.65 O ATOM 217 CG2 THR A 15 3.582 0.646 13.596 1.00 0.77 C ATOM 0 H THR A 15 1.635 3.183 11.132 1.00 0.42 H new ATOM 0 HA THR A 15 3.905 3.235 12.797 1.00 0.45 H new ATOM 0 HB THR A 15 2.449 0.771 11.779 1.00 0.50 H new ATOM 0 HG1 THR A 15 0.857 2.135 12.631 1.00 0.65 H new ATOM 0 HG21 THR A 15 3.005 -0.186 14.001 1.00 0.77 H new ATOM 0 HG22 THR A 15 4.465 0.261 13.085 1.00 0.77 H new ATOM 0 HG23 THR A 15 3.891 1.303 14.409 1.00 0.77 H new ATOM 225 N VAL A 16 4.363 1.829 9.811 1.00 0.41 N ATOM 226 CA VAL A 16 5.395 1.343 8.863 1.00 0.42 C ATOM 227 C VAL A 16 6.432 2.453 8.555 1.00 0.42 C ATOM 228 O VAL A 16 7.608 2.156 8.330 1.00 0.46 O ATOM 229 CB VAL A 16 4.767 0.816 7.520 1.00 0.44 C ATOM 230 CG1 VAL A 16 5.832 0.233 6.577 1.00 0.50 C ATOM 231 CG2 VAL A 16 3.682 -0.233 7.785 1.00 0.49 C ATOM 0 H VAL A 16 3.430 1.908 9.406 1.00 0.41 H new ATOM 0 HA VAL A 16 5.897 0.507 9.350 1.00 0.42 H new ATOM 0 HB VAL A 16 4.313 1.678 7.031 1.00 0.44 H new ATOM 0 HG11 VAL A 16 5.355 -0.119 5.662 1.00 0.50 H new ATOM 0 HG12 VAL A 16 6.562 1.004 6.332 1.00 0.50 H new ATOM 0 HG13 VAL A 16 6.335 -0.600 7.067 1.00 0.50 H new ATOM 0 HG21 VAL A 16 3.269 -0.576 6.837 1.00 0.49 H new ATOM 0 HG22 VAL A 16 4.116 -1.078 8.319 1.00 0.49 H new ATOM 0 HG23 VAL A 16 2.889 0.209 8.388 1.00 0.49 H new ATOM 241 N VAL A 17 5.984 3.727 8.558 1.00 0.42 N ATOM 242 CA VAL A 17 6.867 4.878 8.282 1.00 0.47 C ATOM 243 C VAL A 17 7.711 5.234 9.525 1.00 0.55 C ATOM 244 O VAL A 17 8.932 5.292 9.441 1.00 0.95 O ATOM 245 CB VAL A 17 6.049 6.138 7.801 1.00 0.51 C ATOM 246 CG1 VAL A 17 6.948 7.363 7.548 1.00 0.60 C ATOM 247 CG2 VAL A 17 5.236 5.811 6.542 1.00 0.52 C ATOM 0 H VAL A 17 5.015 3.983 8.749 1.00 0.42 H new ATOM 0 HA VAL A 17 7.537 4.584 7.474 1.00 0.47 H new ATOM 0 HB VAL A 17 5.367 6.396 8.611 1.00 0.51 H new ATOM 0 HG11 VAL A 17 6.335 8.202 7.219 1.00 0.60 H new ATOM 0 HG12 VAL A 17 7.466 7.631 8.469 1.00 0.60 H new ATOM 0 HG13 VAL A 17 7.680 7.124 6.777 1.00 0.60 H new ATOM 0 HG21 VAL A 17 4.680 6.694 6.228 1.00 0.52 H new ATOM 0 HG22 VAL A 17 5.911 5.504 5.743 1.00 0.52 H new ATOM 0 HG23 VAL A 17 4.539 5.002 6.759 1.00 0.52 H new ATOM 257 N THR A 18 7.052 5.433 10.679 1.00 0.47 N ATOM 258 CA THR A 18 7.737 5.823 11.938 1.00 0.51 C ATOM 259 C THR A 18 8.710 4.755 12.503 1.00 0.51 C ATOM 260 O THR A 18 9.655 5.112 13.212 1.00 0.60 O ATOM 261 CB THR A 18 6.707 6.186 13.046 1.00 0.56 C ATOM 262 OG1 THR A 18 5.827 5.077 13.285 1.00 0.57 O ATOM 263 CG2 THR A 18 5.879 7.413 12.667 1.00 0.62 C ATOM 0 H THR A 18 6.041 5.331 10.773 1.00 0.47 H new ATOM 0 HA THR A 18 8.336 6.690 11.661 1.00 0.51 H new ATOM 0 HB THR A 18 7.269 6.417 13.951 1.00 0.56 H new ATOM 0 HG1 THR A 18 4.912 5.406 13.408 1.00 0.57 H new ATOM 0 HG21 THR A 18 5.171 7.635 13.466 1.00 0.62 H new ATOM 0 HG22 THR A 18 6.540 8.267 12.520 1.00 0.62 H new ATOM 0 HG23 THR A 18 5.334 7.213 11.744 1.00 0.62 H new ATOM 271 N THR A 19 8.495 3.462 12.186 1.00 0.49 N ATOM 272 CA THR A 19 9.344 2.370 12.713 1.00 0.53 C ATOM 273 C THR A 19 10.680 2.203 11.946 1.00 0.53 C ATOM 274 O THR A 19 11.720 2.022 12.589 1.00 0.62 O ATOM 275 CB THR A 19 8.559 1.019 12.747 1.00 0.55 C ATOM 276 OG1 THR A 19 7.352 1.190 13.504 1.00 0.56 O ATOM 277 CG2 THR A 19 9.365 -0.125 13.372 1.00 0.66 C ATOM 0 H THR A 19 7.745 3.148 11.571 1.00 0.49 H new ATOM 0 HA THR A 19 9.606 2.658 13.731 1.00 0.53 H new ATOM 0 HB THR A 19 8.347 0.750 11.712 1.00 0.55 H new ATOM 0 HG1 THR A 19 6.763 1.822 13.042 1.00 0.56 H new ATOM 0 HG21 THR A 19 8.767 -1.036 13.367 1.00 0.66 H new ATOM 0 HG22 THR A 19 10.276 -0.286 12.795 1.00 0.66 H new ATOM 0 HG23 THR A 19 9.626 0.132 14.399 1.00 0.66 H new ATOM 285 N PHE A 20 10.667 2.278 10.596 1.00 0.53 N ATOM 286 CA PHE A 20 11.902 2.087 9.796 1.00 0.57 C ATOM 287 C PHE A 20 12.553 3.403 9.309 1.00 0.57 C ATOM 288 O PHE A 20 13.757 3.404 9.034 1.00 0.89 O ATOM 289 CB PHE A 20 11.630 1.155 8.593 1.00 0.64 C ATOM 290 CG PHE A 20 12.878 0.768 7.806 1.00 0.71 C ATOM 291 CD1 PHE A 20 13.876 -0.008 8.389 1.00 0.83 C ATOM 292 CD2 PHE A 20 13.057 1.191 6.492 1.00 0.76 C ATOM 293 CE1 PHE A 20 15.013 -0.352 7.683 1.00 0.95 C ATOM 294 CE2 PHE A 20 14.195 0.847 5.785 1.00 0.86 C ATOM 295 CZ PHE A 20 15.172 0.075 6.382 1.00 0.93 C ATOM 0 H PHE A 20 9.831 2.466 10.043 1.00 0.53 H new ATOM 0 HA PHE A 20 12.621 1.626 10.474 1.00 0.57 H new ATOM 0 HB2 PHE A 20 11.146 0.247 8.953 1.00 0.64 H new ATOM 0 HB3 PHE A 20 10.927 1.646 7.920 1.00 0.64 H new ATOM 0 HD1 PHE A 20 13.760 -0.346 9.408 1.00 0.83 H new ATOM 0 HD2 PHE A 20 12.298 1.796 6.018 1.00 0.76 H new ATOM 0 HE1 PHE A 20 15.777 -0.955 8.151 1.00 0.95 H new ATOM 0 HE2 PHE A 20 14.319 1.182 4.766 1.00 0.86 H new ATOM 0 HZ PHE A 20 16.060 -0.194 5.830 1.00 0.93 H new ATOM 305 N PHE A 21 11.793 4.514 9.204 1.00 0.71 N ATOM 306 CA PHE A 21 12.368 5.800 8.725 1.00 0.73 C ATOM 307 C PHE A 21 13.391 6.411 9.711 1.00 0.66 C ATOM 308 O PHE A 21 14.114 7.343 9.342 1.00 0.67 O ATOM 309 CB PHE A 21 11.270 6.822 8.368 1.00 1.04 C ATOM 310 CG PHE A 21 10.597 6.583 7.021 1.00 1.67 C ATOM 311 CD1 PHE A 21 10.091 5.328 6.663 1.00 1.97 C ATOM 312 CD2 PHE A 21 10.469 7.625 6.107 1.00 2.34 C ATOM 313 CE1 PHE A 21 9.485 5.132 5.440 1.00 2.74 C ATOM 314 CE2 PHE A 21 9.861 7.424 4.885 1.00 3.02 C ATOM 315 CZ PHE A 21 9.371 6.181 4.551 1.00 3.17 C ATOM 0 H PHE A 21 10.801 4.553 9.437 1.00 0.71 H new ATOM 0 HA PHE A 21 12.915 5.558 7.814 1.00 0.73 H new ATOM 0 HB2 PHE A 21 10.509 6.806 9.148 1.00 1.04 H new ATOM 0 HB3 PHE A 21 11.707 7.821 8.370 1.00 1.04 H new ATOM 0 HD1 PHE A 21 10.176 4.502 7.354 1.00 1.97 H new ATOM 0 HD2 PHE A 21 10.851 8.604 6.358 1.00 2.34 H new ATOM 0 HE1 PHE A 21 9.100 4.158 5.178 1.00 2.74 H new ATOM 0 HE2 PHE A 21 9.769 8.244 4.188 1.00 3.02 H new ATOM 0 HZ PHE A 21 8.897 6.027 3.593 1.00 3.17 H new ATOM 325 N THR A 22 13.447 5.900 10.964 1.00 0.75 N ATOM 326 CA THR A 22 14.436 6.359 11.960 1.00 0.89 C ATOM 327 C THR A 22 15.865 5.945 11.521 1.00 0.82 C ATOM 328 O THR A 22 16.839 6.634 11.842 1.00 0.97 O ATOM 329 CB THR A 22 14.135 5.777 13.379 1.00 1.11 C ATOM 330 OG1 THR A 22 12.730 5.884 13.671 1.00 1.25 O ATOM 331 CG2 THR A 22 14.935 6.488 14.476 1.00 1.37 C ATOM 0 H THR A 22 12.819 5.172 11.305 1.00 0.75 H new ATOM 0 HA THR A 22 14.369 7.445 12.017 1.00 0.89 H new ATOM 0 HB THR A 22 14.436 4.730 13.367 1.00 1.11 H new ATOM 0 HG1 THR A 22 12.552 5.515 14.561 1.00 1.25 H new ATOM 0 HG21 THR A 22 14.693 6.050 15.444 1.00 1.37 H new ATOM 0 HG22 THR A 22 16.001 6.373 14.282 1.00 1.37 H new ATOM 0 HG23 THR A 22 14.680 7.548 14.483 1.00 1.37 H new ATOM 339 N PHE A 23 15.967 4.811 10.788 1.00 0.69 N ATOM 340 CA PHE A 23 17.249 4.293 10.269 1.00 0.76 C ATOM 341 C PHE A 23 17.438 4.662 8.781 1.00 0.69 C ATOM 342 O PHE A 23 18.577 4.789 8.321 1.00 0.82 O ATOM 343 CB PHE A 23 17.330 2.762 10.458 1.00 0.87 C ATOM 344 CG PHE A 23 17.229 2.321 11.906 1.00 1.04 C ATOM 345 CD1 PHE A 23 18.365 2.231 12.704 1.00 1.34 C ATOM 346 CD2 PHE A 23 15.995 2.011 12.471 1.00 1.01 C ATOM 347 CE1 PHE A 23 18.269 1.845 14.027 1.00 1.55 C ATOM 348 CE2 PHE A 23 15.898 1.624 13.791 1.00 1.24 C ATOM 349 CZ PHE A 23 17.036 1.541 14.571 1.00 1.49 C ATOM 0 H PHE A 23 15.163 4.233 10.542 1.00 0.69 H new ATOM 0 HA PHE A 23 18.054 4.759 10.837 1.00 0.76 H new ATOM 0 HB2 PHE A 23 16.530 2.291 9.887 1.00 0.87 H new ATOM 0 HB3 PHE A 23 18.272 2.403 10.043 1.00 0.87 H new ATOM 0 HD1 PHE A 23 19.332 2.465 12.285 1.00 1.34 H new ATOM 0 HD2 PHE A 23 15.102 2.074 11.867 1.00 1.01 H new ATOM 0 HE1 PHE A 23 19.158 1.781 14.636 1.00 1.55 H new ATOM 0 HE2 PHE A 23 14.934 1.386 14.215 1.00 1.24 H new ATOM 0 HZ PHE A 23 16.961 1.239 15.605 1.00 1.49 H new ATOM 359 N ALA A 24 16.319 4.836 8.030 1.00 0.59 N ATOM 360 CA ALA A 24 16.369 5.206 6.596 1.00 0.67 C ATOM 361 C ALA A 24 16.892 6.640 6.384 1.00 0.62 C ATOM 362 O ALA A 24 17.468 6.936 5.332 1.00 0.83 O ATOM 363 CB ALA A 24 14.996 5.045 5.949 1.00 0.82 C ATOM 0 H ALA A 24 15.373 4.725 8.396 1.00 0.59 H new ATOM 0 HA ALA A 24 17.072 4.525 6.115 1.00 0.67 H new ATOM 0 HB1 ALA A 24 15.055 5.322 4.896 1.00 0.82 H new ATOM 0 HB2 ALA A 24 14.673 4.007 6.034 1.00 0.82 H new ATOM 0 HB3 ALA A 24 14.278 5.691 6.454 1.00 0.82 H new ATOM 369 N ARG A 25 16.676 7.531 7.382 1.00 0.61 N ATOM 370 CA ARG A 25 17.153 8.934 7.316 1.00 0.65 C ATOM 371 C ARG A 25 18.704 9.026 7.317 1.00 0.69 C ATOM 372 O ARG A 25 19.254 10.052 6.907 1.00 0.88 O ATOM 373 CB ARG A 25 16.570 9.783 8.476 1.00 0.75 C ATOM 374 CG ARG A 25 16.904 9.270 9.884 1.00 0.78 C ATOM 375 CD ARG A 25 16.459 10.240 10.982 1.00 0.97 C ATOM 376 NE ARG A 25 16.796 9.750 12.334 1.00 1.09 N ATOM 377 CZ ARG A 25 16.610 10.442 13.480 1.00 1.32 C ATOM 378 NH1 ARG A 25 16.083 11.675 13.477 1.00 1.55 N ATOM 379 NH2 ARG A 25 16.956 9.887 14.645 1.00 1.47 N ATOM 0 H ARG A 25 16.175 7.303 8.241 1.00 0.61 H new ATOM 0 HA ARG A 25 16.794 9.339 6.370 1.00 0.65 H new ATOM 0 HB2 ARG A 25 16.939 10.804 8.380 1.00 0.75 H new ATOM 0 HB3 ARG A 25 15.486 9.824 8.368 1.00 0.75 H new ATOM 0 HG2 ARG A 25 16.422 8.305 10.039 1.00 0.78 H new ATOM 0 HG3 ARG A 25 17.979 9.106 9.962 1.00 0.78 H new ATOM 0 HD2 ARG A 25 16.932 11.209 10.821 1.00 0.97 H new ATOM 0 HD3 ARG A 25 15.382 10.395 10.912 1.00 0.97 H new ATOM 0 HE ARG A 25 17.201 8.817 12.409 1.00 1.09 H new ATOM 0 HH11 ARG A 25 15.812 12.112 12.596 1.00 1.55 H new ATOM 0 HH12 ARG A 25 15.953 12.176 14.356 1.00 1.55 H new ATOM 0 HH21 ARG A 25 17.357 8.949 14.664 1.00 1.47 H new ATOM 0 HH22 ARG A 25 16.820 10.401 15.515 1.00 1.47 H new ATOM 393 N GLN A 26 19.397 7.947 7.785 1.00 0.73 N ATOM 394 CA GLN A 26 20.881 7.895 7.842 1.00 0.84 C ATOM 395 C GLN A 26 21.521 8.228 6.477 1.00 0.78 C ATOM 396 O GLN A 26 22.489 8.993 6.416 1.00 0.89 O ATOM 397 CB GLN A 26 21.359 6.504 8.329 1.00 1.01 C ATOM 398 CG GLN A 26 22.781 6.486 8.892 1.00 1.22 C ATOM 399 CD GLN A 26 23.171 5.126 9.462 1.00 1.49 C ATOM 400 OE1 GLN A 26 23.746 4.293 8.762 1.00 1.63 O ATOM 401 NE2 GLN A 26 22.850 4.890 10.738 1.00 1.80 N ATOM 0 H GLN A 26 18.944 7.100 8.129 1.00 0.73 H new ATOM 0 HA GLN A 26 21.204 8.654 8.555 1.00 0.84 H new ATOM 0 HB2 GLN A 26 20.673 6.146 9.096 1.00 1.01 H new ATOM 0 HB3 GLN A 26 21.302 5.802 7.497 1.00 1.01 H new ATOM 0 HG2 GLN A 26 23.483 6.760 8.104 1.00 1.22 H new ATOM 0 HG3 GLN A 26 22.868 7.241 9.673 1.00 1.22 H new ATOM 0 HE21 GLN A 26 22.373 5.607 11.285 1.00 1.80 H new ATOM 0 HE22 GLN A 26 23.082 3.993 11.165 1.00 1.80 H new ATOM 410 N GLU A 27 20.965 7.655 5.391 1.00 0.70 N ATOM 411 CA GLU A 27 21.464 7.899 4.025 1.00 0.76 C ATOM 412 C GLU A 27 20.710 9.088 3.382 1.00 0.93 C ATOM 413 O GLU A 27 19.856 9.702 4.035 1.00 1.59 O ATOM 414 CB GLU A 27 21.326 6.611 3.174 1.00 0.92 C ATOM 415 CG GLU A 27 22.201 5.440 3.644 1.00 1.09 C ATOM 416 CD GLU A 27 23.678 5.621 3.325 1.00 1.27 C ATOM 417 OE1 GLU A 27 24.355 6.376 4.053 1.00 1.46 O ATOM 418 OE2 GLU A 27 24.153 5.004 2.348 1.00 1.52 O ATOM 0 H GLU A 27 20.169 7.019 5.435 1.00 0.70 H new ATOM 0 HA GLU A 27 22.521 8.163 4.069 1.00 0.76 H new ATOM 0 HB2 GLU A 27 20.283 6.295 3.183 1.00 0.92 H new ATOM 0 HB3 GLU A 27 21.579 6.845 2.140 1.00 0.92 H new ATOM 0 HG2 GLU A 27 22.082 5.317 4.720 1.00 1.09 H new ATOM 0 HG3 GLU A 27 21.846 4.521 3.177 1.00 1.09 H new ATOM 425 N GLY A 28 21.040 9.418 2.108 1.00 0.79 N ATOM 426 CA GLY A 28 20.404 10.534 1.387 1.00 0.92 C ATOM 427 C GLY A 28 18.870 10.492 1.382 1.00 0.73 C ATOM 428 O GLY A 28 18.287 9.404 1.381 1.00 0.72 O ATOM 0 H GLY A 28 21.745 8.922 1.563 1.00 0.79 H new ATOM 0 HA2 GLY A 28 20.728 11.473 1.836 1.00 0.92 H new ATOM 0 HA3 GLY A 28 20.759 10.534 0.356 1.00 0.92 H new ATOM 432 N ARG A 29 18.225 11.689 1.373 1.00 0.72 N ATOM 433 CA ARG A 29 16.744 11.838 1.380 1.00 0.71 C ATOM 434 C ARG A 29 16.121 11.306 2.686 1.00 0.68 C ATOM 435 O ARG A 29 16.495 10.236 3.174 1.00 0.76 O ATOM 436 CB ARG A 29 16.076 11.162 0.149 1.00 0.73 C ATOM 437 CG ARG A 29 15.955 12.057 -1.087 1.00 0.92 C ATOM 438 CD ARG A 29 17.284 12.261 -1.809 1.00 1.31 C ATOM 439 NE ARG A 29 17.157 13.193 -2.945 1.00 1.46 N ATOM 440 CZ ARG A 29 18.114 13.426 -3.865 1.00 1.91 C ATOM 441 NH1 ARG A 29 19.309 12.822 -3.802 1.00 2.60 N ATOM 442 NH2 ARG A 29 17.873 14.291 -4.854 1.00 2.05 N ATOM 0 H ARG A 29 18.719 12.581 1.361 1.00 0.72 H new ATOM 0 HA ARG A 29 16.548 12.908 1.318 1.00 0.71 H new ATOM 0 HB2 ARG A 29 16.651 10.275 -0.117 1.00 0.73 H new ATOM 0 HB3 ARG A 29 15.080 10.823 0.434 1.00 0.73 H new ATOM 0 HG2 ARG A 29 15.236 11.617 -1.778 1.00 0.92 H new ATOM 0 HG3 ARG A 29 15.557 13.027 -0.789 1.00 0.92 H new ATOM 0 HD2 ARG A 29 18.024 12.645 -1.106 1.00 1.31 H new ATOM 0 HD3 ARG A 29 17.653 11.300 -2.168 1.00 1.31 H new ATOM 0 HE ARG A 29 16.277 13.700 -3.042 1.00 1.46 H new ATOM 0 HH11 ARG A 29 19.511 12.169 -3.045 1.00 2.60 H new ATOM 0 HH12 ARG A 29 20.016 13.016 -4.511 1.00 2.60 H new ATOM 0 HH21 ARG A 29 16.972 14.767 -4.907 1.00 2.05 H new ATOM 0 HH22 ARG A 29 18.590 14.476 -5.556 1.00 2.05 H new ATOM 456 N LYS A 30 15.153 12.062 3.239 1.00 0.67 N ATOM 457 CA LYS A 30 14.468 11.678 4.489 1.00 0.67 C ATOM 458 C LYS A 30 13.296 10.721 4.210 1.00 0.66 C ATOM 459 O LYS A 30 13.085 9.764 4.961 1.00 0.72 O ATOM 460 CB LYS A 30 13.956 12.932 5.233 1.00 0.76 C ATOM 461 CG LYS A 30 15.053 13.886 5.724 1.00 0.82 C ATOM 462 CD LYS A 30 15.810 13.341 6.942 1.00 0.89 C ATOM 463 CE LYS A 30 16.843 14.339 7.475 1.00 1.00 C ATOM 464 NZ LYS A 30 18.005 14.515 6.553 1.00 1.22 N ATOM 0 H LYS A 30 14.828 12.942 2.840 1.00 0.67 H new ATOM 0 HA LYS A 30 15.192 11.160 5.118 1.00 0.67 H new ATOM 0 HB2 LYS A 30 13.287 13.481 4.571 1.00 0.76 H new ATOM 0 HB3 LYS A 30 13.364 12.611 6.090 1.00 0.76 H new ATOM 0 HG2 LYS A 30 15.759 14.068 4.914 1.00 0.82 H new ATOM 0 HG3 LYS A 30 14.606 14.847 5.979 1.00 0.82 H new ATOM 0 HD2 LYS A 30 15.099 13.100 7.732 1.00 0.89 H new ATOM 0 HD3 LYS A 30 16.311 12.412 6.670 1.00 0.89 H new ATOM 0 HE2 LYS A 30 16.361 15.304 7.634 1.00 1.00 H new ATOM 0 HE3 LYS A 30 17.203 13.999 8.446 1.00 1.00 H new ATOM 0 HZ1 LYS A 30 18.672 15.200 6.962 1.00 1.22 H new ATOM 0 HZ2 LYS A 30 18.484 13.602 6.420 1.00 1.22 H new ATOM 0 HZ3 LYS A 30 17.669 14.866 5.634 1.00 1.22 H new ATOM 478 N ASP A 31 12.545 10.986 3.123 1.00 0.66 N ATOM 479 CA ASP A 31 11.387 10.159 2.737 1.00 0.71 C ATOM 480 C ASP A 31 11.800 8.868 1.985 1.00 0.64 C ATOM 481 O ASP A 31 10.984 7.948 1.859 1.00 0.89 O ATOM 482 CB ASP A 31 10.412 10.975 1.867 1.00 0.87 C ATOM 483 CG ASP A 31 9.807 12.162 2.610 1.00 1.03 C ATOM 484 OD1 ASP A 31 9.164 11.942 3.661 1.00 1.38 O ATOM 485 OD2 ASP A 31 9.980 13.307 2.143 1.00 1.43 O ATOM 0 H ASP A 31 12.722 11.770 2.495 1.00 0.66 H new ATOM 0 HA ASP A 31 10.895 9.857 3.662 1.00 0.71 H new ATOM 0 HB2 ASP A 31 10.937 11.335 0.982 1.00 0.87 H new ATOM 0 HB3 ASP A 31 9.610 10.323 1.519 1.00 0.87 H new ATOM 490 N SER A 32 13.060 8.799 1.491 1.00 0.65 N ATOM 491 CA SER A 32 13.557 7.624 0.745 1.00 0.58 C ATOM 492 C SER A 32 14.207 6.577 1.663 1.00 0.56 C ATOM 493 O SER A 32 14.859 6.923 2.653 1.00 0.63 O ATOM 494 CB SER A 32 14.574 8.066 -0.325 1.00 0.58 C ATOM 495 OG SER A 32 14.985 6.978 -1.139 1.00 1.09 O ATOM 0 H SER A 32 13.748 9.544 1.597 1.00 0.65 H new ATOM 0 HA SER A 32 12.691 7.160 0.272 1.00 0.58 H new ATOM 0 HB2 SER A 32 14.131 8.841 -0.950 1.00 0.58 H new ATOM 0 HB3 SER A 32 15.445 8.507 0.160 1.00 0.58 H new ATOM 0 HG SER A 32 15.628 7.294 -1.807 1.00 1.09 H new ATOM 501 N LEU A 33 14.012 5.289 1.307 1.00 0.54 N ATOM 502 CA LEU A 33 14.585 4.149 2.043 1.00 0.54 C ATOM 503 C LEU A 33 15.896 3.706 1.360 1.00 0.52 C ATOM 504 O LEU A 33 15.994 3.754 0.131 1.00 0.66 O ATOM 505 CB LEU A 33 13.595 2.959 2.095 1.00 0.55 C ATOM 506 CG LEU A 33 12.339 3.129 2.997 1.00 0.67 C ATOM 507 CD1 LEU A 33 11.342 4.132 2.404 1.00 0.76 C ATOM 508 CD2 LEU A 33 11.662 1.772 3.230 1.00 0.75 C ATOM 0 H LEU A 33 13.452 5.014 0.500 1.00 0.54 H new ATOM 0 HA LEU A 33 14.786 4.466 3.066 1.00 0.54 H new ATOM 0 HB2 LEU A 33 13.258 2.753 1.079 1.00 0.55 H new ATOM 0 HB3 LEU A 33 14.140 2.078 2.435 1.00 0.55 H new ATOM 0 HG LEU A 33 12.673 3.528 3.955 1.00 0.67 H new ATOM 0 HD11 LEU A 33 10.480 4.221 3.064 1.00 0.76 H new ATOM 0 HD12 LEU A 33 11.823 5.105 2.301 1.00 0.76 H new ATOM 0 HD13 LEU A 33 11.014 3.784 1.425 1.00 0.76 H new ATOM 0 HD21 LEU A 33 10.785 1.907 3.863 1.00 0.75 H new ATOM 0 HD22 LEU A 33 11.357 1.348 2.273 1.00 0.75 H new ATOM 0 HD23 LEU A 33 12.362 1.095 3.720 1.00 0.75 H new ATOM 520 N SER A 34 16.893 3.256 2.150 1.00 0.50 N ATOM 521 CA SER A 34 18.198 2.826 1.596 1.00 0.52 C ATOM 522 C SER A 34 18.085 1.508 0.803 1.00 0.47 C ATOM 523 O SER A 34 17.203 0.691 1.077 1.00 0.47 O ATOM 524 CB SER A 34 19.234 2.679 2.720 1.00 0.62 C ATOM 525 OG SER A 34 20.530 2.406 2.204 1.00 0.68 O ATOM 0 H SER A 34 16.823 3.180 3.165 1.00 0.50 H new ATOM 0 HA SER A 34 18.526 3.600 0.902 1.00 0.52 H new ATOM 0 HB2 SER A 34 19.262 3.594 3.311 1.00 0.62 H new ATOM 0 HB3 SER A 34 18.932 1.875 3.391 1.00 0.62 H new ATOM 0 HG SER A 34 21.166 2.320 2.945 1.00 0.68 H new ATOM 531 N VAL A 35 18.995 1.318 -0.175 1.00 0.50 N ATOM 532 CA VAL A 35 19.015 0.106 -1.024 1.00 0.49 C ATOM 533 C VAL A 35 19.671 -1.109 -0.314 1.00 0.45 C ATOM 534 O VAL A 35 19.374 -2.255 -0.663 1.00 0.46 O ATOM 535 CB VAL A 35 19.712 0.387 -2.409 1.00 0.59 C ATOM 536 CG1 VAL A 35 21.200 0.744 -2.256 1.00 0.63 C ATOM 537 CG2 VAL A 35 19.528 -0.784 -3.387 1.00 0.64 C ATOM 0 H VAL A 35 19.729 1.991 -0.398 1.00 0.50 H new ATOM 0 HA VAL A 35 17.974 -0.157 -1.210 1.00 0.49 H new ATOM 0 HB VAL A 35 19.212 1.259 -2.830 1.00 0.59 H new ATOM 0 HG11 VAL A 35 21.633 0.928 -3.239 1.00 0.63 H new ATOM 0 HG12 VAL A 35 21.298 1.640 -1.643 1.00 0.63 H new ATOM 0 HG13 VAL A 35 21.725 -0.083 -1.777 1.00 0.63 H new ATOM 0 HG21 VAL A 35 20.023 -0.552 -4.330 1.00 0.64 H new ATOM 0 HG22 VAL A 35 19.966 -1.687 -2.960 1.00 0.64 H new ATOM 0 HG23 VAL A 35 18.465 -0.946 -3.565 1.00 0.64 H new ATOM 547 N ASN A 36 20.553 -0.855 0.675 1.00 0.45 N ATOM 548 CA ASN A 36 21.244 -1.929 1.417 1.00 0.46 C ATOM 549 C ASN A 36 20.532 -2.270 2.748 1.00 0.44 C ATOM 550 O ASN A 36 20.649 -3.403 3.230 1.00 0.55 O ATOM 551 CB ASN A 36 22.710 -1.523 1.678 1.00 0.55 C ATOM 552 CG ASN A 36 23.568 -2.668 2.216 1.00 0.64 C ATOM 553 OD1 ASN A 36 24.101 -3.470 1.448 1.00 0.82 O ATOM 554 ND2 ASN A 36 23.710 -2.751 3.541 1.00 0.77 N ATOM 0 H ASN A 36 20.803 0.086 0.978 1.00 0.45 H new ATOM 0 HA ASN A 36 21.218 -2.828 0.802 1.00 0.46 H new ATOM 0 HB2 ASN A 36 23.148 -1.155 0.750 1.00 0.55 H new ATOM 0 HB3 ASN A 36 22.730 -0.698 2.390 1.00 0.55 H new ATOM 0 HD21 ASN A 36 24.275 -3.497 3.948 1.00 0.77 H new ATOM 0 HD22 ASN A 36 23.254 -2.069 4.147 1.00 0.77 H new ATOM 561 N GLU A 37 19.797 -1.298 3.337 1.00 0.44 N ATOM 562 CA GLU A 37 19.095 -1.508 4.626 1.00 0.46 C ATOM 563 C GLU A 37 17.729 -2.202 4.464 1.00 0.41 C ATOM 564 O GLU A 37 17.323 -2.950 5.358 1.00 0.43 O ATOM 565 CB GLU A 37 18.904 -0.179 5.379 1.00 0.55 C ATOM 566 CG GLU A 37 20.208 0.541 5.728 1.00 0.70 C ATOM 567 CD GLU A 37 20.056 1.556 6.854 1.00 0.83 C ATOM 568 OE1 GLU A 37 19.099 2.361 6.814 1.00 1.25 O ATOM 569 OE2 GLU A 37 20.900 1.547 7.775 1.00 1.54 O ATOM 0 H GLU A 37 19.675 -0.365 2.943 1.00 0.44 H new ATOM 0 HA GLU A 37 19.737 -2.171 5.206 1.00 0.46 H new ATOM 0 HB2 GLU A 37 18.288 0.484 4.771 1.00 0.55 H new ATOM 0 HB3 GLU A 37 18.352 -0.372 6.299 1.00 0.55 H new ATOM 0 HG2 GLU A 37 20.957 -0.198 6.013 1.00 0.70 H new ATOM 0 HG3 GLU A 37 20.583 1.049 4.839 1.00 0.70 H new ATOM 576 N PHE A 38 17.009 -1.945 3.343 1.00 0.40 N ATOM 577 CA PHE A 38 15.688 -2.578 3.108 1.00 0.39 C ATOM 578 C PHE A 38 15.836 -4.106 2.917 1.00 0.37 C ATOM 579 O PHE A 38 14.953 -4.870 3.312 1.00 0.40 O ATOM 580 CB PHE A 38 14.938 -1.909 1.917 1.00 0.43 C ATOM 581 CG PHE A 38 15.132 -2.558 0.549 1.00 0.41 C ATOM 582 CD1 PHE A 38 16.225 -2.242 -0.247 1.00 0.49 C ATOM 583 CD2 PHE A 38 14.210 -3.484 0.066 1.00 0.50 C ATOM 584 CE1 PHE A 38 16.396 -2.834 -1.486 1.00 0.61 C ATOM 585 CE2 PHE A 38 14.379 -4.074 -1.170 1.00 0.61 C ATOM 586 CZ PHE A 38 15.472 -3.748 -1.946 1.00 0.65 C ATOM 0 H PHE A 38 17.314 -1.316 2.601 1.00 0.40 H new ATOM 0 HA PHE A 38 15.074 -2.418 3.995 1.00 0.39 H new ATOM 0 HB2 PHE A 38 13.872 -1.901 2.144 1.00 0.43 H new ATOM 0 HB3 PHE A 38 15.258 -0.869 1.851 1.00 0.43 H new ATOM 0 HD1 PHE A 38 16.951 -1.525 0.106 1.00 0.49 H new ATOM 0 HD2 PHE A 38 13.351 -3.744 0.667 1.00 0.50 H new ATOM 0 HE1 PHE A 38 17.253 -2.580 -2.092 1.00 0.61 H new ATOM 0 HE2 PHE A 38 13.656 -4.791 -1.530 1.00 0.61 H new ATOM 0 HZ PHE A 38 15.604 -4.209 -2.914 1.00 0.65 H new ATOM 596 N LYS A 39 16.965 -4.533 2.309 1.00 0.37 N ATOM 597 CA LYS A 39 17.263 -5.962 2.084 1.00 0.40 C ATOM 598 C LYS A 39 17.505 -6.681 3.431 1.00 0.38 C ATOM 599 O LYS A 39 17.129 -7.846 3.587 1.00 0.42 O ATOM 600 CB LYS A 39 18.488 -6.102 1.156 1.00 0.46 C ATOM 601 CG LYS A 39 18.691 -7.496 0.559 1.00 0.55 C ATOM 602 CD LYS A 39 19.887 -7.531 -0.397 1.00 0.64 C ATOM 603 CE LYS A 39 20.134 -8.924 -0.976 1.00 0.76 C ATOM 604 NZ LYS A 39 19.106 -9.314 -1.987 1.00 0.87 N ATOM 0 H LYS A 39 17.688 -3.902 1.964 1.00 0.37 H new ATOM 0 HA LYS A 39 16.407 -6.433 1.601 1.00 0.40 H new ATOM 0 HB2 LYS A 39 18.391 -5.385 0.341 1.00 0.46 H new ATOM 0 HB3 LYS A 39 19.382 -5.829 1.716 1.00 0.46 H new ATOM 0 HG2 LYS A 39 18.845 -8.217 1.362 1.00 0.55 H new ATOM 0 HG3 LYS A 39 17.790 -7.799 0.026 1.00 0.55 H new ATOM 0 HD2 LYS A 39 19.717 -6.827 -1.212 1.00 0.64 H new ATOM 0 HD3 LYS A 39 20.780 -7.197 0.131 1.00 0.64 H new ATOM 0 HE2 LYS A 39 21.121 -8.952 -1.437 1.00 0.76 H new ATOM 0 HE3 LYS A 39 20.139 -9.655 -0.167 1.00 0.76 H new ATOM 0 HZ1 LYS A 39 19.318 -10.266 -2.349 1.00 0.87 H new ATOM 0 HZ2 LYS A 39 18.165 -9.314 -1.543 1.00 0.87 H new ATOM 0 HZ3 LYS A 39 19.117 -8.634 -2.774 1.00 0.87 H new ATOM 618 N GLU A 40 18.137 -5.972 4.399 1.00 0.38 N ATOM 619 CA GLU A 40 18.395 -6.516 5.749 1.00 0.40 C ATOM 620 C GLU A 40 17.090 -6.562 6.576 1.00 0.40 C ATOM 621 O GLU A 40 16.906 -7.471 7.391 1.00 0.44 O ATOM 622 CB GLU A 40 19.457 -5.673 6.489 1.00 0.45 C ATOM 623 CG GLU A 40 20.845 -5.720 5.851 1.00 0.49 C ATOM 624 CD GLU A 40 21.833 -4.776 6.517 1.00 0.59 C ATOM 625 OE1 GLU A 40 21.917 -3.604 6.090 1.00 0.64 O ATOM 626 OE2 GLU A 40 22.528 -5.212 7.461 1.00 0.73 O ATOM 0 H GLU A 40 18.477 -5.020 4.266 1.00 0.38 H new ATOM 0 HA GLU A 40 18.775 -7.531 5.633 1.00 0.40 H new ATOM 0 HB2 GLU A 40 19.121 -4.637 6.527 1.00 0.45 H new ATOM 0 HB3 GLU A 40 19.530 -6.022 7.519 1.00 0.45 H new ATOM 0 HG2 GLU A 40 21.230 -6.738 5.905 1.00 0.49 H new ATOM 0 HG3 GLU A 40 20.763 -5.466 4.794 1.00 0.49 H new ATOM 633 N LEU A 41 16.190 -5.569 6.354 1.00 0.39 N ATOM 634 CA LEU A 41 14.888 -5.492 7.055 1.00 0.41 C ATOM 635 C LEU A 41 13.956 -6.642 6.625 1.00 0.40 C ATOM 636 O LEU A 41 13.263 -7.222 7.463 1.00 0.44 O ATOM 637 CB LEU A 41 14.204 -4.129 6.791 1.00 0.44 C ATOM 638 CG LEU A 41 13.011 -3.777 7.713 1.00 0.55 C ATOM 639 CD1 LEU A 41 13.491 -3.420 9.126 1.00 0.65 C ATOM 640 CD2 LEU A 41 12.172 -2.648 7.105 1.00 0.58 C ATOM 0 H LEU A 41 16.347 -4.809 5.692 1.00 0.39 H new ATOM 0 HA LEU A 41 15.082 -5.588 8.123 1.00 0.41 H new ATOM 0 HB2 LEU A 41 14.954 -3.344 6.886 1.00 0.44 H new ATOM 0 HB3 LEU A 41 13.856 -4.114 5.758 1.00 0.44 H new ATOM 0 HG LEU A 41 12.375 -4.658 7.798 1.00 0.55 H new ATOM 0 HD11 LEU A 41 12.632 -3.177 9.752 1.00 0.65 H new ATOM 0 HD12 LEU A 41 14.024 -4.269 9.555 1.00 0.65 H new ATOM 0 HD13 LEU A 41 14.159 -2.560 9.077 1.00 0.65 H new ATOM 0 HD21 LEU A 41 11.339 -2.416 7.768 1.00 0.58 H new ATOM 0 HD22 LEU A 41 12.793 -1.761 6.978 1.00 0.58 H new ATOM 0 HD23 LEU A 41 11.787 -2.963 6.135 1.00 0.58 H new ATOM 652 N VAL A 42 13.951 -6.964 5.312 1.00 0.36 N ATOM 653 CA VAL A 42 13.116 -8.052 4.761 1.00 0.37 C ATOM 654 C VAL A 42 13.626 -9.449 5.214 1.00 0.38 C ATOM 655 O VAL A 42 12.867 -10.420 5.166 1.00 0.41 O ATOM 656 CB VAL A 42 13.015 -7.963 3.191 1.00 0.40 C ATOM 657 CG1 VAL A 42 12.273 -9.164 2.579 1.00 0.45 C ATOM 658 CG2 VAL A 42 12.328 -6.657 2.766 1.00 0.41 C ATOM 0 H VAL A 42 14.518 -6.483 4.613 1.00 0.36 H new ATOM 0 HA VAL A 42 12.111 -7.924 5.164 1.00 0.37 H new ATOM 0 HB VAL A 42 14.037 -7.979 2.811 1.00 0.40 H new ATOM 0 HG11 VAL A 42 12.232 -9.053 1.496 1.00 0.45 H new ATOM 0 HG12 VAL A 42 12.801 -10.084 2.829 1.00 0.45 H new ATOM 0 HG13 VAL A 42 11.260 -9.207 2.978 1.00 0.45 H new ATOM 0 HG21 VAL A 42 12.268 -6.615 1.678 1.00 0.41 H new ATOM 0 HG22 VAL A 42 11.323 -6.621 3.187 1.00 0.41 H new ATOM 0 HG23 VAL A 42 12.905 -5.807 3.131 1.00 0.41 H new ATOM 668 N THR A 43 14.902 -9.546 5.663 1.00 0.39 N ATOM 669 CA THR A 43 15.483 -10.822 6.134 1.00 0.42 C ATOM 670 C THR A 43 15.670 -10.844 7.679 1.00 0.49 C ATOM 671 O THR A 43 16.339 -11.741 8.204 1.00 0.80 O ATOM 672 CB THR A 43 16.860 -11.104 5.439 1.00 0.45 C ATOM 673 OG1 THR A 43 16.858 -10.602 4.090 1.00 0.46 O ATOM 674 CG2 THR A 43 17.199 -12.599 5.418 1.00 0.50 C ATOM 0 H THR A 43 15.545 -8.756 5.708 1.00 0.39 H new ATOM 0 HA THR A 43 14.774 -11.605 5.864 1.00 0.42 H new ATOM 0 HB THR A 43 17.620 -10.588 6.025 1.00 0.45 H new ATOM 0 HG1 THR A 43 16.944 -9.626 4.104 1.00 0.46 H new ATOM 0 HG21 THR A 43 18.161 -12.747 4.927 1.00 0.50 H new ATOM 0 HG22 THR A 43 17.251 -12.975 6.440 1.00 0.50 H new ATOM 0 HG23 THR A 43 16.426 -13.140 4.872 1.00 0.50 H new ATOM 682 N GLN A 44 15.056 -9.878 8.411 1.00 0.41 N ATOM 683 CA GLN A 44 15.188 -9.811 9.883 1.00 0.44 C ATOM 684 C GLN A 44 13.844 -9.480 10.566 1.00 0.44 C ATOM 685 O GLN A 44 13.387 -10.243 11.420 1.00 0.50 O ATOM 686 CB GLN A 44 16.264 -8.771 10.284 1.00 0.48 C ATOM 687 CG GLN A 44 16.844 -8.986 11.685 1.00 0.65 C ATOM 688 CD GLN A 44 17.700 -7.824 12.178 1.00 0.77 C ATOM 689 OE1 GLN A 44 18.902 -7.772 11.912 1.00 1.02 O ATOM 690 NE2 GLN A 44 17.091 -6.888 12.910 1.00 1.10 N ATOM 0 H GLN A 44 14.472 -9.145 8.008 1.00 0.41 H new ATOM 0 HA GLN A 44 15.499 -10.797 10.228 1.00 0.44 H new ATOM 0 HB2 GLN A 44 17.075 -8.803 9.557 1.00 0.48 H new ATOM 0 HB3 GLN A 44 15.828 -7.773 10.231 1.00 0.48 H new ATOM 0 HG2 GLN A 44 16.026 -9.146 12.387 1.00 0.65 H new ATOM 0 HG3 GLN A 44 17.446 -9.895 11.684 1.00 0.65 H new ATOM 0 HE21 GLN A 44 16.094 -6.965 13.109 1.00 1.10 H new ATOM 0 HE22 GLN A 44 17.623 -6.096 13.270 1.00 1.10 H new ATOM 699 N GLN A 45 13.221 -8.342 10.185 1.00 0.41 N ATOM 700 CA GLN A 45 11.938 -7.899 10.775 1.00 0.43 C ATOM 701 C GLN A 45 10.716 -8.262 9.896 1.00 0.41 C ATOM 702 O GLN A 45 9.585 -8.255 10.392 1.00 0.45 O ATOM 703 CB GLN A 45 11.976 -6.380 11.040 1.00 0.47 C ATOM 704 CG GLN A 45 10.845 -5.874 11.946 1.00 0.59 C ATOM 705 CD GLN A 45 11.071 -4.463 12.489 1.00 0.64 C ATOM 706 OE1 GLN A 45 11.779 -3.654 11.886 1.00 0.65 O ATOM 707 NE2 GLN A 45 10.459 -4.151 13.634 1.00 0.84 N ATOM 0 H GLN A 45 13.587 -7.713 9.470 1.00 0.41 H new ATOM 0 HA GLN A 45 11.817 -8.434 11.717 1.00 0.43 H new ATOM 0 HB2 GLN A 45 12.933 -6.125 11.495 1.00 0.47 H new ATOM 0 HB3 GLN A 45 11.926 -5.854 10.087 1.00 0.47 H new ATOM 0 HG2 GLN A 45 9.909 -5.892 11.387 1.00 0.59 H new ATOM 0 HG3 GLN A 45 10.729 -6.561 12.784 1.00 0.59 H new ATOM 0 HE21 GLN A 45 9.880 -4.844 14.108 1.00 0.84 H new ATOM 0 HE22 GLN A 45 10.571 -3.220 14.035 1.00 0.84 H new ATOM 716 N LEU A 46 10.937 -8.575 8.599 1.00 0.40 N ATOM 717 CA LEU A 46 9.842 -8.942 7.680 1.00 0.40 C ATOM 718 C LEU A 46 10.190 -10.232 6.867 1.00 0.40 C ATOM 719 O LEU A 46 10.004 -10.255 5.646 1.00 0.42 O ATOM 720 CB LEU A 46 9.562 -7.736 6.742 1.00 0.41 C ATOM 721 CG LEU A 46 8.193 -7.725 5.998 1.00 0.40 C ATOM 722 CD1 LEU A 46 7.359 -6.504 6.406 1.00 0.59 C ATOM 723 CD2 LEU A 46 8.387 -7.754 4.473 1.00 0.67 C ATOM 0 H LEU A 46 11.862 -8.580 8.169 1.00 0.40 H new ATOM 0 HA LEU A 46 8.944 -9.171 8.254 1.00 0.40 H new ATOM 0 HB2 LEU A 46 9.635 -6.823 7.333 1.00 0.41 H new ATOM 0 HB3 LEU A 46 10.355 -7.696 5.995 1.00 0.41 H new ATOM 0 HG LEU A 46 7.653 -8.626 6.289 1.00 0.40 H new ATOM 0 HD11 LEU A 46 6.408 -6.519 5.873 1.00 0.59 H new ATOM 0 HD12 LEU A 46 7.174 -6.532 7.480 1.00 0.59 H new ATOM 0 HD13 LEU A 46 7.901 -5.593 6.155 1.00 0.59 H new ATOM 0 HD21 LEU A 46 7.414 -7.746 3.982 1.00 0.67 H new ATOM 0 HD22 LEU A 46 8.958 -6.879 4.162 1.00 0.67 H new ATOM 0 HD23 LEU A 46 8.927 -8.658 4.192 1.00 0.67 H new ATOM 735 N PRO A 47 10.685 -11.344 7.528 1.00 0.42 N ATOM 736 CA PRO A 47 11.053 -12.595 6.821 1.00 0.45 C ATOM 737 C PRO A 47 9.879 -13.575 6.556 1.00 0.47 C ATOM 738 O PRO A 47 9.870 -14.247 5.522 1.00 0.52 O ATOM 739 CB PRO A 47 12.075 -13.217 7.781 1.00 0.49 C ATOM 740 CG PRO A 47 11.596 -12.829 9.137 1.00 0.49 C ATOM 741 CD PRO A 47 10.954 -11.470 8.990 1.00 0.46 C ATOM 0 HA PRO A 47 11.418 -12.386 5.815 1.00 0.45 H new ATOM 0 HB2 PRO A 47 12.116 -14.300 7.669 1.00 0.49 H new ATOM 0 HB3 PRO A 47 13.079 -12.839 7.591 1.00 0.49 H new ATOM 0 HG2 PRO A 47 10.881 -13.557 9.519 1.00 0.49 H new ATOM 0 HG3 PRO A 47 12.423 -12.793 9.846 1.00 0.49 H new ATOM 0 HD2 PRO A 47 10.034 -11.400 9.571 1.00 0.46 H new ATOM 0 HD3 PRO A 47 11.615 -10.678 9.342 1.00 0.46 H new ATOM 749 N HIS A 48 8.901 -13.654 7.488 1.00 0.47 N ATOM 750 CA HIS A 48 7.745 -14.578 7.360 1.00 0.52 C ATOM 751 C HIS A 48 6.765 -14.161 6.246 1.00 0.50 C ATOM 752 O HIS A 48 6.184 -15.023 5.578 1.00 0.57 O ATOM 753 CB HIS A 48 6.987 -14.684 8.699 1.00 0.57 C ATOM 754 CG HIS A 48 7.806 -15.271 9.815 1.00 0.65 C ATOM 755 ND1 HIS A 48 8.574 -14.506 10.669 1.00 0.69 N ATOM 756 CD2 HIS A 48 7.980 -16.557 10.204 1.00 0.79 C ATOM 757 CE1 HIS A 48 9.184 -15.295 11.534 1.00 0.80 C ATOM 758 NE2 HIS A 48 8.842 -16.543 11.274 1.00 0.85 N ATOM 0 H HIS A 48 8.888 -13.090 8.338 1.00 0.47 H new ATOM 0 HA HIS A 48 8.157 -15.550 7.087 1.00 0.52 H new ATOM 0 HB2 HIS A 48 6.648 -13.691 8.993 1.00 0.57 H new ATOM 0 HB3 HIS A 48 6.096 -15.295 8.554 1.00 0.57 H new ATOM 0 HD2 HIS A 48 7.526 -17.429 9.757 1.00 0.79 H new ATOM 0 HE1 HIS A 48 9.850 -14.974 12.321 1.00 0.80 H new ATOM 0 HE2 HIS A 48 9.165 -17.364 11.785 1.00 0.85 H new ATOM 767 N LEU A 49 6.584 -12.840 6.053 1.00 0.46 N ATOM 768 CA LEU A 49 5.665 -12.305 5.029 1.00 0.46 C ATOM 769 C LEU A 49 6.152 -12.637 3.601 1.00 0.45 C ATOM 770 O LEU A 49 5.527 -13.451 2.916 1.00 0.53 O ATOM 771 CB LEU A 49 5.466 -10.780 5.242 1.00 0.47 C ATOM 772 CG LEU A 49 4.814 -9.966 4.097 1.00 0.50 C ATOM 773 CD1 LEU A 49 3.487 -10.574 3.646 1.00 0.87 C ATOM 774 CD2 LEU A 49 4.613 -8.518 4.536 1.00 0.53 C ATOM 0 H LEU A 49 7.064 -12.121 6.595 1.00 0.46 H new ATOM 0 HA LEU A 49 4.695 -12.790 5.141 1.00 0.46 H new ATOM 0 HB2 LEU A 49 4.858 -10.644 6.137 1.00 0.47 H new ATOM 0 HB3 LEU A 49 6.442 -10.341 5.450 1.00 0.47 H new ATOM 0 HG LEU A 49 5.490 -9.995 3.243 1.00 0.50 H new ATOM 0 HD11 LEU A 49 3.065 -9.971 2.842 1.00 0.87 H new ATOM 0 HD12 LEU A 49 3.655 -11.590 3.288 1.00 0.87 H new ATOM 0 HD13 LEU A 49 2.793 -10.596 4.486 1.00 0.87 H new ATOM 0 HD21 LEU A 49 4.154 -7.952 3.725 1.00 0.53 H new ATOM 0 HD22 LEU A 49 3.964 -8.490 5.411 1.00 0.53 H new ATOM 0 HD23 LEU A 49 5.578 -8.076 4.786 1.00 0.53 H new ATOM 786 N LEU A 50 7.264 -12.017 3.161 1.00 0.43 N ATOM 787 CA LEU A 50 7.812 -12.272 1.818 1.00 0.45 C ATOM 788 C LEU A 50 8.701 -13.531 1.849 1.00 0.48 C ATOM 789 O LEU A 50 9.852 -13.472 2.295 1.00 0.54 O ATOM 790 CB LEU A 50 8.601 -11.040 1.307 1.00 0.48 C ATOM 791 CG LEU A 50 7.757 -9.780 0.970 1.00 0.57 C ATOM 792 CD1 LEU A 50 8.666 -8.582 0.690 1.00 0.66 C ATOM 793 CD2 LEU A 50 6.828 -10.030 -0.226 1.00 0.73 C ATOM 0 H LEU A 50 7.795 -11.342 3.711 1.00 0.43 H new ATOM 0 HA LEU A 50 6.990 -12.446 1.124 1.00 0.45 H new ATOM 0 HB2 LEU A 50 9.338 -10.767 2.062 1.00 0.48 H new ATOM 0 HB3 LEU A 50 9.153 -11.332 0.414 1.00 0.48 H new ATOM 0 HG LEU A 50 7.137 -9.558 1.838 1.00 0.57 H new ATOM 0 HD11 LEU A 50 8.056 -7.709 0.456 1.00 0.66 H new ATOM 0 HD12 LEU A 50 9.275 -8.374 1.570 1.00 0.66 H new ATOM 0 HD13 LEU A 50 9.316 -8.808 -0.156 1.00 0.66 H new ATOM 0 HD21 LEU A 50 6.252 -9.128 -0.434 1.00 0.73 H new ATOM 0 HD22 LEU A 50 7.423 -10.291 -1.101 1.00 0.73 H new ATOM 0 HD23 LEU A 50 6.147 -10.849 0.007 1.00 0.73 H new ATOM 805 N LYS A 51 8.138 -14.679 1.384 1.00 0.55 N ATOM 806 CA LYS A 51 8.854 -15.981 1.375 1.00 0.66 C ATOM 807 C LYS A 51 10.245 -15.921 0.701 1.00 0.63 C ATOM 808 O LYS A 51 11.184 -16.560 1.183 1.00 0.76 O ATOM 809 CB LYS A 51 7.988 -17.123 0.755 1.00 0.78 C ATOM 810 CG LYS A 51 7.735 -17.065 -0.769 1.00 0.78 C ATOM 811 CD LYS A 51 6.488 -16.256 -1.148 1.00 1.18 C ATOM 812 CE LYS A 51 6.283 -16.167 -2.667 1.00 1.16 C ATOM 813 NZ LYS A 51 6.010 -17.491 -3.302 1.00 1.32 N ATOM 0 H LYS A 51 7.190 -14.727 1.011 1.00 0.55 H new ATOM 0 HA LYS A 51 9.028 -16.214 2.425 1.00 0.66 H new ATOM 0 HB2 LYS A 51 8.469 -18.074 0.982 1.00 0.78 H new ATOM 0 HB3 LYS A 51 7.021 -17.126 1.259 1.00 0.78 H new ATOM 0 HG2 LYS A 51 8.605 -16.628 -1.258 1.00 0.78 H new ATOM 0 HG3 LYS A 51 7.631 -18.080 -1.152 1.00 0.78 H new ATOM 0 HD2 LYS A 51 5.610 -16.714 -0.693 1.00 1.18 H new ATOM 0 HD3 LYS A 51 6.573 -15.250 -0.737 1.00 1.18 H new ATOM 0 HE2 LYS A 51 5.453 -15.493 -2.876 1.00 1.16 H new ATOM 0 HE3 LYS A 51 7.171 -15.729 -3.122 1.00 1.16 H new ATOM 0 HZ1 LYS A 51 5.864 -17.363 -4.324 1.00 1.32 H new ATOM 0 HZ2 LYS A 51 6.819 -18.125 -3.145 1.00 1.32 H new ATOM 0 HZ3 LYS A 51 5.156 -17.909 -2.880 1.00 1.32 H new ATOM 827 N ASP A 52 10.374 -15.150 -0.398 1.00 0.64 N ATOM 828 CA ASP A 52 11.655 -15.017 -1.115 1.00 0.71 C ATOM 829 C ASP A 52 12.514 -13.902 -0.486 1.00 0.59 C ATOM 830 O ASP A 52 12.651 -12.810 -1.054 1.00 0.73 O ATOM 831 CB ASP A 52 11.419 -14.745 -2.618 1.00 0.99 C ATOM 832 CG ASP A 52 10.876 -15.952 -3.369 1.00 1.46 C ATOM 833 OD1 ASP A 52 11.667 -16.869 -3.672 1.00 2.08 O ATOM 834 OD2 ASP A 52 9.661 -15.975 -3.656 1.00 2.02 O ATOM 0 H ASP A 52 9.609 -14.613 -0.806 1.00 0.64 H new ATOM 0 HA ASP A 52 12.196 -15.959 -1.024 1.00 0.71 H new ATOM 0 HB2 ASP A 52 10.721 -13.915 -2.725 1.00 0.99 H new ATOM 0 HB3 ASP A 52 12.358 -14.433 -3.076 1.00 0.99 H new ATOM 839 N VAL A 53 13.084 -14.182 0.704 1.00 0.51 N ATOM 840 CA VAL A 53 13.948 -13.211 1.412 1.00 0.52 C ATOM 841 C VAL A 53 15.304 -13.043 0.692 1.00 0.56 C ATOM 842 O VAL A 53 15.869 -11.946 0.683 1.00 0.71 O ATOM 843 CB VAL A 53 14.185 -13.577 2.922 1.00 0.59 C ATOM 844 CG1 VAL A 53 12.886 -13.455 3.725 1.00 0.65 C ATOM 845 CG2 VAL A 53 14.803 -14.974 3.102 1.00 0.64 C ATOM 0 H VAL A 53 12.963 -15.068 1.194 1.00 0.51 H new ATOM 0 HA VAL A 53 13.408 -12.264 1.392 1.00 0.52 H new ATOM 0 HB VAL A 53 14.906 -12.857 3.308 1.00 0.59 H new ATOM 0 HG11 VAL A 53 13.077 -13.714 4.767 1.00 0.65 H new ATOM 0 HG12 VAL A 53 12.517 -12.431 3.667 1.00 0.65 H new ATOM 0 HG13 VAL A 53 12.139 -14.134 3.314 1.00 0.65 H new ATOM 0 HG21 VAL A 53 14.945 -15.175 4.164 1.00 0.64 H new ATOM 0 HG22 VAL A 53 14.136 -15.724 2.677 1.00 0.64 H new ATOM 0 HG23 VAL A 53 15.766 -15.014 2.593 1.00 0.64 H new ATOM 855 N GLY A 54 15.807 -14.145 0.085 1.00 0.53 N ATOM 856 CA GLY A 54 17.074 -14.121 -0.650 1.00 0.64 C ATOM 857 C GLY A 54 16.896 -13.728 -2.113 1.00 0.61 C ATOM 858 O GLY A 54 17.720 -12.981 -2.654 1.00 0.83 O ATOM 0 H GLY A 54 15.348 -15.056 0.096 1.00 0.53 H new ATOM 0 HA2 GLY A 54 17.755 -13.419 -0.169 1.00 0.64 H new ATOM 0 HA3 GLY A 54 17.540 -15.105 -0.596 1.00 0.64 H new ATOM 862 N SER A 55 15.829 -14.247 -2.764 1.00 0.57 N ATOM 863 CA SER A 55 15.530 -13.927 -4.170 1.00 0.58 C ATOM 864 C SER A 55 14.645 -12.668 -4.241 1.00 0.51 C ATOM 865 O SER A 55 13.448 -12.739 -4.555 1.00 0.62 O ATOM 866 CB SER A 55 14.859 -15.122 -4.879 1.00 0.74 C ATOM 867 OG SER A 55 14.652 -14.848 -6.256 1.00 0.85 O ATOM 0 H SER A 55 15.164 -14.889 -2.333 1.00 0.57 H new ATOM 0 HA SER A 55 16.466 -13.724 -4.691 1.00 0.58 H new ATOM 0 HB2 SER A 55 15.482 -16.010 -4.771 1.00 0.74 H new ATOM 0 HB3 SER A 55 13.904 -15.343 -4.401 1.00 0.74 H new ATOM 0 HG SER A 55 14.227 -15.621 -6.683 1.00 0.85 H new ATOM 873 N LEU A 56 15.258 -11.513 -3.924 1.00 0.49 N ATOM 874 CA LEU A 56 14.574 -10.209 -3.932 1.00 0.53 C ATOM 875 C LEU A 56 14.982 -9.375 -5.176 1.00 0.58 C ATOM 876 O LEU A 56 14.514 -8.250 -5.345 1.00 1.03 O ATOM 877 CB LEU A 56 14.892 -9.452 -2.604 1.00 0.67 C ATOM 878 CG LEU A 56 13.759 -8.607 -1.957 1.00 0.83 C ATOM 879 CD1 LEU A 56 13.382 -7.402 -2.820 1.00 1.22 C ATOM 880 CD2 LEU A 56 12.520 -9.459 -1.639 1.00 1.21 C ATOM 0 H LEU A 56 16.241 -11.458 -3.655 1.00 0.49 H new ATOM 0 HA LEU A 56 13.497 -10.367 -3.995 1.00 0.53 H new ATOM 0 HB2 LEU A 56 15.220 -10.188 -1.870 1.00 0.67 H new ATOM 0 HB3 LEU A 56 15.737 -8.790 -2.791 1.00 0.67 H new ATOM 0 HG LEU A 56 14.154 -8.229 -1.014 1.00 0.83 H new ATOM 0 HD11 LEU A 56 12.587 -6.839 -2.331 1.00 1.22 H new ATOM 0 HD12 LEU A 56 14.254 -6.761 -2.950 1.00 1.22 H new ATOM 0 HD13 LEU A 56 13.036 -7.746 -3.795 1.00 1.22 H new ATOM 0 HD21 LEU A 56 11.752 -8.830 -1.188 1.00 1.21 H new ATOM 0 HD22 LEU A 56 12.135 -9.899 -2.559 1.00 1.21 H new ATOM 0 HD23 LEU A 56 12.793 -10.253 -0.944 1.00 1.21 H new ATOM 892 N ASP A 57 15.827 -9.950 -6.070 1.00 0.49 N ATOM 893 CA ASP A 57 16.286 -9.253 -7.295 1.00 0.53 C ATOM 894 C ASP A 57 15.122 -8.935 -8.263 1.00 0.47 C ATOM 895 O ASP A 57 15.186 -7.941 -8.994 1.00 0.50 O ATOM 896 CB ASP A 57 17.381 -10.069 -8.021 1.00 0.67 C ATOM 897 CG ASP A 57 16.915 -11.438 -8.504 1.00 0.70 C ATOM 898 OD1 ASP A 57 16.974 -12.400 -7.707 1.00 0.77 O ATOM 899 OD2 ASP A 57 16.487 -11.544 -9.673 1.00 0.77 O ATOM 0 H ASP A 57 16.202 -10.892 -5.964 1.00 0.49 H new ATOM 0 HA ASP A 57 16.711 -8.302 -6.973 1.00 0.53 H new ATOM 0 HB2 ASP A 57 17.740 -9.496 -8.876 1.00 0.67 H new ATOM 0 HB3 ASP A 57 18.228 -10.201 -7.348 1.00 0.67 H new ATOM 904 N GLU A 58 14.067 -9.787 -8.264 1.00 0.46 N ATOM 905 CA GLU A 58 12.884 -9.588 -9.130 1.00 0.51 C ATOM 906 C GLU A 58 12.166 -8.265 -8.785 1.00 0.47 C ATOM 907 O GLU A 58 11.805 -7.505 -9.688 1.00 0.56 O ATOM 908 CB GLU A 58 11.910 -10.785 -9.008 1.00 0.60 C ATOM 909 CG GLU A 58 10.767 -10.781 -10.026 1.00 0.79 C ATOM 910 CD GLU A 58 9.814 -11.949 -9.846 1.00 0.92 C ATOM 911 OE1 GLU A 58 9.023 -11.927 -8.878 1.00 1.02 O ATOM 912 OE2 GLU A 58 9.856 -12.886 -10.670 1.00 1.09 O ATOM 0 H GLU A 58 14.014 -10.617 -7.674 1.00 0.46 H new ATOM 0 HA GLU A 58 13.227 -9.529 -10.163 1.00 0.51 H new ATOM 0 HB2 GLU A 58 12.476 -11.710 -9.120 1.00 0.60 H new ATOM 0 HB3 GLU A 58 11.485 -10.790 -8.004 1.00 0.60 H new ATOM 0 HG2 GLU A 58 10.211 -9.848 -9.937 1.00 0.79 H new ATOM 0 HG3 GLU A 58 11.183 -10.810 -11.033 1.00 0.79 H new ATOM 919 N LYS A 59 11.974 -7.997 -7.476 1.00 0.42 N ATOM 920 CA LYS A 59 11.319 -6.762 -7.012 1.00 0.47 C ATOM 921 C LYS A 59 12.329 -5.597 -6.912 1.00 0.53 C ATOM 922 O LYS A 59 11.963 -4.453 -7.167 1.00 0.91 O ATOM 923 CB LYS A 59 10.618 -6.979 -5.650 1.00 0.52 C ATOM 924 CG LYS A 59 9.212 -7.603 -5.732 1.00 0.60 C ATOM 925 CD LYS A 59 9.214 -9.095 -6.110 1.00 0.81 C ATOM 926 CE LYS A 59 9.669 -9.988 -4.956 1.00 1.17 C ATOM 927 NZ LYS A 59 9.626 -11.438 -5.305 1.00 1.55 N ATOM 0 H LYS A 59 12.265 -8.622 -6.724 1.00 0.42 H new ATOM 0 HA LYS A 59 10.562 -6.498 -7.751 1.00 0.47 H new ATOM 0 HB2 LYS A 59 11.248 -7.620 -5.033 1.00 0.52 H new ATOM 0 HB3 LYS A 59 10.543 -6.019 -5.140 1.00 0.52 H new ATOM 0 HG2 LYS A 59 8.715 -7.483 -4.769 1.00 0.60 H new ATOM 0 HG3 LYS A 59 8.623 -7.053 -6.466 1.00 0.60 H new ATOM 0 HD2 LYS A 59 8.212 -9.390 -6.420 1.00 0.81 H new ATOM 0 HD3 LYS A 59 9.871 -9.249 -6.966 1.00 0.81 H new ATOM 0 HE2 LYS A 59 10.685 -9.716 -4.669 1.00 1.17 H new ATOM 0 HE3 LYS A 59 9.034 -9.807 -4.089 1.00 1.17 H new ATOM 0 HZ1 LYS A 59 9.944 -12.001 -4.490 1.00 1.55 H new ATOM 0 HZ2 LYS A 59 8.652 -11.707 -5.553 1.00 1.55 H new ATOM 0 HZ3 LYS A 59 10.252 -11.619 -6.116 1.00 1.55 H new ATOM 941 N MET A 60 13.605 -5.898 -6.559 1.00 0.39 N ATOM 942 CA MET A 60 14.669 -4.867 -6.430 1.00 0.41 C ATOM 943 C MET A 60 14.817 -4.024 -7.717 1.00 0.42 C ATOM 944 O MET A 60 15.072 -2.820 -7.638 1.00 0.46 O ATOM 945 CB MET A 60 16.022 -5.513 -6.053 1.00 0.45 C ATOM 946 CG MET A 60 17.093 -4.514 -5.601 1.00 0.53 C ATOM 947 SD MET A 60 18.528 -5.294 -4.824 1.00 0.66 S ATOM 948 CE MET A 60 19.280 -6.142 -6.213 1.00 0.84 C ATOM 0 H MET A 60 13.923 -6.846 -6.358 1.00 0.39 H new ATOM 0 HA MET A 60 14.365 -4.195 -5.627 1.00 0.41 H new ATOM 0 HB2 MET A 60 15.856 -6.236 -5.255 1.00 0.45 H new ATOM 0 HB3 MET A 60 16.399 -6.068 -6.912 1.00 0.45 H new ATOM 0 HG2 MET A 60 17.426 -3.936 -6.463 1.00 0.53 H new ATOM 0 HG3 MET A 60 16.648 -3.810 -4.898 1.00 0.53 H new ATOM 0 HE1 MET A 60 20.176 -6.665 -5.878 1.00 0.84 H new ATOM 0 HE2 MET A 60 18.573 -6.861 -6.627 1.00 0.84 H new ATOM 0 HE3 MET A 60 19.550 -5.416 -6.980 1.00 0.84 H new ATOM 958 N LYS A 61 14.659 -4.668 -8.892 1.00 0.44 N ATOM 959 CA LYS A 61 14.754 -3.973 -10.191 1.00 0.49 C ATOM 960 C LYS A 61 13.456 -3.199 -10.500 1.00 0.46 C ATOM 961 O LYS A 61 13.515 -2.072 -11.002 1.00 0.49 O ATOM 962 CB LYS A 61 15.064 -4.976 -11.325 1.00 0.59 C ATOM 963 CG LYS A 61 16.468 -5.590 -11.259 1.00 0.70 C ATOM 964 CD LYS A 61 17.578 -4.606 -11.663 1.00 1.11 C ATOM 965 CE LYS A 61 17.646 -4.372 -13.178 1.00 1.90 C ATOM 966 NZ LYS A 61 18.193 -5.554 -13.913 1.00 2.56 N ATOM 0 H LYS A 61 14.465 -5.667 -8.967 1.00 0.44 H new ATOM 0 HA LYS A 61 15.572 -3.256 -10.128 1.00 0.49 H new ATOM 0 HB2 LYS A 61 14.327 -5.779 -11.295 1.00 0.59 H new ATOM 0 HB3 LYS A 61 14.946 -4.471 -12.283 1.00 0.59 H new ATOM 0 HG2 LYS A 61 16.656 -5.943 -10.245 1.00 0.70 H new ATOM 0 HG3 LYS A 61 16.508 -6.461 -11.913 1.00 0.70 H new ATOM 0 HD2 LYS A 61 17.412 -3.653 -11.160 1.00 1.11 H new ATOM 0 HD3 LYS A 61 18.538 -4.987 -11.316 1.00 1.11 H new ATOM 0 HE2 LYS A 61 16.648 -4.144 -13.553 1.00 1.90 H new ATOM 0 HE3 LYS A 61 18.269 -3.501 -13.381 1.00 1.90 H new ATOM 0 HZ1 LYS A 61 18.315 -5.312 -14.917 1.00 2.56 H new ATOM 0 HZ2 LYS A 61 19.113 -5.820 -13.507 1.00 2.56 H new ATOM 0 HZ3 LYS A 61 17.532 -6.353 -13.827 1.00 2.56 H new ATOM 980 N SER A 62 12.290 -3.811 -10.189 1.00 0.44 N ATOM 981 CA SER A 62 10.968 -3.184 -10.421 1.00 0.46 C ATOM 982 C SER A 62 10.755 -1.947 -9.523 1.00 0.43 C ATOM 983 O SER A 62 10.072 -1.000 -9.926 1.00 0.47 O ATOM 984 CB SER A 62 9.837 -4.202 -10.181 1.00 0.53 C ATOM 985 OG SER A 62 10.046 -5.386 -10.937 1.00 0.61 O ATOM 0 H SER A 62 12.238 -4.742 -9.775 1.00 0.44 H new ATOM 0 HA SER A 62 10.945 -2.856 -11.460 1.00 0.46 H new ATOM 0 HB2 SER A 62 9.784 -4.448 -9.121 1.00 0.53 H new ATOM 0 HB3 SER A 62 8.880 -3.757 -10.453 1.00 0.53 H new ATOM 0 HG SER A 62 10.629 -5.995 -10.437 1.00 0.61 H new ATOM 991 N LEU A 63 11.346 -1.969 -8.304 1.00 0.40 N ATOM 992 CA LEU A 63 11.244 -0.856 -7.338 1.00 0.43 C ATOM 993 C LEU A 63 11.941 0.406 -7.864 1.00 0.45 C ATOM 994 O LEU A 63 11.290 1.439 -8.036 1.00 0.53 O ATOM 995 CB LEU A 63 11.835 -1.266 -5.967 1.00 0.45 C ATOM 996 CG LEU A 63 11.025 -2.331 -5.193 1.00 0.42 C ATOM 997 CD1 LEU A 63 11.904 -3.106 -4.213 1.00 0.48 C ATOM 998 CD2 LEU A 63 9.846 -1.705 -4.456 1.00 0.68 C ATOM 0 H LEU A 63 11.903 -2.755 -7.967 1.00 0.40 H new ATOM 0 HA LEU A 63 10.186 -0.627 -7.208 1.00 0.43 H new ATOM 0 HB2 LEU A 63 12.845 -1.644 -6.123 1.00 0.45 H new ATOM 0 HB3 LEU A 63 11.921 -0.375 -5.345 1.00 0.45 H new ATOM 0 HG LEU A 63 10.639 -3.033 -5.932 1.00 0.42 H new ATOM 0 HD11 LEU A 63 11.299 -3.845 -3.688 1.00 0.48 H new ATOM 0 HD12 LEU A 63 12.700 -3.611 -4.760 1.00 0.48 H new ATOM 0 HD13 LEU A 63 12.341 -2.416 -3.491 1.00 0.48 H new ATOM 0 HD21 LEU A 63 9.297 -2.481 -3.922 1.00 0.68 H new ATOM 0 HD22 LEU A 63 10.213 -0.965 -3.745 1.00 0.68 H new ATOM 0 HD23 LEU A 63 9.184 -1.221 -5.174 1.00 0.68 H new ATOM 1010 N ASP A 64 13.263 0.316 -8.133 1.00 0.45 N ATOM 1011 CA ASP A 64 14.035 1.462 -8.646 1.00 0.51 C ATOM 1012 C ASP A 64 13.884 1.553 -10.180 1.00 0.50 C ATOM 1013 O ASP A 64 14.749 1.095 -10.938 1.00 0.54 O ATOM 1014 CB ASP A 64 15.529 1.376 -8.216 1.00 0.60 C ATOM 1015 CG ASP A 64 15.933 2.477 -7.244 1.00 0.83 C ATOM 1016 OD1 ASP A 64 15.846 3.668 -7.618 1.00 1.28 O ATOM 1017 OD2 ASP A 64 16.338 2.149 -6.111 1.00 1.39 O ATOM 0 H ASP A 64 13.811 -0.534 -8.003 1.00 0.45 H new ATOM 0 HA ASP A 64 13.635 2.377 -8.209 1.00 0.51 H new ATOM 0 HB2 ASP A 64 15.713 0.406 -7.754 1.00 0.60 H new ATOM 0 HB3 ASP A 64 16.160 1.432 -9.103 1.00 0.60 H new ATOM 1022 N VAL A 65 12.748 2.132 -10.622 1.00 0.51 N ATOM 1023 CA VAL A 65 12.445 2.301 -12.056 1.00 0.55 C ATOM 1024 C VAL A 65 13.241 3.477 -12.682 1.00 0.55 C ATOM 1025 O VAL A 65 13.542 3.447 -13.878 1.00 0.60 O ATOM 1026 CB VAL A 65 10.897 2.458 -12.298 1.00 0.64 C ATOM 1027 CG1 VAL A 65 10.336 3.777 -11.749 1.00 0.67 C ATOM 1028 CG2 VAL A 65 10.535 2.282 -13.776 1.00 0.73 C ATOM 0 H VAL A 65 12.023 2.492 -10.001 1.00 0.51 H new ATOM 0 HA VAL A 65 12.769 1.392 -12.563 1.00 0.55 H new ATOM 0 HB VAL A 65 10.422 1.655 -11.733 1.00 0.64 H new ATOM 0 HG11 VAL A 65 9.265 3.827 -11.946 1.00 0.67 H new ATOM 0 HG12 VAL A 65 10.510 3.827 -10.674 1.00 0.67 H new ATOM 0 HG13 VAL A 65 10.834 4.615 -12.236 1.00 0.67 H new ATOM 0 HG21 VAL A 65 9.459 2.397 -13.903 1.00 0.73 H new ATOM 0 HG22 VAL A 65 11.053 3.035 -14.370 1.00 0.73 H new ATOM 0 HG23 VAL A 65 10.835 1.288 -14.108 1.00 0.73 H new ATOM 1038 N ASN A 66 13.579 4.498 -11.861 1.00 0.56 N ATOM 1039 CA ASN A 66 14.353 5.675 -12.326 1.00 0.60 C ATOM 1040 C ASN A 66 15.875 5.421 -12.244 1.00 0.59 C ATOM 1041 O ASN A 66 16.639 6.027 -13.002 1.00 0.66 O ATOM 1042 CB ASN A 66 13.994 6.930 -11.500 1.00 0.67 C ATOM 1043 CG ASN A 66 12.553 7.394 -11.699 1.00 0.94 C ATOM 1044 OD1 ASN A 66 12.278 8.238 -12.551 1.00 1.29 O ATOM 1045 ND2 ASN A 66 11.623 6.852 -10.909 1.00 1.44 N ATOM 0 H ASN A 66 13.328 4.531 -10.873 1.00 0.56 H new ATOM 0 HA ASN A 66 14.086 5.843 -13.369 1.00 0.60 H new ATOM 0 HB2 ASN A 66 14.158 6.720 -10.443 1.00 0.67 H new ATOM 0 HB3 ASN A 66 14.670 7.741 -11.772 1.00 0.67 H new ATOM 0 HD21 ASN A 66 10.647 7.135 -11.001 1.00 1.44 H new ATOM 0 HD22 ASN A 66 11.888 6.155 -10.213 1.00 1.44 H new ATOM 1052 N GLN A 67 16.309 4.529 -11.312 1.00 0.55 N ATOM 1053 CA GLN A 67 17.734 4.182 -11.108 1.00 0.60 C ATOM 1054 C GLN A 67 18.579 5.427 -10.753 1.00 0.63 C ATOM 1055 O GLN A 67 19.192 6.047 -11.630 1.00 0.78 O ATOM 1056 CB GLN A 67 18.322 3.442 -12.338 1.00 0.70 C ATOM 1057 CG GLN A 67 17.947 1.957 -12.418 1.00 0.88 C ATOM 1058 CD GLN A 67 18.451 1.270 -13.689 1.00 1.20 C ATOM 1059 OE1 GLN A 67 19.470 1.662 -14.266 1.00 1.96 O ATOM 1060 NE2 GLN A 67 17.745 0.226 -14.132 1.00 1.86 N ATOM 0 H GLN A 67 15.677 4.033 -10.684 1.00 0.55 H new ATOM 0 HA GLN A 67 17.778 3.500 -10.259 1.00 0.60 H new ATOM 0 HB2 GLN A 67 17.980 3.941 -13.245 1.00 0.70 H new ATOM 0 HB3 GLN A 67 19.408 3.530 -12.316 1.00 0.70 H new ATOM 0 HG2 GLN A 67 18.354 1.440 -11.549 1.00 0.88 H new ATOM 0 HG3 GLN A 67 16.862 1.861 -12.368 1.00 0.88 H new ATOM 0 HE21 GLN A 67 16.908 -0.072 -13.632 1.00 1.86 H new ATOM 0 HE22 GLN A 67 18.043 -0.273 -14.970 1.00 1.86 H new ATOM 1069 N ASP A 68 18.586 5.786 -9.454 1.00 0.62 N ATOM 1070 CA ASP A 68 19.343 6.945 -8.950 1.00 0.71 C ATOM 1071 C ASP A 68 20.422 6.471 -7.955 1.00 0.77 C ATOM 1072 O ASP A 68 21.613 6.503 -8.274 1.00 1.32 O ATOM 1073 CB ASP A 68 18.378 7.970 -8.297 1.00 0.78 C ATOM 1074 CG ASP A 68 19.008 9.337 -8.065 1.00 1.08 C ATOM 1075 OD1 ASP A 68 19.904 9.442 -7.202 1.00 1.37 O ATOM 1076 OD2 ASP A 68 18.596 10.303 -8.742 1.00 1.41 O ATOM 0 H ASP A 68 18.071 5.284 -8.731 1.00 0.62 H new ATOM 0 HA ASP A 68 19.844 7.443 -9.781 1.00 0.71 H new ATOM 0 HB2 ASP A 68 17.500 8.087 -8.933 1.00 0.78 H new ATOM 0 HB3 ASP A 68 18.030 7.573 -7.343 1.00 0.78 H new ATOM 1081 N SER A 69 19.990 6.016 -6.757 1.00 0.62 N ATOM 1082 CA SER A 69 20.900 5.529 -5.701 1.00 0.67 C ATOM 1083 C SER A 69 20.113 4.735 -4.642 1.00 0.68 C ATOM 1084 O SER A 69 20.429 3.574 -4.367 1.00 1.24 O ATOM 1085 CB SER A 69 21.652 6.704 -5.030 1.00 0.82 C ATOM 1086 OG SER A 69 22.549 7.339 -5.929 1.00 1.31 O ATOM 0 H SER A 69 19.004 5.977 -6.498 1.00 0.62 H new ATOM 0 HA SER A 69 21.635 4.872 -6.166 1.00 0.67 H new ATOM 0 HB2 SER A 69 20.931 7.433 -4.661 1.00 0.82 H new ATOM 0 HB3 SER A 69 22.204 6.336 -4.165 1.00 0.82 H new ATOM 0 HG SER A 69 22.551 6.858 -6.783 1.00 1.31 H new ATOM 1092 N GLU A 70 19.078 5.380 -4.062 1.00 0.66 N ATOM 1093 CA GLU A 70 18.223 4.769 -3.032 1.00 0.77 C ATOM 1094 C GLU A 70 16.788 4.570 -3.560 1.00 0.64 C ATOM 1095 O GLU A 70 16.470 4.996 -4.675 1.00 0.75 O ATOM 1096 CB GLU A 70 18.219 5.657 -1.771 1.00 1.13 C ATOM 1097 CG GLU A 70 19.548 5.682 -1.018 1.00 1.41 C ATOM 1098 CD GLU A 70 19.584 6.733 0.074 1.00 1.90 C ATOM 1099 OE1 GLU A 70 18.912 6.539 1.109 1.00 2.42 O ATOM 1100 OE2 GLU A 70 20.277 7.754 -0.109 1.00 2.41 O ATOM 0 H GLU A 70 18.815 6.337 -4.297 1.00 0.66 H new ATOM 0 HA GLU A 70 18.624 3.788 -2.776 1.00 0.77 H new ATOM 0 HB2 GLU A 70 17.958 6.676 -2.058 1.00 1.13 H new ATOM 0 HB3 GLU A 70 17.438 5.306 -1.096 1.00 1.13 H new ATOM 0 HG2 GLU A 70 19.730 4.701 -0.578 1.00 1.41 H new ATOM 0 HG3 GLU A 70 20.357 5.870 -1.724 1.00 1.41 H new ATOM 1107 N LEU A 71 15.926 3.927 -2.744 1.00 0.57 N ATOM 1108 CA LEU A 71 14.527 3.646 -3.116 1.00 0.51 C ATOM 1109 C LEU A 71 13.557 4.665 -2.482 1.00 0.51 C ATOM 1110 O LEU A 71 13.210 4.543 -1.303 1.00 0.53 O ATOM 1111 CB LEU A 71 14.138 2.207 -2.683 1.00 0.53 C ATOM 1112 CG LEU A 71 14.722 1.053 -3.536 1.00 0.66 C ATOM 1113 CD1 LEU A 71 16.217 0.845 -3.275 1.00 0.95 C ATOM 1114 CD2 LEU A 71 13.954 -0.247 -3.285 1.00 0.74 C ATOM 0 H LEU A 71 16.180 3.591 -1.815 1.00 0.57 H new ATOM 0 HA LEU A 71 14.447 3.734 -4.200 1.00 0.51 H new ATOM 0 HB2 LEU A 71 14.454 2.063 -1.650 1.00 0.53 H new ATOM 0 HB3 LEU A 71 13.051 2.127 -2.697 1.00 0.53 H new ATOM 0 HG LEU A 71 14.607 1.337 -4.582 1.00 0.66 H new ATOM 0 HD11 LEU A 71 16.584 0.026 -3.894 1.00 0.95 H new ATOM 0 HD12 LEU A 71 16.760 1.758 -3.521 1.00 0.95 H new ATOM 0 HD13 LEU A 71 16.373 0.603 -2.224 1.00 0.95 H new ATOM 0 HD21 LEU A 71 14.380 -1.045 -3.894 1.00 0.74 H new ATOM 0 HD22 LEU A 71 14.028 -0.516 -2.231 1.00 0.74 H new ATOM 0 HD23 LEU A 71 12.906 -0.108 -3.551 1.00 0.74 H new ATOM 1126 N LYS A 72 13.127 5.679 -3.274 1.00 0.53 N ATOM 1127 CA LYS A 72 12.158 6.704 -2.803 1.00 0.56 C ATOM 1128 C LYS A 72 10.804 6.017 -2.553 1.00 0.50 C ATOM 1129 O LYS A 72 10.605 4.911 -3.043 1.00 0.48 O ATOM 1130 CB LYS A 72 12.019 7.837 -3.856 1.00 0.63 C ATOM 1131 CG LYS A 72 11.525 9.182 -3.303 1.00 0.86 C ATOM 1132 CD LYS A 72 11.498 10.275 -4.381 1.00 1.00 C ATOM 1133 CE LYS A 72 11.231 11.668 -3.800 1.00 1.43 C ATOM 1134 NZ LYS A 72 9.846 11.818 -3.263 1.00 1.89 N ATOM 0 H LYS A 72 13.434 5.810 -4.238 1.00 0.53 H new ATOM 0 HA LYS A 72 12.512 7.156 -1.876 1.00 0.56 H new ATOM 0 HB2 LYS A 72 12.988 7.991 -4.332 1.00 0.63 H new ATOM 0 HB3 LYS A 72 11.331 7.507 -4.634 1.00 0.63 H new ATOM 0 HG2 LYS A 72 10.525 9.058 -2.888 1.00 0.86 H new ATOM 0 HG3 LYS A 72 12.172 9.497 -2.484 1.00 0.86 H new ATOM 0 HD2 LYS A 72 12.451 10.282 -4.910 1.00 1.00 H new ATOM 0 HD3 LYS A 72 10.728 10.038 -5.115 1.00 1.00 H new ATOM 0 HE2 LYS A 72 11.948 11.867 -3.003 1.00 1.43 H new ATOM 0 HE3 LYS A 72 11.398 12.417 -4.574 1.00 1.43 H new ATOM 0 HZ1 LYS A 72 9.723 12.779 -2.884 1.00 1.89 H new ATOM 0 HZ2 LYS A 72 9.158 11.656 -4.026 1.00 1.89 H new ATOM 0 HZ3 LYS A 72 9.691 11.124 -2.504 1.00 1.89 H new ATOM 1148 N PHE A 73 9.873 6.638 -1.802 1.00 0.53 N ATOM 1149 CA PHE A 73 8.562 5.993 -1.546 1.00 0.50 C ATOM 1150 C PHE A 73 7.781 5.726 -2.855 1.00 0.47 C ATOM 1151 O PHE A 73 6.997 4.774 -2.918 1.00 0.47 O ATOM 1152 CB PHE A 73 7.697 6.789 -0.550 1.00 0.56 C ATOM 1153 CG PHE A 73 6.735 5.905 0.227 1.00 0.69 C ATOM 1154 CD1 PHE A 73 5.463 5.622 -0.266 1.00 0.89 C ATOM 1155 CD2 PHE A 73 7.119 5.328 1.433 1.00 0.87 C ATOM 1156 CE1 PHE A 73 4.604 4.791 0.426 1.00 1.12 C ATOM 1157 CE2 PHE A 73 6.256 4.501 2.131 1.00 1.11 C ATOM 1158 CZ PHE A 73 5.000 4.231 1.625 1.00 1.20 C ATOM 0 H PHE A 73 9.993 7.555 -1.373 1.00 0.53 H new ATOM 0 HA PHE A 73 8.787 5.031 -1.086 1.00 0.50 H new ATOM 0 HB2 PHE A 73 8.347 7.315 0.150 1.00 0.56 H new ATOM 0 HB3 PHE A 73 7.131 7.547 -1.091 1.00 0.56 H new ATOM 0 HD1 PHE A 73 5.145 6.058 -1.201 1.00 0.89 H new ATOM 0 HD2 PHE A 73 8.103 5.528 1.830 1.00 0.87 H new ATOM 0 HE1 PHE A 73 3.622 4.579 0.029 1.00 1.12 H new ATOM 0 HE2 PHE A 73 6.565 4.067 3.071 1.00 1.11 H new ATOM 0 HZ PHE A 73 4.327 3.582 2.166 1.00 1.20 H new ATOM 1168 N ASN A 74 8.001 6.564 -3.896 1.00 0.49 N ATOM 1169 CA ASN A 74 7.353 6.373 -5.209 1.00 0.51 C ATOM 1170 C ASN A 74 7.953 5.134 -5.925 1.00 0.49 C ATOM 1171 O ASN A 74 7.274 4.494 -6.733 1.00 0.53 O ATOM 1172 CB ASN A 74 7.500 7.636 -6.087 1.00 0.57 C ATOM 1173 CG ASN A 74 6.586 7.625 -7.310 1.00 0.65 C ATOM 1174 OD1 ASN A 74 7.037 7.375 -8.429 1.00 0.98 O ATOM 1175 ND2 ASN A 74 5.293 7.878 -7.102 1.00 0.91 N ATOM 0 H ASN A 74 8.619 7.374 -3.849 1.00 0.49 H new ATOM 0 HA ASN A 74 6.289 6.202 -5.047 1.00 0.51 H new ATOM 0 HB2 ASN A 74 7.280 8.518 -5.485 1.00 0.57 H new ATOM 0 HB3 ASN A 74 8.536 7.724 -6.416 1.00 0.57 H new ATOM 0 HD21 ASN A 74 4.639 7.869 -7.885 1.00 0.91 H new ATOM 0 HD22 ASN A 74 4.958 8.081 -6.160 1.00 0.91 H new ATOM 1182 N GLU A 75 9.234 4.818 -5.620 1.00 0.46 N ATOM 1183 CA GLU A 75 9.937 3.649 -6.182 1.00 0.47 C ATOM 1184 C GLU A 75 9.717 2.405 -5.293 1.00 0.43 C ATOM 1185 O GLU A 75 9.451 1.318 -5.804 1.00 0.44 O ATOM 1186 CB GLU A 75 11.450 3.949 -6.327 1.00 0.53 C ATOM 1187 CG GLU A 75 11.808 4.795 -7.555 1.00 0.61 C ATOM 1188 CD GLU A 75 11.558 6.282 -7.358 1.00 0.78 C ATOM 1189 OE1 GLU A 75 10.421 6.732 -7.609 1.00 1.03 O ATOM 1190 OE2 GLU A 75 12.503 6.996 -6.958 1.00 0.98 O ATOM 0 H GLU A 75 9.805 5.368 -4.978 1.00 0.46 H new ATOM 0 HA GLU A 75 9.527 3.442 -7.171 1.00 0.47 H new ATOM 0 HB2 GLU A 75 11.794 4.466 -5.431 1.00 0.53 H new ATOM 0 HB3 GLU A 75 11.993 3.005 -6.379 1.00 0.53 H new ATOM 0 HG2 GLU A 75 12.859 4.640 -7.800 1.00 0.61 H new ATOM 0 HG3 GLU A 75 11.227 4.446 -8.409 1.00 0.61 H new ATOM 1197 N TYR A 76 9.812 2.592 -3.954 1.00 0.42 N ATOM 1198 CA TYR A 76 9.613 1.514 -2.957 1.00 0.41 C ATOM 1199 C TYR A 76 8.138 1.031 -2.902 1.00 0.39 C ATOM 1200 O TYR A 76 7.860 -0.053 -2.379 1.00 0.52 O ATOM 1201 CB TYR A 76 10.061 2.001 -1.560 1.00 0.44 C ATOM 1202 CG TYR A 76 10.215 0.895 -0.517 1.00 0.45 C ATOM 1203 CD1 TYR A 76 11.355 0.095 -0.484 1.00 0.52 C ATOM 1204 CD2 TYR A 76 9.222 0.654 0.428 1.00 0.51 C ATOM 1205 CE1 TYR A 76 11.496 -0.909 0.457 1.00 0.59 C ATOM 1206 CE2 TYR A 76 9.359 -0.347 1.370 1.00 0.57 C ATOM 1207 CZ TYR A 76 10.496 -1.126 1.383 1.00 0.59 C ATOM 1208 OH TYR A 76 10.638 -2.126 2.326 1.00 0.69 O ATOM 0 H TYR A 76 10.029 3.496 -3.535 1.00 0.42 H new ATOM 0 HA TYR A 76 10.223 0.665 -3.266 1.00 0.41 H new ATOM 0 HB2 TYR A 76 11.013 2.522 -1.660 1.00 0.44 H new ATOM 0 HB3 TYR A 76 9.336 2.728 -1.194 1.00 0.44 H new ATOM 0 HD1 TYR A 76 12.142 0.261 -1.205 1.00 0.52 H new ATOM 0 HD2 TYR A 76 8.328 1.260 0.425 1.00 0.51 H new ATOM 0 HE1 TYR A 76 12.386 -1.521 0.467 1.00 0.59 H new ATOM 0 HE2 TYR A 76 8.577 -0.519 2.095 1.00 0.57 H new ATOM 0 HH TYR A 76 9.846 -2.146 2.903 1.00 0.69 H new ATOM 1218 N TRP A 77 7.207 1.850 -3.446 1.00 0.40 N ATOM 1219 CA TRP A 77 5.753 1.554 -3.483 1.00 0.42 C ATOM 1220 C TRP A 77 5.421 0.171 -4.120 1.00 0.37 C ATOM 1221 O TRP A 77 4.376 -0.406 -3.805 1.00 0.39 O ATOM 1222 CB TRP A 77 5.037 2.739 -4.196 1.00 0.58 C ATOM 1223 CG TRP A 77 3.726 2.452 -4.883 1.00 0.49 C ATOM 1224 CD1 TRP A 77 2.541 2.116 -4.296 1.00 0.53 C ATOM 1225 CD2 TRP A 77 3.474 2.510 -6.293 1.00 0.78 C ATOM 1226 NE1 TRP A 77 1.570 1.959 -5.252 1.00 0.77 N ATOM 1227 CE2 TRP A 77 2.118 2.194 -6.487 1.00 0.97 C ATOM 1228 CE3 TRP A 77 4.264 2.796 -7.410 1.00 1.04 C ATOM 1229 CZ2 TRP A 77 1.537 2.157 -7.749 1.00 1.40 C ATOM 1230 CZ3 TRP A 77 3.686 2.761 -8.664 1.00 1.45 C ATOM 1231 CH2 TRP A 77 2.333 2.443 -8.825 1.00 1.62 C ATOM 0 H TRP A 77 7.445 2.744 -3.876 1.00 0.40 H new ATOM 0 HA TRP A 77 5.381 1.466 -2.462 1.00 0.42 H new ATOM 0 HB2 TRP A 77 4.864 3.521 -3.456 1.00 0.58 H new ATOM 0 HB3 TRP A 77 5.723 3.148 -4.938 1.00 0.58 H new ATOM 0 HD1 TRP A 77 2.390 1.992 -3.234 1.00 0.53 H new ATOM 0 HE1 TRP A 77 0.598 1.708 -5.073 1.00 0.77 H new ATOM 0 HE3 TRP A 77 5.310 3.040 -7.294 1.00 1.04 H new ATOM 0 HZ2 TRP A 77 0.493 1.911 -7.876 1.00 1.40 H new ATOM 0 HZ3 TRP A 77 4.287 2.982 -9.533 1.00 1.45 H new ATOM 0 HH2 TRP A 77 1.908 2.423 -9.818 1.00 1.62 H new ATOM 1242 N ARG A 78 6.308 -0.360 -5.000 1.00 0.39 N ATOM 1243 CA ARG A 78 6.098 -1.686 -5.639 1.00 0.42 C ATOM 1244 C ARG A 78 6.165 -2.838 -4.604 1.00 0.40 C ATOM 1245 O ARG A 78 5.580 -3.900 -4.833 1.00 0.45 O ATOM 1246 CB ARG A 78 7.130 -1.937 -6.766 1.00 0.49 C ATOM 1247 CG ARG A 78 7.107 -0.908 -7.911 1.00 0.64 C ATOM 1248 CD ARG A 78 6.060 -1.225 -8.985 1.00 0.82 C ATOM 1249 NE ARG A 78 6.651 -1.866 -10.172 1.00 1.11 N ATOM 1250 CZ ARG A 78 6.970 -1.249 -11.337 1.00 1.57 C ATOM 1251 NH1 ARG A 78 6.804 0.073 -11.509 1.00 1.96 N ATOM 1252 NH2 ARG A 78 7.469 -1.971 -12.341 1.00 1.93 N ATOM 0 H ARG A 78 7.170 0.106 -5.282 1.00 0.39 H new ATOM 0 HA ARG A 78 5.098 -1.670 -6.073 1.00 0.42 H new ATOM 0 HB2 ARG A 78 8.128 -1.948 -6.328 1.00 0.49 H new ATOM 0 HB3 ARG A 78 6.954 -2.928 -7.185 1.00 0.49 H new ATOM 0 HG2 ARG A 78 6.907 0.081 -7.498 1.00 0.64 H new ATOM 0 HG3 ARG A 78 8.093 -0.867 -8.374 1.00 0.64 H new ATOM 0 HD2 ARG A 78 5.297 -1.880 -8.563 1.00 0.82 H new ATOM 0 HD3 ARG A 78 5.559 -0.304 -9.284 1.00 0.82 H new ATOM 0 HE ARG A 78 6.838 -2.867 -10.112 1.00 1.11 H new ATOM 0 HH11 ARG A 78 6.428 0.643 -10.751 1.00 1.96 H new ATOM 0 HH12 ARG A 78 7.054 0.507 -12.398 1.00 1.96 H new ATOM 0 HH21 ARG A 78 7.607 -2.975 -12.228 1.00 1.93 H new ATOM 0 HH22 ARG A 78 7.713 -1.519 -13.222 1.00 1.93 H new ATOM 1266 N LEU A 79 6.879 -2.621 -3.470 1.00 0.37 N ATOM 1267 CA LEU A 79 7.004 -3.629 -2.397 1.00 0.37 C ATOM 1268 C LEU A 79 5.923 -3.403 -1.323 1.00 0.36 C ATOM 1269 O LEU A 79 5.550 -4.343 -0.618 1.00 0.39 O ATOM 1270 CB LEU A 79 8.419 -3.603 -1.763 1.00 0.40 C ATOM 1271 CG LEU A 79 8.854 -4.880 -1.004 1.00 0.44 C ATOM 1272 CD1 LEU A 79 9.003 -6.071 -1.960 1.00 0.49 C ATOM 1273 CD2 LEU A 79 10.163 -4.638 -0.248 1.00 0.53 C ATOM 0 H LEU A 79 7.377 -1.752 -3.279 1.00 0.37 H new ATOM 0 HA LEU A 79 6.857 -4.614 -2.839 1.00 0.37 H new ATOM 0 HB2 LEU A 79 9.145 -3.411 -2.553 1.00 0.40 H new ATOM 0 HB3 LEU A 79 8.469 -2.761 -1.073 1.00 0.40 H new ATOM 0 HG LEU A 79 8.073 -5.121 -0.283 1.00 0.44 H new ATOM 0 HD11 LEU A 79 9.309 -6.953 -1.398 1.00 0.49 H new ATOM 0 HD12 LEU A 79 8.049 -6.266 -2.450 1.00 0.49 H new ATOM 0 HD13 LEU A 79 9.757 -5.841 -2.713 1.00 0.49 H new ATOM 0 HD21 LEU A 79 10.452 -5.547 0.279 1.00 0.53 H new ATOM 0 HD22 LEU A 79 10.946 -4.364 -0.955 1.00 0.53 H new ATOM 0 HD23 LEU A 79 10.024 -3.830 0.471 1.00 0.53 H new ATOM 1285 N ILE A 80 5.438 -2.138 -1.194 1.00 0.38 N ATOM 1286 CA ILE A 80 4.366 -1.785 -0.239 1.00 0.41 C ATOM 1287 C ILE A 80 3.059 -2.528 -0.613 1.00 0.40 C ATOM 1288 O ILE A 80 2.316 -2.959 0.275 1.00 0.43 O ATOM 1289 CB ILE A 80 4.120 -0.229 -0.189 1.00 0.49 C ATOM 1290 CG1 ILE A 80 5.401 0.537 0.251 1.00 0.53 C ATOM 1291 CG2 ILE A 80 2.930 0.142 0.711 1.00 0.59 C ATOM 1292 CD1 ILE A 80 5.908 0.219 1.654 1.00 0.61 C ATOM 0 H ILE A 80 5.777 -1.349 -1.743 1.00 0.38 H new ATOM 0 HA ILE A 80 4.685 -2.097 0.755 1.00 0.41 H new ATOM 0 HB ILE A 80 3.871 0.079 -1.204 1.00 0.49 H new ATOM 0 HG12 ILE A 80 6.196 0.319 -0.462 1.00 0.53 H new ATOM 0 HG13 ILE A 80 5.202 1.607 0.189 1.00 0.53 H new ATOM 0 HG21 ILE A 80 2.800 1.224 0.714 1.00 0.59 H new ATOM 0 HG22 ILE A 80 2.025 -0.332 0.331 1.00 0.59 H new ATOM 0 HG23 ILE A 80 3.121 -0.203 1.727 1.00 0.59 H new ATOM 0 HD11 ILE A 80 6.803 0.806 1.859 1.00 0.61 H new ATOM 0 HD12 ILE A 80 5.137 0.466 2.384 1.00 0.61 H new ATOM 0 HD13 ILE A 80 6.146 -0.842 1.723 1.00 0.61 H new ATOM 1304 N GLY A 81 2.790 -2.664 -1.936 1.00 0.40 N ATOM 1305 CA GLY A 81 1.612 -3.388 -2.413 1.00 0.44 C ATOM 1306 C GLY A 81 1.753 -4.892 -2.198 1.00 0.41 C ATOM 1307 O GLY A 81 0.794 -5.550 -1.788 1.00 0.47 O ATOM 0 H GLY A 81 3.376 -2.280 -2.677 1.00 0.40 H new ATOM 0 HA2 GLY A 81 0.726 -3.027 -1.891 1.00 0.44 H new ATOM 0 HA3 GLY A 81 1.463 -3.184 -3.473 1.00 0.44 H new ATOM 1311 N GLU A 82 2.968 -5.429 -2.473 1.00 0.38 N ATOM 1312 CA GLU A 82 3.271 -6.865 -2.270 1.00 0.38 C ATOM 1313 C GLU A 82 3.275 -7.214 -0.766 1.00 0.36 C ATOM 1314 O GLU A 82 3.101 -8.378 -0.399 1.00 0.42 O ATOM 1315 CB GLU A 82 4.636 -7.242 -2.899 1.00 0.43 C ATOM 1316 CG GLU A 82 4.658 -7.234 -4.431 1.00 0.51 C ATOM 1317 CD GLU A 82 4.087 -8.506 -5.046 1.00 0.62 C ATOM 1318 OE1 GLU A 82 4.844 -9.489 -5.191 1.00 0.83 O ATOM 1319 OE2 GLU A 82 2.882 -8.517 -5.376 1.00 0.86 O ATOM 0 H GLU A 82 3.753 -4.888 -2.836 1.00 0.38 H new ATOM 0 HA GLU A 82 2.489 -7.440 -2.766 1.00 0.38 H new ATOM 0 HB2 GLU A 82 5.393 -6.548 -2.535 1.00 0.43 H new ATOM 0 HB3 GLU A 82 4.920 -8.235 -2.550 1.00 0.43 H new ATOM 0 HG2 GLU A 82 4.089 -6.377 -4.792 1.00 0.51 H new ATOM 0 HG3 GLU A 82 5.685 -7.102 -4.773 1.00 0.51 H new ATOM 1326 N LEU A 83 3.490 -6.192 0.098 1.00 0.36 N ATOM 1327 CA LEU A 83 3.491 -6.365 1.563 1.00 0.39 C ATOM 1328 C LEU A 83 2.111 -6.858 2.055 1.00 0.40 C ATOM 1329 O LEU A 83 2.030 -7.834 2.800 1.00 0.49 O ATOM 1330 CB LEU A 83 3.878 -5.033 2.271 1.00 0.44 C ATOM 1331 CG LEU A 83 5.121 -5.086 3.190 1.00 0.49 C ATOM 1332 CD1 LEU A 83 6.404 -5.313 2.383 1.00 0.67 C ATOM 1333 CD2 LEU A 83 5.228 -3.805 4.022 1.00 0.61 C ATOM 0 H LEU A 83 3.666 -5.233 -0.203 1.00 0.36 H new ATOM 0 HA LEU A 83 4.235 -7.120 1.817 1.00 0.39 H new ATOM 0 HB2 LEU A 83 4.049 -4.275 1.506 1.00 0.44 H new ATOM 0 HB3 LEU A 83 3.027 -4.700 2.865 1.00 0.44 H new ATOM 0 HG LEU A 83 5.000 -5.932 3.866 1.00 0.49 H new ATOM 0 HD11 LEU A 83 7.258 -5.345 3.059 1.00 0.67 H new ATOM 0 HD12 LEU A 83 6.332 -6.258 1.844 1.00 0.67 H new ATOM 0 HD13 LEU A 83 6.535 -4.498 1.671 1.00 0.67 H new ATOM 0 HD21 LEU A 83 6.108 -3.860 4.663 1.00 0.61 H new ATOM 0 HD22 LEU A 83 5.316 -2.946 3.357 1.00 0.61 H new ATOM 0 HD23 LEU A 83 4.336 -3.696 4.639 1.00 0.61 H new ATOM 1345 N ALA A 84 1.032 -6.180 1.607 1.00 0.39 N ATOM 1346 CA ALA A 84 -0.350 -6.536 1.987 1.00 0.45 C ATOM 1347 C ALA A 84 -0.984 -7.568 1.027 1.00 0.45 C ATOM 1348 O ALA A 84 -2.045 -8.117 1.341 1.00 0.55 O ATOM 1349 CB ALA A 84 -1.209 -5.277 2.071 1.00 0.54 C ATOM 0 H ALA A 84 1.094 -5.379 0.978 1.00 0.39 H new ATOM 0 HA ALA A 84 -0.306 -7.010 2.968 1.00 0.45 H new ATOM 0 HB1 ALA A 84 -2.227 -5.549 2.352 1.00 0.54 H new ATOM 0 HB2 ALA A 84 -0.794 -4.603 2.820 1.00 0.54 H new ATOM 0 HB3 ALA A 84 -1.221 -4.779 1.101 1.00 0.54 H new ATOM 1355 N LYS A 85 -0.343 -7.831 -0.136 1.00 0.42 N ATOM 1356 CA LYS A 85 -0.854 -8.812 -1.114 1.00 0.46 C ATOM 1357 C LYS A 85 -0.346 -10.235 -0.796 1.00 0.47 C ATOM 1358 O LYS A 85 -1.088 -11.204 -0.970 1.00 0.55 O ATOM 1359 CB LYS A 85 -0.461 -8.410 -2.554 1.00 0.49 C ATOM 1360 CG LYS A 85 -1.320 -9.075 -3.634 1.00 0.59 C ATOM 1361 CD LYS A 85 -0.752 -8.912 -5.051 1.00 0.64 C ATOM 1362 CE LYS A 85 -0.921 -7.496 -5.622 1.00 0.69 C ATOM 1363 NZ LYS A 85 0.272 -6.628 -5.374 1.00 0.96 N ATOM 0 H LYS A 85 0.526 -7.377 -0.417 1.00 0.42 H new ATOM 0 HA LYS A 85 -1.941 -8.815 -1.040 1.00 0.46 H new ATOM 0 HB2 LYS A 85 -0.540 -7.328 -2.654 1.00 0.49 H new ATOM 0 HB3 LYS A 85 0.584 -8.670 -2.722 1.00 0.49 H new ATOM 0 HG2 LYS A 85 -1.416 -10.137 -3.409 1.00 0.59 H new ATOM 0 HG3 LYS A 85 -2.324 -8.651 -3.602 1.00 0.59 H new ATOM 0 HD2 LYS A 85 0.308 -9.166 -5.040 1.00 0.64 H new ATOM 0 HD3 LYS A 85 -1.244 -9.623 -5.715 1.00 0.64 H new ATOM 0 HE2 LYS A 85 -1.102 -7.560 -6.695 1.00 0.69 H new ATOM 0 HE3 LYS A 85 -1.802 -7.032 -5.178 1.00 0.69 H new ATOM 0 HZ1 LYS A 85 0.331 -5.900 -6.114 1.00 0.96 H new ATOM 0 HZ2 LYS A 85 0.181 -6.170 -4.445 1.00 0.96 H new ATOM 0 HZ3 LYS A 85 1.134 -7.210 -5.391 1.00 0.96 H new ATOM 1377 N GLU A 86 0.919 -10.356 -0.334 1.00 0.42 N ATOM 1378 CA GLU A 86 1.514 -11.668 0.011 1.00 0.46 C ATOM 1379 C GLU A 86 1.211 -12.082 1.474 1.00 0.52 C ATOM 1380 O GLU A 86 1.511 -13.211 1.866 1.00 0.92 O ATOM 1381 CB GLU A 86 3.045 -11.665 -0.225 1.00 0.49 C ATOM 1382 CG GLU A 86 3.489 -11.283 -1.645 1.00 0.55 C ATOM 1383 CD GLU A 86 2.900 -12.164 -2.740 1.00 1.03 C ATOM 1384 OE1 GLU A 86 3.455 -13.254 -2.992 1.00 1.52 O ATOM 1385 OE2 GLU A 86 1.886 -11.760 -3.347 1.00 1.65 O ATOM 0 H GLU A 86 1.546 -9.564 -0.192 1.00 0.42 H new ATOM 0 HA GLU A 86 1.051 -12.402 -0.649 1.00 0.46 H new ATOM 0 HB2 GLU A 86 3.503 -10.972 0.480 1.00 0.49 H new ATOM 0 HB3 GLU A 86 3.434 -12.657 0.005 1.00 0.49 H new ATOM 0 HG2 GLU A 86 3.207 -10.248 -1.836 1.00 0.55 H new ATOM 0 HG3 GLU A 86 4.577 -11.332 -1.700 1.00 0.55 H new ATOM 1392 N ILE A 87 0.615 -11.178 2.280 1.00 0.44 N ATOM 1393 CA ILE A 87 0.273 -11.474 3.687 1.00 0.47 C ATOM 1394 C ILE A 87 -0.831 -12.558 3.782 1.00 0.51 C ATOM 1395 O ILE A 87 -0.765 -13.436 4.646 1.00 0.61 O ATOM 1396 CB ILE A 87 -0.129 -10.150 4.454 1.00 0.51 C ATOM 1397 CG1 ILE A 87 0.213 -10.218 5.969 1.00 0.59 C ATOM 1398 CG2 ILE A 87 -1.596 -9.746 4.230 1.00 0.55 C ATOM 1399 CD1 ILE A 87 -0.540 -11.264 6.781 1.00 0.66 C ATOM 0 H ILE A 87 0.361 -10.237 1.980 1.00 0.44 H new ATOM 0 HA ILE A 87 1.158 -11.881 4.176 1.00 0.47 H new ATOM 0 HB ILE A 87 0.483 -9.362 4.015 1.00 0.51 H new ATOM 0 HG12 ILE A 87 1.281 -10.409 6.071 1.00 0.59 H new ATOM 0 HG13 ILE A 87 0.020 -9.239 6.408 1.00 0.59 H new ATOM 0 HG21 ILE A 87 -1.810 -8.831 4.782 1.00 0.55 H new ATOM 0 HG22 ILE A 87 -1.769 -9.577 3.167 1.00 0.55 H new ATOM 0 HG23 ILE A 87 -2.251 -10.543 4.582 1.00 0.55 H new ATOM 0 HD11 ILE A 87 -0.219 -11.217 7.822 1.00 0.66 H new ATOM 0 HD12 ILE A 87 -1.611 -11.068 6.723 1.00 0.66 H new ATOM 0 HD13 ILE A 87 -0.330 -12.256 6.380 1.00 0.66 H new ATOM 1411 N ARG A 88 -1.818 -12.499 2.866 1.00 0.54 N ATOM 1412 CA ARG A 88 -2.936 -13.460 2.850 1.00 0.68 C ATOM 1413 C ARG A 88 -2.815 -14.500 1.714 1.00 0.68 C ATOM 1414 O ARG A 88 -3.287 -15.631 1.877 1.00 0.87 O ATOM 1415 CB ARG A 88 -4.301 -12.714 2.796 1.00 0.83 C ATOM 1416 CG ARG A 88 -4.760 -12.191 1.421 1.00 0.91 C ATOM 1417 CD ARG A 88 -3.959 -10.986 0.926 1.00 1.05 C ATOM 1418 NE ARG A 88 -4.625 -10.322 -0.211 1.00 1.18 N ATOM 1419 CZ ARG A 88 -5.398 -9.213 -0.140 1.00 1.39 C ATOM 1420 NH1 ARG A 88 -5.644 -8.594 1.024 1.00 1.74 N ATOM 1421 NH2 ARG A 88 -5.947 -8.728 -1.254 1.00 1.73 N ATOM 0 H ARG A 88 -1.863 -11.796 2.128 1.00 0.54 H new ATOM 0 HA ARG A 88 -2.886 -14.022 3.782 1.00 0.68 H new ATOM 0 HB2 ARG A 88 -5.070 -13.387 3.176 1.00 0.83 H new ATOM 0 HB3 ARG A 88 -4.251 -11.867 3.481 1.00 0.83 H new ATOM 0 HG2 ARG A 88 -4.679 -12.996 0.690 1.00 0.91 H new ATOM 0 HG3 ARG A 88 -5.814 -11.918 1.479 1.00 0.91 H new ATOM 0 HD2 ARG A 88 -3.832 -10.273 1.741 1.00 1.05 H new ATOM 0 HD3 ARG A 88 -2.962 -11.309 0.626 1.00 1.05 H new ATOM 0 HE ARG A 88 -4.491 -10.736 -1.134 1.00 1.18 H new ATOM 0 HH11 ARG A 88 -5.244 -8.957 1.889 1.00 1.74 H new ATOM 0 HH12 ARG A 88 -6.231 -7.760 1.044 1.00 1.74 H new ATOM 0 HH21 ARG A 88 -5.783 -9.192 -2.147 1.00 1.73 H new ATOM 0 HH22 ARG A 88 -6.531 -7.893 -1.213 1.00 1.73 H new ATOM 1435 N LYS A 89 -2.187 -14.124 0.573 1.00 0.58 N ATOM 1436 CA LYS A 89 -2.033 -15.039 -0.576 1.00 0.64 C ATOM 1437 C LYS A 89 -0.600 -15.029 -1.160 1.00 0.58 C ATOM 1438 O LYS A 89 -0.385 -14.606 -2.304 1.00 0.69 O ATOM 1439 CB LYS A 89 -3.085 -14.719 -1.670 1.00 0.76 C ATOM 1440 CG LYS A 89 -3.096 -13.266 -2.156 1.00 0.77 C ATOM 1441 CD LYS A 89 -3.953 -13.082 -3.410 1.00 1.00 C ATOM 1442 CE LYS A 89 -3.727 -11.712 -4.047 1.00 1.22 C ATOM 1443 NZ LYS A 89 -4.591 -11.491 -5.241 1.00 1.52 N ATOM 0 H LYS A 89 -1.783 -13.199 0.428 1.00 0.58 H new ATOM 0 HA LYS A 89 -2.207 -16.049 -0.206 1.00 0.64 H new ATOM 0 HB2 LYS A 89 -2.907 -15.371 -2.525 1.00 0.76 H new ATOM 0 HB3 LYS A 89 -4.074 -14.964 -1.284 1.00 0.76 H new ATOM 0 HG2 LYS A 89 -3.474 -12.622 -1.362 1.00 0.77 H new ATOM 0 HG3 LYS A 89 -2.075 -12.947 -2.366 1.00 0.77 H new ATOM 0 HD2 LYS A 89 -3.716 -13.864 -4.132 1.00 1.00 H new ATOM 0 HD3 LYS A 89 -5.006 -13.195 -3.152 1.00 1.00 H new ATOM 0 HE2 LYS A 89 -3.925 -10.934 -3.309 1.00 1.22 H new ATOM 0 HE3 LYS A 89 -2.680 -11.617 -4.337 1.00 1.22 H new ATOM 0 HZ1 LYS A 89 -4.401 -10.548 -5.637 1.00 1.52 H new ATOM 0 HZ2 LYS A 89 -4.385 -12.216 -5.958 1.00 1.52 H new ATOM 0 HZ3 LYS A 89 -5.591 -11.554 -4.962 1.00 1.52 H new ATOM 1457 N LYS A 90 0.389 -15.502 -0.368 1.00 0.56 N ATOM 1458 CA LYS A 90 1.792 -15.587 -0.841 1.00 0.55 C ATOM 1459 C LYS A 90 1.951 -16.791 -1.794 1.00 0.55 C ATOM 1460 O LYS A 90 2.719 -16.731 -2.760 1.00 0.60 O ATOM 1461 CB LYS A 90 2.814 -15.680 0.329 1.00 0.61 C ATOM 1462 CG LYS A 90 2.592 -16.834 1.333 1.00 0.71 C ATOM 1463 CD LYS A 90 1.973 -16.370 2.660 1.00 0.97 C ATOM 1464 CE LYS A 90 3.023 -15.885 3.665 1.00 1.39 C ATOM 1465 NZ LYS A 90 3.718 -17.014 4.357 1.00 1.87 N ATOM 0 H LYS A 90 0.246 -15.827 0.588 1.00 0.56 H new ATOM 0 HA LYS A 90 2.012 -14.663 -1.376 1.00 0.55 H new ATOM 0 HB2 LYS A 90 3.813 -15.781 -0.095 1.00 0.61 H new ATOM 0 HB3 LYS A 90 2.794 -14.739 0.878 1.00 0.61 H new ATOM 0 HG2 LYS A 90 1.943 -17.583 0.879 1.00 0.71 H new ATOM 0 HG3 LYS A 90 3.546 -17.320 1.535 1.00 0.71 H new ATOM 0 HD2 LYS A 90 1.265 -15.565 2.464 1.00 0.97 H new ATOM 0 HD3 LYS A 90 1.408 -17.192 3.100 1.00 0.97 H new ATOM 0 HE2 LYS A 90 3.760 -15.271 3.147 1.00 1.39 H new ATOM 0 HE3 LYS A 90 2.543 -15.248 4.408 1.00 1.39 H new ATOM 0 HZ1 LYS A 90 4.418 -16.633 5.026 1.00 1.87 H new ATOM 0 HZ2 LYS A 90 3.020 -17.586 4.874 1.00 1.87 H new ATOM 0 HZ3 LYS A 90 4.200 -17.609 3.653 1.00 1.87 H new ATOM 1479 N LYS A 91 1.211 -17.880 -1.494 1.00 0.57 N ATOM 1480 CA LYS A 91 1.210 -19.108 -2.298 1.00 0.64 C ATOM 1481 C LYS A 91 -0.237 -19.612 -2.439 1.00 0.69 C ATOM 1482 O LYS A 91 -0.618 -20.625 -1.839 1.00 0.71 O ATOM 1483 CB LYS A 91 2.098 -20.187 -1.646 1.00 0.72 C ATOM 1484 CG LYS A 91 3.586 -19.843 -1.610 1.00 0.85 C ATOM 1485 CD LYS A 91 4.374 -20.833 -0.758 1.00 0.97 C ATOM 1486 CE LYS A 91 5.871 -20.518 -0.739 1.00 1.29 C ATOM 1487 NZ LYS A 91 6.553 -20.906 -2.013 1.00 1.53 N ATOM 0 H LYS A 91 0.596 -17.926 -0.681 1.00 0.57 H new ATOM 0 HA LYS A 91 1.619 -18.894 -3.285 1.00 0.64 H new ATOM 0 HB2 LYS A 91 1.752 -20.357 -0.626 1.00 0.72 H new ATOM 0 HB3 LYS A 91 1.967 -21.124 -2.188 1.00 0.72 H new ATOM 0 HG2 LYS A 91 3.983 -19.840 -2.625 1.00 0.85 H new ATOM 0 HG3 LYS A 91 3.717 -18.836 -1.213 1.00 0.85 H new ATOM 0 HD2 LYS A 91 3.989 -20.819 0.262 1.00 0.97 H new ATOM 0 HD3 LYS A 91 4.222 -21.842 -1.142 1.00 0.97 H new ATOM 0 HE2 LYS A 91 6.013 -19.451 -0.565 1.00 1.29 H new ATOM 0 HE3 LYS A 91 6.339 -21.042 0.094 1.00 1.29 H new ATOM 0 HZ1 LYS A 91 7.565 -20.673 -1.950 1.00 1.53 H new ATOM 0 HZ2 LYS A 91 6.443 -21.928 -2.168 1.00 1.53 H new ATOM 0 HZ3 LYS A 91 6.127 -20.387 -2.807 1.00 1.53 H new ATOM 1501 N ASP A 92 -1.054 -18.873 -3.223 1.00 0.78 N ATOM 1502 CA ASP A 92 -2.471 -19.235 -3.441 1.00 0.87 C ATOM 1503 C ASP A 92 -2.601 -20.399 -4.447 1.00 1.03 C ATOM 1504 O ASP A 92 -3.022 -20.216 -5.599 1.00 1.81 O ATOM 1505 CB ASP A 92 -3.327 -18.008 -3.861 1.00 0.89 C ATOM 1506 CG ASP A 92 -2.777 -17.234 -5.058 1.00 0.98 C ATOM 1507 OD1 ASP A 92 -1.925 -16.346 -4.852 1.00 1.01 O ATOM 1508 OD2 ASP A 92 -3.209 -17.511 -6.199 1.00 1.18 O ATOM 0 H ASP A 92 -0.758 -18.028 -3.712 1.00 0.78 H new ATOM 0 HA ASP A 92 -2.869 -19.581 -2.487 1.00 0.87 H new ATOM 0 HB2 ASP A 92 -4.336 -18.348 -4.096 1.00 0.89 H new ATOM 0 HB3 ASP A 92 -3.409 -17.330 -3.012 1.00 0.89 H new ATOM 1513 N LEU A 93 -2.216 -21.605 -3.983 1.00 0.67 N ATOM 1514 CA LEU A 93 -2.263 -22.843 -4.788 1.00 0.70 C ATOM 1515 C LEU A 93 -1.970 -24.073 -3.902 1.00 0.70 C ATOM 1516 O LEU A 93 -2.703 -25.068 -3.957 1.00 0.79 O ATOM 1517 CB LEU A 93 -1.261 -22.794 -5.974 1.00 0.77 C ATOM 1518 CG LEU A 93 -1.667 -23.594 -7.233 1.00 0.97 C ATOM 1519 CD1 LEU A 93 -2.809 -22.901 -7.987 1.00 1.24 C ATOM 1520 CD2 LEU A 93 -0.462 -23.803 -8.154 1.00 1.15 C ATOM 0 H LEU A 93 -1.863 -21.748 -3.037 1.00 0.67 H new ATOM 0 HA LEU A 93 -3.269 -22.927 -5.200 1.00 0.70 H new ATOM 0 HB2 LEU A 93 -1.117 -21.752 -6.260 1.00 0.77 H new ATOM 0 HB3 LEU A 93 -0.297 -23.166 -5.626 1.00 0.77 H new ATOM 0 HG LEU A 93 -2.025 -24.570 -6.906 1.00 0.97 H new ATOM 0 HD11 LEU A 93 -3.072 -23.487 -8.867 1.00 1.24 H new ATOM 0 HD12 LEU A 93 -3.678 -22.817 -7.334 1.00 1.24 H new ATOM 0 HD13 LEU A 93 -2.490 -21.906 -8.296 1.00 1.24 H new ATOM 0 HD21 LEU A 93 -0.770 -24.368 -9.034 1.00 1.15 H new ATOM 0 HD22 LEU A 93 -0.069 -22.835 -8.464 1.00 1.15 H new ATOM 0 HD23 LEU A 93 0.312 -24.355 -7.621 1.00 1.15 H new ATOM 1532 N LYS A 94 -0.886 -23.996 -3.091 1.00 0.70 N ATOM 1533 CA LYS A 94 -0.493 -25.084 -2.174 1.00 0.77 C ATOM 1534 C LYS A 94 -1.169 -24.905 -0.797 1.00 0.71 C ATOM 1535 O LYS A 94 -1.829 -25.827 -0.309 1.00 0.77 O ATOM 1536 CB LYS A 94 1.050 -25.128 -2.023 1.00 0.92 C ATOM 1537 CG LYS A 94 1.600 -26.478 -1.552 1.00 1.09 C ATOM 1538 CD LYS A 94 1.610 -27.531 -2.671 1.00 1.23 C ATOM 1539 CE LYS A 94 1.664 -28.958 -2.125 1.00 1.57 C ATOM 1540 NZ LYS A 94 0.399 -29.356 -1.433 1.00 1.73 N ATOM 0 H LYS A 94 -0.268 -23.185 -3.057 1.00 0.70 H new ATOM 0 HA LYS A 94 -0.827 -26.032 -2.597 1.00 0.77 H new ATOM 0 HB2 LYS A 94 1.504 -24.879 -2.982 1.00 0.92 H new ATOM 0 HB3 LYS A 94 1.356 -24.358 -1.315 1.00 0.92 H new ATOM 0 HG2 LYS A 94 2.614 -26.342 -1.176 1.00 1.09 H new ATOM 0 HG3 LYS A 94 0.997 -26.842 -0.720 1.00 1.09 H new ATOM 0 HD2 LYS A 94 0.718 -27.413 -3.286 1.00 1.23 H new ATOM 0 HD3 LYS A 94 2.469 -27.360 -3.320 1.00 1.23 H new ATOM 0 HE2 LYS A 94 1.859 -29.650 -2.945 1.00 1.57 H new ATOM 0 HE3 LYS A 94 2.498 -29.046 -1.429 1.00 1.57 H new ATOM 0 HZ1 LYS A 94 0.382 -30.388 -1.308 1.00 1.73 H new ATOM 0 HZ2 LYS A 94 0.352 -28.893 -0.503 1.00 1.73 H new ATOM 0 HZ3 LYS A 94 -0.417 -29.063 -2.007 1.00 1.73 H new ATOM 1554 N ILE A 95 -0.988 -23.713 -0.184 1.00 0.68 N ATOM 1555 CA ILE A 95 -1.590 -23.380 1.126 1.00 0.67 C ATOM 1556 C ILE A 95 -2.626 -22.251 0.953 1.00 0.67 C ATOM 1557 O ILE A 95 -2.305 -21.193 0.400 1.00 0.77 O ATOM 1558 CB ILE A 95 -0.514 -22.985 2.207 1.00 0.75 C ATOM 1559 CG1 ILE A 95 0.500 -21.933 1.667 1.00 0.87 C ATOM 1560 CG2 ILE A 95 0.211 -24.242 2.712 1.00 0.85 C ATOM 1561 CD1 ILE A 95 1.437 -21.345 2.715 1.00 1.06 C ATOM 0 H ILE A 95 -0.425 -22.961 -0.580 1.00 0.68 H new ATOM 0 HA ILE A 95 -2.085 -24.278 1.495 1.00 0.67 H new ATOM 0 HB ILE A 95 -1.036 -22.518 3.042 1.00 0.75 H new ATOM 0 HG12 ILE A 95 1.100 -22.397 0.884 1.00 0.87 H new ATOM 0 HG13 ILE A 95 -0.057 -21.120 1.202 1.00 0.87 H new ATOM 0 HG21 ILE A 95 0.953 -23.959 3.459 1.00 0.85 H new ATOM 0 HG22 ILE A 95 -0.512 -24.924 3.159 1.00 0.85 H new ATOM 0 HG23 ILE A 95 0.707 -24.736 1.877 1.00 0.85 H new ATOM 0 HD11 ILE A 95 2.104 -20.624 2.243 1.00 1.06 H new ATOM 0 HD12 ILE A 95 0.852 -20.846 3.488 1.00 1.06 H new ATOM 0 HD13 ILE A 95 2.026 -22.144 3.165 1.00 1.06 H new ATOM 1573 N ARG A 96 -3.873 -22.490 1.415 1.00 0.71 N ATOM 1574 CA ARG A 96 -4.971 -21.503 1.288 1.00 0.77 C ATOM 1575 C ARG A 96 -5.901 -21.490 2.530 1.00 0.77 C ATOM 1576 O ARG A 96 -7.125 -21.364 2.393 1.00 0.93 O ATOM 1577 CB ARG A 96 -5.780 -21.792 -0.004 1.00 0.93 C ATOM 1578 CG ARG A 96 -6.357 -23.213 -0.094 1.00 1.05 C ATOM 1579 CD ARG A 96 -7.170 -23.440 -1.368 1.00 1.26 C ATOM 1580 NE ARG A 96 -8.451 -22.700 -1.368 1.00 1.40 N ATOM 1581 CZ ARG A 96 -9.614 -23.139 -1.902 1.00 1.83 C ATOM 1582 NH1 ARG A 96 -9.717 -24.341 -2.492 1.00 2.26 N ATOM 1583 NH2 ARG A 96 -10.697 -22.359 -1.841 1.00 2.18 N ATOM 0 H ARG A 96 -4.145 -23.357 1.879 1.00 0.71 H new ATOM 0 HA ARG A 96 -4.524 -20.511 1.225 1.00 0.77 H new ATOM 0 HB2 ARG A 96 -6.600 -21.077 -0.071 1.00 0.93 H new ATOM 0 HB3 ARG A 96 -5.136 -21.621 -0.866 1.00 0.93 H new ATOM 0 HG2 ARG A 96 -5.541 -23.935 -0.055 1.00 1.05 H new ATOM 0 HG3 ARG A 96 -6.990 -23.399 0.774 1.00 1.05 H new ATOM 0 HD2 ARG A 96 -6.578 -23.134 -2.231 1.00 1.26 H new ATOM 0 HD3 ARG A 96 -7.371 -24.505 -1.481 1.00 1.26 H new ATOM 0 HE ARG A 96 -8.458 -21.780 -0.928 1.00 1.40 H new ATOM 0 HH11 ARG A 96 -8.903 -24.953 -2.547 1.00 2.26 H new ATOM 0 HH12 ARG A 96 -10.609 -24.642 -2.885 1.00 2.26 H new ATOM 0 HH21 ARG A 96 -10.641 -21.443 -1.395 1.00 2.18 H new ATOM 0 HH22 ARG A 96 -11.579 -22.679 -2.240 1.00 2.18 H new ATOM 1597 N LYS A 97 -5.321 -21.598 3.743 1.00 0.72 N ATOM 1598 CA LYS A 97 -6.111 -21.593 4.992 1.00 0.75 C ATOM 1599 C LYS A 97 -5.293 -21.060 6.192 1.00 0.74 C ATOM 1600 O LYS A 97 -4.941 -21.815 7.109 1.00 0.95 O ATOM 1601 CB LYS A 97 -6.705 -23.001 5.281 1.00 0.87 C ATOM 1602 CG LYS A 97 -5.696 -24.155 5.233 1.00 0.94 C ATOM 1603 CD LYS A 97 -6.352 -25.501 5.560 1.00 1.10 C ATOM 1604 CE LYS A 97 -5.367 -26.667 5.485 1.00 1.36 C ATOM 1605 NZ LYS A 97 -4.327 -26.614 6.556 1.00 1.74 N ATOM 0 H LYS A 97 -4.315 -21.689 3.884 1.00 0.72 H new ATOM 0 HA LYS A 97 -6.943 -20.904 4.850 1.00 0.75 H new ATOM 0 HB2 LYS A 97 -7.170 -22.987 6.267 1.00 0.87 H new ATOM 0 HB3 LYS A 97 -7.496 -23.200 4.558 1.00 0.87 H new ATOM 0 HG2 LYS A 97 -5.245 -24.202 4.242 1.00 0.94 H new ATOM 0 HG3 LYS A 97 -4.890 -23.962 5.941 1.00 0.94 H new ATOM 0 HD2 LYS A 97 -6.783 -25.458 6.560 1.00 1.10 H new ATOM 0 HD3 LYS A 97 -7.174 -25.679 4.866 1.00 1.10 H new ATOM 0 HE2 LYS A 97 -5.915 -27.606 5.563 1.00 1.36 H new ATOM 0 HE3 LYS A 97 -4.879 -26.663 4.510 1.00 1.36 H new ATOM 0 HZ1 LYS A 97 -3.707 -27.445 6.479 1.00 1.74 H new ATOM 0 HZ2 LYS A 97 -3.761 -25.748 6.448 1.00 1.74 H new ATOM 0 HZ3 LYS A 97 -4.788 -26.612 7.488 1.00 1.74 H new ATOM 1619 N LYS A 98 -4.992 -19.746 6.171 1.00 0.69 N ATOM 1620 CA LYS A 98 -4.234 -19.082 7.248 1.00 0.72 C ATOM 1621 C LYS A 98 -5.173 -18.210 8.088 1.00 0.76 C ATOM 1622 O LYS A 98 -5.864 -18.704 8.978 1.00 0.98 O ATOM 1623 CB LYS A 98 -3.085 -18.234 6.659 1.00 0.88 C ATOM 1624 CG LYS A 98 -2.105 -17.683 7.705 1.00 1.04 C ATOM 1625 CD LYS A 98 -0.862 -17.060 7.064 1.00 1.35 C ATOM 1626 CE LYS A 98 0.098 -16.476 8.103 1.00 1.61 C ATOM 1627 NZ LYS A 98 0.669 -17.514 9.017 1.00 1.71 N ATOM 0 H LYS A 98 -5.265 -19.120 5.413 1.00 0.69 H new ATOM 0 HA LYS A 98 -3.796 -19.845 7.892 1.00 0.72 H new ATOM 0 HB2 LYS A 98 -2.531 -18.842 5.944 1.00 0.88 H new ATOM 0 HB3 LYS A 98 -3.513 -17.399 6.104 1.00 0.88 H new ATOM 0 HG2 LYS A 98 -2.611 -16.934 8.315 1.00 1.04 H new ATOM 0 HG3 LYS A 98 -1.801 -18.488 8.375 1.00 1.04 H new ATOM 0 HD2 LYS A 98 -0.341 -17.816 6.477 1.00 1.35 H new ATOM 0 HD3 LYS A 98 -1.168 -16.274 6.373 1.00 1.35 H new ATOM 0 HE2 LYS A 98 0.912 -15.963 7.590 1.00 1.61 H new ATOM 0 HE3 LYS A 98 -0.428 -15.727 8.695 1.00 1.61 H new ATOM 0 HZ1 LYS A 98 1.362 -17.072 9.654 1.00 1.71 H new ATOM 0 HZ2 LYS A 98 -0.095 -17.940 9.579 1.00 1.71 H new ATOM 0 HZ3 LYS A 98 1.138 -18.252 8.454 1.00 1.71 H new ATOM 1642 N MET B 1 -5.578 -17.805 2.641 1.00 0.85 N ATOM 1643 CA MET B 1 -6.544 -16.915 1.997 1.00 0.86 C ATOM 1644 C MET B 1 -6.846 -15.668 2.852 1.00 0.76 C ATOM 1645 O MET B 1 -7.004 -14.574 2.304 1.00 0.93 O ATOM 1646 CB MET B 1 -7.850 -17.677 1.662 1.00 1.04 C ATOM 1647 CG MET B 1 -8.557 -18.314 2.864 1.00 1.09 C ATOM 1648 SD MET B 1 -10.070 -19.190 2.409 1.00 1.44 S ATOM 1649 CE MET B 1 -10.775 -19.518 4.026 1.00 1.75 C ATOM 0 H1 MET B 1 -5.431 -18.646 2.047 1.00 0.85 H new ATOM 0 H2 MET B 1 -4.674 -17.305 2.764 1.00 0.85 H new ATOM 0 H3 MET B 1 -5.941 -18.097 3.571 1.00 0.85 H new ATOM 0 HA MET B 1 -6.092 -16.567 1.068 1.00 0.86 H new ATOM 0 HB2 MET B 1 -8.541 -16.987 1.177 1.00 1.04 H new ATOM 0 HB3 MET B 1 -7.621 -18.459 0.938 1.00 1.04 H new ATOM 0 HG2 MET B 1 -7.875 -19.009 3.354 1.00 1.09 H new ATOM 0 HG3 MET B 1 -8.797 -17.538 3.591 1.00 1.09 H new ATOM 0 HE1 MET B 1 -11.716 -20.056 3.910 1.00 1.75 H new ATOM 0 HE2 MET B 1 -10.081 -20.123 4.610 1.00 1.75 H new ATOM 0 HE3 MET B 1 -10.957 -18.575 4.542 1.00 1.75 H new ATOM 1659 N ALA B 2 -6.928 -15.840 4.192 1.00 0.73 N ATOM 1660 CA ALA B 2 -7.220 -14.729 5.115 1.00 0.67 C ATOM 1661 C ALA B 2 -5.936 -14.165 5.741 1.00 0.60 C ATOM 1662 O ALA B 2 -4.891 -14.826 5.739 1.00 0.68 O ATOM 1663 CB ALA B 2 -8.202 -15.187 6.198 1.00 0.78 C ATOM 0 H ALA B 2 -6.795 -16.740 4.654 1.00 0.73 H new ATOM 0 HA ALA B 2 -7.681 -13.925 4.542 1.00 0.67 H new ATOM 0 HB1 ALA B 2 -8.410 -14.358 6.874 1.00 0.78 H new ATOM 0 HB2 ALA B 2 -9.130 -15.517 5.731 1.00 0.78 H new ATOM 0 HB3 ALA B 2 -7.765 -16.012 6.760 1.00 0.78 H new ATOM 1669 N ALA B 3 -6.030 -12.933 6.281 1.00 0.57 N ATOM 1670 CA ALA B 3 -4.887 -12.251 6.907 1.00 0.57 C ATOM 1671 C ALA B 3 -4.847 -12.491 8.431 1.00 0.58 C ATOM 1672 O ALA B 3 -5.831 -12.224 9.130 1.00 0.69 O ATOM 1673 CB ALA B 3 -4.938 -10.753 6.598 1.00 0.64 C ATOM 0 H ALA B 3 -6.893 -12.390 6.294 1.00 0.57 H new ATOM 0 HA ALA B 3 -3.973 -12.670 6.487 1.00 0.57 H new ATOM 0 HB1 ALA B 3 -4.088 -10.256 7.065 1.00 0.64 H new ATOM 0 HB2 ALA B 3 -4.898 -10.602 5.519 1.00 0.64 H new ATOM 0 HB3 ALA B 3 -5.864 -10.332 6.989 1.00 0.64 H new ATOM 1679 N GLU B 4 -3.700 -13.002 8.932 1.00 0.56 N ATOM 1680 CA GLU B 4 -3.501 -13.286 10.368 1.00 0.59 C ATOM 1681 C GLU B 4 -2.303 -12.467 10.910 1.00 0.56 C ATOM 1682 O GLU B 4 -1.313 -12.304 10.190 1.00 0.54 O ATOM 1683 CB GLU B 4 -3.261 -14.803 10.566 1.00 0.66 C ATOM 1684 CG GLU B 4 -3.384 -15.292 12.011 1.00 0.79 C ATOM 1685 CD GLU B 4 -3.168 -16.793 12.147 1.00 0.91 C ATOM 1686 OE1 GLU B 4 -2.006 -17.212 12.346 1.00 1.00 O ATOM 1687 OE2 GLU B 4 -4.160 -17.548 12.059 1.00 1.10 O ATOM 0 H GLU B 4 -2.891 -13.228 8.354 1.00 0.56 H new ATOM 0 HA GLU B 4 -4.393 -12.995 10.923 1.00 0.59 H new ATOM 0 HB2 GLU B 4 -3.973 -15.352 9.950 1.00 0.66 H new ATOM 0 HB3 GLU B 4 -2.265 -15.049 10.198 1.00 0.66 H new ATOM 0 HG2 GLU B 4 -2.656 -14.767 12.630 1.00 0.79 H new ATOM 0 HG3 GLU B 4 -4.372 -15.036 12.394 1.00 0.79 H new ATOM 1694 N PRO B 5 -2.369 -11.920 12.175 1.00 0.62 N ATOM 1695 CA PRO B 5 -1.259 -11.123 12.776 1.00 0.65 C ATOM 1696 C PRO B 5 0.117 -11.822 12.739 1.00 0.59 C ATOM 1697 O PRO B 5 0.207 -13.037 12.938 1.00 0.68 O ATOM 1698 CB PRO B 5 -1.722 -10.916 14.227 1.00 0.83 C ATOM 1699 CG PRO B 5 -3.205 -10.957 14.151 1.00 0.80 C ATOM 1700 CD PRO B 5 -3.531 -11.988 13.107 1.00 0.73 C ATOM 0 HA PRO B 5 -1.093 -10.202 12.217 1.00 0.65 H new ATOM 0 HB2 PRO B 5 -1.336 -11.697 14.882 1.00 0.83 H new ATOM 0 HB3 PRO B 5 -1.371 -9.964 14.624 1.00 0.83 H new ATOM 0 HG2 PRO B 5 -3.639 -11.225 15.114 1.00 0.80 H new ATOM 0 HG3 PRO B 5 -3.610 -9.982 13.879 1.00 0.80 H new ATOM 0 HD2 PRO B 5 -3.638 -12.981 13.543 1.00 0.73 H new ATOM 0 HD3 PRO B 5 -4.468 -11.761 12.598 1.00 0.73 H new ATOM 1708 N LEU B 6 1.187 -11.032 12.477 1.00 0.61 N ATOM 1709 CA LEU B 6 2.569 -11.554 12.400 1.00 0.70 C ATOM 1710 C LEU B 6 3.553 -10.601 13.157 1.00 0.73 C ATOM 1711 O LEU B 6 3.294 -10.273 14.318 1.00 1.24 O ATOM 1712 CB LEU B 6 2.958 -11.765 10.909 1.00 0.87 C ATOM 1713 CG LEU B 6 2.077 -12.749 10.095 1.00 0.95 C ATOM 1714 CD1 LEU B 6 2.336 -12.597 8.593 1.00 1.18 C ATOM 1715 CD2 LEU B 6 2.315 -14.200 10.530 1.00 1.08 C ATOM 0 H LEU B 6 1.116 -10.027 12.315 1.00 0.61 H new ATOM 0 HA LEU B 6 2.634 -12.523 12.896 1.00 0.70 H new ATOM 0 HB2 LEU B 6 2.936 -10.796 10.411 1.00 0.87 H new ATOM 0 HB3 LEU B 6 3.988 -12.119 10.872 1.00 0.87 H new ATOM 0 HG LEU B 6 1.035 -12.500 10.296 1.00 0.95 H new ATOM 0 HD11 LEU B 6 1.707 -13.297 8.043 1.00 1.18 H new ATOM 0 HD12 LEU B 6 2.101 -11.578 8.285 1.00 1.18 H new ATOM 0 HD13 LEU B 6 3.384 -12.807 8.381 1.00 1.18 H new ATOM 0 HD21 LEU B 6 1.683 -14.865 9.941 1.00 1.08 H new ATOM 0 HD22 LEU B 6 3.362 -14.460 10.372 1.00 1.08 H new ATOM 0 HD23 LEU B 6 2.070 -14.308 11.587 1.00 1.08 H new ATOM 1727 N THR B 7 4.675 -10.160 12.518 1.00 0.52 N ATOM 1728 CA THR B 7 5.665 -9.260 13.158 1.00 0.50 C ATOM 1729 C THR B 7 5.178 -7.790 13.123 1.00 0.48 C ATOM 1730 O THR B 7 4.286 -7.463 12.347 1.00 0.53 O ATOM 1731 CB THR B 7 7.061 -9.401 12.462 1.00 0.53 C ATOM 1732 OG1 THR B 7 7.372 -10.792 12.285 1.00 0.92 O ATOM 1733 CG2 THR B 7 8.192 -8.747 13.261 1.00 1.06 C ATOM 0 H THR B 7 4.911 -10.417 11.560 1.00 0.52 H new ATOM 0 HA THR B 7 5.770 -9.553 14.203 1.00 0.50 H new ATOM 0 HB THR B 7 6.988 -8.888 11.503 1.00 0.53 H new ATOM 0 HG1 THR B 7 7.364 -11.010 11.330 1.00 0.92 H new ATOM 0 HG21 THR B 7 9.135 -8.877 12.730 1.00 1.06 H new ATOM 0 HG22 THR B 7 7.986 -7.683 13.380 1.00 1.06 H new ATOM 0 HG23 THR B 7 8.261 -9.215 14.243 1.00 1.06 H new ATOM 1741 N GLU B 8 5.769 -6.920 13.976 1.00 0.49 N ATOM 1742 CA GLU B 8 5.400 -5.478 14.082 1.00 0.49 C ATOM 1743 C GLU B 8 5.144 -4.786 12.715 1.00 0.44 C ATOM 1744 O GLU B 8 4.126 -4.107 12.556 1.00 0.47 O ATOM 1745 CB GLU B 8 6.486 -4.709 14.870 1.00 0.54 C ATOM 1746 CG GLU B 8 6.007 -3.391 15.486 1.00 0.95 C ATOM 1747 CD GLU B 8 7.034 -2.770 16.419 1.00 1.01 C ATOM 1748 OE1 GLU B 8 7.031 -3.118 17.620 1.00 1.51 O ATOM 1749 OE2 GLU B 8 7.836 -1.936 15.950 1.00 1.29 O ATOM 0 H GLU B 8 6.517 -7.193 14.613 1.00 0.49 H new ATOM 0 HA GLU B 8 4.450 -5.449 14.616 1.00 0.49 H new ATOM 0 HB2 GLU B 8 6.864 -5.351 15.665 1.00 0.54 H new ATOM 0 HB3 GLU B 8 7.323 -4.501 14.203 1.00 0.54 H new ATOM 0 HG2 GLU B 8 5.774 -2.686 14.688 1.00 0.95 H new ATOM 0 HG3 GLU B 8 5.082 -3.567 16.036 1.00 0.95 H new ATOM 1756 N LEU B 9 6.066 -4.959 11.739 1.00 0.42 N ATOM 1757 CA LEU B 9 5.922 -4.348 10.390 1.00 0.39 C ATOM 1758 C LEU B 9 4.848 -5.063 9.551 1.00 0.38 C ATOM 1759 O LEU B 9 4.075 -4.411 8.841 1.00 0.39 O ATOM 1760 CB LEU B 9 7.260 -4.378 9.617 1.00 0.41 C ATOM 1761 CG LEU B 9 8.404 -3.505 10.181 1.00 0.50 C ATOM 1762 CD1 LEU B 9 9.690 -3.748 9.390 1.00 0.63 C ATOM 1763 CD2 LEU B 9 8.038 -2.010 10.174 1.00 0.65 C ATOM 0 H LEU B 9 6.914 -5.513 11.856 1.00 0.42 H new ATOM 0 HA LEU B 9 5.616 -3.314 10.550 1.00 0.39 H new ATOM 0 HB2 LEU B 9 7.607 -5.410 9.577 1.00 0.41 H new ATOM 0 HB3 LEU B 9 7.068 -4.066 8.590 1.00 0.41 H new ATOM 0 HG LEU B 9 8.564 -3.795 11.219 1.00 0.50 H new ATOM 0 HD11 LEU B 9 10.489 -3.128 9.796 1.00 0.63 H new ATOM 0 HD12 LEU B 9 9.971 -4.798 9.466 1.00 0.63 H new ATOM 0 HD13 LEU B 9 9.527 -3.491 8.343 1.00 0.63 H new ATOM 0 HD21 LEU B 9 8.868 -1.430 10.578 1.00 0.65 H new ATOM 0 HD22 LEU B 9 7.835 -1.690 9.152 1.00 0.65 H new ATOM 0 HD23 LEU B 9 7.151 -1.850 10.787 1.00 0.65 H new ATOM 1775 N GLU B 10 4.826 -6.405 9.631 1.00 0.39 N ATOM 1776 CA GLU B 10 3.857 -7.238 8.891 1.00 0.41 C ATOM 1777 C GLU B 10 2.424 -7.053 9.434 1.00 0.42 C ATOM 1778 O GLU B 10 1.469 -7.034 8.659 1.00 0.47 O ATOM 1779 CB GLU B 10 4.253 -8.727 8.980 1.00 0.46 C ATOM 1780 CG GLU B 10 5.651 -9.048 8.441 1.00 0.50 C ATOM 1781 CD GLU B 10 6.090 -10.478 8.737 1.00 0.56 C ATOM 1782 OE1 GLU B 10 5.351 -11.416 8.370 1.00 0.95 O ATOM 1783 OE2 GLU B 10 7.168 -10.657 9.340 1.00 0.95 O ATOM 0 H GLU B 10 5.475 -6.942 10.207 1.00 0.39 H new ATOM 0 HA GLU B 10 3.875 -6.917 7.850 1.00 0.41 H new ATOM 0 HB2 GLU B 10 4.198 -9.042 10.022 1.00 0.46 H new ATOM 0 HB3 GLU B 10 3.521 -9.318 8.429 1.00 0.46 H new ATOM 0 HG2 GLU B 10 5.665 -8.885 7.363 1.00 0.50 H new ATOM 0 HG3 GLU B 10 6.371 -8.355 8.877 1.00 0.50 H new ATOM 1790 N GLU B 11 2.295 -6.901 10.769 1.00 0.42 N ATOM 1791 CA GLU B 11 0.993 -6.724 11.446 1.00 0.45 C ATOM 1792 C GLU B 11 0.312 -5.388 11.073 1.00 0.43 C ATOM 1793 O GLU B 11 -0.917 -5.331 11.022 1.00 0.45 O ATOM 1794 CB GLU B 11 1.165 -6.832 12.979 1.00 0.51 C ATOM 1795 CG GLU B 11 -0.147 -6.990 13.750 1.00 0.62 C ATOM 1796 CD GLU B 11 0.054 -7.113 15.253 1.00 0.70 C ATOM 1797 OE1 GLU B 11 0.147 -6.067 15.929 1.00 0.85 O ATOM 1798 OE2 GLU B 11 0.117 -8.257 15.752 1.00 0.82 O ATOM 0 H GLU B 11 3.090 -6.898 11.408 1.00 0.42 H new ATOM 0 HA GLU B 11 0.339 -7.524 11.100 1.00 0.45 H new ATOM 0 HB2 GLU B 11 1.808 -7.683 13.202 1.00 0.51 H new ATOM 0 HB3 GLU B 11 1.679 -5.941 13.339 1.00 0.51 H new ATOM 0 HG2 GLU B 11 -0.788 -6.132 13.544 1.00 0.62 H new ATOM 0 HG3 GLU B 11 -0.671 -7.874 13.386 1.00 0.62 H new ATOM 1805 N SER B 12 1.106 -4.320 10.818 1.00 0.43 N ATOM 1806 CA SER B 12 0.552 -2.999 10.443 1.00 0.44 C ATOM 1807 C SER B 12 -0.209 -3.088 9.106 1.00 0.42 C ATOM 1808 O SER B 12 -1.390 -2.739 9.047 1.00 0.47 O ATOM 1809 CB SER B 12 1.656 -1.930 10.372 1.00 0.48 C ATOM 1810 OG SER B 12 2.281 -1.772 11.637 1.00 0.56 O ATOM 0 H SER B 12 2.125 -4.348 10.865 1.00 0.43 H new ATOM 0 HA SER B 12 -0.151 -2.699 11.220 1.00 0.44 H new ATOM 0 HB2 SER B 12 2.398 -2.215 9.627 1.00 0.48 H new ATOM 0 HB3 SER B 12 1.230 -0.980 10.050 1.00 0.48 H new ATOM 0 HG SER B 12 2.834 -2.558 11.829 1.00 0.56 H new ATOM 1816 N ILE B 13 0.469 -3.583 8.044 1.00 0.40 N ATOM 1817 CA ILE B 13 -0.164 -3.757 6.712 1.00 0.41 C ATOM 1818 C ILE B 13 -1.203 -4.913 6.711 1.00 0.41 C ATOM 1819 O ILE B 13 -2.044 -4.989 5.810 1.00 0.48 O ATOM 1820 CB ILE B 13 0.885 -3.972 5.557 1.00 0.46 C ATOM 1821 CG1 ILE B 13 1.840 -5.178 5.819 1.00 0.45 C ATOM 1822 CG2 ILE B 13 1.695 -2.690 5.333 1.00 0.53 C ATOM 1823 CD1 ILE B 13 1.248 -6.541 5.497 1.00 0.45 C ATOM 0 H ILE B 13 1.448 -3.868 8.081 1.00 0.40 H new ATOM 0 HA ILE B 13 -0.684 -2.820 6.512 1.00 0.41 H new ATOM 0 HB ILE B 13 0.319 -4.211 4.656 1.00 0.46 H new ATOM 0 HG12 ILE B 13 2.745 -5.042 5.228 1.00 0.45 H new ATOM 0 HG13 ILE B 13 2.139 -5.166 6.867 1.00 0.45 H new ATOM 0 HG21 ILE B 13 2.417 -2.851 4.532 1.00 0.53 H new ATOM 0 HG22 ILE B 13 1.022 -1.878 5.057 1.00 0.53 H new ATOM 0 HG23 ILE B 13 2.223 -2.428 6.250 1.00 0.53 H new ATOM 0 HD11 ILE B 13 1.983 -7.317 5.710 1.00 0.45 H new ATOM 0 HD12 ILE B 13 0.360 -6.705 6.107 1.00 0.45 H new ATOM 0 HD13 ILE B 13 0.976 -6.579 4.442 1.00 0.45 H new ATOM 1835 N GLU B 14 -1.126 -5.812 7.725 1.00 0.40 N ATOM 1836 CA GLU B 14 -2.063 -6.945 7.880 1.00 0.43 C ATOM 1837 C GLU B 14 -3.401 -6.469 8.485 1.00 0.45 C ATOM 1838 O GLU B 14 -4.469 -6.925 8.066 1.00 0.48 O ATOM 1839 CB GLU B 14 -1.418 -8.041 8.772 1.00 0.46 C ATOM 1840 CG GLU B 14 -2.260 -9.301 9.010 1.00 0.57 C ATOM 1841 CD GLU B 14 -3.309 -9.153 10.106 1.00 0.64 C ATOM 1842 OE1 GLU B 14 -2.955 -8.712 11.221 1.00 0.92 O ATOM 1843 OE2 GLU B 14 -4.485 -9.482 9.848 1.00 1.00 O ATOM 0 H GLU B 14 -0.414 -5.769 8.454 1.00 0.40 H new ATOM 0 HA GLU B 14 -2.271 -7.366 6.897 1.00 0.43 H new ATOM 0 HB2 GLU B 14 -0.473 -8.341 8.318 1.00 0.46 H new ATOM 0 HB3 GLU B 14 -1.181 -7.599 9.740 1.00 0.46 H new ATOM 0 HG2 GLU B 14 -2.759 -9.572 8.080 1.00 0.57 H new ATOM 0 HG3 GLU B 14 -1.595 -10.125 9.268 1.00 0.57 H new ATOM 1850 N THR B 15 -3.331 -5.552 9.479 1.00 0.45 N ATOM 1851 CA THR B 15 -4.533 -5.013 10.153 1.00 0.49 C ATOM 1852 C THR B 15 -5.437 -4.221 9.180 1.00 0.47 C ATOM 1853 O THR B 15 -6.662 -4.261 9.319 1.00 0.50 O ATOM 1854 CB THR B 15 -4.161 -4.124 11.381 1.00 0.54 C ATOM 1855 OG1 THR B 15 -3.244 -4.822 12.232 1.00 0.75 O ATOM 1856 CG2 THR B 15 -5.392 -3.740 12.207 1.00 0.88 C ATOM 0 H THR B 15 -2.453 -5.171 9.831 1.00 0.45 H new ATOM 0 HA THR B 15 -5.094 -5.876 10.512 1.00 0.49 H new ATOM 0 HB THR B 15 -3.707 -3.214 10.989 1.00 0.54 H new ATOM 0 HG1 THR B 15 -2.343 -4.779 11.848 1.00 0.75 H new ATOM 0 HG21 THR B 15 -5.086 -3.122 13.051 1.00 0.88 H new ATOM 0 HG22 THR B 15 -6.089 -3.182 11.583 1.00 0.88 H new ATOM 0 HG23 THR B 15 -5.878 -4.643 12.576 1.00 0.88 H new ATOM 1864 N VAL B 16 -4.833 -3.510 8.199 1.00 0.45 N ATOM 1865 CA VAL B 16 -5.603 -2.726 7.197 1.00 0.47 C ATOM 1866 C VAL B 16 -6.532 -3.649 6.364 1.00 0.47 C ATOM 1867 O VAL B 16 -7.615 -3.224 5.948 1.00 0.52 O ATOM 1868 CB VAL B 16 -4.663 -1.906 6.240 1.00 0.49 C ATOM 1869 CG1 VAL B 16 -5.457 -1.083 5.213 1.00 0.56 C ATOM 1870 CG2 VAL B 16 -3.735 -0.989 7.040 1.00 0.53 C ATOM 0 H VAL B 16 -3.821 -3.461 8.078 1.00 0.45 H new ATOM 0 HA VAL B 16 -6.214 -2.016 7.755 1.00 0.47 H new ATOM 0 HB VAL B 16 -4.062 -2.631 5.692 1.00 0.49 H new ATOM 0 HG11 VAL B 16 -4.766 -0.534 4.574 1.00 0.56 H new ATOM 0 HG12 VAL B 16 -6.063 -1.751 4.601 1.00 0.56 H new ATOM 0 HG13 VAL B 16 -6.106 -0.380 5.734 1.00 0.56 H new ATOM 0 HG21 VAL B 16 -3.095 -0.433 6.356 1.00 0.53 H new ATOM 0 HG22 VAL B 16 -4.331 -0.291 7.628 1.00 0.53 H new ATOM 0 HG23 VAL B 16 -3.117 -1.590 7.708 1.00 0.53 H new ATOM 1880 N VAL B 17 -6.096 -4.908 6.135 1.00 0.46 N ATOM 1881 CA VAL B 17 -6.877 -5.900 5.372 1.00 0.50 C ATOM 1882 C VAL B 17 -8.101 -6.377 6.186 1.00 0.57 C ATOM 1883 O VAL B 17 -9.230 -6.283 5.710 1.00 0.97 O ATOM 1884 CB VAL B 17 -5.991 -7.137 4.960 1.00 0.53 C ATOM 1885 CG1 VAL B 17 -6.802 -8.231 4.241 1.00 0.63 C ATOM 1886 CG2 VAL B 17 -4.807 -6.693 4.091 1.00 0.55 C ATOM 0 H VAL B 17 -5.200 -5.260 6.472 1.00 0.46 H new ATOM 0 HA VAL B 17 -7.225 -5.411 4.462 1.00 0.50 H new ATOM 0 HB VAL B 17 -5.611 -7.573 5.884 1.00 0.53 H new ATOM 0 HG11 VAL B 17 -6.144 -9.059 3.980 1.00 0.63 H new ATOM 0 HG12 VAL B 17 -7.593 -8.590 4.900 1.00 0.63 H new ATOM 0 HG13 VAL B 17 -7.244 -7.819 3.334 1.00 0.63 H new ATOM 0 HG21 VAL B 17 -4.209 -7.563 3.818 1.00 0.55 H new ATOM 0 HG22 VAL B 17 -5.180 -6.211 3.187 1.00 0.55 H new ATOM 0 HG23 VAL B 17 -4.190 -5.989 4.649 1.00 0.55 H new ATOM 1896 N THR B 18 -7.858 -6.854 7.425 1.00 0.50 N ATOM 1897 CA THR B 18 -8.920 -7.395 8.309 1.00 0.52 C ATOM 1898 C THR B 18 -9.997 -6.365 8.722 1.00 0.54 C ATOM 1899 O THR B 18 -11.140 -6.759 8.978 1.00 0.67 O ATOM 1900 CB THR B 18 -8.319 -8.022 9.600 1.00 0.56 C ATOM 1901 OG1 THR B 18 -7.508 -7.058 10.289 1.00 0.58 O ATOM 1902 CG2 THR B 18 -7.471 -9.251 9.281 1.00 0.62 C ATOM 0 H THR B 18 -6.927 -6.876 7.842 1.00 0.50 H new ATOM 0 HA THR B 18 -9.411 -8.155 7.702 1.00 0.52 H new ATOM 0 HB THR B 18 -9.151 -8.328 10.234 1.00 0.56 H new ATOM 0 HG1 THR B 18 -7.524 -6.208 9.801 1.00 0.58 H new ATOM 0 HG21 THR B 18 -7.067 -9.664 10.205 1.00 0.62 H new ATOM 0 HG22 THR B 18 -8.089 -10.002 8.788 1.00 0.62 H new ATOM 0 HG23 THR B 18 -6.651 -8.966 8.622 1.00 0.62 H new ATOM 1910 N THR B 19 -9.647 -5.064 8.783 1.00 0.53 N ATOM 1911 CA THR B 19 -10.605 -4.015 9.200 1.00 0.57 C ATOM 1912 C THR B 19 -11.698 -3.741 8.139 1.00 0.57 C ATOM 1913 O THR B 19 -12.884 -3.722 8.481 1.00 0.66 O ATOM 1914 CB THR B 19 -9.874 -2.682 9.559 1.00 0.60 C ATOM 1915 OG1 THR B 19 -8.773 -2.951 10.440 1.00 0.61 O ATOM 1916 CG2 THR B 19 -10.809 -1.677 10.237 1.00 0.69 C ATOM 0 H THR B 19 -8.717 -4.715 8.551 1.00 0.53 H new ATOM 0 HA THR B 19 -11.099 -4.404 10.091 1.00 0.57 H new ATOM 0 HB THR B 19 -9.521 -2.247 8.624 1.00 0.60 H new ATOM 0 HG1 THR B 19 -8.037 -3.351 9.931 1.00 0.61 H new ATOM 0 HG21 THR B 19 -10.258 -0.766 10.468 1.00 0.69 H new ATOM 0 HG22 THR B 19 -11.636 -1.441 9.568 1.00 0.69 H new ATOM 0 HG23 THR B 19 -11.200 -2.108 11.159 1.00 0.69 H new ATOM 1924 N PHE B 20 -11.301 -3.537 6.862 1.00 0.56 N ATOM 1925 CA PHE B 20 -12.268 -3.238 5.780 1.00 0.60 C ATOM 1926 C PHE B 20 -12.802 -4.502 5.066 1.00 0.60 C ATOM 1927 O PHE B 20 -13.860 -4.430 4.430 1.00 0.94 O ATOM 1928 CB PHE B 20 -11.655 -2.251 4.752 1.00 0.68 C ATOM 1929 CG PHE B 20 -12.636 -1.743 3.703 1.00 0.75 C ATOM 1930 CD1 PHE B 20 -13.785 -1.048 4.073 1.00 0.91 C ATOM 1931 CD2 PHE B 20 -12.415 -1.974 2.351 1.00 0.80 C ATOM 1932 CE1 PHE B 20 -14.680 -0.598 3.119 1.00 1.02 C ATOM 1933 CE2 PHE B 20 -13.311 -1.528 1.398 1.00 0.90 C ATOM 1934 CZ PHE B 20 -14.444 -0.840 1.782 1.00 0.97 C ATOM 0 H PHE B 20 -10.328 -3.573 6.557 1.00 0.56 H new ATOM 0 HA PHE B 20 -13.127 -2.770 6.262 1.00 0.60 H new ATOM 0 HB2 PHE B 20 -11.242 -1.397 5.289 1.00 0.68 H new ATOM 0 HB3 PHE B 20 -10.824 -2.742 4.246 1.00 0.68 H new ATOM 0 HD1 PHE B 20 -13.980 -0.858 5.118 1.00 0.91 H new ATOM 0 HD2 PHE B 20 -11.530 -2.510 2.040 1.00 0.80 H new ATOM 0 HE1 PHE B 20 -15.564 -0.057 3.421 1.00 1.02 H new ATOM 0 HE2 PHE B 20 -13.124 -1.718 0.351 1.00 0.90 H new ATOM 0 HZ PHE B 20 -15.144 -0.492 1.037 1.00 0.97 H new ATOM 1944 N PHE B 21 -12.102 -5.656 5.167 1.00 0.71 N ATOM 1945 CA PHE B 21 -12.563 -6.906 4.503 1.00 0.72 C ATOM 1946 C PHE B 21 -13.907 -7.422 5.071 1.00 0.68 C ATOM 1947 O PHE B 21 -14.603 -8.185 4.396 1.00 0.71 O ATOM 1948 CB PHE B 21 -11.482 -8.015 4.565 1.00 1.01 C ATOM 1949 CG PHE B 21 -10.582 -8.089 3.335 1.00 1.63 C ATOM 1950 CD1 PHE B 21 -10.039 -6.940 2.762 1.00 1.93 C ATOM 1951 CD2 PHE B 21 -10.289 -9.317 2.748 1.00 2.26 C ATOM 1952 CE1 PHE B 21 -9.232 -7.020 1.641 1.00 2.67 C ATOM 1953 CE2 PHE B 21 -9.484 -9.395 1.630 1.00 2.92 C ATOM 1954 CZ PHE B 21 -8.956 -8.246 1.077 1.00 3.08 C ATOM 0 H PHE B 21 -11.232 -5.752 5.691 1.00 0.71 H new ATOM 0 HA PHE B 21 -12.733 -6.650 3.457 1.00 0.72 H new ATOM 0 HB2 PHE B 21 -10.861 -7.851 5.445 1.00 1.01 H new ATOM 0 HB3 PHE B 21 -11.975 -8.978 4.698 1.00 1.01 H new ATOM 0 HD1 PHE B 21 -10.251 -5.975 3.199 1.00 1.93 H new ATOM 0 HD2 PHE B 21 -10.698 -10.221 3.174 1.00 2.26 H new ATOM 0 HE1 PHE B 21 -8.818 -6.121 1.208 1.00 2.67 H new ATOM 0 HE2 PHE B 21 -9.267 -10.356 1.187 1.00 2.92 H new ATOM 0 HZ PHE B 21 -8.326 -8.308 0.202 1.00 3.08 H new ATOM 1964 N THR B 22 -14.268 -7.004 6.308 1.00 0.76 N ATOM 1965 CA THR B 22 -15.542 -7.400 6.945 1.00 0.91 C ATOM 1966 C THR B 22 -16.758 -6.877 6.141 1.00 0.84 C ATOM 1967 O THR B 22 -17.817 -7.510 6.133 1.00 1.01 O ATOM 1968 CB THR B 22 -15.637 -6.874 8.415 1.00 1.10 C ATOM 1969 OG1 THR B 22 -14.351 -6.952 9.059 1.00 1.23 O ATOM 1970 CG2 THR B 22 -16.667 -7.663 9.237 1.00 1.37 C ATOM 0 H THR B 22 -13.691 -6.391 6.884 1.00 0.76 H new ATOM 0 HA THR B 22 -15.560 -8.490 6.957 1.00 0.91 H new ATOM 0 HB THR B 22 -15.962 -5.835 8.366 1.00 1.10 H new ATOM 0 HG1 THR B 22 -14.424 -6.618 9.977 1.00 1.23 H new ATOM 0 HG21 THR B 22 -16.703 -7.267 10.252 1.00 1.37 H new ATOM 0 HG22 THR B 22 -17.650 -7.569 8.776 1.00 1.37 H new ATOM 0 HG23 THR B 22 -16.380 -8.714 9.268 1.00 1.37 H new ATOM 1978 N PHE B 23 -16.591 -5.712 5.474 1.00 0.69 N ATOM 1979 CA PHE B 23 -17.659 -5.091 4.662 1.00 0.75 C ATOM 1980 C PHE B 23 -17.451 -5.341 3.154 1.00 0.70 C ATOM 1981 O PHE B 23 -18.425 -5.366 2.395 1.00 0.83 O ATOM 1982 CB PHE B 23 -17.738 -3.580 4.948 1.00 0.84 C ATOM 1983 CG PHE B 23 -17.992 -3.255 6.412 1.00 1.00 C ATOM 1984 CD1 PHE B 23 -19.286 -3.242 6.923 1.00 1.32 C ATOM 1985 CD2 PHE B 23 -16.938 -2.969 7.274 1.00 1.03 C ATOM 1986 CE1 PHE B 23 -19.521 -2.952 8.253 1.00 1.54 C ATOM 1987 CE2 PHE B 23 -17.174 -2.679 8.607 1.00 1.27 C ATOM 1988 CZ PHE B 23 -18.465 -2.671 9.097 1.00 1.48 C ATOM 0 H PHE B 23 -15.720 -5.181 5.484 1.00 0.69 H new ATOM 0 HA PHE B 23 -18.602 -5.558 4.946 1.00 0.75 H new ATOM 0 HB2 PHE B 23 -16.806 -3.109 4.635 1.00 0.84 H new ATOM 0 HB3 PHE B 23 -18.533 -3.144 4.343 1.00 0.84 H new ATOM 0 HD1 PHE B 23 -20.118 -3.462 6.271 1.00 1.32 H new ATOM 0 HD2 PHE B 23 -15.925 -2.973 6.899 1.00 1.03 H new ATOM 0 HE1 PHE B 23 -20.532 -2.945 8.633 1.00 1.54 H new ATOM 0 HE2 PHE B 23 -16.347 -2.459 9.265 1.00 1.27 H new ATOM 0 HZ PHE B 23 -18.648 -2.446 10.137 1.00 1.48 H new ATOM 1998 N ALA B 24 -16.181 -5.530 2.719 1.00 0.61 N ATOM 1999 CA ALA B 24 -15.860 -5.789 1.297 1.00 0.67 C ATOM 2000 C ALA B 24 -16.276 -7.208 0.845 1.00 0.65 C ATOM 2001 O ALA B 24 -16.498 -7.433 -0.349 1.00 0.85 O ATOM 2002 CB ALA B 24 -14.369 -5.574 1.033 1.00 0.77 C ATOM 0 H ALA B 24 -15.366 -5.508 3.332 1.00 0.61 H new ATOM 0 HA ALA B 24 -16.439 -5.076 0.710 1.00 0.67 H new ATOM 0 HB1 ALA B 24 -14.154 -5.769 -0.017 1.00 0.77 H new ATOM 0 HB2 ALA B 24 -14.102 -4.545 1.273 1.00 0.77 H new ATOM 0 HB3 ALA B 24 -13.788 -6.254 1.655 1.00 0.77 H new ATOM 2008 N ARG B 25 -16.378 -8.158 1.807 1.00 0.62 N ATOM 2009 CA ARG B 25 -16.770 -9.562 1.529 1.00 0.68 C ATOM 2010 C ARG B 25 -18.173 -9.680 0.881 1.00 0.70 C ATOM 2011 O ARG B 25 -18.411 -10.596 0.088 1.00 0.87 O ATOM 2012 CB ARG B 25 -16.725 -10.398 2.834 1.00 0.77 C ATOM 2013 CG ARG B 25 -17.756 -9.973 3.893 1.00 0.80 C ATOM 2014 CD ARG B 25 -17.589 -10.715 5.217 1.00 1.01 C ATOM 2015 NE ARG B 25 -18.596 -10.306 6.219 1.00 1.10 N ATOM 2016 CZ ARG B 25 -18.710 -10.823 7.461 1.00 1.38 C ATOM 2017 NH1 ARG B 25 -17.901 -11.800 7.891 1.00 1.73 N ATOM 2018 NH2 ARG B 25 -19.652 -10.353 8.280 1.00 1.48 N ATOM 0 H ARG B 25 -16.192 -7.974 2.793 1.00 0.62 H new ATOM 0 HA ARG B 25 -16.049 -9.951 0.810 1.00 0.68 H new ATOM 0 HB2 ARG B 25 -16.888 -11.447 2.586 1.00 0.77 H new ATOM 0 HB3 ARG B 25 -15.727 -10.324 3.265 1.00 0.77 H new ATOM 0 HG2 ARG B 25 -17.667 -8.901 4.069 1.00 0.80 H new ATOM 0 HG3 ARG B 25 -18.760 -10.150 3.507 1.00 0.80 H new ATOM 0 HD2 ARG B 25 -17.668 -11.788 5.042 1.00 1.01 H new ATOM 0 HD3 ARG B 25 -16.590 -10.529 5.612 1.00 1.01 H new ATOM 0 HE ARG B 25 -19.256 -9.576 5.951 1.00 1.10 H new ATOM 0 HH11 ARG B 25 -17.177 -12.171 7.275 1.00 1.73 H new ATOM 0 HH12 ARG B 25 -18.008 -12.173 8.834 1.00 1.73 H new ATOM 0 HH21 ARG B 25 -20.277 -9.611 7.966 1.00 1.48 H new ATOM 0 HH22 ARG B 25 -19.747 -10.736 9.221 1.00 1.48 H new ATOM 2032 N GLN B 26 -19.092 -8.754 1.231 1.00 0.71 N ATOM 2033 CA GLN B 26 -20.479 -8.760 0.711 1.00 0.79 C ATOM 2034 C GLN B 26 -20.545 -8.666 -0.834 1.00 0.73 C ATOM 2035 O GLN B 26 -21.447 -9.246 -1.443 1.00 0.84 O ATOM 2036 CB GLN B 26 -21.289 -7.614 1.360 1.00 0.90 C ATOM 2037 CG GLN B 26 -22.803 -7.837 1.384 1.00 1.09 C ATOM 2038 CD GLN B 26 -23.533 -6.841 2.286 1.00 1.31 C ATOM 2039 OE1 GLN B 26 -23.976 -5.789 1.827 1.00 1.46 O ATOM 2040 NE2 GLN B 26 -23.662 -7.166 3.576 1.00 1.68 N ATOM 0 H GLN B 26 -18.897 -7.988 1.876 1.00 0.71 H new ATOM 0 HA GLN B 26 -20.920 -9.720 0.981 1.00 0.79 H new ATOM 0 HB2 GLN B 26 -20.940 -7.474 2.383 1.00 0.90 H new ATOM 0 HB3 GLN B 26 -21.080 -6.689 0.822 1.00 0.90 H new ATOM 0 HG2 GLN B 26 -23.194 -7.756 0.370 1.00 1.09 H new ATOM 0 HG3 GLN B 26 -23.011 -8.851 1.726 1.00 1.09 H new ATOM 0 HE21 GLN B 26 -23.282 -8.047 3.920 1.00 1.68 H new ATOM 0 HE22 GLN B 26 -24.141 -6.533 4.216 1.00 1.68 H new ATOM 2049 N GLU B 27 -19.594 -7.935 -1.454 1.00 0.66 N ATOM 2050 CA GLU B 27 -19.549 -7.779 -2.923 1.00 0.71 C ATOM 2051 C GLU B 27 -18.695 -8.895 -3.567 1.00 0.88 C ATOM 2052 O GLU B 27 -18.116 -9.724 -2.857 1.00 1.45 O ATOM 2053 CB GLU B 27 -19.008 -6.378 -3.292 1.00 0.83 C ATOM 2054 CG GLU B 27 -19.915 -5.214 -2.870 1.00 0.93 C ATOM 2055 CD GLU B 27 -21.271 -5.213 -3.564 1.00 1.04 C ATOM 2056 OE1 GLU B 27 -21.343 -4.778 -4.732 1.00 1.23 O ATOM 2057 OE2 GLU B 27 -22.258 -5.655 -2.938 1.00 1.16 O ATOM 0 H GLU B 27 -18.848 -7.444 -0.960 1.00 0.66 H new ATOM 0 HA GLU B 27 -20.561 -7.870 -3.316 1.00 0.71 H new ATOM 0 HB2 GLU B 27 -18.030 -6.246 -2.829 1.00 0.83 H new ATOM 0 HB3 GLU B 27 -18.858 -6.333 -4.371 1.00 0.83 H new ATOM 0 HG2 GLU B 27 -20.068 -5.257 -1.792 1.00 0.93 H new ATOM 0 HG3 GLU B 27 -19.407 -4.273 -3.083 1.00 0.93 H new ATOM 2064 N GLY B 28 -18.628 -8.913 -4.921 1.00 0.73 N ATOM 2065 CA GLY B 28 -17.860 -9.932 -5.650 1.00 0.86 C ATOM 2066 C GLY B 28 -16.373 -9.965 -5.290 1.00 0.69 C ATOM 2067 O GLY B 28 -15.769 -8.912 -5.066 1.00 0.66 O ATOM 0 H GLY B 28 -19.097 -8.234 -5.521 1.00 0.73 H new ATOM 0 HA2 GLY B 28 -18.294 -10.912 -5.450 1.00 0.86 H new ATOM 0 HA3 GLY B 28 -17.960 -9.752 -6.720 1.00 0.86 H new ATOM 2071 N ARG B 29 -15.789 -11.193 -5.237 1.00 0.68 N ATOM 2072 CA ARG B 29 -14.361 -11.419 -4.903 1.00 0.65 C ATOM 2073 C ARG B 29 -14.013 -10.922 -3.482 1.00 0.62 C ATOM 2074 O ARG B 29 -14.069 -9.719 -3.209 1.00 0.69 O ATOM 2075 CB ARG B 29 -13.423 -10.770 -5.957 1.00 0.66 C ATOM 2076 CG ARG B 29 -13.226 -11.610 -7.222 1.00 0.84 C ATOM 2077 CD ARG B 29 -12.301 -10.927 -8.233 1.00 1.28 C ATOM 2078 NE ARG B 29 -12.051 -11.761 -9.428 1.00 1.44 N ATOM 2079 CZ ARG B 29 -11.400 -11.351 -10.539 1.00 1.93 C ATOM 2080 NH1 ARG B 29 -10.898 -10.113 -10.641 1.00 2.62 N ATOM 2081 NH2 ARG B 29 -11.238 -12.202 -11.554 1.00 2.09 N ATOM 0 H ARG B 29 -16.300 -12.055 -5.426 1.00 0.68 H new ATOM 0 HA ARG B 29 -14.200 -12.497 -4.922 1.00 0.65 H new ATOM 0 HB2 ARG B 29 -13.829 -9.798 -6.239 1.00 0.66 H new ATOM 0 HB3 ARG B 29 -12.450 -10.589 -5.499 1.00 0.66 H new ATOM 0 HG2 ARG B 29 -12.811 -12.580 -6.950 1.00 0.84 H new ATOM 0 HG3 ARG B 29 -14.194 -11.796 -7.687 1.00 0.84 H new ATOM 0 HD2 ARG B 29 -12.743 -9.979 -8.542 1.00 1.28 H new ATOM 0 HD3 ARG B 29 -11.351 -10.694 -7.752 1.00 1.28 H new ATOM 0 HE ARG B 29 -12.397 -12.720 -9.413 1.00 1.44 H new ATOM 0 HH11 ARG B 29 -11.003 -9.455 -9.869 1.00 2.62 H new ATOM 0 HH12 ARG B 29 -10.411 -9.829 -11.491 1.00 2.62 H new ATOM 0 HH21 ARG B 29 -11.604 -13.152 -11.487 1.00 2.09 H new ATOM 0 HH22 ARG B 29 -10.748 -11.903 -12.397 1.00 2.09 H new ATOM 2095 N LYS B 30 -13.646 -11.864 -2.581 1.00 0.64 N ATOM 2096 CA LYS B 30 -13.280 -11.528 -1.184 1.00 0.65 C ATOM 2097 C LYS B 30 -12.033 -10.620 -1.127 1.00 0.63 C ATOM 2098 O LYS B 30 -11.989 -9.688 -0.319 1.00 0.67 O ATOM 2099 CB LYS B 30 -13.033 -12.805 -0.346 1.00 0.73 C ATOM 2100 CG LYS B 30 -14.260 -13.711 -0.163 1.00 0.79 C ATOM 2101 CD LYS B 30 -15.295 -13.128 0.809 1.00 0.87 C ATOM 2102 CE LYS B 30 -16.410 -14.131 1.133 1.00 1.01 C ATOM 2103 NZ LYS B 30 -17.311 -14.397 -0.029 1.00 1.11 N ATOM 0 H LYS B 30 -13.596 -12.860 -2.796 1.00 0.64 H new ATOM 0 HA LYS B 30 -14.124 -10.985 -0.758 1.00 0.65 H new ATOM 0 HB2 LYS B 30 -12.240 -13.384 -0.820 1.00 0.73 H new ATOM 0 HB3 LYS B 30 -12.668 -12.510 0.638 1.00 0.73 H new ATOM 0 HG2 LYS B 30 -14.731 -13.875 -1.132 1.00 0.79 H new ATOM 0 HG3 LYS B 30 -13.935 -14.685 0.202 1.00 0.79 H new ATOM 0 HD2 LYS B 30 -14.797 -12.829 1.732 1.00 0.87 H new ATOM 0 HD3 LYS B 30 -15.732 -12.228 0.376 1.00 0.87 H new ATOM 0 HE2 LYS B 30 -15.963 -15.069 1.462 1.00 1.01 H new ATOM 0 HE3 LYS B 30 -17.002 -13.751 1.966 1.00 1.01 H new ATOM 0 HZ1 LYS B 30 -18.044 -15.081 0.249 1.00 1.11 H new ATOM 0 HZ2 LYS B 30 -17.762 -13.509 -0.329 1.00 1.11 H new ATOM 0 HZ3 LYS B 30 -16.755 -14.786 -0.817 1.00 1.11 H new ATOM 2117 N ASP B 31 -11.029 -10.897 -1.990 1.00 0.65 N ATOM 2118 CA ASP B 31 -9.789 -10.093 -2.048 1.00 0.69 C ATOM 2119 C ASP B 31 -10.039 -8.697 -2.656 1.00 0.64 C ATOM 2120 O ASP B 31 -9.319 -7.747 -2.333 1.00 0.88 O ATOM 2121 CB ASP B 31 -8.690 -10.821 -2.853 1.00 0.83 C ATOM 2122 CG ASP B 31 -8.073 -11.988 -2.096 1.00 0.94 C ATOM 2123 OD1 ASP B 31 -8.744 -13.033 -1.964 1.00 1.24 O ATOM 2124 OD2 ASP B 31 -6.920 -11.854 -1.631 1.00 1.36 O ATOM 0 H ASP B 31 -11.054 -11.670 -2.655 1.00 0.65 H new ATOM 0 HA ASP B 31 -9.450 -9.964 -1.020 1.00 0.69 H new ATOM 0 HB2 ASP B 31 -9.114 -11.185 -3.789 1.00 0.83 H new ATOM 0 HB3 ASP B 31 -7.907 -10.109 -3.114 1.00 0.83 H new ATOM 2129 N SER B 32 -11.064 -8.579 -3.531 1.00 0.65 N ATOM 2130 CA SER B 32 -11.396 -7.305 -4.182 1.00 0.59 C ATOM 2131 C SER B 32 -12.273 -6.409 -3.293 1.00 0.57 C ATOM 2132 O SER B 32 -13.098 -6.901 -2.515 1.00 0.64 O ATOM 2133 CB SER B 32 -12.099 -7.557 -5.524 1.00 0.59 C ATOM 2134 OG SER B 32 -12.277 -6.351 -6.248 1.00 1.13 O ATOM 0 H SER B 32 -11.671 -9.354 -3.798 1.00 0.65 H new ATOM 0 HA SER B 32 -10.457 -6.780 -4.355 1.00 0.59 H new ATOM 0 HB2 SER B 32 -11.512 -8.257 -6.118 1.00 0.59 H new ATOM 0 HB3 SER B 32 -13.068 -8.024 -5.347 1.00 0.59 H new ATOM 0 HG SER B 32 -11.811 -6.414 -7.108 1.00 1.13 H new ATOM 2140 N LEU B 33 -12.073 -5.083 -3.432 1.00 0.55 N ATOM 2141 CA LEU B 33 -12.821 -4.060 -2.681 1.00 0.56 C ATOM 2142 C LEU B 33 -13.869 -3.398 -3.595 1.00 0.55 C ATOM 2143 O LEU B 33 -13.670 -3.314 -4.812 1.00 0.72 O ATOM 2144 CB LEU B 33 -11.849 -2.984 -2.121 1.00 0.59 C ATOM 2145 CG LEU B 33 -10.954 -3.403 -0.923 1.00 0.69 C ATOM 2146 CD1 LEU B 33 -9.978 -4.524 -1.297 1.00 0.79 C ATOM 2147 CD2 LEU B 33 -10.183 -2.194 -0.386 1.00 0.75 C ATOM 0 H LEU B 33 -11.383 -4.691 -4.073 1.00 0.55 H new ATOM 0 HA LEU B 33 -13.330 -4.541 -1.846 1.00 0.56 H new ATOM 0 HB2 LEU B 33 -11.199 -2.658 -2.933 1.00 0.59 H new ATOM 0 HB3 LEU B 33 -12.439 -2.119 -1.818 1.00 0.59 H new ATOM 0 HG LEU B 33 -11.614 -3.787 -0.145 1.00 0.69 H new ATOM 0 HD11 LEU B 33 -9.373 -4.784 -0.429 1.00 0.79 H new ATOM 0 HD12 LEU B 33 -10.538 -5.400 -1.625 1.00 0.79 H new ATOM 0 HD13 LEU B 33 -9.328 -4.186 -2.104 1.00 0.79 H new ATOM 0 HD21 LEU B 33 -9.560 -2.503 0.453 1.00 0.75 H new ATOM 0 HD22 LEU B 33 -9.552 -1.785 -1.175 1.00 0.75 H new ATOM 0 HD23 LEU B 33 -10.887 -1.432 -0.053 1.00 0.75 H new ATOM 2159 N SER B 34 -14.982 -2.924 -3.002 1.00 0.52 N ATOM 2160 CA SER B 34 -16.068 -2.265 -3.760 1.00 0.53 C ATOM 2161 C SER B 34 -15.668 -0.846 -4.202 1.00 0.50 C ATOM 2162 O SER B 34 -14.767 -0.248 -3.619 1.00 0.52 O ATOM 2163 CB SER B 34 -17.345 -2.208 -2.906 1.00 0.62 C ATOM 2164 OG SER B 34 -18.431 -1.636 -3.621 1.00 0.69 O ATOM 0 H SER B 34 -15.154 -2.985 -1.999 1.00 0.52 H new ATOM 0 HA SER B 34 -16.256 -2.855 -4.657 1.00 0.53 H new ATOM 0 HB2 SER B 34 -17.612 -3.214 -2.583 1.00 0.62 H new ATOM 0 HB3 SER B 34 -17.155 -1.624 -2.005 1.00 0.62 H new ATOM 0 HG SER B 34 -19.226 -1.617 -3.048 1.00 0.69 H new ATOM 2170 N VAL B 35 -16.355 -0.322 -5.242 1.00 0.52 N ATOM 2171 CA VAL B 35 -16.091 1.033 -5.774 1.00 0.53 C ATOM 2172 C VAL B 35 -16.868 2.133 -4.996 1.00 0.48 C ATOM 2173 O VAL B 35 -16.499 3.309 -5.064 1.00 0.52 O ATOM 2174 CB VAL B 35 -16.409 1.115 -7.312 1.00 0.64 C ATOM 2175 CG1 VAL B 35 -17.917 1.061 -7.607 1.00 0.67 C ATOM 2176 CG2 VAL B 35 -15.768 2.354 -7.952 1.00 0.71 C ATOM 0 H VAL B 35 -17.099 -0.820 -5.731 1.00 0.52 H new ATOM 0 HA VAL B 35 -15.027 1.222 -5.631 1.00 0.53 H new ATOM 0 HB VAL B 35 -15.965 0.229 -7.766 1.00 0.64 H new ATOM 0 HG11 VAL B 35 -18.080 1.121 -8.683 1.00 0.67 H new ATOM 0 HG12 VAL B 35 -18.328 0.125 -7.230 1.00 0.67 H new ATOM 0 HG13 VAL B 35 -18.414 1.899 -7.118 1.00 0.67 H new ATOM 0 HG21 VAL B 35 -16.008 2.380 -9.015 1.00 0.71 H new ATOM 0 HG22 VAL B 35 -16.154 3.253 -7.471 1.00 0.71 H new ATOM 0 HG23 VAL B 35 -14.686 2.311 -7.825 1.00 0.71 H new ATOM 2186 N ASN B 36 -17.937 1.742 -4.263 1.00 0.47 N ATOM 2187 CA ASN B 36 -18.755 2.689 -3.483 1.00 0.48 C ATOM 2188 C ASN B 36 -18.382 2.660 -1.985 1.00 0.46 C ATOM 2189 O ASN B 36 -18.276 3.717 -1.363 1.00 0.66 O ATOM 2190 CB ASN B 36 -20.255 2.367 -3.671 1.00 0.55 C ATOM 2191 CG ASN B 36 -21.166 3.559 -3.382 1.00 0.64 C ATOM 2192 OD1 ASN B 36 -21.490 4.331 -4.285 1.00 0.83 O ATOM 2193 ND2 ASN B 36 -21.584 3.718 -2.125 1.00 0.79 N ATOM 0 H ASN B 36 -18.250 0.773 -4.198 1.00 0.47 H new ATOM 0 HA ASN B 36 -18.554 3.694 -3.853 1.00 0.48 H new ATOM 0 HB2 ASN B 36 -20.422 2.029 -4.694 1.00 0.55 H new ATOM 0 HB3 ASN B 36 -20.528 1.541 -3.014 1.00 0.55 H new ATOM 0 HD21 ASN B 36 -22.193 4.500 -1.885 1.00 0.79 H new ATOM 0 HD22 ASN B 36 -21.294 3.057 -1.404 1.00 0.79 H new ATOM 2200 N GLU B 37 -18.172 1.447 -1.415 1.00 0.46 N ATOM 2201 CA GLU B 37 -17.826 1.296 0.022 1.00 0.50 C ATOM 2202 C GLU B 37 -16.430 1.862 0.358 1.00 0.45 C ATOM 2203 O GLU B 37 -16.249 2.431 1.438 1.00 0.46 O ATOM 2204 CB GLU B 37 -17.916 -0.177 0.479 1.00 0.62 C ATOM 2205 CG GLU B 37 -19.316 -0.790 0.365 1.00 0.69 C ATOM 2206 CD GLU B 37 -19.415 -2.164 1.009 1.00 0.88 C ATOM 2207 OE1 GLU B 37 -18.903 -3.136 0.414 1.00 1.28 O ATOM 2208 OE2 GLU B 37 -20.007 -2.265 2.106 1.00 1.61 O ATOM 0 H GLU B 37 -18.235 0.565 -1.924 1.00 0.46 H new ATOM 0 HA GLU B 37 -18.566 1.881 0.569 1.00 0.50 H new ATOM 0 HB2 GLU B 37 -17.222 -0.772 -0.115 1.00 0.62 H new ATOM 0 HB3 GLU B 37 -17.586 -0.244 1.516 1.00 0.62 H new ATOM 0 HG2 GLU B 37 -20.039 -0.122 0.833 1.00 0.69 H new ATOM 0 HG3 GLU B 37 -19.589 -0.867 -0.688 1.00 0.69 H new ATOM 2215 N PHE B 38 -15.442 1.703 -0.558 1.00 0.43 N ATOM 2216 CA PHE B 38 -14.074 2.227 -0.329 1.00 0.43 C ATOM 2217 C PHE B 38 -14.090 3.774 -0.306 1.00 0.39 C ATOM 2218 O PHE B 38 -13.362 4.396 0.473 1.00 0.42 O ATOM 2219 CB PHE B 38 -13.069 1.666 -1.379 1.00 0.48 C ATOM 2220 CG PHE B 38 -12.756 2.579 -2.558 1.00 0.46 C ATOM 2221 CD1 PHE B 38 -13.584 2.615 -3.669 1.00 0.52 C ATOM 2222 CD2 PHE B 38 -11.632 3.396 -2.546 1.00 0.55 C ATOM 2223 CE1 PHE B 38 -13.302 3.439 -4.738 1.00 0.61 C ATOM 2224 CE2 PHE B 38 -11.347 4.223 -3.614 1.00 0.65 C ATOM 2225 CZ PHE B 38 -12.183 4.243 -4.712 1.00 0.66 C ATOM 0 H PHE B 38 -15.565 1.223 -1.450 1.00 0.43 H new ATOM 0 HA PHE B 38 -13.729 1.884 0.646 1.00 0.43 H new ATOM 0 HB2 PHE B 38 -12.135 1.431 -0.869 1.00 0.48 H new ATOM 0 HB3 PHE B 38 -13.465 0.728 -1.767 1.00 0.48 H new ATOM 0 HD1 PHE B 38 -14.463 1.988 -3.698 1.00 0.52 H new ATOM 0 HD2 PHE B 38 -10.973 3.384 -1.690 1.00 0.55 H new ATOM 0 HE1 PHE B 38 -13.958 3.454 -5.596 1.00 0.61 H new ATOM 0 HE2 PHE B 38 -10.471 4.854 -3.590 1.00 0.65 H new ATOM 0 HZ PHE B 38 -11.961 4.888 -5.549 1.00 0.66 H new ATOM 2235 N LYS B 39 -14.937 4.375 -1.176 1.00 0.37 N ATOM 2236 CA LYS B 39 -15.112 5.841 -1.257 1.00 0.38 C ATOM 2237 C LYS B 39 -15.714 6.383 0.062 1.00 0.36 C ATOM 2238 O LYS B 39 -15.358 7.478 0.507 1.00 0.39 O ATOM 2239 CB LYS B 39 -16.020 6.190 -2.462 1.00 0.43 C ATOM 2240 CG LYS B 39 -16.205 7.688 -2.740 1.00 0.50 C ATOM 2241 CD LYS B 39 -17.132 7.931 -3.937 1.00 0.60 C ATOM 2242 CE LYS B 39 -17.528 9.402 -4.090 1.00 0.70 C ATOM 2243 NZ LYS B 39 -16.392 10.271 -4.525 1.00 0.81 N ATOM 0 H LYS B 39 -15.515 3.857 -1.838 1.00 0.37 H new ATOM 0 HA LYS B 39 -14.140 6.313 -1.403 1.00 0.38 H new ATOM 0 HB2 LYS B 39 -15.605 5.722 -3.354 1.00 0.43 H new ATOM 0 HB3 LYS B 39 -17.001 5.746 -2.296 1.00 0.43 H new ATOM 0 HG2 LYS B 39 -16.617 8.174 -1.856 1.00 0.50 H new ATOM 0 HG3 LYS B 39 -15.234 8.145 -2.932 1.00 0.50 H new ATOM 0 HD2 LYS B 39 -16.637 7.596 -4.848 1.00 0.60 H new ATOM 0 HD3 LYS B 39 -18.032 7.327 -3.823 1.00 0.60 H new ATOM 0 HE2 LYS B 39 -18.337 9.481 -4.816 1.00 0.70 H new ATOM 0 HE3 LYS B 39 -17.916 9.769 -3.140 1.00 0.70 H new ATOM 0 HZ1 LYS B 39 -16.720 11.254 -4.611 1.00 0.81 H new ATOM 0 HZ2 LYS B 39 -15.628 10.222 -3.821 1.00 0.81 H new ATOM 0 HZ3 LYS B 39 -16.037 9.943 -5.446 1.00 0.81 H new ATOM 2257 N GLU B 40 -16.628 5.594 0.674 1.00 0.35 N ATOM 2258 CA GLU B 40 -17.264 5.953 1.959 1.00 0.38 C ATOM 2259 C GLU B 40 -16.269 5.816 3.132 1.00 0.38 C ATOM 2260 O GLU B 40 -16.395 6.526 4.134 1.00 0.41 O ATOM 2261 CB GLU B 40 -18.514 5.078 2.209 1.00 0.43 C ATOM 2262 CG GLU B 40 -19.657 5.345 1.230 1.00 0.47 C ATOM 2263 CD GLU B 40 -20.851 4.428 1.442 1.00 0.56 C ATOM 2264 OE1 GLU B 40 -20.803 3.271 0.971 1.00 0.63 O ATOM 2265 OE2 GLU B 40 -21.836 4.870 2.074 1.00 0.69 O ATOM 0 H GLU B 40 -16.941 4.701 0.294 1.00 0.35 H new ATOM 0 HA GLU B 40 -17.573 6.996 1.899 1.00 0.38 H new ATOM 0 HB2 GLU B 40 -18.230 4.028 2.144 1.00 0.43 H new ATOM 0 HB3 GLU B 40 -18.870 5.250 3.225 1.00 0.43 H new ATOM 0 HG2 GLU B 40 -19.980 6.381 1.332 1.00 0.47 H new ATOM 0 HG3 GLU B 40 -19.290 5.224 0.211 1.00 0.47 H new ATOM 2272 N LEU B 41 -15.282 4.893 3.001 1.00 0.37 N ATOM 2273 CA LEU B 41 -14.238 4.681 4.032 1.00 0.40 C ATOM 2274 C LEU B 41 -13.353 5.938 4.178 1.00 0.38 C ATOM 2275 O LEU B 41 -12.934 6.275 5.288 1.00 0.40 O ATOM 2276 CB LEU B 41 -13.365 3.452 3.668 1.00 0.44 C ATOM 2277 CG LEU B 41 -12.404 2.921 4.768 1.00 0.55 C ATOM 2278 CD1 LEU B 41 -13.170 2.185 5.874 1.00 0.68 C ATOM 2279 CD2 LEU B 41 -11.333 2.006 4.157 1.00 0.64 C ATOM 0 H LEU B 41 -15.189 4.283 2.189 1.00 0.37 H new ATOM 0 HA LEU B 41 -14.731 4.493 4.986 1.00 0.40 H new ATOM 0 HB2 LEU B 41 -14.029 2.638 3.377 1.00 0.44 H new ATOM 0 HB3 LEU B 41 -12.769 3.707 2.791 1.00 0.44 H new ATOM 0 HG LEU B 41 -11.911 3.782 5.219 1.00 0.55 H new ATOM 0 HD11 LEU B 41 -12.468 1.827 6.627 1.00 0.68 H new ATOM 0 HD12 LEU B 41 -13.883 2.866 6.338 1.00 0.68 H new ATOM 0 HD13 LEU B 41 -13.705 1.338 5.444 1.00 0.68 H new ATOM 0 HD21 LEU B 41 -10.671 1.645 4.944 1.00 0.64 H new ATOM 0 HD22 LEU B 41 -11.814 1.158 3.670 1.00 0.64 H new ATOM 0 HD23 LEU B 41 -10.753 2.565 3.423 1.00 0.64 H new ATOM 2291 N VAL B 42 -13.079 6.624 3.043 1.00 0.37 N ATOM 2292 CA VAL B 42 -12.263 7.854 3.034 1.00 0.38 C ATOM 2293 C VAL B 42 -13.059 9.056 3.591 1.00 0.39 C ATOM 2294 O VAL B 42 -12.468 9.960 4.187 1.00 0.43 O ATOM 2295 CB VAL B 42 -11.710 8.181 1.600 1.00 0.43 C ATOM 2296 CG1 VAL B 42 -10.869 9.467 1.579 1.00 0.48 C ATOM 2297 CG2 VAL B 42 -10.886 7.005 1.053 1.00 0.47 C ATOM 0 H VAL B 42 -13.414 6.343 2.121 1.00 0.37 H new ATOM 0 HA VAL B 42 -11.409 7.672 3.686 1.00 0.38 H new ATOM 0 HB VAL B 42 -12.576 8.343 0.958 1.00 0.43 H new ATOM 0 HG11 VAL B 42 -10.510 9.650 0.566 1.00 0.48 H new ATOM 0 HG12 VAL B 42 -11.482 10.308 1.904 1.00 0.48 H new ATOM 0 HG13 VAL B 42 -10.018 9.356 2.252 1.00 0.48 H new ATOM 0 HG21 VAL B 42 -10.513 7.253 0.059 1.00 0.47 H new ATOM 0 HG22 VAL B 42 -10.045 6.810 1.718 1.00 0.47 H new ATOM 0 HG23 VAL B 42 -11.515 6.117 0.993 1.00 0.47 H new ATOM 2307 N THR B 43 -14.399 9.054 3.414 1.00 0.38 N ATOM 2308 CA THR B 43 -15.264 10.147 3.901 1.00 0.42 C ATOM 2309 C THR B 43 -15.934 9.791 5.260 1.00 0.48 C ATOM 2310 O THR B 43 -17.017 10.305 5.573 1.00 0.83 O ATOM 2311 CB THR B 43 -16.362 10.494 2.837 1.00 0.44 C ATOM 2312 OG1 THR B 43 -15.864 10.253 1.510 1.00 0.46 O ATOM 2313 CG2 THR B 43 -16.816 11.956 2.934 1.00 0.49 C ATOM 0 H THR B 43 -14.903 8.307 2.937 1.00 0.38 H new ATOM 0 HA THR B 43 -14.629 11.019 4.059 1.00 0.42 H new ATOM 0 HB THR B 43 -17.218 9.851 3.043 1.00 0.44 H new ATOM 0 HG1 THR B 43 -15.808 9.287 1.352 1.00 0.46 H new ATOM 0 HG21 THR B 43 -17.577 12.152 2.178 1.00 0.49 H new ATOM 0 HG22 THR B 43 -17.231 12.143 3.924 1.00 0.49 H new ATOM 0 HG23 THR B 43 -15.963 12.614 2.768 1.00 0.49 H new ATOM 2321 N GLN B 44 -15.282 8.924 6.078 1.00 0.42 N ATOM 2322 CA GLN B 44 -15.832 8.520 7.388 1.00 0.44 C ATOM 2323 C GLN B 44 -14.728 8.077 8.376 1.00 0.44 C ATOM 2324 O GLN B 44 -14.667 8.595 9.495 1.00 0.50 O ATOM 2325 CB GLN B 44 -16.880 7.393 7.212 1.00 0.47 C ATOM 2326 CG GLN B 44 -17.864 7.269 8.375 1.00 0.58 C ATOM 2327 CD GLN B 44 -18.937 6.211 8.139 1.00 0.67 C ATOM 2328 OE1 GLN B 44 -19.988 6.504 7.570 1.00 0.91 O ATOM 2329 NE2 GLN B 44 -18.682 4.974 8.570 1.00 0.98 N ATOM 0 H GLN B 44 -14.383 8.498 5.852 1.00 0.42 H new ATOM 0 HA GLN B 44 -16.317 9.397 7.816 1.00 0.44 H new ATOM 0 HB2 GLN B 44 -17.440 7.572 6.294 1.00 0.47 H new ATOM 0 HB3 GLN B 44 -16.359 6.443 7.088 1.00 0.47 H new ATOM 0 HG2 GLN B 44 -17.314 7.024 9.284 1.00 0.58 H new ATOM 0 HG3 GLN B 44 -18.343 8.234 8.542 1.00 0.58 H new ATOM 0 HE21 GLN B 44 -17.799 4.769 9.038 1.00 0.98 H new ATOM 0 HE22 GLN B 44 -19.370 4.234 8.432 1.00 0.98 H new ATOM 2338 N GLN B 45 -13.860 7.127 7.956 1.00 0.42 N ATOM 2339 CA GLN B 45 -12.783 6.593 8.820 1.00 0.43 C ATOM 2340 C GLN B 45 -11.357 6.970 8.339 1.00 0.41 C ATOM 2341 O GLN B 45 -10.382 6.691 9.048 1.00 0.46 O ATOM 2342 CB GLN B 45 -12.941 5.058 8.935 1.00 0.47 C ATOM 2343 CG GLN B 45 -12.293 4.444 10.182 1.00 0.57 C ATOM 2344 CD GLN B 45 -12.748 3.008 10.458 1.00 0.62 C ATOM 2345 OE1 GLN B 45 -13.060 2.254 9.535 1.00 0.70 O ATOM 2346 NE2 GLN B 45 -12.794 2.616 11.734 1.00 0.73 N ATOM 0 H GLN B 45 -13.885 6.715 7.023 1.00 0.42 H new ATOM 0 HA GLN B 45 -12.890 7.058 9.800 1.00 0.43 H new ATOM 0 HB2 GLN B 45 -14.003 4.814 8.935 1.00 0.47 H new ATOM 0 HB3 GLN B 45 -12.507 4.593 8.049 1.00 0.47 H new ATOM 0 HG2 GLN B 45 -11.210 4.458 10.064 1.00 0.57 H new ATOM 0 HG3 GLN B 45 -12.527 5.064 11.047 1.00 0.57 H new ATOM 0 HE21 GLN B 45 -12.529 3.264 12.476 1.00 0.73 H new ATOM 0 HE22 GLN B 45 -13.094 1.669 11.966 1.00 0.73 H new ATOM 2355 N LEU B 46 -11.224 7.608 7.150 1.00 0.39 N ATOM 2356 CA LEU B 46 -9.906 8.022 6.620 1.00 0.38 C ATOM 2357 C LEU B 46 -9.944 9.455 5.990 1.00 0.38 C ATOM 2358 O LEU B 46 -9.285 9.685 4.970 1.00 0.41 O ATOM 2359 CB LEU B 46 -9.440 6.983 5.566 1.00 0.40 C ATOM 2360 CG LEU B 46 -7.912 6.781 5.431 1.00 0.41 C ATOM 2361 CD1 LEU B 46 -7.426 5.632 6.323 1.00 0.58 C ATOM 2362 CD2 LEU B 46 -7.525 6.543 3.964 1.00 0.62 C ATOM 0 H LEU B 46 -12.010 7.845 6.545 1.00 0.39 H new ATOM 0 HA LEU B 46 -9.201 8.061 7.450 1.00 0.38 H new ATOM 0 HB2 LEU B 46 -9.892 6.022 5.810 1.00 0.40 H new ATOM 0 HB3 LEU B 46 -9.833 7.282 4.594 1.00 0.40 H new ATOM 0 HG LEU B 46 -7.419 7.693 5.768 1.00 0.41 H new ATOM 0 HD11 LEU B 46 -6.349 5.513 6.208 1.00 0.58 H new ATOM 0 HD12 LEU B 46 -7.657 5.857 7.364 1.00 0.58 H new ATOM 0 HD13 LEU B 46 -7.926 4.709 6.032 1.00 0.58 H new ATOM 0 HD21 LEU B 46 -6.447 6.403 3.890 1.00 0.62 H new ATOM 0 HD22 LEU B 46 -8.032 5.652 3.594 1.00 0.62 H new ATOM 0 HD23 LEU B 46 -7.821 7.404 3.365 1.00 0.62 H new ATOM 2374 N PRO B 47 -10.687 10.459 6.585 1.00 0.40 N ATOM 2375 CA PRO B 47 -10.766 11.828 6.017 1.00 0.42 C ATOM 2376 C PRO B 47 -9.519 12.701 6.285 1.00 0.42 C ATOM 2377 O PRO B 47 -9.153 13.524 5.440 1.00 0.46 O ATOM 2378 CB PRO B 47 -12.004 12.413 6.714 1.00 0.48 C ATOM 2379 CG PRO B 47 -12.029 11.749 8.047 1.00 0.48 C ATOM 2380 CD PRO B 47 -11.499 10.356 7.831 1.00 0.44 C ATOM 0 HA PRO B 47 -10.824 11.803 4.929 1.00 0.42 H new ATOM 0 HB2 PRO B 47 -11.930 13.496 6.811 1.00 0.48 H new ATOM 0 HB3 PRO B 47 -12.913 12.205 6.150 1.00 0.48 H new ATOM 0 HG2 PRO B 47 -11.414 12.293 8.765 1.00 0.48 H new ATOM 0 HG3 PRO B 47 -13.041 11.722 8.450 1.00 0.48 H new ATOM 0 HD2 PRO B 47 -10.893 10.026 8.675 1.00 0.44 H new ATOM 0 HD3 PRO B 47 -12.309 9.635 7.719 1.00 0.44 H new ATOM 2388 N HIS B 48 -8.870 12.518 7.457 1.00 0.42 N ATOM 2389 CA HIS B 48 -7.673 13.305 7.833 1.00 0.44 C ATOM 2390 C HIS B 48 -6.429 12.904 7.017 1.00 0.43 C ATOM 2391 O HIS B 48 -5.554 13.742 6.782 1.00 0.49 O ATOM 2392 CB HIS B 48 -7.374 13.166 9.339 1.00 0.49 C ATOM 2393 CG HIS B 48 -8.519 13.563 10.227 1.00 0.56 C ATOM 2394 ND1 HIS B 48 -9.493 12.677 10.637 1.00 0.67 N ATOM 2395 CD2 HIS B 48 -8.850 14.760 10.767 1.00 0.70 C ATOM 2396 CE1 HIS B 48 -10.373 13.310 11.389 1.00 0.79 C ATOM 2397 NE2 HIS B 48 -10.006 14.575 11.485 1.00 0.81 N ATOM 0 H HIS B 48 -9.154 11.834 8.158 1.00 0.42 H new ATOM 0 HA HIS B 48 -7.901 14.346 7.605 1.00 0.44 H new ATOM 0 HB2 HIS B 48 -7.104 12.132 9.552 1.00 0.49 H new ATOM 0 HB3 HIS B 48 -6.507 13.779 9.585 1.00 0.49 H new ATOM 0 HD2 HIS B 48 -8.307 15.687 10.654 1.00 0.70 H new ATOM 0 HE1 HIS B 48 -11.245 12.869 11.848 1.00 0.79 H new ATOM 0 HE2 HIS B 48 -10.501 15.298 12.008 1.00 0.81 H new ATOM 2406 N LEU B 49 -6.347 11.622 6.591 1.00 0.41 N ATOM 2407 CA LEU B 49 -5.202 11.133 5.800 1.00 0.42 C ATOM 2408 C LEU B 49 -5.218 11.730 4.382 1.00 0.40 C ATOM 2409 O LEU B 49 -4.222 12.316 3.948 1.00 0.48 O ATOM 2410 CB LEU B 49 -5.196 9.589 5.751 1.00 0.43 C ATOM 2411 CG LEU B 49 -3.931 8.903 5.171 1.00 0.52 C ATOM 2412 CD1 LEU B 49 -2.644 9.489 5.753 1.00 0.88 C ATOM 2413 CD2 LEU B 49 -3.984 7.397 5.433 1.00 0.62 C ATOM 0 H LEU B 49 -7.057 10.915 6.782 1.00 0.41 H new ATOM 0 HA LEU B 49 -4.285 11.461 6.289 1.00 0.42 H new ATOM 0 HB2 LEU B 49 -5.347 9.218 6.765 1.00 0.43 H new ATOM 0 HB3 LEU B 49 -6.055 9.266 5.163 1.00 0.43 H new ATOM 0 HG LEU B 49 -3.921 9.088 4.097 1.00 0.52 H new ATOM 0 HD11 LEU B 49 -1.784 8.979 5.319 1.00 0.88 H new ATOM 0 HD12 LEU B 49 -2.591 10.553 5.521 1.00 0.88 H new ATOM 0 HD13 LEU B 49 -2.639 9.353 6.834 1.00 0.88 H new ATOM 0 HD21 LEU B 49 -3.092 6.925 5.022 1.00 0.62 H new ATOM 0 HD22 LEU B 49 -4.029 7.216 6.507 1.00 0.62 H new ATOM 0 HD23 LEU B 49 -4.869 6.976 4.957 1.00 0.62 H new ATOM 2425 N LEU B 50 -6.355 11.579 3.673 1.00 0.38 N ATOM 2426 CA LEU B 50 -6.513 12.125 2.320 1.00 0.41 C ATOM 2427 C LEU B 50 -7.285 13.451 2.399 1.00 0.45 C ATOM 2428 O LEU B 50 -8.509 13.457 2.582 1.00 0.52 O ATOM 2429 CB LEU B 50 -7.233 11.119 1.388 1.00 0.44 C ATOM 2430 CG LEU B 50 -6.456 9.818 1.052 1.00 0.51 C ATOM 2431 CD1 LEU B 50 -7.357 8.822 0.315 1.00 0.57 C ATOM 2432 CD2 LEU B 50 -5.198 10.111 0.221 1.00 0.70 C ATOM 0 H LEU B 50 -7.175 11.082 4.020 1.00 0.38 H new ATOM 0 HA LEU B 50 -5.527 12.307 1.894 1.00 0.41 H new ATOM 0 HB2 LEU B 50 -8.181 10.842 1.850 1.00 0.44 H new ATOM 0 HB3 LEU B 50 -7.470 11.627 0.453 1.00 0.44 H new ATOM 0 HG LEU B 50 -6.140 9.374 1.996 1.00 0.51 H new ATOM 0 HD11 LEU B 50 -6.792 7.918 0.090 1.00 0.57 H new ATOM 0 HD12 LEU B 50 -8.210 8.569 0.944 1.00 0.57 H new ATOM 0 HD13 LEU B 50 -7.711 9.270 -0.614 1.00 0.57 H new ATOM 0 HD21 LEU B 50 -4.679 9.177 0.005 1.00 0.70 H new ATOM 0 HD22 LEU B 50 -5.484 10.593 -0.714 1.00 0.70 H new ATOM 0 HD23 LEU B 50 -4.537 10.772 0.782 1.00 0.70 H new ATOM 2444 N LYS B 51 -6.547 14.573 2.282 1.00 0.50 N ATOM 2445 CA LYS B 51 -7.128 15.936 2.358 1.00 0.58 C ATOM 2446 C LYS B 51 -8.243 16.175 1.314 1.00 0.53 C ATOM 2447 O LYS B 51 -9.204 16.899 1.592 1.00 0.61 O ATOM 2448 CB LYS B 51 -6.018 17.009 2.214 1.00 0.68 C ATOM 2449 CG LYS B 51 -5.314 17.035 0.841 1.00 0.72 C ATOM 2450 CD LYS B 51 -3.788 17.037 0.955 1.00 1.06 C ATOM 2451 CE LYS B 51 -3.116 16.872 -0.412 1.00 1.03 C ATOM 2452 NZ LYS B 51 -3.023 18.162 -1.161 1.00 1.23 N ATOM 0 H LYS B 51 -5.538 14.565 2.133 1.00 0.50 H new ATOM 0 HA LYS B 51 -7.591 16.022 3.341 1.00 0.58 H new ATOM 0 HB2 LYS B 51 -6.455 17.990 2.401 1.00 0.68 H new ATOM 0 HB3 LYS B 51 -5.268 16.841 2.987 1.00 0.68 H new ATOM 0 HG2 LYS B 51 -5.629 16.168 0.260 1.00 0.72 H new ATOM 0 HG3 LYS B 51 -5.634 17.920 0.291 1.00 0.72 H new ATOM 0 HD2 LYS B 51 -3.459 17.970 1.412 1.00 1.06 H new ATOM 0 HD3 LYS B 51 -3.472 16.230 1.616 1.00 1.06 H new ATOM 0 HE2 LYS B 51 -2.115 16.462 -0.275 1.00 1.03 H new ATOM 0 HE3 LYS B 51 -3.678 16.150 -1.005 1.00 1.03 H new ATOM 0 HZ1 LYS B 51 -2.561 17.998 -2.078 1.00 1.23 H new ATOM 0 HZ2 LYS B 51 -3.978 18.542 -1.317 1.00 1.23 H new ATOM 0 HZ3 LYS B 51 -2.464 18.844 -0.609 1.00 1.23 H new ATOM 2466 N ASP B 52 -8.105 15.562 0.119 1.00 0.48 N ATOM 2467 CA ASP B 52 -9.082 15.709 -0.966 1.00 0.54 C ATOM 2468 C ASP B 52 -10.122 14.571 -0.901 1.00 0.48 C ATOM 2469 O ASP B 52 -9.987 13.545 -1.583 1.00 0.60 O ATOM 2470 CB ASP B 52 -8.337 15.736 -2.322 1.00 0.69 C ATOM 2471 CG ASP B 52 -9.197 16.216 -3.479 1.00 1.20 C ATOM 2472 OD1 ASP B 52 -9.737 17.342 -3.398 1.00 1.94 O ATOM 2473 OD2 ASP B 52 -9.318 15.470 -4.470 1.00 1.78 O ATOM 0 H ASP B 52 -7.317 14.957 -0.114 1.00 0.48 H new ATOM 0 HA ASP B 52 -9.624 16.648 -0.857 1.00 0.54 H new ATOM 0 HB2 ASP B 52 -7.465 16.384 -2.235 1.00 0.69 H new ATOM 0 HB3 ASP B 52 -7.969 14.735 -2.545 1.00 0.69 H new ATOM 2478 N VAL B 53 -11.151 14.752 -0.044 1.00 0.44 N ATOM 2479 CA VAL B 53 -12.222 13.745 0.131 1.00 0.45 C ATOM 2480 C VAL B 53 -13.354 13.921 -0.902 1.00 0.46 C ATOM 2481 O VAL B 53 -13.985 12.935 -1.296 1.00 0.57 O ATOM 2482 CB VAL B 53 -12.825 13.735 1.584 1.00 0.53 C ATOM 2483 CG1 VAL B 53 -11.761 13.364 2.619 1.00 0.60 C ATOM 2484 CG2 VAL B 53 -13.491 15.070 1.959 1.00 0.58 C ATOM 0 H VAL B 53 -11.263 15.584 0.536 1.00 0.44 H new ATOM 0 HA VAL B 53 -11.740 12.781 -0.035 1.00 0.45 H new ATOM 0 HB VAL B 53 -13.604 12.973 1.588 1.00 0.53 H new ATOM 0 HG11 VAL B 53 -12.206 13.365 3.614 1.00 0.60 H new ATOM 0 HG12 VAL B 53 -11.369 12.371 2.398 1.00 0.60 H new ATOM 0 HG13 VAL B 53 -10.950 14.091 2.583 1.00 0.60 H new ATOM 0 HG21 VAL B 53 -13.889 15.006 2.972 1.00 0.58 H new ATOM 0 HG22 VAL B 53 -12.754 15.871 1.909 1.00 0.58 H new ATOM 0 HG23 VAL B 53 -14.303 15.280 1.262 1.00 0.58 H new ATOM 2494 N GLY B 54 -13.603 15.177 -1.337 1.00 0.44 N ATOM 2495 CA GLY B 54 -14.655 15.461 -2.314 1.00 0.51 C ATOM 2496 C GLY B 54 -14.334 14.955 -3.716 1.00 0.51 C ATOM 2497 O GLY B 54 -15.116 14.184 -4.286 1.00 0.67 O ATOM 0 H GLY B 54 -13.088 16.000 -1.023 1.00 0.44 H new ATOM 0 HA2 GLY B 54 -15.586 15.006 -1.976 1.00 0.51 H new ATOM 0 HA3 GLY B 54 -14.822 16.537 -2.354 1.00 0.51 H new ATOM 2501 N SER B 55 -13.181 15.379 -4.275 1.00 0.51 N ATOM 2502 CA SER B 55 -12.760 14.956 -5.623 1.00 0.57 C ATOM 2503 C SER B 55 -11.941 13.649 -5.563 1.00 0.52 C ATOM 2504 O SER B 55 -10.731 13.639 -5.819 1.00 0.63 O ATOM 2505 CB SER B 55 -11.962 16.080 -6.312 1.00 0.74 C ATOM 2506 OG SER B 55 -11.562 15.706 -7.623 1.00 0.92 O ATOM 0 H SER B 55 -12.528 16.012 -3.813 1.00 0.51 H new ATOM 0 HA SER B 55 -13.653 14.757 -6.216 1.00 0.57 H new ATOM 0 HB2 SER B 55 -12.571 16.983 -6.360 1.00 0.74 H new ATOM 0 HB3 SER B 55 -11.081 16.320 -5.716 1.00 0.74 H new ATOM 0 HG SER B 55 -11.060 16.440 -8.034 1.00 0.92 H new ATOM 2512 N LEU B 56 -12.624 12.539 -5.219 1.00 0.47 N ATOM 2513 CA LEU B 56 -11.984 11.210 -5.127 1.00 0.47 C ATOM 2514 C LEU B 56 -11.744 10.607 -6.533 1.00 0.48 C ATOM 2515 O LEU B 56 -10.876 9.745 -6.690 1.00 0.81 O ATOM 2516 CB LEU B 56 -12.854 10.263 -4.248 1.00 0.58 C ATOM 2517 CG LEU B 56 -12.162 9.051 -3.551 1.00 0.75 C ATOM 2518 CD1 LEU B 56 -11.832 7.924 -4.535 1.00 1.09 C ATOM 2519 CD2 LEU B 56 -10.909 9.476 -2.766 1.00 1.24 C ATOM 0 H LEU B 56 -13.620 12.536 -5.000 1.00 0.47 H new ATOM 0 HA LEU B 56 -11.009 11.324 -4.654 1.00 0.47 H new ATOM 0 HB2 LEU B 56 -13.323 10.868 -3.472 1.00 0.58 H new ATOM 0 HB3 LEU B 56 -13.655 9.872 -4.875 1.00 0.58 H new ATOM 0 HG LEU B 56 -12.886 8.659 -2.836 1.00 0.75 H new ATOM 0 HD11 LEU B 56 -11.352 7.104 -4.001 1.00 1.09 H new ATOM 0 HD12 LEU B 56 -12.751 7.566 -5.000 1.00 1.09 H new ATOM 0 HD13 LEU B 56 -11.158 8.299 -5.305 1.00 1.09 H new ATOM 0 HD21 LEU B 56 -10.459 8.601 -2.297 1.00 1.24 H new ATOM 0 HD22 LEU B 56 -10.190 9.932 -3.447 1.00 1.24 H new ATOM 0 HD23 LEU B 56 -11.188 10.196 -1.997 1.00 1.24 H new ATOM 2531 N ASP B 57 -12.491 11.086 -7.558 1.00 0.48 N ATOM 2532 CA ASP B 57 -12.354 10.590 -8.950 1.00 0.49 C ATOM 2533 C ASP B 57 -10.917 10.713 -9.515 1.00 0.44 C ATOM 2534 O ASP B 57 -10.552 9.952 -10.418 1.00 0.46 O ATOM 2535 CB ASP B 57 -13.357 11.286 -9.894 1.00 0.60 C ATOM 2536 CG ASP B 57 -13.209 12.803 -9.945 1.00 0.64 C ATOM 2537 OD1 ASP B 57 -12.418 13.296 -10.776 1.00 0.69 O ATOM 2538 OD2 ASP B 57 -13.885 13.493 -9.151 1.00 0.73 O ATOM 0 H ASP B 57 -13.195 11.816 -7.447 1.00 0.48 H new ATOM 0 HA ASP B 57 -12.582 9.525 -8.903 1.00 0.49 H new ATOM 0 HB2 ASP B 57 -13.232 10.885 -10.900 1.00 0.60 H new ATOM 0 HB3 ASP B 57 -14.370 11.040 -9.576 1.00 0.60 H new ATOM 2543 N GLU B 58 -10.112 11.671 -8.991 1.00 0.45 N ATOM 2544 CA GLU B 58 -8.712 11.857 -9.439 1.00 0.50 C ATOM 2545 C GLU B 58 -7.880 10.570 -9.215 1.00 0.47 C ATOM 2546 O GLU B 58 -7.038 10.229 -10.050 1.00 0.57 O ATOM 2547 CB GLU B 58 -8.057 13.063 -8.720 1.00 0.59 C ATOM 2548 CG GLU B 58 -6.814 13.609 -9.426 1.00 0.73 C ATOM 2549 CD GLU B 58 -6.207 14.806 -8.714 1.00 0.92 C ATOM 2550 OE1 GLU B 58 -6.719 15.931 -8.901 1.00 1.10 O ATOM 2551 OE2 GLU B 58 -5.215 14.619 -7.974 1.00 1.06 O ATOM 0 H GLU B 58 -10.407 12.322 -8.263 1.00 0.45 H new ATOM 0 HA GLU B 58 -8.730 12.066 -10.509 1.00 0.50 H new ATOM 0 HB2 GLU B 58 -8.792 13.863 -8.631 1.00 0.59 H new ATOM 0 HB3 GLU B 58 -7.786 12.765 -7.707 1.00 0.59 H new ATOM 0 HG2 GLU B 58 -6.067 12.819 -9.498 1.00 0.73 H new ATOM 0 HG3 GLU B 58 -7.077 13.894 -10.445 1.00 0.73 H new ATOM 2558 N LYS B 59 -8.130 9.869 -8.085 1.00 0.43 N ATOM 2559 CA LYS B 59 -7.438 8.607 -7.759 1.00 0.48 C ATOM 2560 C LYS B 59 -8.276 7.393 -8.221 1.00 0.54 C ATOM 2561 O LYS B 59 -7.710 6.408 -8.694 1.00 0.91 O ATOM 2562 CB LYS B 59 -7.139 8.503 -6.240 1.00 0.52 C ATOM 2563 CG LYS B 59 -5.943 9.341 -5.758 1.00 0.59 C ATOM 2564 CD LYS B 59 -6.279 10.824 -5.586 1.00 0.79 C ATOM 2565 CE LYS B 59 -5.079 11.627 -5.084 1.00 1.19 C ATOM 2566 NZ LYS B 59 -5.381 13.084 -4.981 1.00 1.47 N ATOM 0 H LYS B 59 -8.810 10.161 -7.383 1.00 0.43 H new ATOM 0 HA LYS B 59 -6.487 8.604 -8.292 1.00 0.48 H new ATOM 0 HB2 LYS B 59 -8.027 8.811 -5.688 1.00 0.52 H new ATOM 0 HB3 LYS B 59 -6.956 7.458 -5.991 1.00 0.52 H new ATOM 0 HG2 LYS B 59 -5.587 8.943 -4.808 1.00 0.59 H new ATOM 0 HG3 LYS B 59 -5.125 9.240 -6.472 1.00 0.59 H new ATOM 0 HD2 LYS B 59 -6.616 11.233 -6.539 1.00 0.79 H new ATOM 0 HD3 LYS B 59 -7.106 10.930 -4.884 1.00 0.79 H new ATOM 0 HE2 LYS B 59 -4.775 11.251 -4.107 1.00 1.19 H new ATOM 0 HE3 LYS B 59 -4.236 11.479 -5.759 1.00 1.19 H new ATOM 0 HZ1 LYS B 59 -4.698 13.536 -4.340 1.00 1.47 H new ATOM 0 HZ2 LYS B 59 -5.313 13.520 -5.923 1.00 1.47 H new ATOM 0 HZ3 LYS B 59 -6.343 13.214 -4.608 1.00 1.47 H new ATOM 2580 N MET B 60 -9.626 7.481 -8.095 1.00 0.40 N ATOM 2581 CA MET B 60 -10.562 6.393 -8.493 1.00 0.43 C ATOM 2582 C MET B 60 -10.290 5.862 -9.919 1.00 0.45 C ATOM 2583 O MET B 60 -10.320 4.647 -10.140 1.00 0.49 O ATOM 2584 CB MET B 60 -12.024 6.880 -8.393 1.00 0.47 C ATOM 2585 CG MET B 60 -13.062 5.760 -8.344 1.00 0.55 C ATOM 2586 SD MET B 60 -14.760 6.372 -8.276 1.00 0.67 S ATOM 2587 CE MET B 60 -15.009 6.932 -9.963 1.00 0.81 C ATOM 0 H MET B 60 -10.096 8.304 -7.717 1.00 0.40 H new ATOM 0 HA MET B 60 -10.395 5.569 -7.800 1.00 0.43 H new ATOM 0 HB2 MET B 60 -12.129 7.495 -7.499 1.00 0.47 H new ATOM 0 HB3 MET B 60 -12.240 7.521 -9.248 1.00 0.47 H new ATOM 0 HG2 MET B 60 -12.945 5.126 -9.223 1.00 0.55 H new ATOM 0 HG3 MET B 60 -12.872 5.134 -7.472 1.00 0.55 H new ATOM 0 HE1 MET B 60 -16.051 7.219 -10.101 1.00 0.81 H new ATOM 0 HE2 MET B 60 -14.367 7.790 -10.160 1.00 0.81 H new ATOM 0 HE3 MET B 60 -14.760 6.127 -10.654 1.00 0.81 H new ATOM 2597 N LYS B 61 -10.040 6.778 -10.881 1.00 0.47 N ATOM 2598 CA LYS B 61 -9.744 6.392 -12.280 1.00 0.53 C ATOM 2599 C LYS B 61 -8.395 5.655 -12.381 1.00 0.48 C ATOM 2600 O LYS B 61 -8.247 4.737 -13.192 1.00 0.52 O ATOM 2601 CB LYS B 61 -9.738 7.627 -13.211 1.00 0.63 C ATOM 2602 CG LYS B 61 -11.118 8.261 -13.452 1.00 0.78 C ATOM 2603 CD LYS B 61 -12.114 7.338 -14.177 1.00 1.13 C ATOM 2604 CE LYS B 61 -11.616 6.839 -15.543 1.00 1.87 C ATOM 2605 NZ LYS B 61 -11.433 7.939 -16.535 1.00 2.39 N ATOM 0 H LYS B 61 -10.037 7.785 -10.716 1.00 0.47 H new ATOM 0 HA LYS B 61 -10.536 5.716 -12.603 1.00 0.53 H new ATOM 0 HB2 LYS B 61 -9.077 8.382 -12.786 1.00 0.63 H new ATOM 0 HB3 LYS B 61 -9.314 7.337 -14.173 1.00 0.63 H new ATOM 0 HG2 LYS B 61 -11.544 8.555 -12.493 1.00 0.78 H new ATOM 0 HG3 LYS B 61 -10.991 9.172 -14.037 1.00 0.78 H new ATOM 0 HD2 LYS B 61 -12.326 6.478 -13.542 1.00 1.13 H new ATOM 0 HD3 LYS B 61 -13.054 7.872 -14.316 1.00 1.13 H new ATOM 0 HE2 LYS B 61 -10.669 6.317 -15.409 1.00 1.87 H new ATOM 0 HE3 LYS B 61 -12.327 6.114 -15.940 1.00 1.87 H new ATOM 0 HZ1 LYS B 61 -11.096 7.542 -17.435 1.00 2.39 H new ATOM 0 HZ2 LYS B 61 -12.341 8.423 -16.688 1.00 2.39 H new ATOM 0 HZ3 LYS B 61 -10.734 8.619 -16.174 1.00 2.39 H new ATOM 2619 N SER B 62 -7.418 6.063 -11.543 1.00 0.46 N ATOM 2620 CA SER B 62 -6.087 5.431 -11.507 1.00 0.47 C ATOM 2621 C SER B 62 -6.135 4.042 -10.835 1.00 0.44 C ATOM 2622 O SER B 62 -5.290 3.186 -11.126 1.00 0.50 O ATOM 2623 CB SER B 62 -5.086 6.331 -10.767 1.00 0.54 C ATOM 2624 OG SER B 62 -4.894 7.554 -11.454 1.00 0.63 O ATOM 0 H SER B 62 -7.530 6.831 -10.881 1.00 0.46 H new ATOM 0 HA SER B 62 -5.761 5.298 -12.538 1.00 0.47 H new ATOM 0 HB2 SER B 62 -5.448 6.530 -9.758 1.00 0.54 H new ATOM 0 HB3 SER B 62 -4.132 5.813 -10.667 1.00 0.54 H new ATOM 0 HG SER B 62 -4.254 8.109 -10.961 1.00 0.63 H new ATOM 2630 N LEU B 63 -7.127 3.821 -9.938 1.00 0.41 N ATOM 2631 CA LEU B 63 -7.288 2.537 -9.235 1.00 0.44 C ATOM 2632 C LEU B 63 -7.865 1.466 -10.177 1.00 0.47 C ATOM 2633 O LEU B 63 -7.172 0.501 -10.509 1.00 0.57 O ATOM 2634 CB LEU B 63 -8.193 2.696 -7.988 1.00 0.45 C ATOM 2635 CG LEU B 63 -7.698 3.682 -6.906 1.00 0.42 C ATOM 2636 CD1 LEU B 63 -8.800 3.968 -5.886 1.00 0.47 C ATOM 2637 CD2 LEU B 63 -6.441 3.162 -6.204 1.00 0.69 C ATOM 0 H LEU B 63 -7.826 4.521 -9.688 1.00 0.41 H new ATOM 0 HA LEU B 63 -6.301 2.214 -8.905 1.00 0.44 H new ATOM 0 HB2 LEU B 63 -9.180 3.019 -8.320 1.00 0.45 H new ATOM 0 HB3 LEU B 63 -8.317 1.716 -7.527 1.00 0.45 H new ATOM 0 HG LEU B 63 -7.439 4.614 -7.408 1.00 0.42 H new ATOM 0 HD11 LEU B 63 -8.428 4.664 -5.134 1.00 0.47 H new ATOM 0 HD12 LEU B 63 -9.660 4.406 -6.393 1.00 0.47 H new ATOM 0 HD13 LEU B 63 -9.099 3.038 -5.403 1.00 0.47 H new ATOM 0 HD21 LEU B 63 -6.122 3.881 -5.450 1.00 0.69 H new ATOM 0 HD22 LEU B 63 -6.660 2.207 -5.725 1.00 0.69 H new ATOM 0 HD23 LEU B 63 -5.645 3.027 -6.936 1.00 0.69 H new ATOM 2649 N ASP B 64 -9.129 1.655 -10.622 1.00 0.47 N ATOM 2650 CA ASP B 64 -9.798 0.710 -11.531 1.00 0.55 C ATOM 2651 C ASP B 64 -9.277 0.913 -12.973 1.00 0.53 C ATOM 2652 O ASP B 64 -9.951 1.522 -13.813 1.00 0.60 O ATOM 2653 CB ASP B 64 -11.338 0.881 -11.437 1.00 0.66 C ATOM 2654 CG ASP B 64 -12.130 -0.204 -12.160 1.00 0.85 C ATOM 2655 OD1 ASP B 64 -11.814 -1.398 -11.976 1.00 1.27 O ATOM 2656 OD2 ASP B 64 -13.073 0.144 -12.902 1.00 1.32 O ATOM 0 H ASP B 64 -9.703 2.457 -10.362 1.00 0.47 H new ATOM 0 HA ASP B 64 -9.565 -0.313 -11.236 1.00 0.55 H new ATOM 0 HB2 ASP B 64 -11.629 0.889 -10.386 1.00 0.66 H new ATOM 0 HB3 ASP B 64 -11.611 1.852 -11.851 1.00 0.66 H new ATOM 2661 N VAL B 65 -8.052 0.405 -13.235 1.00 0.53 N ATOM 2662 CA VAL B 65 -7.401 0.519 -14.557 1.00 0.56 C ATOM 2663 C VAL B 65 -7.909 -0.563 -15.541 1.00 0.56 C ATOM 2664 O VAL B 65 -7.939 -0.328 -16.753 1.00 0.61 O ATOM 2665 CB VAL B 65 -5.834 0.475 -14.432 1.00 0.64 C ATOM 2666 CG1 VAL B 65 -5.311 -0.896 -13.974 1.00 0.68 C ATOM 2667 CG2 VAL B 65 -5.157 0.908 -15.740 1.00 0.72 C ATOM 0 H VAL B 65 -7.492 -0.091 -12.542 1.00 0.53 H new ATOM 0 HA VAL B 65 -7.676 1.491 -14.966 1.00 0.56 H new ATOM 0 HB VAL B 65 -5.569 1.190 -13.653 1.00 0.64 H new ATOM 0 HG11 VAL B 65 -4.224 -0.866 -13.906 1.00 0.68 H new ATOM 0 HG12 VAL B 65 -5.729 -1.137 -12.997 1.00 0.68 H new ATOM 0 HG13 VAL B 65 -5.609 -1.658 -14.694 1.00 0.68 H new ATOM 0 HG21 VAL B 65 -4.074 0.867 -15.620 1.00 0.72 H new ATOM 0 HG22 VAL B 65 -5.459 0.238 -16.545 1.00 0.72 H new ATOM 0 HG23 VAL B 65 -5.456 1.927 -15.985 1.00 0.72 H new ATOM 2677 N ASN B 66 -8.309 -1.740 -15.011 1.00 0.56 N ATOM 2678 CA ASN B 66 -8.825 -2.848 -15.842 1.00 0.60 C ATOM 2679 C ASN B 66 -10.260 -2.568 -16.346 1.00 0.61 C ATOM 2680 O ASN B 66 -10.654 -3.094 -17.391 1.00 0.68 O ATOM 2681 CB ASN B 66 -8.798 -4.178 -15.059 1.00 0.65 C ATOM 2682 CG ASN B 66 -7.386 -4.685 -14.759 1.00 0.90 C ATOM 2683 OD1 ASN B 66 -6.470 -3.900 -14.505 1.00 1.38 O ATOM 2684 ND2 ASN B 66 -7.195 -6.006 -14.789 1.00 1.32 N ATOM 0 H ASN B 66 -8.284 -1.946 -14.012 1.00 0.56 H new ATOM 0 HA ASN B 66 -8.170 -2.929 -16.710 1.00 0.60 H new ATOM 0 HB2 ASN B 66 -9.335 -4.048 -14.120 1.00 0.65 H new ATOM 0 HB3 ASN B 66 -9.334 -4.937 -15.630 1.00 0.65 H new ATOM 0 HD21 ASN B 66 -6.270 -6.392 -14.598 1.00 1.32 H new ATOM 0 HD22 ASN B 66 -7.974 -6.629 -15.002 1.00 1.32 H new ATOM 2691 N GLN B 67 -11.036 -1.747 -15.587 1.00 0.59 N ATOM 2692 CA GLN B 67 -12.428 -1.378 -15.932 1.00 0.64 C ATOM 2693 C GLN B 67 -13.366 -2.602 -15.843 1.00 0.64 C ATOM 2694 O GLN B 67 -13.806 -3.149 -16.862 1.00 0.77 O ATOM 2695 CB GLN B 67 -12.514 -0.686 -17.317 1.00 0.75 C ATOM 2696 CG GLN B 67 -11.730 0.626 -17.402 1.00 0.96 C ATOM 2697 CD GLN B 67 -11.922 1.350 -18.732 1.00 1.28 C ATOM 2698 OE1 GLN B 67 -12.831 2.170 -18.874 1.00 2.02 O ATOM 2699 NE2 GLN B 67 -11.075 1.049 -19.719 1.00 1.87 N ATOM 0 H GLN B 67 -10.709 -1.324 -14.718 1.00 0.59 H new ATOM 0 HA GLN B 67 -12.767 -0.650 -15.195 1.00 0.64 H new ATOM 0 HB2 GLN B 67 -12.142 -1.371 -18.079 1.00 0.75 H new ATOM 0 HB3 GLN B 67 -13.560 -0.489 -17.550 1.00 0.75 H new ATOM 0 HG2 GLN B 67 -12.041 1.282 -16.589 1.00 0.96 H new ATOM 0 HG3 GLN B 67 -10.670 0.419 -17.257 1.00 0.96 H new ATOM 0 HE21 GLN B 67 -10.334 0.365 -19.565 1.00 1.87 H new ATOM 0 HE22 GLN B 67 -11.168 1.503 -20.628 1.00 1.87 H new ATOM 2708 N ASP B 68 -13.642 -3.031 -14.594 1.00 0.65 N ATOM 2709 CA ASP B 68 -14.517 -4.189 -14.309 1.00 0.72 C ATOM 2710 C ASP B 68 -15.435 -3.929 -13.081 1.00 0.79 C ATOM 2711 O ASP B 68 -16.032 -4.871 -12.548 1.00 1.30 O ATOM 2712 CB ASP B 68 -13.633 -5.438 -14.075 1.00 0.76 C ATOM 2713 CG ASP B 68 -14.379 -6.756 -14.244 1.00 0.97 C ATOM 2714 OD1 ASP B 68 -14.550 -7.198 -15.400 1.00 1.16 O ATOM 2715 OD2 ASP B 68 -14.788 -7.346 -13.221 1.00 1.25 O ATOM 0 H ASP B 68 -13.266 -2.586 -13.756 1.00 0.65 H new ATOM 0 HA ASP B 68 -15.172 -4.353 -15.165 1.00 0.72 H new ATOM 0 HB2 ASP B 68 -12.794 -5.414 -14.770 1.00 0.76 H new ATOM 0 HB3 ASP B 68 -13.215 -5.393 -13.069 1.00 0.76 H new ATOM 2720 N SER B 69 -15.563 -2.644 -12.643 1.00 0.66 N ATOM 2721 CA SER B 69 -16.389 -2.260 -11.469 1.00 0.71 C ATOM 2722 C SER B 69 -15.958 -2.994 -10.171 1.00 0.71 C ATOM 2723 O SER B 69 -16.765 -3.169 -9.250 1.00 1.26 O ATOM 2724 CB SER B 69 -17.886 -2.496 -11.759 1.00 0.86 C ATOM 2725 OG SER B 69 -18.334 -1.679 -12.830 1.00 1.35 O ATOM 0 H SER B 69 -15.099 -1.854 -13.092 1.00 0.66 H new ATOM 0 HA SER B 69 -16.225 -1.196 -11.298 1.00 0.71 H new ATOM 0 HB2 SER B 69 -18.051 -3.545 -12.004 1.00 0.86 H new ATOM 0 HB3 SER B 69 -18.471 -2.282 -10.865 1.00 0.86 H new ATOM 0 HG SER B 69 -19.285 -1.849 -12.995 1.00 1.35 H new ATOM 2731 N GLU B 70 -14.673 -3.404 -10.104 1.00 0.69 N ATOM 2732 CA GLU B 70 -14.118 -4.110 -8.940 1.00 0.75 C ATOM 2733 C GLU B 70 -12.675 -3.652 -8.709 1.00 0.62 C ATOM 2734 O GLU B 70 -11.835 -3.782 -9.606 1.00 0.78 O ATOM 2735 CB GLU B 70 -14.149 -5.640 -9.150 1.00 1.11 C ATOM 2736 CG GLU B 70 -15.548 -6.259 -9.131 1.00 1.39 C ATOM 2737 CD GLU B 70 -15.538 -7.757 -9.416 1.00 1.87 C ATOM 2738 OE1 GLU B 70 -15.189 -8.537 -8.501 1.00 2.40 O ATOM 2739 OE2 GLU B 70 -15.883 -8.150 -10.551 1.00 2.37 O ATOM 0 H GLU B 70 -13.998 -3.254 -10.854 1.00 0.69 H new ATOM 0 HA GLU B 70 -14.729 -3.873 -8.069 1.00 0.75 H new ATOM 0 HB2 GLU B 70 -13.677 -5.872 -10.105 1.00 1.11 H new ATOM 0 HB3 GLU B 70 -13.547 -6.112 -8.374 1.00 1.11 H new ATOM 0 HG2 GLU B 70 -16.005 -6.083 -8.157 1.00 1.39 H new ATOM 0 HG3 GLU B 70 -16.172 -5.758 -9.871 1.00 1.39 H new ATOM 2746 N LEU B 71 -12.398 -3.104 -7.512 1.00 0.54 N ATOM 2747 CA LEU B 71 -11.055 -2.621 -7.165 1.00 0.51 C ATOM 2748 C LEU B 71 -10.267 -3.695 -6.401 1.00 0.50 C ATOM 2749 O LEU B 71 -10.282 -3.733 -5.165 1.00 0.52 O ATOM 2750 CB LEU B 71 -11.127 -1.304 -6.344 1.00 0.58 C ATOM 2751 CG LEU B 71 -11.362 -0.005 -7.156 1.00 0.78 C ATOM 2752 CD1 LEU B 71 -12.796 0.075 -7.688 1.00 1.13 C ATOM 2753 CD2 LEU B 71 -11.032 1.228 -6.310 1.00 0.92 C ATOM 0 H LEU B 71 -13.089 -2.986 -6.771 1.00 0.54 H new ATOM 0 HA LEU B 71 -10.528 -2.408 -8.095 1.00 0.51 H new ATOM 0 HB2 LEU B 71 -11.928 -1.400 -5.611 1.00 0.58 H new ATOM 0 HB3 LEU B 71 -10.197 -1.196 -5.786 1.00 0.58 H new ATOM 0 HG LEU B 71 -10.691 -0.028 -8.015 1.00 0.78 H new ATOM 0 HD11 LEU B 71 -12.924 0.999 -8.252 1.00 1.13 H new ATOM 0 HD12 LEU B 71 -12.991 -0.777 -8.339 1.00 1.13 H new ATOM 0 HD13 LEU B 71 -13.495 0.061 -6.852 1.00 1.13 H new ATOM 0 HD21 LEU B 71 -11.204 2.129 -6.898 1.00 0.92 H new ATOM 0 HD22 LEU B 71 -11.670 1.244 -5.426 1.00 0.92 H new ATOM 0 HD23 LEU B 71 -9.987 1.189 -6.002 1.00 0.92 H new ATOM 2765 N LYS B 72 -9.587 -4.584 -7.156 1.00 0.52 N ATOM 2766 CA LYS B 72 -8.749 -5.651 -6.566 1.00 0.54 C ATOM 2767 C LYS B 72 -7.552 -5.001 -5.841 1.00 0.48 C ATOM 2768 O LYS B 72 -7.356 -3.793 -5.978 1.00 0.46 O ATOM 2769 CB LYS B 72 -8.268 -6.626 -7.674 1.00 0.60 C ATOM 2770 CG LYS B 72 -8.323 -8.103 -7.293 1.00 0.78 C ATOM 2771 CD LYS B 72 -7.840 -8.996 -8.440 1.00 0.91 C ATOM 2772 CE LYS B 72 -7.938 -10.483 -8.100 1.00 1.29 C ATOM 2773 NZ LYS B 72 -7.143 -10.852 -6.891 1.00 1.81 N ATOM 0 H LYS B 72 -9.602 -4.584 -8.176 1.00 0.52 H new ATOM 0 HA LYS B 72 -9.330 -6.227 -5.846 1.00 0.54 H new ATOM 0 HB2 LYS B 72 -8.878 -6.472 -8.564 1.00 0.60 H new ATOM 0 HB3 LYS B 72 -7.242 -6.372 -7.942 1.00 0.60 H new ATOM 0 HG2 LYS B 72 -7.706 -8.276 -6.411 1.00 0.78 H new ATOM 0 HG3 LYS B 72 -9.344 -8.373 -7.025 1.00 0.78 H new ATOM 0 HD2 LYS B 72 -8.432 -8.790 -9.332 1.00 0.91 H new ATOM 0 HD3 LYS B 72 -6.806 -8.748 -8.680 1.00 0.91 H new ATOM 0 HE2 LYS B 72 -8.983 -10.746 -7.937 1.00 1.29 H new ATOM 0 HE3 LYS B 72 -7.591 -11.070 -8.951 1.00 1.29 H new ATOM 0 HZ1 LYS B 72 -7.148 -11.885 -6.774 1.00 1.81 H new ATOM 0 HZ2 LYS B 72 -6.164 -10.521 -7.005 1.00 1.81 H new ATOM 0 HZ3 LYS B 72 -7.563 -10.407 -6.050 1.00 1.81 H new ATOM 2787 N PHE B 73 -6.744 -5.767 -5.078 1.00 0.51 N ATOM 2788 CA PHE B 73 -5.591 -5.159 -4.369 1.00 0.49 C ATOM 2789 C PHE B 73 -4.529 -4.626 -5.358 1.00 0.46 C ATOM 2790 O PHE B 73 -3.759 -3.736 -4.998 1.00 0.46 O ATOM 2791 CB PHE B 73 -4.963 -6.109 -3.328 1.00 0.55 C ATOM 2792 CG PHE B 73 -4.426 -5.376 -2.108 1.00 0.69 C ATOM 2793 CD1 PHE B 73 -3.134 -4.858 -2.096 1.00 0.89 C ATOM 2794 CD2 PHE B 73 -5.227 -5.185 -0.982 1.00 0.90 C ATOM 2795 CE1 PHE B 73 -2.658 -4.173 -0.995 1.00 1.14 C ATOM 2796 CE2 PHE B 73 -4.747 -4.501 0.119 1.00 1.15 C ATOM 2797 CZ PHE B 73 -3.464 -3.996 0.111 1.00 1.23 C ATOM 0 H PHE B 73 -6.858 -6.771 -4.938 1.00 0.51 H new ATOM 0 HA PHE B 73 -5.987 -4.308 -3.815 1.00 0.49 H new ATOM 0 HB2 PHE B 73 -5.710 -6.836 -3.009 1.00 0.55 H new ATOM 0 HB3 PHE B 73 -4.153 -6.668 -3.796 1.00 0.55 H new ATOM 0 HD1 PHE B 73 -2.497 -4.993 -2.957 1.00 0.89 H new ATOM 0 HD2 PHE B 73 -6.234 -5.576 -0.970 1.00 0.90 H new ATOM 0 HE1 PHE B 73 -1.654 -3.775 -1.000 1.00 1.14 H new ATOM 0 HE2 PHE B 73 -5.377 -4.362 0.985 1.00 1.15 H new ATOM 0 HZ PHE B 73 -3.089 -3.461 0.971 1.00 1.23 H new ATOM 2807 N ASN B 74 -4.498 -5.170 -6.599 1.00 0.47 N ATOM 2808 CA ASN B 74 -3.578 -4.692 -7.653 1.00 0.50 C ATOM 2809 C ASN B 74 -4.076 -3.324 -8.188 1.00 0.48 C ATOM 2810 O ASN B 74 -3.272 -2.481 -8.594 1.00 0.54 O ATOM 2811 CB ASN B 74 -3.484 -5.731 -8.794 1.00 0.55 C ATOM 2812 CG ASN B 74 -2.387 -5.425 -9.818 1.00 0.63 C ATOM 2813 OD1 ASN B 74 -2.627 -4.741 -10.814 1.00 0.99 O ATOM 2814 ND2 ASN B 74 -1.177 -5.942 -9.585 1.00 0.93 N ATOM 0 H ASN B 74 -5.100 -5.939 -6.892 1.00 0.47 H new ATOM 0 HA ASN B 74 -2.580 -4.564 -7.234 1.00 0.50 H new ATOM 0 HB2 ASN B 74 -3.301 -6.715 -8.363 1.00 0.55 H new ATOM 0 HB3 ASN B 74 -4.444 -5.781 -9.308 1.00 0.55 H new ATOM 0 HD21 ASN B 74 -0.416 -5.775 -10.243 1.00 0.93 H new ATOM 0 HD22 ASN B 74 -1.015 -6.504 -8.749 1.00 0.93 H new ATOM 2821 N GLU B 75 -5.420 -3.131 -8.187 1.00 0.44 N ATOM 2822 CA GLU B 75 -6.057 -1.869 -8.613 1.00 0.47 C ATOM 2823 C GLU B 75 -6.021 -0.850 -7.451 1.00 0.41 C ATOM 2824 O GLU B 75 -5.636 0.302 -7.647 1.00 0.42 O ATOM 2825 CB GLU B 75 -7.518 -2.125 -9.066 1.00 0.54 C ATOM 2826 CG GLU B 75 -7.662 -2.655 -10.496 1.00 0.64 C ATOM 2827 CD GLU B 75 -7.274 -4.121 -10.644 1.00 0.76 C ATOM 2828 OE1 GLU B 75 -6.076 -4.398 -10.874 1.00 0.93 O ATOM 2829 OE2 GLU B 75 -8.169 -4.988 -10.533 1.00 0.91 O ATOM 0 H GLU B 75 -6.085 -3.845 -7.891 1.00 0.44 H new ATOM 0 HA GLU B 75 -5.505 -1.461 -9.460 1.00 0.47 H new ATOM 0 HB2 GLU B 75 -7.977 -2.838 -8.381 1.00 0.54 H new ATOM 0 HB3 GLU B 75 -8.079 -1.194 -8.980 1.00 0.54 H new ATOM 0 HG2 GLU B 75 -8.695 -2.526 -10.820 1.00 0.64 H new ATOM 0 HG3 GLU B 75 -7.042 -2.054 -11.162 1.00 0.64 H new ATOM 2836 N TYR B 76 -6.412 -1.310 -6.236 1.00 0.41 N ATOM 2837 CA TYR B 76 -6.411 -0.482 -5.004 1.00 0.39 C ATOM 2838 C TYR B 76 -4.968 -0.118 -4.553 1.00 0.36 C ATOM 2839 O TYR B 76 -4.786 0.803 -3.749 1.00 0.43 O ATOM 2840 CB TYR B 76 -7.160 -1.233 -3.871 1.00 0.43 C ATOM 2841 CG TYR B 76 -7.453 -0.402 -2.620 1.00 0.44 C ATOM 2842 CD1 TYR B 76 -8.239 0.745 -2.690 1.00 0.50 C ATOM 2843 CD2 TYR B 76 -6.950 -0.773 -1.372 1.00 0.52 C ATOM 2844 CE1 TYR B 76 -8.514 1.494 -1.564 1.00 0.58 C ATOM 2845 CE2 TYR B 76 -7.225 -0.027 -0.242 1.00 0.59 C ATOM 2846 CZ TYR B 76 -8.004 1.106 -0.340 1.00 0.59 C ATOM 2847 OH TYR B 76 -8.272 1.850 0.789 1.00 0.71 O ATOM 0 H TYR B 76 -6.737 -2.265 -6.083 1.00 0.41 H new ATOM 0 HA TYR B 76 -6.926 0.453 -5.224 1.00 0.39 H new ATOM 0 HB2 TYR B 76 -8.104 -1.608 -4.268 1.00 0.43 H new ATOM 0 HB3 TYR B 76 -6.569 -2.101 -3.580 1.00 0.43 H new ATOM 0 HD1 TYR B 76 -8.641 1.054 -3.643 1.00 0.50 H new ATOM 0 HD2 TYR B 76 -6.336 -1.657 -1.288 1.00 0.52 H new ATOM 0 HE1 TYR B 76 -9.126 2.381 -1.639 1.00 0.58 H new ATOM 0 HE2 TYR B 76 -6.830 -0.331 0.716 1.00 0.59 H new ATOM 0 HH TYR B 76 -7.838 1.436 1.564 1.00 0.71 H new ATOM 2857 N TRP B 77 -3.960 -0.855 -5.083 1.00 0.39 N ATOM 2858 CA TRP B 77 -2.520 -0.638 -4.791 1.00 0.40 C ATOM 2859 C TRP B 77 -2.088 0.837 -4.979 1.00 0.35 C ATOM 2860 O TRP B 77 -1.226 1.321 -4.236 1.00 0.37 O ATOM 2861 CB TRP B 77 -1.692 -1.605 -5.682 1.00 0.58 C ATOM 2862 CG TRP B 77 -0.213 -1.333 -5.800 1.00 0.48 C ATOM 2863 CD1 TRP B 77 0.677 -1.117 -4.788 1.00 0.56 C ATOM 2864 CD2 TRP B 77 0.543 -1.278 -7.017 1.00 0.74 C ATOM 2865 NE1 TRP B 77 1.935 -0.925 -5.302 1.00 0.79 N ATOM 2866 CE2 TRP B 77 1.877 -1.016 -6.670 1.00 0.94 C ATOM 2867 CE3 TRP B 77 0.215 -1.423 -8.368 1.00 0.98 C ATOM 2868 CZ2 TRP B 77 2.883 -0.893 -7.625 1.00 1.34 C ATOM 2869 CZ3 TRP B 77 1.212 -1.302 -9.314 1.00 1.37 C ATOM 2870 CH2 TRP B 77 2.534 -1.039 -8.940 1.00 1.54 C ATOM 0 H TRP B 77 -4.125 -1.625 -5.732 1.00 0.39 H new ATOM 0 HA TRP B 77 -2.334 -0.855 -3.739 1.00 0.40 H new ATOM 0 HB2 TRP B 77 -1.820 -2.616 -5.295 1.00 0.58 H new ATOM 0 HB3 TRP B 77 -2.120 -1.591 -6.685 1.00 0.58 H new ATOM 0 HD1 TRP B 77 0.428 -1.100 -3.737 1.00 0.56 H new ATOM 0 HE1 TRP B 77 2.777 -0.744 -4.755 1.00 0.79 H new ATOM 0 HE3 TRP B 77 -0.803 -1.627 -8.667 1.00 0.98 H new ATOM 0 HZ2 TRP B 77 3.904 -0.689 -7.338 1.00 1.34 H new ATOM 0 HZ3 TRP B 77 0.968 -1.412 -10.360 1.00 1.37 H new ATOM 0 HH2 TRP B 77 3.293 -0.950 -9.703 1.00 1.54 H new ATOM 2881 N ARG B 78 -2.682 1.547 -5.966 1.00 0.37 N ATOM 2882 CA ARG B 78 -2.354 2.968 -6.216 1.00 0.41 C ATOM 2883 C ARG B 78 -2.753 3.866 -5.029 1.00 0.38 C ATOM 2884 O ARG B 78 -2.081 4.868 -4.776 1.00 0.45 O ATOM 2885 CB ARG B 78 -3.016 3.484 -7.514 1.00 0.49 C ATOM 2886 CG ARG B 78 -2.371 2.976 -8.808 1.00 0.68 C ATOM 2887 CD ARG B 78 -1.090 3.737 -9.166 1.00 0.88 C ATOM 2888 NE ARG B 78 -1.364 5.016 -9.844 1.00 1.17 N ATOM 2889 CZ ARG B 78 -1.491 5.185 -11.179 1.00 1.72 C ATOM 2890 NH1 ARG B 78 -1.457 4.145 -12.024 1.00 2.14 N ATOM 2891 NH2 ARG B 78 -1.673 6.413 -11.669 1.00 2.15 N ATOM 0 H ARG B 78 -3.385 1.162 -6.597 1.00 0.37 H new ATOM 0 HA ARG B 78 -1.272 3.020 -6.335 1.00 0.41 H new ATOM 0 HB2 ARG B 78 -4.067 3.194 -7.510 1.00 0.49 H new ATOM 0 HB3 ARG B 78 -2.986 4.574 -7.513 1.00 0.49 H new ATOM 0 HG2 ARG B 78 -2.142 1.915 -8.703 1.00 0.68 H new ATOM 0 HG3 ARG B 78 -3.085 3.069 -9.626 1.00 0.68 H new ATOM 0 HD2 ARG B 78 -0.518 3.926 -8.258 1.00 0.88 H new ATOM 0 HD3 ARG B 78 -0.469 3.114 -9.810 1.00 0.88 H new ATOM 0 HE ARG B 78 -1.466 5.844 -9.257 1.00 1.17 H new ATOM 0 HH11 ARG B 78 -1.333 3.199 -11.664 1.00 2.14 H new ATOM 0 HH12 ARG B 78 -1.555 4.300 -13.027 1.00 2.14 H new ATOM 0 HH21 ARG B 78 -1.715 7.213 -11.038 1.00 2.15 H new ATOM 0 HH22 ARG B 78 -1.770 6.552 -12.675 1.00 2.15 H new ATOM 2905 N LEU B 79 -3.845 3.512 -4.302 1.00 0.33 N ATOM 2906 CA LEU B 79 -4.290 4.303 -3.137 1.00 0.34 C ATOM 2907 C LEU B 79 -3.466 3.938 -1.888 1.00 0.32 C ATOM 2908 O LEU B 79 -3.263 4.793 -1.028 1.00 0.36 O ATOM 2909 CB LEU B 79 -5.805 4.139 -2.850 1.00 0.36 C ATOM 2910 CG LEU B 79 -6.477 5.320 -2.099 1.00 0.41 C ATOM 2911 CD1 LEU B 79 -6.582 6.566 -2.985 1.00 0.49 C ATOM 2912 CD2 LEU B 79 -7.857 4.919 -1.566 1.00 0.48 C ATOM 0 H LEU B 79 -4.422 2.695 -4.502 1.00 0.33 H new ATOM 0 HA LEU B 79 -4.122 5.351 -3.384 1.00 0.34 H new ATOM 0 HB2 LEU B 79 -6.322 3.993 -3.798 1.00 0.36 H new ATOM 0 HB3 LEU B 79 -5.950 3.231 -2.265 1.00 0.36 H new ATOM 0 HG LEU B 79 -5.840 5.569 -1.250 1.00 0.41 H new ATOM 0 HD11 LEU B 79 -7.057 7.371 -2.425 1.00 0.49 H new ATOM 0 HD12 LEU B 79 -5.584 6.878 -3.293 1.00 0.49 H new ATOM 0 HD13 LEU B 79 -7.179 6.336 -3.867 1.00 0.49 H new ATOM 0 HD21 LEU B 79 -8.305 5.765 -1.044 1.00 0.48 H new ATOM 0 HD22 LEU B 79 -8.497 4.625 -2.398 1.00 0.48 H new ATOM 0 HD23 LEU B 79 -7.751 4.082 -0.876 1.00 0.48 H new ATOM 2924 N ILE B 80 -2.996 2.665 -1.789 1.00 0.34 N ATOM 2925 CA ILE B 80 -2.152 2.217 -0.653 1.00 0.37 C ATOM 2926 C ILE B 80 -0.846 3.047 -0.627 1.00 0.36 C ATOM 2927 O ILE B 80 -0.360 3.413 0.448 1.00 0.39 O ATOM 2928 CB ILE B 80 -1.826 0.678 -0.723 1.00 0.44 C ATOM 2929 CG1 ILE B 80 -3.121 -0.177 -0.680 1.00 0.47 C ATOM 2930 CG2 ILE B 80 -0.852 0.242 0.389 1.00 0.54 C ATOM 2931 CD1 ILE B 80 -3.953 -0.043 0.592 1.00 0.56 C ATOM 0 H ILE B 80 -3.187 1.938 -2.478 1.00 0.34 H new ATOM 0 HA ILE B 80 -2.712 2.379 0.268 1.00 0.37 H new ATOM 0 HB ILE B 80 -1.333 0.505 -1.679 1.00 0.44 H new ATOM 0 HG12 ILE B 80 -3.744 0.096 -1.532 1.00 0.47 H new ATOM 0 HG13 ILE B 80 -2.849 -1.225 -0.807 1.00 0.47 H new ATOM 0 HG21 ILE B 80 -0.655 -0.827 0.302 1.00 0.54 H new ATOM 0 HG22 ILE B 80 0.084 0.792 0.290 1.00 0.54 H new ATOM 0 HG23 ILE B 80 -1.294 0.452 1.363 1.00 0.54 H new ATOM 0 HD11 ILE B 80 -4.834 -0.681 0.519 1.00 0.56 H new ATOM 0 HD12 ILE B 80 -3.355 -0.347 1.451 1.00 0.56 H new ATOM 0 HD13 ILE B 80 -4.265 0.994 0.715 1.00 0.56 H new ATOM 2943 N GLY B 81 -0.294 3.333 -1.830 1.00 0.36 N ATOM 2944 CA GLY B 81 0.906 4.154 -1.953 1.00 0.39 C ATOM 2945 C GLY B 81 0.636 5.610 -1.582 1.00 0.37 C ATOM 2946 O GLY B 81 1.449 6.234 -0.896 1.00 0.42 O ATOM 0 H GLY B 81 -0.669 3.002 -2.719 1.00 0.36 H new ATOM 0 HA2 GLY B 81 1.688 3.753 -1.308 1.00 0.39 H new ATOM 0 HA3 GLY B 81 1.279 4.102 -2.976 1.00 0.39 H new ATOM 2950 N GLU B 82 -0.523 6.146 -2.031 1.00 0.34 N ATOM 2951 CA GLU B 82 -0.929 7.536 -1.728 1.00 0.36 C ATOM 2952 C GLU B 82 -1.363 7.696 -0.252 1.00 0.33 C ATOM 2953 O GLU B 82 -1.331 8.807 0.279 1.00 0.40 O ATOM 2954 CB GLU B 82 -2.068 8.003 -2.664 1.00 0.41 C ATOM 2955 CG GLU B 82 -1.689 8.080 -4.150 1.00 0.49 C ATOM 2956 CD GLU B 82 -0.637 9.141 -4.465 1.00 0.61 C ATOM 2957 OE1 GLU B 82 -0.669 10.225 -3.841 1.00 0.91 O ATOM 2958 OE2 GLU B 82 0.214 8.885 -5.344 1.00 0.79 O ATOM 0 H GLU B 82 -1.193 5.635 -2.605 1.00 0.34 H new ATOM 0 HA GLU B 82 -0.055 8.165 -1.898 1.00 0.36 H new ATOM 0 HB2 GLU B 82 -2.912 7.322 -2.554 1.00 0.41 H new ATOM 0 HB3 GLU B 82 -2.407 8.987 -2.338 1.00 0.41 H new ATOM 0 HG2 GLU B 82 -1.317 7.107 -4.471 1.00 0.49 H new ATOM 0 HG3 GLU B 82 -2.586 8.287 -4.734 1.00 0.49 H new ATOM 2965 N LEU B 83 -1.775 6.583 0.401 1.00 0.33 N ATOM 2966 CA LEU B 83 -2.192 6.596 1.819 1.00 0.35 C ATOM 2967 C LEU B 83 -0.990 6.910 2.728 1.00 0.37 C ATOM 2968 O LEU B 83 -1.050 7.827 3.544 1.00 0.45 O ATOM 2969 CB LEU B 83 -2.824 5.231 2.222 1.00 0.42 C ATOM 2970 CG LEU B 83 -4.333 5.248 2.552 1.00 0.51 C ATOM 2971 CD1 LEU B 83 -5.187 5.405 1.294 1.00 0.69 C ATOM 2972 CD2 LEU B 83 -4.728 3.987 3.325 1.00 0.63 C ATOM 0 H LEU B 83 -1.827 5.663 -0.036 1.00 0.33 H new ATOM 0 HA LEU B 83 -2.944 7.375 1.945 1.00 0.35 H new ATOM 0 HB2 LEU B 83 -2.659 4.524 1.409 1.00 0.42 H new ATOM 0 HB3 LEU B 83 -2.288 4.849 3.091 1.00 0.42 H new ATOM 0 HG LEU B 83 -4.523 6.116 3.183 1.00 0.51 H new ATOM 0 HD11 LEU B 83 -6.242 5.412 1.569 1.00 0.69 H new ATOM 0 HD12 LEU B 83 -4.935 6.342 0.798 1.00 0.69 H new ATOM 0 HD13 LEU B 83 -4.994 4.573 0.617 1.00 0.69 H new ATOM 0 HD21 LEU B 83 -5.794 4.016 3.549 1.00 0.63 H new ATOM 0 HD22 LEU B 83 -4.508 3.106 2.721 1.00 0.63 H new ATOM 0 HD23 LEU B 83 -4.163 3.939 4.256 1.00 0.63 H new ATOM 2984 N ALA B 84 0.104 6.140 2.558 1.00 0.38 N ATOM 2985 CA ALA B 84 1.334 6.324 3.347 1.00 0.44 C ATOM 2986 C ALA B 84 2.161 7.543 2.870 1.00 0.45 C ATOM 2987 O ALA B 84 3.014 8.035 3.614 1.00 0.55 O ATOM 2988 CB ALA B 84 2.173 5.051 3.294 1.00 0.55 C ATOM 0 H ALA B 84 0.158 5.382 1.877 1.00 0.38 H new ATOM 0 HA ALA B 84 1.042 6.526 4.378 1.00 0.44 H new ATOM 0 HB1 ALA B 84 3.082 5.190 3.879 1.00 0.55 H new ATOM 0 HB2 ALA B 84 1.600 4.220 3.706 1.00 0.55 H new ATOM 0 HB3 ALA B 84 2.437 4.832 2.259 1.00 0.55 H new ATOM 2994 N LYS B 85 1.905 8.023 1.629 1.00 0.41 N ATOM 2995 CA LYS B 85 2.611 9.187 1.056 1.00 0.45 C ATOM 2996 C LYS B 85 1.954 10.515 1.489 1.00 0.47 C ATOM 2997 O LYS B 85 2.654 11.508 1.702 1.00 0.57 O ATOM 2998 CB LYS B 85 2.645 9.087 -0.487 1.00 0.49 C ATOM 2999 CG LYS B 85 3.541 10.126 -1.176 1.00 0.57 C ATOM 3000 CD LYS B 85 3.244 10.278 -2.675 1.00 0.66 C ATOM 3001 CE LYS B 85 3.944 9.230 -3.548 1.00 0.79 C ATOM 3002 NZ LYS B 85 3.241 7.911 -3.554 1.00 1.10 N ATOM 0 H LYS B 85 1.209 7.616 1.004 1.00 0.41 H new ATOM 0 HA LYS B 85 3.632 9.178 1.437 1.00 0.45 H new ATOM 0 HB2 LYS B 85 2.987 8.090 -0.766 1.00 0.49 H new ATOM 0 HB3 LYS B 85 1.629 9.194 -0.867 1.00 0.49 H new ATOM 0 HG2 LYS B 85 3.411 11.091 -0.686 1.00 0.57 H new ATOM 0 HG3 LYS B 85 4.585 9.840 -1.046 1.00 0.57 H new ATOM 0 HD2 LYS B 85 2.168 10.210 -2.832 1.00 0.66 H new ATOM 0 HD3 LYS B 85 3.551 11.272 -2.999 1.00 0.66 H new ATOM 0 HE2 LYS B 85 4.013 9.604 -4.570 1.00 0.79 H new ATOM 0 HE3 LYS B 85 4.964 9.090 -3.191 1.00 0.79 H new ATOM 0 HZ1 LYS B 85 3.471 7.399 -4.430 1.00 1.10 H new ATOM 0 HZ2 LYS B 85 3.548 7.350 -2.734 1.00 1.10 H new ATOM 0 HZ3 LYS B 85 2.214 8.065 -3.503 1.00 1.10 H new ATOM 3016 N GLU B 86 0.606 10.525 1.616 1.00 0.42 N ATOM 3017 CA GLU B 86 -0.143 11.735 2.016 1.00 0.46 C ATOM 3018 C GLU B 86 -0.371 11.795 3.552 1.00 0.50 C ATOM 3019 O GLU B 86 -1.437 12.223 4.005 1.00 0.81 O ATOM 3020 CB GLU B 86 -1.496 11.801 1.259 1.00 0.52 C ATOM 3021 CG GLU B 86 -1.378 11.884 -0.269 1.00 0.59 C ATOM 3022 CD GLU B 86 -0.876 13.231 -0.765 1.00 1.01 C ATOM 3023 OE1 GLU B 86 0.357 13.434 -0.795 1.00 1.68 O ATOM 3024 OE2 GLU B 86 -1.715 14.081 -1.128 1.00 1.48 O ATOM 0 H GLU B 86 0.018 9.709 1.447 1.00 0.42 H new ATOM 0 HA GLU B 86 0.459 12.602 1.745 1.00 0.46 H new ATOM 0 HB2 GLU B 86 -2.083 10.919 1.516 1.00 0.52 H new ATOM 0 HB3 GLU B 86 -2.052 12.669 1.614 1.00 0.52 H new ATOM 0 HG2 GLU B 86 -0.702 11.103 -0.617 1.00 0.59 H new ATOM 0 HG3 GLU B 86 -2.353 11.683 -0.713 1.00 0.59 H new ATOM 3031 N ILE B 87 0.646 11.381 4.348 1.00 0.48 N ATOM 3032 CA ILE B 87 0.564 11.406 5.824 1.00 0.51 C ATOM 3033 C ILE B 87 1.597 12.394 6.409 1.00 0.53 C ATOM 3034 O ILE B 87 1.262 13.191 7.290 1.00 0.58 O ATOM 3035 CB ILE B 87 0.720 9.957 6.436 1.00 0.56 C ATOM 3036 CG1 ILE B 87 0.037 9.844 7.839 1.00 0.61 C ATOM 3037 CG2 ILE B 87 2.181 9.457 6.468 1.00 0.62 C ATOM 3038 CD1 ILE B 87 0.748 10.521 9.005 1.00 0.63 C ATOM 0 H ILE B 87 1.532 11.026 3.989 1.00 0.48 H new ATOM 0 HA ILE B 87 -0.428 11.760 6.104 1.00 0.51 H new ATOM 0 HB ILE B 87 0.193 9.289 5.755 1.00 0.56 H new ATOM 0 HG12 ILE B 87 -0.966 10.263 7.763 1.00 0.61 H new ATOM 0 HG13 ILE B 87 -0.076 8.787 8.078 1.00 0.61 H new ATOM 0 HG21 ILE B 87 2.214 8.457 6.900 1.00 0.62 H new ATOM 0 HG22 ILE B 87 2.578 9.427 5.453 1.00 0.62 H new ATOM 0 HG23 ILE B 87 2.784 10.134 7.073 1.00 0.62 H new ATOM 0 HD11 ILE B 87 0.174 10.369 9.919 1.00 0.63 H new ATOM 0 HD12 ILE B 87 1.742 10.090 9.125 1.00 0.63 H new ATOM 0 HD13 ILE B 87 0.838 11.589 8.806 1.00 0.63 H new ATOM 3050 N ARG B 88 2.845 12.358 5.887 1.00 0.57 N ATOM 3051 CA ARG B 88 3.929 13.238 6.355 1.00 0.67 C ATOM 3052 C ARG B 88 4.139 14.440 5.413 1.00 0.67 C ATOM 3053 O ARG B 88 4.440 15.542 5.883 1.00 0.84 O ATOM 3054 CB ARG B 88 5.250 12.432 6.571 1.00 0.75 C ATOM 3055 CG ARG B 88 6.133 12.159 5.330 1.00 0.82 C ATOM 3056 CD ARG B 88 5.663 10.971 4.480 1.00 1.05 C ATOM 3057 NE ARG B 88 6.391 10.895 3.197 1.00 1.17 N ATOM 3058 CZ ARG B 88 6.381 9.843 2.349 1.00 1.26 C ATOM 3059 NH1 ARG B 88 5.773 8.691 2.661 1.00 1.64 N ATOM 3060 NH2 ARG B 88 7.011 9.948 1.177 1.00 1.55 N ATOM 0 H ARG B 88 3.122 11.724 5.138 1.00 0.57 H new ATOM 0 HA ARG B 88 3.629 13.645 7.320 1.00 0.67 H new ATOM 0 HB2 ARG B 88 5.855 12.968 7.302 1.00 0.75 H new ATOM 0 HB3 ARG B 88 4.989 11.472 7.016 1.00 0.75 H new ATOM 0 HG2 ARG B 88 6.153 13.053 4.707 1.00 0.82 H new ATOM 0 HG3 ARG B 88 7.156 11.976 5.658 1.00 0.82 H new ATOM 0 HD2 ARG B 88 5.809 10.045 5.036 1.00 1.05 H new ATOM 0 HD3 ARG B 88 4.594 11.062 4.287 1.00 1.05 H new ATOM 0 HE ARG B 88 6.949 11.706 2.928 1.00 1.17 H new ATOM 0 HH11 ARG B 88 5.301 8.591 3.559 1.00 1.64 H new ATOM 0 HH12 ARG B 88 5.782 7.914 2.000 1.00 1.64 H new ATOM 0 HH21 ARG B 88 7.491 10.814 0.932 1.00 1.55 H new ATOM 0 HH22 ARG B 88 7.012 9.162 0.526 1.00 1.55 H new ATOM 3074 N LYS B 89 3.972 14.225 4.086 1.00 0.60 N ATOM 3075 CA LYS B 89 4.158 15.290 3.083 1.00 0.67 C ATOM 3076 C LYS B 89 2.868 15.538 2.261 1.00 0.63 C ATOM 3077 O LYS B 89 2.929 15.733 1.038 1.00 0.76 O ATOM 3078 CB LYS B 89 5.375 14.955 2.175 1.00 0.76 C ATOM 3079 CG LYS B 89 5.193 13.748 1.238 1.00 0.78 C ATOM 3080 CD LYS B 89 6.373 13.582 0.270 1.00 1.06 C ATOM 3081 CE LYS B 89 5.986 12.791 -0.980 1.00 1.32 C ATOM 3082 NZ LYS B 89 7.091 12.734 -1.981 1.00 1.65 N ATOM 0 H LYS B 89 3.709 13.323 3.690 1.00 0.60 H new ATOM 0 HA LYS B 89 4.369 16.224 3.604 1.00 0.67 H new ATOM 0 HB2 LYS B 89 5.605 15.831 1.569 1.00 0.76 H new ATOM 0 HB3 LYS B 89 6.241 14.771 2.811 1.00 0.76 H new ATOM 0 HG2 LYS B 89 5.083 12.841 1.833 1.00 0.78 H new ATOM 0 HG3 LYS B 89 4.272 13.868 0.668 1.00 0.78 H new ATOM 0 HD2 LYS B 89 6.741 14.565 -0.023 1.00 1.06 H new ATOM 0 HD3 LYS B 89 7.191 13.074 0.781 1.00 1.06 H new ATOM 0 HE2 LYS B 89 5.706 11.777 -0.693 1.00 1.32 H new ATOM 0 HE3 LYS B 89 5.108 13.246 -1.438 1.00 1.32 H new ATOM 0 HZ1 LYS B 89 6.781 12.188 -2.810 1.00 1.65 H new ATOM 0 HZ2 LYS B 89 7.342 13.699 -2.277 1.00 1.65 H new ATOM 0 HZ3 LYS B 89 7.922 12.275 -1.555 1.00 1.65 H new ATOM 3096 N LYS B 90 1.701 15.569 2.944 1.00 0.58 N ATOM 3097 CA LYS B 90 0.401 15.801 2.270 1.00 0.56 C ATOM 3098 C LYS B 90 0.351 17.196 1.611 1.00 0.54 C ATOM 3099 O LYS B 90 -0.086 17.325 0.465 1.00 0.58 O ATOM 3100 CB LYS B 90 -0.788 15.591 3.241 1.00 0.59 C ATOM 3101 CG LYS B 90 -0.849 16.551 4.442 1.00 0.66 C ATOM 3102 CD LYS B 90 -1.788 16.045 5.549 1.00 0.96 C ATOM 3103 CE LYS B 90 -3.272 16.194 5.187 1.00 1.48 C ATOM 3104 NZ LYS B 90 -3.811 17.552 5.512 1.00 2.03 N ATOM 0 H LYS B 90 1.632 15.438 3.953 1.00 0.58 H new ATOM 0 HA LYS B 90 0.308 15.059 1.477 1.00 0.56 H new ATOM 0 HB2 LYS B 90 -1.715 15.687 2.676 1.00 0.59 H new ATOM 0 HB3 LYS B 90 -0.748 14.569 3.618 1.00 0.59 H new ATOM 0 HG2 LYS B 90 0.153 16.682 4.851 1.00 0.66 H new ATOM 0 HG3 LYS B 90 -1.185 17.531 4.104 1.00 0.66 H new ATOM 0 HD2 LYS B 90 -1.572 14.996 5.750 1.00 0.96 H new ATOM 0 HD3 LYS B 90 -1.587 16.594 6.469 1.00 0.96 H new ATOM 0 HE2 LYS B 90 -3.404 16.000 4.122 1.00 1.48 H new ATOM 0 HE3 LYS B 90 -3.850 15.440 5.722 1.00 1.48 H new ATOM 0 HZ1 LYS B 90 -4.816 17.599 5.248 1.00 2.03 H new ATOM 0 HZ2 LYS B 90 -3.712 17.730 6.532 1.00 2.03 H new ATOM 0 HZ3 LYS B 90 -3.280 18.272 4.982 1.00 2.03 H new ATOM 3118 N LYS B 91 0.823 18.228 2.338 1.00 0.55 N ATOM 3119 CA LYS B 91 0.870 19.608 1.835 1.00 0.59 C ATOM 3120 C LYS B 91 2.310 20.133 1.933 1.00 0.62 C ATOM 3121 O LYS B 91 2.625 20.968 2.788 1.00 0.69 O ATOM 3122 CB LYS B 91 -0.113 20.511 2.619 1.00 0.64 C ATOM 3123 CG LYS B 91 -1.558 20.444 2.121 1.00 0.74 C ATOM 3124 CD LYS B 91 -2.492 21.338 2.948 1.00 0.84 C ATOM 3125 CE LYS B 91 -3.811 21.633 2.230 1.00 1.14 C ATOM 3126 NZ LYS B 91 -3.643 22.562 1.070 1.00 1.36 N ATOM 0 H LYS B 91 1.181 18.125 3.288 1.00 0.55 H new ATOM 0 HA LYS B 91 0.560 19.624 0.790 1.00 0.59 H new ATOM 0 HB2 LYS B 91 -0.089 20.227 3.671 1.00 0.64 H new ATOM 0 HB3 LYS B 91 0.233 21.543 2.559 1.00 0.64 H new ATOM 0 HG2 LYS B 91 -1.596 20.749 1.075 1.00 0.74 H new ATOM 0 HG3 LYS B 91 -1.909 19.413 2.165 1.00 0.74 H new ATOM 0 HD2 LYS B 91 -2.702 20.854 3.902 1.00 0.84 H new ATOM 0 HD3 LYS B 91 -1.986 22.277 3.172 1.00 0.84 H new ATOM 0 HE2 LYS B 91 -4.246 20.697 1.880 1.00 1.14 H new ATOM 0 HE3 LYS B 91 -4.516 22.067 2.939 1.00 1.14 H new ATOM 0 HZ1 LYS B 91 -4.578 22.834 0.705 1.00 1.36 H new ATOM 0 HZ2 LYS B 91 -3.130 23.413 1.378 1.00 1.36 H new ATOM 0 HZ3 LYS B 91 -3.104 22.086 0.319 1.00 1.36 H new ATOM 3140 N ASP B 92 3.190 19.623 1.046 1.00 0.66 N ATOM 3141 CA ASP B 92 4.614 20.020 1.027 1.00 0.74 C ATOM 3142 C ASP B 92 4.792 21.383 0.321 1.00 0.92 C ATOM 3143 O ASP B 92 5.331 21.470 -0.791 1.00 1.72 O ATOM 3144 CB ASP B 92 5.494 18.909 0.391 1.00 0.75 C ATOM 3145 CG ASP B 92 5.051 18.476 -1.006 1.00 0.88 C ATOM 3146 OD1 ASP B 92 4.103 17.666 -1.104 1.00 0.93 O ATOM 3147 OD2 ASP B 92 5.653 18.944 -1.992 1.00 1.15 O ATOM 0 H ASP B 92 2.940 18.936 0.334 1.00 0.66 H new ATOM 0 HA ASP B 92 4.953 20.143 2.056 1.00 0.74 H new ATOM 0 HB2 ASP B 92 6.524 19.263 0.339 1.00 0.75 H new ATOM 0 HB3 ASP B 92 5.489 18.038 1.047 1.00 0.75 H new ATOM 3152 N LEU B 93 4.319 22.451 0.998 1.00 0.63 N ATOM 3153 CA LEU B 93 4.378 23.829 0.475 1.00 0.66 C ATOM 3154 C LEU B 93 4.051 24.850 1.588 1.00 0.69 C ATOM 3155 O LEU B 93 4.795 25.817 1.785 1.00 0.82 O ATOM 3156 CB LEU B 93 3.397 24.004 -0.716 1.00 0.71 C ATOM 3157 CG LEU B 93 3.787 25.075 -1.760 1.00 0.97 C ATOM 3158 CD1 LEU B 93 4.944 24.588 -2.636 1.00 1.27 C ATOM 3159 CD2 LEU B 93 2.582 25.468 -2.621 1.00 1.18 C ATOM 0 H LEU B 93 3.887 22.381 1.919 1.00 0.63 H new ATOM 0 HA LEU B 93 5.392 24.014 0.122 1.00 0.66 H new ATOM 0 HB2 LEU B 93 3.301 23.045 -1.226 1.00 0.71 H new ATOM 0 HB3 LEU B 93 2.414 24.254 -0.318 1.00 0.71 H new ATOM 0 HG LEU B 93 4.120 25.962 -1.221 1.00 0.97 H new ATOM 0 HD11 LEU B 93 5.200 25.359 -3.363 1.00 1.27 H new ATOM 0 HD12 LEU B 93 5.811 24.377 -2.010 1.00 1.27 H new ATOM 0 HD13 LEU B 93 4.646 23.680 -3.160 1.00 1.27 H new ATOM 0 HD21 LEU B 93 2.884 26.223 -3.347 1.00 1.18 H new ATOM 0 HD22 LEU B 93 2.208 24.589 -3.146 1.00 1.18 H new ATOM 0 HD23 LEU B 93 1.796 25.872 -1.983 1.00 1.18 H new ATOM 3171 N LYS B 94 2.930 24.615 2.311 1.00 0.66 N ATOM 3172 CA LYS B 94 2.476 25.497 3.402 1.00 0.74 C ATOM 3173 C LYS B 94 2.877 24.929 4.783 1.00 0.70 C ATOM 3174 O LYS B 94 3.421 25.662 5.616 1.00 0.79 O ATOM 3175 CB LYS B 94 0.941 25.681 3.316 1.00 0.84 C ATOM 3176 CG LYS B 94 0.375 26.849 4.137 1.00 1.00 C ATOM 3177 CD LYS B 94 0.621 28.206 3.462 1.00 1.15 C ATOM 3178 CE LYS B 94 0.154 29.379 4.321 1.00 1.45 C ATOM 3179 NZ LYS B 94 1.054 29.620 5.487 1.00 1.61 N ATOM 0 H LYS B 94 2.321 23.812 2.152 1.00 0.66 H new ATOM 0 HA LYS B 94 2.962 26.466 3.290 1.00 0.74 H new ATOM 0 HB2 LYS B 94 0.667 25.826 2.271 1.00 0.84 H new ATOM 0 HB3 LYS B 94 0.462 24.760 3.647 1.00 0.84 H new ATOM 0 HG2 LYS B 94 -0.696 26.705 4.280 1.00 1.00 H new ATOM 0 HG3 LYS B 94 0.831 26.850 5.127 1.00 1.00 H new ATOM 0 HD2 LYS B 94 1.685 28.315 3.250 1.00 1.15 H new ATOM 0 HD3 LYS B 94 0.101 28.231 2.504 1.00 1.15 H new ATOM 0 HE2 LYS B 94 0.108 30.279 3.708 1.00 1.45 H new ATOM 0 HE3 LYS B 94 -0.857 29.185 4.679 1.00 1.45 H new ATOM 0 HZ1 LYS B 94 0.697 30.425 6.040 1.00 1.61 H new ATOM 0 HZ2 LYS B 94 1.079 28.771 6.087 1.00 1.61 H new ATOM 0 HZ3 LYS B 94 2.014 29.832 5.147 1.00 1.61 H new ATOM 3193 N ILE B 95 2.590 23.625 5.022 1.00 0.65 N ATOM 3194 CA ILE B 95 2.914 22.950 6.304 1.00 0.66 C ATOM 3195 C ILE B 95 3.861 21.749 6.082 1.00 0.68 C ATOM 3196 O ILE B 95 3.585 20.887 5.246 1.00 0.78 O ATOM 3197 CB ILE B 95 1.624 22.471 7.066 1.00 0.74 C ATOM 3198 CG1 ILE B 95 0.674 21.652 6.141 1.00 0.83 C ATOM 3199 CG2 ILE B 95 0.891 23.672 7.680 1.00 0.84 C ATOM 3200 CD1 ILE B 95 -0.522 21.013 6.839 1.00 1.04 C ATOM 0 H ILE B 95 2.133 23.018 4.341 1.00 0.65 H new ATOM 0 HA ILE B 95 3.418 23.692 6.923 1.00 0.66 H new ATOM 0 HB ILE B 95 1.940 21.806 7.869 1.00 0.74 H new ATOM 0 HG12 ILE B 95 0.306 22.309 5.353 1.00 0.83 H new ATOM 0 HG13 ILE B 95 1.254 20.866 5.656 1.00 0.83 H new ATOM 0 HG21 ILE B 95 0.000 23.326 8.204 1.00 0.84 H new ATOM 0 HG22 ILE B 95 1.551 24.180 8.383 1.00 0.84 H new ATOM 0 HG23 ILE B 95 0.601 24.364 6.889 1.00 0.84 H new ATOM 0 HD11 ILE B 95 -1.120 20.467 6.109 1.00 1.04 H new ATOM 0 HD12 ILE B 95 -0.170 20.325 7.608 1.00 1.04 H new ATOM 0 HD13 ILE B 95 -1.132 21.790 7.299 1.00 1.04 H new ATOM 3212 N ARG B 96 4.986 21.708 6.830 1.00 0.70 N ATOM 3213 CA ARG B 96 5.971 20.609 6.724 1.00 0.79 C ATOM 3214 C ARG B 96 6.429 20.100 8.116 1.00 0.79 C ATOM 3215 O ARG B 96 7.591 19.712 8.288 1.00 1.02 O ATOM 3216 CB ARG B 96 7.181 21.049 5.858 1.00 0.99 C ATOM 3217 CG ARG B 96 7.929 22.295 6.355 1.00 1.12 C ATOM 3218 CD ARG B 96 9.115 22.655 5.453 1.00 1.41 C ATOM 3219 NE ARG B 96 10.264 21.741 5.628 1.00 1.59 N ATOM 3220 CZ ARG B 96 11.285 21.589 4.750 1.00 2.01 C ATOM 3221 NH1 ARG B 96 11.316 22.249 3.582 1.00 2.42 N ATOM 3222 NH2 ARG B 96 12.286 20.753 5.048 1.00 2.37 N ATOM 0 H ARG B 96 5.234 22.423 7.513 1.00 0.70 H new ATOM 0 HA ARG B 96 5.479 19.771 6.231 1.00 0.79 H new ATOM 0 HB2 ARG B 96 7.887 20.220 5.803 1.00 0.99 H new ATOM 0 HB3 ARG B 96 6.830 21.237 4.843 1.00 0.99 H new ATOM 0 HG2 ARG B 96 7.239 23.138 6.399 1.00 1.12 H new ATOM 0 HG3 ARG B 96 8.286 22.122 7.370 1.00 1.12 H new ATOM 0 HD2 ARG B 96 8.794 22.633 4.412 1.00 1.41 H new ATOM 0 HD3 ARG B 96 9.432 23.676 5.667 1.00 1.41 H new ATOM 0 HE ARG B 96 10.290 21.179 6.479 1.00 1.59 H new ATOM 0 HH11 ARG B 96 10.558 22.885 3.335 1.00 2.42 H new ATOM 0 HH12 ARG B 96 12.098 22.115 2.941 1.00 2.42 H new ATOM 0 HH21 ARG B 96 12.275 20.238 5.928 1.00 2.37 H new ATOM 0 HH22 ARG B 96 13.060 20.631 4.395 1.00 2.37 H new ATOM 3236 N LYS B 97 5.508 20.090 9.109 1.00 0.72 N ATOM 3237 CA LYS B 97 5.824 19.602 10.471 1.00 0.76 C ATOM 3238 C LYS B 97 4.542 19.296 11.276 1.00 0.76 C ATOM 3239 O LYS B 97 3.810 20.209 11.668 1.00 1.04 O ATOM 3240 CB LYS B 97 6.740 20.590 11.243 1.00 0.89 C ATOM 3241 CG LYS B 97 6.237 22.037 11.326 1.00 0.94 C ATOM 3242 CD LYS B 97 7.046 22.864 12.330 1.00 1.16 C ATOM 3243 CE LYS B 97 6.469 24.266 12.533 1.00 1.49 C ATOM 3244 NZ LYS B 97 5.176 24.249 13.284 1.00 1.86 N ATOM 0 H LYS B 97 4.547 20.412 8.993 1.00 0.72 H new ATOM 0 HA LYS B 97 6.375 18.669 10.351 1.00 0.76 H new ATOM 0 HB2 LYS B 97 6.877 20.214 12.257 1.00 0.89 H new ATOM 0 HB3 LYS B 97 7.722 20.593 10.769 1.00 0.89 H new ATOM 0 HG2 LYS B 97 6.298 22.500 10.341 1.00 0.94 H new ATOM 0 HG3 LYS B 97 5.186 22.040 11.615 1.00 0.94 H new ATOM 0 HD2 LYS B 97 7.072 22.343 13.287 1.00 1.16 H new ATOM 0 HD3 LYS B 97 8.076 22.945 11.983 1.00 1.16 H new ATOM 0 HE2 LYS B 97 7.191 24.878 13.073 1.00 1.49 H new ATOM 0 HE3 LYS B 97 6.315 24.736 11.562 1.00 1.49 H new ATOM 0 HZ1 LYS B 97 4.869 25.225 13.469 1.00 1.86 H new ATOM 0 HZ2 LYS B 97 4.453 23.760 12.719 1.00 1.86 H new ATOM 0 HZ3 LYS B 97 5.306 23.750 14.187 1.00 1.86 H new ATOM 3258 N LYS B 98 4.272 17.994 11.502 1.00 0.71 N ATOM 3259 CA LYS B 98 3.093 17.546 12.265 1.00 0.74 C ATOM 3260 C LYS B 98 3.503 16.476 13.290 1.00 0.90 C ATOM 3261 O LYS B 98 3.469 16.774 14.503 1.00 1.07 O ATOM 3262 CB LYS B 98 1.996 17.010 11.310 1.00 0.96 C ATOM 3263 CG LYS B 98 0.629 16.803 11.975 1.00 1.08 C ATOM 3264 CD LYS B 98 -0.377 16.125 11.040 1.00 1.52 C ATOM 3265 CE LYS B 98 -1.718 15.850 11.729 1.00 1.69 C ATOM 3266 NZ LYS B 98 -2.508 17.093 11.983 1.00 1.85 N ATOM 3267 OXT LYS B 98 3.871 15.357 12.868 1.00 1.15 O ATOM 0 H LYS B 98 4.860 17.232 11.164 1.00 0.71 H new ATOM 0 HA LYS B 98 2.679 18.398 12.804 1.00 0.74 H new ATOM 0 HB2 LYS B 98 1.882 17.706 10.479 1.00 0.96 H new ATOM 0 HB3 LYS B 98 2.329 16.062 10.888 1.00 0.96 H new ATOM 0 HG2 LYS B 98 0.752 16.197 12.873 1.00 1.08 H new ATOM 0 HG3 LYS B 98 0.233 17.767 12.293 1.00 1.08 H new ATOM 0 HD2 LYS B 98 -0.542 16.757 10.168 1.00 1.52 H new ATOM 0 HD3 LYS B 98 0.042 15.186 10.678 1.00 1.52 H new ATOM 0 HE2 LYS B 98 -2.306 15.172 11.110 1.00 1.69 H new ATOM 0 HE3 LYS B 98 -1.537 15.341 12.676 1.00 1.69 H new ATOM 0 HZ1 LYS B 98 -3.404 16.846 12.450 1.00 1.85 H new ATOM 0 HZ2 LYS B 98 -1.963 17.732 12.596 1.00 1.85 H new ATOM 0 HZ3 LYS B 98 -2.708 17.568 11.080 1.00 1.85 H new