USER MOD reduce.3.24.130724 H: found=0, std=0, add=1556, rem=0, adj=62 USER MOD reduce.3.24.130724 removed 1562 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: B 81 CYS SG : rot -88:sc= -13.2! USER MOD Set 1.2: B 85 MET CE :methyl -162:sc= 0 (180deg=-0.206) USER MOD Set 2.1: B 64 SER OG : rot 88:sc= 1.7 USER MOD Set 2.2: C1920 LYS NZ :NH3+ 175:sc= 1.14 (180deg=0.532) USER MOD Set 3.1: B 31 LYS NZ :NH3+ -171:sc= -0.0542 (180deg=-0.21) USER MOD Set 3.2: B 68 ASN : amide:sc= -1.58! K(o=-1.6!,f=-4.8) USER MOD Set 4.1: A 12 MET CE :methyl -158:sc= 0 (180deg=-0.631) USER MOD Set 4.2: A 80 SER OG : rot -90:sc= -1.07 USER MOD Set 4.3: B 12 MET CE :methyl -127:sc= -3.06! (180deg=-8.26!) USER MOD Set 4.4: B 80 SER OG : rot -148:sc= -1.54! USER MOD Set 5.1: A 81 CYS SG : rot 55:sc= -4.85! USER MOD Set 5.2: A 84 MET CE :methyl 176:sc= -5.85! (180deg=-5.91!) USER MOD Set 5.3: C1910 MET CE :methyl -168:sc= -5.06! (180deg=-5.48!) USER MOD Set 6.1: A 73 GLN :FLIP amide:sc= 0.376 F(o=-0.59!,f=0.83) USER MOD Set 6.2: C1915 SER OG : rot 89:sc= 0.454 USER MOD Set 7.1: A 64 SER OG : rot -32:sc= 1.26 USER MOD Set 7.2: C1911 ASN : amide:sc= 0.354 K(o=1.6,f=-0.73) USER MOD Set 8.1: A 57 LYS NZ :NH3+ -144:sc= 1.25 (180deg=0) USER MOD Set 8.2: A 61 ASN : amide:sc= 0.953 K(o=1.1,f=-8.8!) USER MOD Set 8.3: C1904 THR OG1 : rot -120:sc= -1.07 USER MOD Set 9.1: A 30 ASN : amide:sc= -0.763 K(o=-0.76,f=-4!) USER MOD Set 9.2: A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 3 CYS SG : rot 180:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.024) USER MOD Single : A 14 SER OG : rot 94:sc= 1.27 USER MOD Single : A 15 THR OG1 : rot 79:sc= -0.26 USER MOD Single : A 17 HIS : no HE2:sc= -0.977 X(o=-0.98,f=-1) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 TYR OH : rot 180:sc= -0.395 USER MOD Single : A 20 SER OG : rot -56:sc= 0.87 USER MOD Single : A 28 LYS NZ :NH3+ -168:sc= -0.446 (180deg=-0.811) USER MOD Single : A 31 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0303) USER MOD Single : A 35 LYS NZ :NH3+ 152:sc= 1.13 (180deg=0.964) USER MOD Single : A 39 THR OG1 : rot -7:sc= -0.495! USER MOD Single : A 44 SER OG : rot 180:sc= 0.0358 USER MOD Single : A 48 LYS NZ :NH3+ 169:sc=-0.00602 (180deg=-0.137) USER MOD Single : A 50 THR OG1 : rot 90:sc= -2.63! USER MOD Single : A 56 GLN :FLIP amide:sc= 0 F(o=-0.68,f=0) USER MOD Single : A 59 MET CE :methyl 144:sc= -2.56! (180deg=-6.29!) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 65 ASN : amide:sc= 0.124 X(o=0.12,f=-0.28) USER MOD Single : A 68 ASN : amide:sc=-0.00724 K(o=-0.0072,f=-0.91) USER MOD Single : A 75 TYR OH : rot 70:sc= -0.7 USER MOD Single : A 76 CYS SG : rot 63:sc= -3.15! USER MOD Single : A 85 MET CE :methyl 178:sc= -7.98! (180deg=-8.12!) USER MOD Single : A 86 CYS SG : rot -28:sc= 0.0404 USER MOD Single : A 87 ASN : amide:sc= 0 X(o=0,f=-0.47) USER MOD Single : B 3 CYS SG : rot 180:sc= 0 USER MOD Single : B 7 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0103) USER MOD Single : B 14 SER OG : rot 75:sc= 1.28 USER MOD Single : B 15 THR OG1 : rot -130:sc= 0.192 USER MOD Single : B 17 HIS : no HE2:sc= -0.881 X(o=-0.88,f=-1) USER MOD Single : B 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 19 TYR OH : rot 180:sc= -0.408 USER MOD Single : B 20 SER OG : rot -67:sc= 0.916 USER MOD Single : B 28 LYS NZ :NH3+ -164:sc= -0.692 (180deg=-1.21) USER MOD Single : B 30 ASN : amide:sc= -0.853 K(o=-0.85,f=-4.1!) USER MOD Single : B 32 SER OG : rot 180:sc= 0 USER MOD Single : B 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 39 THR OG1 : rot -10:sc= -0.481! USER MOD Single : B 44 SER OG : rot 180:sc= 0.0266 USER MOD Single : B 48 LYS NZ :NH3+ -135:sc= 1.24 (180deg=0.458) USER MOD Single : B 50 THR OG1 : rot 46:sc= 0.297 USER MOD Single : B 56 GLN :FLIP amide:sc= 0 F(o=-0.81,f=0) USER MOD Single : B 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 59 MET CE :methyl 171:sc= -2.33 (180deg=-2.44) USER MOD Single : B 60 SER OG : rot 162:sc= 0.917 USER MOD Single : B 61 ASN : amide:sc= -0.57 X(o=-0.57,f=-0.9) USER MOD Single : B 65 ASN : amide:sc= 0.988 K(o=0.99,f=-0.0066) USER MOD Single : B 73 GLN : amide:sc= 0.151 K(o=0.15,f=-0.49) USER MOD Single : B 75 TYR OH : rot 100:sc= -0.65 USER MOD Single : B 76 CYS SG : rot 69:sc= 0.379 USER MOD Single : B 84 MET CE :methyl 153:sc= -7.28! (180deg=-11.8!) USER MOD Single : B 86 CYS SG : rot -1:sc= -2.76! USER MOD Single : B 87 ASN : amide:sc= 0.0724 X(o=0.072,f=0) USER MOD Single : C1906 THR OG1 : rot 72:sc= 1.45 USER MOD Single : C1916 SER OG : rot 180:sc= 0 USER MOD Single : C1918 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.13) USER MOD Single : C1919 ASN : amide:sc= 0 K(o=0,f=-0.67) USER MOD ----------------------------------------------------------------- ATOM 44 N GLU C1899 -14.341 -9.157 2.135 1.00 0.40 N ATOM 45 CA GLU C1899 -12.921 -9.323 2.211 1.00 0.29 C ATOM 46 C GLU C1899 -12.343 -8.212 3.057 1.00 0.24 C ATOM 47 O GLU C1899 -11.393 -8.413 3.800 1.00 0.27 O ATOM 48 CB GLU C1899 -12.357 -9.238 0.800 1.00 0.30 C ATOM 49 CG GLU C1899 -12.995 -8.112 -0.007 1.00 0.35 C ATOM 50 CD GLU C1899 -14.306 -8.527 -0.659 1.00 0.62 C ATOM 51 OE1 GLU C1899 -14.275 -9.254 -1.669 1.00 0.76 O ATOM 52 OE2 GLU C1899 -15.379 -8.158 -0.121 1.00 0.97 O ATOM 0 HA GLU C1899 -12.668 -10.285 2.657 1.00 0.29 H new ATOM 0 HB2 GLU C1899 -11.279 -9.082 0.850 1.00 0.30 H new ATOM 0 HB3 GLU C1899 -12.518 -10.187 0.288 1.00 0.30 H new ATOM 0 HG2 GLU C1899 -13.173 -7.258 0.646 1.00 0.35 H new ATOM 0 HG3 GLU C1899 -12.298 -7.783 -0.778 1.00 0.35 H new ATOM 59 N LEU C1900 -12.974 -7.039 2.964 1.00 0.24 N ATOM 60 CA LEU C1900 -12.487 -5.846 3.631 1.00 0.25 C ATOM 61 C LEU C1900 -12.606 -5.971 5.151 1.00 0.28 C ATOM 62 O LEU C1900 -12.087 -5.136 5.888 1.00 0.44 O ATOM 63 CB LEU C1900 -13.228 -4.586 3.153 1.00 0.33 C ATOM 64 CG LEU C1900 -12.858 -4.037 1.772 1.00 0.20 C ATOM 65 CD1 LEU C1900 -11.358 -4.014 1.566 1.00 0.22 C ATOM 66 CD2 LEU C1900 -13.560 -4.781 0.670 1.00 0.31 C ATOM 0 H LEU C1900 -13.830 -6.898 2.427 1.00 0.24 H new ATOM 0 HA LEU C1900 -11.434 -5.746 3.369 1.00 0.25 H new ATOM 0 HB2 LEU C1900 -14.297 -4.801 3.156 1.00 0.33 H new ATOM 0 HB3 LEU C1900 -13.060 -3.797 3.886 1.00 0.33 H new ATOM 0 HG LEU C1900 -13.205 -3.005 1.732 1.00 0.20 H new ATOM 0 HD11 LEU C1900 -11.133 -3.619 0.576 1.00 0.22 H new ATOM 0 HD12 LEU C1900 -10.896 -3.380 2.323 1.00 0.22 H new ATOM 0 HD13 LEU C1900 -10.964 -5.027 1.651 1.00 0.22 H new ATOM 0 HD21 LEU C1900 -13.271 -4.361 -0.294 1.00 0.31 H new ATOM 0 HD22 LEU C1900 -13.280 -5.834 0.706 1.00 0.31 H new ATOM 0 HD23 LEU C1900 -14.638 -4.688 0.798 1.00 0.31 H new ATOM 78 N GLU C1901 -13.284 -7.013 5.620 1.00 0.27 N ATOM 79 CA GLU C1901 -13.390 -7.263 7.050 1.00 0.34 C ATOM 80 C GLU C1901 -12.052 -7.752 7.585 1.00 0.37 C ATOM 81 O GLU C1901 -11.579 -7.286 8.617 1.00 0.52 O ATOM 82 CB GLU C1901 -14.487 -8.288 7.343 1.00 0.48 C ATOM 83 CG GLU C1901 -14.649 -8.617 8.818 1.00 1.00 C ATOM 84 CD GLU C1901 -15.799 -9.565 9.083 1.00 1.11 C ATOM 85 OE1 GLU C1901 -15.614 -10.788 8.914 1.00 1.48 O ATOM 86 OE2 GLU C1901 -16.896 -9.097 9.463 1.00 1.44 O ATOM 0 H GLU C1901 -13.766 -7.694 5.033 1.00 0.27 H new ATOM 0 HA GLU C1901 -13.657 -6.332 7.549 1.00 0.34 H new ATOM 0 HB2 GLU C1901 -15.435 -7.910 6.960 1.00 0.48 H new ATOM 0 HB3 GLU C1901 -14.266 -9.206 6.799 1.00 0.48 H new ATOM 0 HG2 GLU C1901 -13.725 -9.060 9.191 1.00 1.00 H new ATOM 0 HG3 GLU C1901 -14.808 -7.694 9.376 1.00 1.00 H new ATOM 93 N ASP C1902 -11.448 -8.684 6.862 1.00 0.37 N ATOM 94 CA ASP C1902 -10.132 -9.202 7.215 1.00 0.46 C ATOM 95 C ASP C1902 -9.051 -8.348 6.564 1.00 0.44 C ATOM 96 O ASP C1902 -7.948 -8.213 7.085 1.00 0.58 O ATOM 97 CB ASP C1902 -10.005 -10.658 6.758 1.00 0.60 C ATOM 98 CG ASP C1902 -8.713 -11.311 7.204 1.00 1.18 C ATOM 99 OD1 ASP C1902 -8.648 -11.770 8.363 1.00 1.42 O ATOM 100 OD2 ASP C1902 -7.766 -11.389 6.391 1.00 2.01 O ATOM 0 H ASP C1902 -11.851 -9.100 6.022 1.00 0.37 H new ATOM 0 HA ASP C1902 -10.009 -9.163 8.297 1.00 0.46 H new ATOM 0 HB2 ASP C1902 -10.847 -11.230 7.148 1.00 0.60 H new ATOM 0 HB3 ASP C1902 -10.069 -10.698 5.671 1.00 0.60 H new ATOM 105 N ALA C1903 -9.407 -7.757 5.428 1.00 0.36 N ATOM 106 CA ALA C1903 -8.505 -6.914 4.651 1.00 0.46 C ATOM 107 C ALA C1903 -7.940 -5.773 5.460 1.00 0.37 C ATOM 108 O ALA C1903 -6.760 -5.740 5.808 1.00 0.37 O ATOM 109 CB ALA C1903 -9.244 -6.295 3.481 1.00 0.66 C ATOM 0 H ALA C1903 -10.336 -7.850 5.018 1.00 0.36 H new ATOM 0 HA ALA C1903 -7.695 -7.564 4.322 1.00 0.46 H new ATOM 0 HB1 ALA C1903 -8.560 -5.668 2.909 1.00 0.66 H new ATOM 0 HB2 ALA C1903 -9.635 -7.084 2.839 1.00 0.66 H new ATOM 0 HB3 ALA C1903 -10.069 -5.687 3.852 1.00 0.66 H new ATOM 115 N THR C1904 -8.813 -4.838 5.754 1.00 0.37 N ATOM 116 CA THR C1904 -8.408 -3.569 6.282 1.00 0.36 C ATOM 117 C THR C1904 -8.474 -3.564 7.798 1.00 0.34 C ATOM 118 O THR C1904 -8.159 -2.569 8.444 1.00 0.36 O ATOM 119 CB THR C1904 -9.264 -2.458 5.661 1.00 0.40 C ATOM 120 OG1 THR C1904 -10.656 -2.715 5.881 1.00 0.42 O ATOM 121 CG2 THR C1904 -9.002 -2.392 4.164 1.00 0.40 C ATOM 0 H THR C1904 -9.820 -4.941 5.632 1.00 0.37 H new ATOM 0 HA THR C1904 -7.367 -3.383 6.016 1.00 0.36 H new ATOM 0 HB THR C1904 -8.998 -1.511 6.130 1.00 0.40 H new ATOM 0 HG1 THR C1904 -11.115 -2.793 5.018 1.00 0.42 H new ATOM 0 HG21 THR C1904 -9.610 -1.603 3.723 1.00 0.40 H new ATOM 0 HG22 THR C1904 -7.948 -2.179 3.988 1.00 0.40 H new ATOM 0 HG23 THR C1904 -9.260 -3.347 3.707 1.00 0.40 H new ATOM 129 N GLU C1905 -8.876 -4.690 8.364 1.00 0.32 N ATOM 130 CA GLU C1905 -8.725 -4.909 9.789 1.00 0.32 C ATOM 131 C GLU C1905 -7.258 -4.759 10.127 1.00 0.28 C ATOM 132 O GLU C1905 -6.868 -4.106 11.095 1.00 0.32 O ATOM 133 CB GLU C1905 -9.169 -6.312 10.151 1.00 0.36 C ATOM 134 CG GLU C1905 -9.044 -6.630 11.630 1.00 0.62 C ATOM 135 CD GLU C1905 -9.811 -7.871 12.034 1.00 1.25 C ATOM 136 OE1 GLU C1905 -11.046 -7.907 11.834 1.00 1.76 O ATOM 137 OE2 GLU C1905 -9.190 -8.811 12.573 1.00 2.06 O ATOM 0 H GLU C1905 -9.308 -5.463 7.858 1.00 0.32 H new ATOM 0 HA GLU C1905 -9.332 -4.192 10.342 1.00 0.32 H new ATOM 0 HB2 GLU C1905 -10.207 -6.445 9.847 1.00 0.36 H new ATOM 0 HB3 GLU C1905 -8.576 -7.029 9.583 1.00 0.36 H new ATOM 0 HG2 GLU C1905 -7.991 -6.762 11.880 1.00 0.62 H new ATOM 0 HG3 GLU C1905 -9.405 -5.781 12.211 1.00 0.62 H new ATOM 144 N THR C1906 -6.458 -5.382 9.283 1.00 0.25 N ATOM 145 CA THR C1906 -5.027 -5.306 9.374 1.00 0.24 C ATOM 146 C THR C1906 -4.522 -3.932 8.942 1.00 0.21 C ATOM 147 O THR C1906 -3.416 -3.534 9.314 1.00 0.19 O ATOM 148 CB THR C1906 -4.397 -6.411 8.515 1.00 0.29 C ATOM 149 OG1 THR C1906 -5.416 -7.052 7.734 1.00 0.48 O ATOM 150 CG2 THR C1906 -3.720 -7.438 9.401 1.00 0.47 C ATOM 0 H THR C1906 -6.794 -5.958 8.511 1.00 0.25 H new ATOM 0 HA THR C1906 -4.734 -5.452 10.414 1.00 0.24 H new ATOM 0 HB THR C1906 -3.654 -5.965 7.854 1.00 0.29 H new ATOM 0 HG1 THR C1906 -5.719 -6.443 7.028 1.00 0.48 H new ATOM 0 HG21 THR C1906 -3.276 -8.217 8.781 1.00 0.47 H new ATOM 0 HG22 THR C1906 -2.940 -6.954 9.989 1.00 0.47 H new ATOM 0 HG23 THR C1906 -4.456 -7.882 10.071 1.00 0.47 H new ATOM 158 N ALA C1907 -5.332 -3.209 8.155 1.00 0.23 N ATOM 159 CA ALA C1907 -4.985 -1.837 7.782 1.00 0.21 C ATOM 160 C ALA C1907 -4.729 -0.982 9.014 1.00 0.21 C ATOM 161 O ALA C1907 -3.780 -0.204 9.047 1.00 0.21 O ATOM 162 CB ALA C1907 -6.052 -1.182 6.910 1.00 0.22 C ATOM 0 H ALA C1907 -6.215 -3.546 7.772 1.00 0.23 H new ATOM 0 HA ALA C1907 -4.069 -1.901 7.194 1.00 0.21 H new ATOM 0 HB1 ALA C1907 -5.746 -0.166 6.662 1.00 0.22 H new ATOM 0 HB2 ALA C1907 -6.176 -1.758 5.993 1.00 0.22 H new ATOM 0 HB3 ALA C1907 -6.997 -1.154 7.452 1.00 0.22 H new ATOM 168 N ASP C1908 -5.581 -1.141 10.025 1.00 0.24 N ATOM 169 CA ASP C1908 -5.419 -0.435 11.298 1.00 0.26 C ATOM 170 C ASP C1908 -4.002 -0.625 11.838 1.00 0.27 C ATOM 171 O ASP C1908 -3.328 0.344 12.185 1.00 0.34 O ATOM 172 CB ASP C1908 -6.445 -0.954 12.317 1.00 0.33 C ATOM 173 CG ASP C1908 -6.441 -0.185 13.631 1.00 0.44 C ATOM 174 OD1 ASP C1908 -5.454 -0.282 14.391 1.00 0.68 O ATOM 175 OD2 ASP C1908 -7.452 0.489 13.931 1.00 0.58 O ATOM 0 H ASP C1908 -6.395 -1.755 9.988 1.00 0.24 H new ATOM 0 HA ASP C1908 -5.587 0.629 11.132 1.00 0.26 H new ATOM 0 HB2 ASP C1908 -7.441 -0.900 11.877 1.00 0.33 H new ATOM 0 HB3 ASP C1908 -6.243 -2.006 12.520 1.00 0.33 H new ATOM 180 N ALA C1909 -3.545 -1.875 11.872 1.00 0.23 N ATOM 181 CA ALA C1909 -2.205 -2.190 12.366 1.00 0.24 C ATOM 182 C ALA C1909 -1.129 -1.591 11.460 1.00 0.22 C ATOM 183 O ALA C1909 -0.296 -0.803 11.916 1.00 0.24 O ATOM 184 CB ALA C1909 -2.023 -3.693 12.487 1.00 0.27 C ATOM 0 H ALA C1909 -4.082 -2.686 11.564 1.00 0.23 H new ATOM 0 HA ALA C1909 -2.097 -1.745 13.355 1.00 0.24 H new ATOM 0 HB1 ALA C1909 -1.020 -3.910 12.856 1.00 0.27 H new ATOM 0 HB2 ALA C1909 -2.760 -4.094 13.183 1.00 0.27 H new ATOM 0 HB3 ALA C1909 -2.158 -4.156 11.509 1.00 0.27 H new ATOM 190 N MET C1910 -1.160 -1.967 10.180 1.00 0.19 N ATOM 191 CA MET C1910 -0.250 -1.418 9.172 1.00 0.19 C ATOM 192 C MET C1910 -0.151 0.105 9.232 1.00 0.19 C ATOM 193 O MET C1910 0.911 0.658 9.027 1.00 0.22 O ATOM 194 CB MET C1910 -0.700 -1.868 7.776 1.00 0.18 C ATOM 195 CG MET C1910 -0.156 -1.022 6.630 1.00 0.20 C ATOM 196 SD MET C1910 -0.613 -1.682 5.027 1.00 0.20 S ATOM 197 CE MET C1910 0.146 -3.298 5.125 1.00 0.14 C ATOM 0 H MET C1910 -1.814 -2.658 9.813 1.00 0.19 H new ATOM 0 HA MET C1910 0.747 -1.804 9.386 1.00 0.19 H new ATOM 0 HB2 MET C1910 -0.391 -2.902 7.625 1.00 0.18 H new ATOM 0 HB3 MET C1910 -1.789 -1.852 7.737 1.00 0.18 H new ATOM 0 HG2 MET C1910 -0.532 -0.003 6.722 1.00 0.20 H new ATOM 0 HG3 MET C1910 0.930 -0.969 6.703 1.00 0.20 H new ATOM 0 HE1 MET C1910 0.144 -3.761 4.138 1.00 0.14 H new ATOM 0 HE2 MET C1910 1.173 -3.197 5.476 1.00 0.14 H new ATOM 0 HE3 MET C1910 -0.416 -3.922 5.820 1.00 0.14 H new ATOM 207 N ASN C1911 -1.244 0.770 9.532 1.00 0.21 N ATOM 208 CA ASN C1911 -1.281 2.233 9.585 1.00 0.22 C ATOM 209 C ASN C1911 -0.413 2.787 10.705 1.00 0.23 C ATOM 210 O ASN C1911 0.290 3.780 10.527 1.00 0.27 O ATOM 211 CB ASN C1911 -2.716 2.671 9.800 1.00 0.24 C ATOM 212 CG ASN C1911 -2.894 4.167 9.796 1.00 0.25 C ATOM 213 OD1 ASN C1911 -2.733 4.828 10.822 1.00 0.42 O ATOM 214 ND2 ASN C1911 -3.244 4.703 8.646 1.00 0.25 N ATOM 0 H ASN C1911 -2.135 0.323 9.747 1.00 0.21 H new ATOM 0 HA ASN C1911 -0.889 2.620 8.644 1.00 0.22 H new ATOM 0 HB2 ASN C1911 -3.341 2.236 9.020 1.00 0.24 H new ATOM 0 HB3 ASN C1911 -3.070 2.273 10.751 1.00 0.24 H new ATOM 0 HD21 ASN C1911 -3.394 5.710 8.577 1.00 0.25 H new ATOM 0 HD22 ASN C1911 -3.365 4.112 7.824 1.00 0.25 H new ATOM 221 N ARG C1912 -0.451 2.143 11.855 1.00 0.23 N ATOM 222 CA ARG C1912 0.270 2.646 13.013 1.00 0.26 C ATOM 223 C ARG C1912 1.764 2.549 12.763 1.00 0.28 C ATOM 224 O ARG C1912 2.534 3.454 13.090 1.00 0.38 O ATOM 225 CB ARG C1912 -0.102 1.854 14.264 1.00 0.30 C ATOM 226 CG ARG C1912 -1.598 1.603 14.410 1.00 0.75 C ATOM 227 CD ARG C1912 -2.415 2.864 14.162 1.00 1.46 C ATOM 228 NE ARG C1912 -2.091 3.935 15.103 1.00 2.17 N ATOM 229 CZ ARG C1912 -2.322 5.228 14.867 1.00 2.91 C ATOM 230 NH1 ARG C1912 -2.909 5.601 13.734 1.00 3.13 N ATOM 231 NH2 ARG C1912 -1.977 6.141 15.767 1.00 3.76 N ATOM 0 H ARG C1912 -0.968 1.278 12.014 1.00 0.23 H new ATOM 0 HA ARG C1912 -0.005 3.689 13.172 1.00 0.26 H new ATOM 0 HB2 ARG C1912 0.418 0.896 14.244 1.00 0.30 H new ATOM 0 HB3 ARG C1912 0.254 2.392 15.143 1.00 0.30 H new ATOM 0 HG2 ARG C1912 -1.906 0.828 13.708 1.00 0.75 H new ATOM 0 HG3 ARG C1912 -1.806 1.227 15.412 1.00 0.75 H new ATOM 0 HD2 ARG C1912 -2.239 3.213 13.145 1.00 1.46 H new ATOM 0 HD3 ARG C1912 -3.476 2.626 14.238 1.00 1.46 H new ATOM 0 HE ARG C1912 -1.663 3.679 15.993 1.00 2.17 H new ATOM 0 HH11 ARG C1912 -3.182 4.899 13.046 1.00 3.13 H new ATOM 0 HH12 ARG C1912 -3.086 6.589 13.553 1.00 3.13 H new ATOM 0 HH21 ARG C1912 -1.535 5.855 16.640 1.00 3.76 H new ATOM 0 HH22 ARG C1912 -2.154 7.129 15.585 1.00 3.76 H new ATOM 245 N GLU C1913 2.159 1.450 12.152 1.00 0.23 N ATOM 246 CA GLU C1913 3.548 1.214 11.819 1.00 0.25 C ATOM 247 C GLU C1913 3.938 1.949 10.544 1.00 0.22 C ATOM 248 O GLU C1913 5.077 2.360 10.398 1.00 0.27 O ATOM 249 CB GLU C1913 3.789 -0.282 11.667 1.00 0.29 C ATOM 250 CG GLU C1913 2.778 -0.947 10.756 1.00 0.29 C ATOM 251 CD GLU C1913 2.870 -2.455 10.779 1.00 0.39 C ATOM 252 OE1 GLU C1913 2.499 -3.067 11.794 1.00 0.79 O ATOM 253 OE2 GLU C1913 3.314 -3.044 9.764 1.00 0.57 O ATOM 0 H GLU C1913 1.528 0.698 11.874 1.00 0.23 H new ATOM 0 HA GLU C1913 4.171 1.598 12.627 1.00 0.25 H new ATOM 0 HB2 GLU C1913 4.791 -0.446 11.272 1.00 0.29 H new ATOM 0 HB3 GLU C1913 3.752 -0.753 12.649 1.00 0.29 H new ATOM 0 HG2 GLU C1913 1.774 -0.644 11.053 1.00 0.29 H new ATOM 0 HG3 GLU C1913 2.928 -0.594 9.736 1.00 0.29 H new ATOM 260 N VAL C1914 2.985 2.117 9.630 1.00 0.19 N ATOM 261 CA VAL C1914 3.232 2.793 8.355 1.00 0.20 C ATOM 262 C VAL C1914 3.473 4.274 8.575 1.00 0.18 C ATOM 263 O VAL C1914 4.274 4.898 7.880 1.00 0.20 O ATOM 264 CB VAL C1914 2.035 2.620 7.377 1.00 0.24 C ATOM 265 CG1 VAL C1914 0.950 3.654 7.613 1.00 0.26 C ATOM 266 CG2 VAL C1914 2.480 2.680 5.941 1.00 0.29 C ATOM 0 H VAL C1914 2.026 1.792 9.749 1.00 0.19 H new ATOM 0 HA VAL C1914 4.118 2.334 7.915 1.00 0.20 H new ATOM 0 HB VAL C1914 1.620 1.633 7.579 1.00 0.24 H new ATOM 0 HG11 VAL C1914 0.135 3.494 6.907 1.00 0.26 H new ATOM 0 HG12 VAL C1914 0.572 3.559 8.631 1.00 0.26 H new ATOM 0 HG13 VAL C1914 1.362 4.653 7.471 1.00 0.26 H new ATOM 0 HG21 VAL C1914 1.617 2.555 5.287 1.00 0.29 H new ATOM 0 HG22 VAL C1914 2.947 3.645 5.745 1.00 0.29 H new ATOM 0 HG23 VAL C1914 3.199 1.883 5.749 1.00 0.29 H new ATOM 276 N SER C1915 2.770 4.828 9.548 1.00 0.21 N ATOM 277 CA SER C1915 2.884 6.228 9.866 1.00 0.28 C ATOM 278 C SER C1915 4.252 6.489 10.472 1.00 0.28 C ATOM 279 O SER C1915 4.807 7.581 10.355 1.00 0.36 O ATOM 280 CB SER C1915 1.759 6.619 10.808 1.00 0.36 C ATOM 281 OG SER C1915 1.724 8.019 11.034 1.00 1.31 O ATOM 0 H SER C1915 2.109 4.317 10.133 1.00 0.21 H new ATOM 0 HA SER C1915 2.793 6.839 8.968 1.00 0.28 H new ATOM 0 HB2 SER C1915 0.806 6.294 10.391 1.00 0.36 H new ATOM 0 HB3 SER C1915 1.884 6.100 11.759 1.00 0.36 H new ATOM 0 HG SER C1915 1.156 8.445 10.359 1.00 1.31 H new ATOM 287 N SER C1916 4.792 5.467 11.115 1.00 0.25 N ATOM 288 CA SER C1916 6.174 5.490 11.545 1.00 0.27 C ATOM 289 C SER C1916 7.080 5.110 10.371 1.00 0.27 C ATOM 290 O SER C1916 8.191 5.612 10.244 1.00 0.29 O ATOM 291 CB SER C1916 6.380 4.519 12.714 1.00 0.31 C ATOM 292 OG SER C1916 7.709 4.568 13.205 1.00 1.04 O ATOM 0 H SER C1916 4.290 4.610 11.350 1.00 0.25 H new ATOM 0 HA SER C1916 6.430 6.494 11.883 1.00 0.27 H new ATOM 0 HB2 SER C1916 5.685 4.764 13.518 1.00 0.31 H new ATOM 0 HB3 SER C1916 6.148 3.504 12.390 1.00 0.31 H new ATOM 0 HG SER C1916 7.806 3.939 13.950 1.00 1.04 H new ATOM 298 N LEU C1917 6.575 4.242 9.496 1.00 0.30 N ATOM 299 CA LEU C1917 7.364 3.683 8.410 1.00 0.30 C ATOM 300 C LEU C1917 7.751 4.718 7.385 1.00 0.26 C ATOM 301 O LEU C1917 8.930 4.892 7.094 1.00 0.26 O ATOM 302 CB LEU C1917 6.637 2.552 7.694 1.00 0.42 C ATOM 303 CG LEU C1917 7.488 1.853 6.637 1.00 0.57 C ATOM 304 CD1 LEU C1917 8.901 1.726 7.128 1.00 1.25 C ATOM 305 CD2 LEU C1917 6.960 0.483 6.325 1.00 1.16 C ATOM 0 H LEU C1917 5.611 3.910 9.523 1.00 0.30 H new ATOM 0 HA LEU C1917 8.265 3.295 8.886 1.00 0.30 H new ATOM 0 HB2 LEU C1917 6.311 1.817 8.430 1.00 0.42 H new ATOM 0 HB3 LEU C1917 5.739 2.950 7.221 1.00 0.42 H new ATOM 0 HG LEU C1917 7.452 2.456 5.730 1.00 0.57 H new ATOM 0 HD11 LEU C1917 9.506 1.227 6.371 1.00 1.25 H new ATOM 0 HD12 LEU C1917 9.309 2.718 7.322 1.00 1.25 H new ATOM 0 HD13 LEU C1917 8.915 1.141 8.048 1.00 1.25 H new ATOM 0 HD21 LEU C1917 7.590 0.014 5.569 1.00 1.16 H new ATOM 0 HD22 LEU C1917 6.966 -0.124 7.230 1.00 1.16 H new ATOM 0 HD23 LEU C1917 5.940 0.563 5.949 1.00 1.16 H new ATOM 317 N LYS C1918 6.773 5.400 6.820 1.00 0.28 N ATOM 318 CA LYS C1918 7.071 6.364 5.779 1.00 0.29 C ATOM 319 C LYS C1918 7.925 7.498 6.363 1.00 0.32 C ATOM 320 O LYS C1918 8.490 8.321 5.644 1.00 0.38 O ATOM 321 CB LYS C1918 5.789 6.884 5.107 1.00 0.39 C ATOM 322 CG LYS C1918 5.297 8.214 5.627 1.00 0.29 C ATOM 323 CD LYS C1918 4.725 8.086 7.030 1.00 0.40 C ATOM 324 CE LYS C1918 5.040 9.304 7.865 1.00 0.69 C ATOM 325 NZ LYS C1918 4.645 10.580 7.204 1.00 1.36 N ATOM 0 H LYS C1918 5.785 5.308 7.058 1.00 0.28 H new ATOM 0 HA LYS C1918 7.645 5.874 4.992 1.00 0.29 H new ATOM 0 HB2 LYS C1918 5.967 6.972 4.035 1.00 0.39 H new ATOM 0 HB3 LYS C1918 5.000 6.144 5.239 1.00 0.39 H new ATOM 0 HG2 LYS C1918 6.118 8.931 5.632 1.00 0.29 H new ATOM 0 HG3 LYS C1918 4.534 8.608 4.956 1.00 0.29 H new ATOM 0 HD2 LYS C1918 3.645 7.951 6.974 1.00 0.40 H new ATOM 0 HD3 LYS C1918 5.133 7.197 7.511 1.00 0.40 H new ATOM 0 HE2 LYS C1918 4.527 9.223 8.823 1.00 0.69 H new ATOM 0 HE3 LYS C1918 6.109 9.326 8.077 1.00 0.69 H new ATOM 0 HZ1 LYS C1918 4.710 11.360 7.889 1.00 1.36 H new ATOM 0 HZ2 LYS C1918 5.282 10.768 6.403 1.00 1.36 H new ATOM 0 HZ3 LYS C1918 3.667 10.504 6.858 1.00 1.36 H new ATOM 339 N ASN C1919 8.021 7.498 7.693 1.00 0.31 N ATOM 340 CA ASN C1919 8.851 8.433 8.435 1.00 0.33 C ATOM 341 C ASN C1919 10.269 7.870 8.622 1.00 0.32 C ATOM 342 O ASN C1919 11.238 8.624 8.658 1.00 0.41 O ATOM 343 CB ASN C1919 8.195 8.729 9.794 1.00 0.37 C ATOM 344 CG ASN C1919 8.973 9.718 10.645 1.00 0.43 C ATOM 345 OD1 ASN C1919 9.706 10.561 10.131 1.00 1.05 O ATOM 346 ND2 ASN C1919 8.789 9.640 11.955 1.00 1.15 N ATOM 0 H ASN C1919 7.517 6.840 8.287 1.00 0.31 H new ATOM 0 HA ASN C1919 8.936 9.362 7.872 1.00 0.33 H new ATOM 0 HB2 ASN C1919 7.191 9.119 9.626 1.00 0.37 H new ATOM 0 HB3 ASN C1919 8.086 7.795 10.346 1.00 0.37 H new ATOM 0 HD21 ASN C1919 9.264 10.294 12.577 1.00 1.15 H new ATOM 0 HD22 ASN C1919 8.172 8.926 12.342 1.00 1.15 H new ATOM 353 N LYS C1920 10.399 6.539 8.681 1.00 0.28 N ATOM 354 CA LYS C1920 11.696 5.919 8.873 1.00 0.37 C ATOM 355 C LYS C1920 12.326 5.655 7.527 1.00 0.41 C ATOM 356 O LYS C1920 13.532 5.479 7.418 1.00 0.53 O ATOM 357 CB LYS C1920 11.641 4.619 9.720 1.00 0.48 C ATOM 358 CG LYS C1920 10.425 3.693 9.534 1.00 0.33 C ATOM 359 CD LYS C1920 10.587 2.438 10.390 1.00 0.44 C ATOM 360 CE LYS C1920 9.362 1.534 10.341 1.00 1.36 C ATOM 361 NZ LYS C1920 9.689 0.135 10.736 1.00 1.64 N ATOM 0 H LYS C1920 9.622 5.883 8.598 1.00 0.28 H new ATOM 0 HA LYS C1920 12.308 6.617 9.444 1.00 0.37 H new ATOM 0 HB2 LYS C1920 12.539 4.040 9.504 1.00 0.48 H new ATOM 0 HB3 LYS C1920 11.689 4.902 10.772 1.00 0.48 H new ATOM 0 HG2 LYS C1920 9.512 4.218 9.813 1.00 0.33 H new ATOM 0 HG3 LYS C1920 10.325 3.417 8.484 1.00 0.33 H new ATOM 0 HD2 LYS C1920 11.459 1.880 10.049 1.00 0.44 H new ATOM 0 HD3 LYS C1920 10.778 2.729 11.423 1.00 0.44 H new ATOM 0 HE2 LYS C1920 8.593 1.928 11.005 1.00 1.36 H new ATOM 0 HE3 LYS C1920 8.947 1.539 9.333 1.00 1.36 H new ATOM 0 HZ1 LYS C1920 8.816 -0.429 10.772 1.00 1.64 H new ATOM 0 HZ2 LYS C1920 10.340 -0.279 10.039 1.00 1.64 H new ATOM 0 HZ3 LYS C1920 10.140 0.135 11.673 1.00 1.64 H new ATOM 375 N LEU C1921 11.506 5.659 6.496 1.00 0.38 N ATOM 376 CA LEU C1921 12.005 5.494 5.150 1.00 0.46 C ATOM 377 C LEU C1921 12.337 6.839 4.535 1.00 0.59 C ATOM 378 O LEU C1921 12.999 6.931 3.508 1.00 0.92 O ATOM 379 CB LEU C1921 11.002 4.747 4.288 1.00 0.44 C ATOM 380 CG LEU C1921 10.622 3.367 4.808 1.00 0.38 C ATOM 381 CD1 LEU C1921 9.888 2.607 3.735 1.00 0.40 C ATOM 382 CD2 LEU C1921 11.846 2.595 5.272 1.00 0.48 C ATOM 0 H LEU C1921 10.495 5.774 6.566 1.00 0.38 H new ATOM 0 HA LEU C1921 12.919 4.902 5.199 1.00 0.46 H new ATOM 0 HB2 LEU C1921 10.098 5.350 4.201 1.00 0.44 H new ATOM 0 HB3 LEU C1921 11.413 4.642 3.284 1.00 0.44 H new ATOM 0 HG LEU C1921 9.968 3.490 5.671 1.00 0.38 H new ATOM 0 HD11 LEU C1921 9.617 1.620 4.109 1.00 0.40 H new ATOM 0 HD12 LEU C1921 8.985 3.150 3.457 1.00 0.40 H new ATOM 0 HD13 LEU C1921 10.530 2.500 2.861 1.00 0.40 H new ATOM 0 HD21 LEU C1921 11.541 1.614 5.637 1.00 0.48 H new ATOM 0 HD22 LEU C1921 12.537 2.473 4.438 1.00 0.48 H new ATOM 0 HD23 LEU C1921 12.340 3.144 6.074 1.00 0.48 H new ATOM 394 N ARG C1922 11.877 7.887 5.171 1.00 0.49 N ATOM 395 CA ARG C1922 12.276 9.214 4.784 1.00 0.66 C ATOM 396 C ARG C1922 13.445 9.625 5.660 1.00 0.65 C ATOM 397 O ARG C1922 13.985 10.727 5.562 1.00 0.78 O ATOM 398 CB ARG C1922 11.102 10.159 4.926 1.00 0.87 C ATOM 399 CG ARG C1922 11.098 11.257 3.893 1.00 1.15 C ATOM 400 CD ARG C1922 9.686 11.558 3.458 1.00 1.07 C ATOM 401 NE ARG C1922 9.541 12.910 2.935 1.00 1.64 N ATOM 402 CZ ARG C1922 8.428 13.621 3.068 1.00 2.45 C ATOM 403 NH1 ARG C1922 7.361 13.072 3.628 1.00 2.92 N ATOM 404 NH2 ARG C1922 8.376 14.878 2.645 1.00 3.23 N ATOM 0 H ARG C1922 11.228 7.846 5.957 1.00 0.49 H new ATOM 0 HA ARG C1922 12.590 9.244 3.741 1.00 0.66 H new ATOM 0 HB2 ARG C1922 10.175 9.591 4.848 1.00 0.87 H new ATOM 0 HB3 ARG C1922 11.120 10.604 5.921 1.00 0.87 H new ATOM 0 HG2 ARG C1922 11.559 12.155 4.305 1.00 1.15 H new ATOM 0 HG3 ARG C1922 11.696 10.958 3.032 1.00 1.15 H new ATOM 0 HD2 ARG C1922 9.384 10.842 2.694 1.00 1.07 H new ATOM 0 HD3 ARG C1922 9.012 11.425 4.304 1.00 1.07 H new ATOM 0 HE ARG C1922 10.331 13.329 2.444 1.00 1.64 H new ATOM 0 HH11 ARG C1922 7.397 12.107 3.955 1.00 2.92 H new ATOM 0 HH12 ARG C1922 6.504 13.615 3.732 1.00 2.92 H new ATOM 0 HH21 ARG C1922 9.196 15.305 2.214 1.00 3.23 H new ATOM 0 HH22 ARG C1922 7.516 15.417 2.751 1.00 3.23 H new ATOM 461 N LEU C1926 18.100 6.412 4.158 1.00 0.64 N ATOM 462 CA LEU C1926 17.504 5.546 3.153 1.00 0.60 C ATOM 463 C LEU C1926 17.997 5.855 1.745 1.00 0.54 C ATOM 464 O LEU C1926 18.160 7.018 1.358 1.00 0.72 O ATOM 465 CB LEU C1926 15.979 5.669 3.180 1.00 0.93 C ATOM 466 CG LEU C1926 15.218 4.656 4.046 1.00 0.48 C ATOM 467 CD1 LEU C1926 14.047 4.123 3.238 1.00 0.56 C ATOM 468 CD2 LEU C1926 16.110 3.498 4.463 1.00 0.57 C ATOM 0 HA LEU C1926 17.808 4.530 3.402 1.00 0.60 H new ATOM 0 HB2 LEU C1926 15.725 6.671 3.527 1.00 0.93 H new ATOM 0 HB3 LEU C1926 15.613 5.584 2.157 1.00 0.93 H new ATOM 0 HG LEU C1926 14.874 5.155 4.952 1.00 0.48 H new ATOM 0 HD11 LEU C1926 13.492 3.400 3.836 1.00 0.56 H new ATOM 0 HD12 LEU C1926 13.390 4.948 2.963 1.00 0.56 H new ATOM 0 HD13 LEU C1926 14.419 3.638 2.335 1.00 0.56 H new ATOM 0 HD21 LEU C1926 15.538 2.800 5.075 1.00 0.57 H new ATOM 0 HD22 LEU C1926 16.478 2.984 3.575 1.00 0.57 H new ATOM 0 HD23 LEU C1926 16.954 3.878 5.039 1.00 0.57 H new ATOM 480 N PRO C1927 18.239 4.796 0.958 1.00 0.46 N ATOM 481 CA PRO C1927 18.591 4.912 -0.449 1.00 0.55 C ATOM 482 C PRO C1927 17.353 4.952 -1.330 1.00 0.63 C ATOM 483 O PRO C1927 17.444 4.843 -2.553 1.00 1.12 O ATOM 484 CB PRO C1927 19.364 3.624 -0.701 1.00 0.54 C ATOM 485 CG PRO C1927 18.716 2.622 0.195 1.00 0.44 C ATOM 486 CD PRO C1927 18.203 3.385 1.392 1.00 0.41 C ATOM 0 HA PRO C1927 19.147 5.822 -0.674 1.00 0.55 H new ATOM 0 HB2 PRO C1927 19.302 3.321 -1.746 1.00 0.54 H new ATOM 0 HB3 PRO C1927 20.422 3.743 -0.466 1.00 0.54 H new ATOM 0 HG2 PRO C1927 17.901 2.112 -0.319 1.00 0.44 H new ATOM 0 HG3 PRO C1927 19.429 1.856 0.500 1.00 0.44 H new ATOM 0 HD2 PRO C1927 17.193 3.075 1.660 1.00 0.41 H new ATOM 0 HD3 PRO C1927 18.830 3.221 2.269 1.00 0.41 H new ATOM 494 N PHE C1928 16.198 5.089 -0.691 1.00 0.30 N ATOM 495 CA PHE C1928 14.933 5.056 -1.390 1.00 0.27 C ATOM 496 C PHE C1928 13.931 5.971 -0.719 1.00 0.27 C ATOM 497 O PHE C1928 13.820 5.992 0.505 1.00 0.31 O ATOM 498 CB PHE C1928 14.440 3.607 -1.483 1.00 0.24 C ATOM 499 CG PHE C1928 13.180 3.258 -0.766 1.00 0.23 C ATOM 500 CD1 PHE C1928 12.039 3.948 -1.065 1.00 0.30 C ATOM 501 CD2 PHE C1928 13.142 2.292 0.220 1.00 0.26 C ATOM 502 CE1 PHE C1928 10.867 3.682 -0.404 1.00 0.33 C ATOM 503 CE2 PHE C1928 11.981 2.025 0.885 1.00 0.29 C ATOM 504 CZ PHE C1928 10.880 2.511 0.537 1.00 0.27 C ATOM 0 H PHE C1928 16.118 5.225 0.317 1.00 0.30 H new ATOM 0 HA PHE C1928 15.060 5.429 -2.406 1.00 0.27 H new ATOM 0 HB2 PHE C1928 14.304 3.366 -2.537 1.00 0.24 H new ATOM 0 HB3 PHE C1928 15.231 2.958 -1.107 1.00 0.24 H new ATOM 0 HD1 PHE C1928 12.060 4.711 -1.830 1.00 0.30 H new ATOM 0 HD2 PHE C1928 14.039 1.743 0.467 1.00 0.26 H new ATOM 0 HE1 PHE C1928 9.982 4.283 -0.552 1.00 0.33 H new ATOM 0 HE2 PHE C1928 12.012 1.370 1.743 1.00 0.29 H new ATOM 0 HZ PHE C1928 9.955 2.095 0.908 1.00 0.27 H new ATOM 514 N VAL C1929 13.198 6.699 -1.556 1.00 0.25 N ATOM 515 CA VAL C1929 12.252 7.720 -1.132 1.00 0.25 C ATOM 516 C VAL C1929 11.413 8.145 -2.311 1.00 0.25 C ATOM 517 O VAL C1929 11.809 7.950 -3.455 1.00 0.27 O ATOM 518 CB VAL C1929 12.964 8.975 -0.626 1.00 0.29 C ATOM 519 CG1 VAL C1929 13.410 8.797 0.799 1.00 0.62 C ATOM 520 CG2 VAL C1929 14.141 9.265 -1.529 1.00 0.62 C ATOM 0 H VAL C1929 13.248 6.591 -2.569 1.00 0.25 H new ATOM 0 HA VAL C1929 11.650 7.288 -0.333 1.00 0.25 H new ATOM 0 HB VAL C1929 12.275 9.819 -0.648 1.00 0.29 H new ATOM 0 HG11 VAL C1929 13.914 9.702 1.138 1.00 0.62 H new ATOM 0 HG12 VAL C1929 12.542 8.606 1.431 1.00 0.62 H new ATOM 0 HG13 VAL C1929 14.097 7.953 0.862 1.00 0.62 H new ATOM 0 HG21 VAL C1929 14.657 10.159 -1.178 1.00 0.62 H new ATOM 0 HG22 VAL C1929 14.828 8.419 -1.514 1.00 0.62 H new ATOM 0 HG23 VAL C1929 13.787 9.427 -2.547 1.00 0.62 H new ATOM 530 N VAL C1930 10.278 8.752 -2.047 1.00 0.26 N ATOM 531 CA VAL C1930 9.463 9.251 -3.127 1.00 0.26 C ATOM 532 C VAL C1930 10.067 10.521 -3.716 1.00 0.29 C ATOM 533 O VAL C1930 10.388 11.466 -2.996 1.00 0.32 O ATOM 534 CB VAL C1930 8.021 9.532 -2.696 1.00 0.28 C ATOM 535 CG1 VAL C1930 7.204 10.003 -3.888 1.00 0.34 C ATOM 536 CG2 VAL C1930 7.406 8.296 -2.080 1.00 0.32 C ATOM 0 H VAL C1930 9.905 8.909 -1.111 1.00 0.26 H new ATOM 0 HA VAL C1930 9.440 8.465 -3.882 1.00 0.26 H new ATOM 0 HB VAL C1930 8.024 10.321 -1.944 1.00 0.28 H new ATOM 0 HG11 VAL C1930 6.180 10.200 -3.572 1.00 0.34 H new ATOM 0 HG12 VAL C1930 7.642 10.916 -4.291 1.00 0.34 H new ATOM 0 HG13 VAL C1930 7.204 9.231 -4.657 1.00 0.34 H new ATOM 0 HG21 VAL C1930 6.381 8.511 -1.779 1.00 0.32 H new ATOM 0 HG22 VAL C1930 7.407 7.487 -2.810 1.00 0.32 H new ATOM 0 HG23 VAL C1930 7.986 7.998 -1.207 1.00 0.32 H new ATOM 546 N PRO C1931 10.267 10.523 -5.030 1.00 0.34 N ATOM 547 CA PRO C1931 10.716 11.694 -5.777 1.00 0.42 C ATOM 548 C PRO C1931 9.565 12.637 -6.099 1.00 0.45 C ATOM 549 O PRO C1931 8.402 12.317 -5.850 1.00 0.45 O ATOM 550 CB PRO C1931 11.252 11.078 -7.065 1.00 0.56 C ATOM 551 CG PRO C1931 10.380 9.891 -7.278 1.00 0.48 C ATOM 552 CD PRO C1931 10.088 9.353 -5.904 1.00 0.36 C ATOM 0 HA PRO C1931 11.441 12.291 -5.223 1.00 0.42 H new ATOM 0 HB2 PRO C1931 11.189 11.776 -7.899 1.00 0.56 H new ATOM 0 HB3 PRO C1931 12.299 10.793 -6.967 1.00 0.56 H new ATOM 0 HG2 PRO C1931 9.461 10.167 -7.794 1.00 0.48 H new ATOM 0 HG3 PRO C1931 10.879 9.143 -7.894 1.00 0.48 H new ATOM 0 HD2 PRO C1931 9.076 8.953 -5.837 1.00 0.36 H new ATOM 0 HD3 PRO C1931 10.769 8.545 -5.637 1.00 0.36 H new ATOM 560 N ARG C1932 9.895 13.809 -6.616 1.00 0.54 N ATOM 561 CA ARG C1932 8.888 14.689 -7.189 1.00 0.70 C ATOM 562 C ARG C1932 8.150 13.957 -8.308 1.00 0.89 C ATOM 563 O ARG C1932 8.727 13.684 -9.365 1.00 1.79 O ATOM 564 CB ARG C1932 9.538 15.968 -7.725 1.00 0.83 C ATOM 565 CG ARG C1932 10.815 15.720 -8.514 1.00 1.53 C ATOM 566 CD ARG C1932 11.323 16.986 -9.176 1.00 2.00 C ATOM 567 NE ARG C1932 10.494 17.391 -10.307 1.00 2.79 N ATOM 568 CZ ARG C1932 10.395 18.644 -10.747 1.00 3.62 C ATOM 569 NH1 ARG C1932 11.011 19.631 -10.103 1.00 3.88 N ATOM 570 NH2 ARG C1932 9.666 18.910 -11.822 1.00 4.56 N ATOM 0 H ARG C1932 10.847 14.173 -6.651 1.00 0.54 H new ATOM 0 HA ARG C1932 8.175 14.969 -6.414 1.00 0.70 H new ATOM 0 HB2 ARG C1932 8.823 16.489 -8.362 1.00 0.83 H new ATOM 0 HB3 ARG C1932 9.761 16.630 -6.888 1.00 0.83 H new ATOM 0 HG2 ARG C1932 11.582 15.325 -7.848 1.00 1.53 H new ATOM 0 HG3 ARG C1932 10.631 14.961 -9.274 1.00 1.53 H new ATOM 0 HD2 ARG C1932 11.351 17.791 -8.442 1.00 2.00 H new ATOM 0 HD3 ARG C1932 12.347 16.830 -9.516 1.00 2.00 H new ATOM 0 HE ARG C1932 9.958 16.670 -10.790 1.00 2.79 H new ATOM 0 HH11 ARG C1932 11.562 19.430 -9.269 1.00 3.88 H new ATOM 0 HH12 ARG C1932 10.933 20.589 -10.444 1.00 3.88 H new ATOM 0 HH21 ARG C1932 9.183 18.156 -12.310 1.00 4.56 H new ATOM 0 HH22 ARG C1932 9.588 19.869 -12.161 1.00 4.56 H new ATOM 584 N ARG C1933 6.887 13.619 -8.051 1.00 0.74 N ATOM 585 CA ARG C1933 6.078 12.830 -8.984 1.00 0.76 C ATOM 586 C ARG C1933 6.654 11.421 -9.119 1.00 0.65 C ATOM 587 O ARG C1933 7.460 10.988 -8.297 1.00 0.69 O ATOM 588 CB ARG C1933 6.021 13.504 -10.358 1.00 0.95 C ATOM 589 CG ARG C1933 5.505 14.929 -10.328 1.00 1.66 C ATOM 590 CD ARG C1933 5.696 15.603 -11.672 1.00 1.80 C ATOM 591 NE ARG C1933 4.876 14.992 -12.716 1.00 2.56 N ATOM 592 CZ ARG C1933 5.037 15.220 -14.017 1.00 2.86 C ATOM 593 NH1 ARG C1933 6.005 16.018 -14.445 1.00 2.53 N ATOM 594 NH2 ARG C1933 4.230 14.642 -14.890 1.00 3.92 N ATOM 0 H ARG C1933 6.397 13.882 -7.196 1.00 0.74 H new ATOM 0 HA ARG C1933 5.065 12.766 -8.588 1.00 0.76 H new ATOM 0 HB2 ARG C1933 7.020 13.500 -10.794 1.00 0.95 H new ATOM 0 HB3 ARG C1933 5.384 12.912 -11.015 1.00 0.95 H new ATOM 0 HG2 ARG C1933 4.448 14.931 -10.063 1.00 1.66 H new ATOM 0 HG3 ARG C1933 6.029 15.493 -9.556 1.00 1.66 H new ATOM 0 HD2 ARG C1933 5.444 16.660 -11.586 1.00 1.80 H new ATOM 0 HD3 ARG C1933 6.746 15.548 -11.958 1.00 1.80 H new ATOM 0 HE ARG C1933 4.135 14.352 -12.430 1.00 2.56 H new ATOM 0 HH11 ARG C1933 6.633 16.462 -13.775 1.00 2.53 H new ATOM 0 HH12 ARG C1933 6.122 16.188 -15.444 1.00 2.53 H new ATOM 0 HH21 ARG C1933 3.487 14.023 -14.566 1.00 3.92 H new ATOM 0 HH22 ARG C1933 4.351 14.815 -15.888 1.00 3.92 H new ATOM 654 N ALA A 2 1.777 -1.917 -17.784 1.00 0.37 N ATOM 655 CA ALA A 2 2.559 -0.883 -17.123 1.00 0.33 C ATOM 656 C ALA A 2 3.512 -1.501 -16.111 1.00 0.30 C ATOM 657 O ALA A 2 3.427 -2.699 -15.838 1.00 0.39 O ATOM 658 CB ALA A 2 1.634 0.111 -16.447 1.00 0.33 C ATOM 0 HA ALA A 2 3.152 -0.357 -17.871 1.00 0.33 H new ATOM 0 HB1 ALA A 2 2.226 0.882 -15.954 1.00 0.33 H new ATOM 0 HB2 ALA A 2 0.987 0.572 -17.193 1.00 0.33 H new ATOM 0 HB3 ALA A 2 1.023 -0.406 -15.707 1.00 0.33 H new ATOM 664 N CYS A 3 4.428 -0.697 -15.574 1.00 0.29 N ATOM 665 CA CYS A 3 5.299 -1.150 -14.503 1.00 0.27 C ATOM 666 C CYS A 3 4.454 -1.440 -13.272 1.00 0.22 C ATOM 667 O CYS A 3 3.965 -0.525 -12.612 1.00 0.21 O ATOM 668 CB CYS A 3 6.370 -0.102 -14.198 1.00 0.32 C ATOM 669 SG CYS A 3 7.434 0.280 -15.609 1.00 0.43 S ATOM 0 H CYS A 3 4.582 0.268 -15.865 1.00 0.29 H new ATOM 0 HA CYS A 3 5.813 -2.061 -14.810 1.00 0.27 H new ATOM 0 HB2 CYS A 3 5.884 0.814 -13.862 1.00 0.32 H new ATOM 0 HB3 CYS A 3 6.988 -0.456 -13.373 1.00 0.32 H new ATOM 0 HG CYS A 3 8.309 1.177 -15.262 1.00 0.43 H new ATOM 675 N PRO A 4 4.265 -2.729 -12.969 1.00 0.20 N ATOM 676 CA PRO A 4 3.286 -3.194 -11.975 1.00 0.18 C ATOM 677 C PRO A 4 3.453 -2.551 -10.608 1.00 0.16 C ATOM 678 O PRO A 4 2.563 -1.838 -10.137 1.00 0.16 O ATOM 679 CB PRO A 4 3.588 -4.691 -11.891 1.00 0.21 C ATOM 680 CG PRO A 4 4.149 -5.025 -13.222 1.00 0.24 C ATOM 681 CD PRO A 4 5.008 -3.854 -13.569 1.00 0.24 C ATOM 0 HA PRO A 4 2.266 -2.943 -12.267 1.00 0.18 H new ATOM 0 HB2 PRO A 4 4.298 -4.910 -11.093 1.00 0.21 H new ATOM 0 HB3 PRO A 4 2.687 -5.268 -11.683 1.00 0.21 H new ATOM 0 HG2 PRO A 4 4.729 -5.947 -13.188 1.00 0.24 H new ATOM 0 HG3 PRO A 4 3.360 -5.172 -13.960 1.00 0.24 H new ATOM 0 HD2 PRO A 4 6.011 -3.948 -13.152 1.00 0.24 H new ATOM 0 HD3 PRO A 4 5.121 -3.738 -14.647 1.00 0.24 H new ATOM 689 N LEU A 5 4.598 -2.779 -9.981 1.00 0.16 N ATOM 690 CA LEU A 5 4.833 -2.266 -8.644 1.00 0.17 C ATOM 691 C LEU A 5 4.903 -0.744 -8.664 1.00 0.19 C ATOM 692 O LEU A 5 4.484 -0.088 -7.714 1.00 0.24 O ATOM 693 CB LEU A 5 6.117 -2.865 -8.064 1.00 0.17 C ATOM 694 CG LEU A 5 6.038 -3.312 -6.599 1.00 0.18 C ATOM 695 CD1 LEU A 5 5.892 -2.118 -5.675 1.00 0.20 C ATOM 696 CD2 LEU A 5 4.885 -4.283 -6.396 1.00 0.20 C ATOM 0 H LEU A 5 5.373 -3.313 -10.375 1.00 0.16 H new ATOM 0 HA LEU A 5 4.001 -2.559 -8.004 1.00 0.17 H new ATOM 0 HB2 LEU A 5 6.403 -3.723 -8.672 1.00 0.17 H new ATOM 0 HB3 LEU A 5 6.915 -2.128 -8.158 1.00 0.17 H new ATOM 0 HG LEU A 5 6.969 -3.823 -6.352 1.00 0.18 H new ATOM 0 HD11 LEU A 5 5.838 -2.462 -4.642 1.00 0.20 H new ATOM 0 HD12 LEU A 5 6.752 -1.459 -5.794 1.00 0.20 H new ATOM 0 HD13 LEU A 5 4.981 -1.574 -5.924 1.00 0.20 H new ATOM 0 HD21 LEU A 5 4.846 -4.588 -5.350 1.00 0.20 H new ATOM 0 HD22 LEU A 5 3.948 -3.797 -6.667 1.00 0.20 H new ATOM 0 HD23 LEU A 5 5.034 -5.161 -7.025 1.00 0.20 H new ATOM 708 N GLU A 6 5.405 -0.183 -9.762 1.00 0.19 N ATOM 709 CA GLU A 6 5.459 1.264 -9.911 1.00 0.23 C ATOM 710 C GLU A 6 4.054 1.850 -9.878 1.00 0.21 C ATOM 711 O GLU A 6 3.788 2.827 -9.170 1.00 0.25 O ATOM 712 CB GLU A 6 6.153 1.667 -11.213 1.00 0.32 C ATOM 713 CG GLU A 6 6.248 3.174 -11.405 1.00 0.47 C ATOM 714 CD GLU A 6 6.900 3.562 -12.713 1.00 0.90 C ATOM 715 OE1 GLU A 6 6.211 3.539 -13.758 1.00 1.78 O ATOM 716 OE2 GLU A 6 8.098 3.906 -12.708 1.00 1.39 O ATOM 0 H GLU A 6 5.777 -0.706 -10.555 1.00 0.19 H new ATOM 0 HA GLU A 6 6.039 1.660 -9.078 1.00 0.23 H new ATOM 0 HB2 GLU A 6 7.157 1.242 -11.228 1.00 0.32 H new ATOM 0 HB3 GLU A 6 5.611 1.234 -12.054 1.00 0.32 H new ATOM 0 HG2 GLU A 6 5.247 3.604 -11.362 1.00 0.47 H new ATOM 0 HG3 GLU A 6 6.816 3.605 -10.580 1.00 0.47 H new ATOM 723 N LYS A 7 3.159 1.236 -10.643 1.00 0.18 N ATOM 724 CA LYS A 7 1.768 1.657 -10.687 1.00 0.20 C ATOM 725 C LYS A 7 1.139 1.601 -9.305 1.00 0.17 C ATOM 726 O LYS A 7 0.393 2.491 -8.941 1.00 0.19 O ATOM 727 CB LYS A 7 0.966 0.791 -11.666 1.00 0.26 C ATOM 728 CG LYS A 7 1.173 1.140 -13.138 1.00 0.41 C ATOM 729 CD LYS A 7 0.374 2.370 -13.557 1.00 0.90 C ATOM 730 CE LYS A 7 1.013 3.666 -13.079 1.00 0.83 C ATOM 731 NZ LYS A 7 2.220 4.020 -13.870 1.00 1.16 N ATOM 0 H LYS A 7 3.376 0.441 -11.244 1.00 0.18 H new ATOM 0 HA LYS A 7 1.745 2.689 -11.036 1.00 0.20 H new ATOM 0 HB2 LYS A 7 1.236 -0.254 -11.512 1.00 0.26 H new ATOM 0 HB3 LYS A 7 -0.094 0.884 -11.429 1.00 0.26 H new ATOM 0 HG2 LYS A 7 2.233 1.317 -13.322 1.00 0.41 H new ATOM 0 HG3 LYS A 7 0.880 0.291 -13.756 1.00 0.41 H new ATOM 0 HD2 LYS A 7 0.286 2.390 -14.643 1.00 0.90 H new ATOM 0 HD3 LYS A 7 -0.637 2.297 -13.157 1.00 0.90 H new ATOM 0 HE2 LYS A 7 0.286 4.475 -13.147 1.00 0.83 H new ATOM 0 HE3 LYS A 7 1.285 3.569 -12.028 1.00 0.83 H new ATOM 0 HZ1 LYS A 7 2.553 4.965 -13.591 1.00 1.16 H new ATOM 0 HZ2 LYS A 7 2.969 3.321 -13.691 1.00 1.16 H new ATOM 0 HZ3 LYS A 7 1.983 4.022 -14.883 1.00 1.16 H new ATOM 745 N ALA A 8 1.471 0.572 -8.533 1.00 0.18 N ATOM 746 CA ALA A 8 0.891 0.380 -7.203 1.00 0.19 C ATOM 747 C ALA A 8 0.912 1.662 -6.370 1.00 0.17 C ATOM 748 O ALA A 8 -0.113 2.062 -5.822 1.00 0.21 O ATOM 749 CB ALA A 8 1.614 -0.733 -6.465 1.00 0.20 C ATOM 0 H ALA A 8 2.142 -0.147 -8.805 1.00 0.18 H new ATOM 0 HA ALA A 8 -0.153 0.101 -7.347 1.00 0.19 H new ATOM 0 HB1 ALA A 8 1.171 -0.863 -5.478 1.00 0.20 H new ATOM 0 HB2 ALA A 8 1.524 -1.662 -7.028 1.00 0.20 H new ATOM 0 HB3 ALA A 8 2.667 -0.474 -6.358 1.00 0.20 H new ATOM 755 N LEU A 9 2.067 2.310 -6.281 1.00 0.14 N ATOM 756 CA LEU A 9 2.180 3.541 -5.501 1.00 0.14 C ATOM 757 C LEU A 9 1.639 4.729 -6.290 1.00 0.13 C ATOM 758 O LEU A 9 0.971 5.604 -5.736 1.00 0.16 O ATOM 759 CB LEU A 9 3.631 3.821 -5.080 1.00 0.15 C ATOM 760 CG LEU A 9 4.340 2.692 -4.322 1.00 0.16 C ATOM 761 CD1 LEU A 9 3.396 2.030 -3.338 1.00 0.19 C ATOM 762 CD2 LEU A 9 4.920 1.665 -5.277 1.00 0.15 C ATOM 0 H LEU A 9 2.931 2.010 -6.733 1.00 0.14 H new ATOM 0 HA LEU A 9 1.585 3.403 -4.598 1.00 0.14 H new ATOM 0 HB2 LEU A 9 4.210 4.051 -5.974 1.00 0.15 H new ATOM 0 HB3 LEU A 9 3.641 4.714 -4.455 1.00 0.15 H new ATOM 0 HG LEU A 9 5.165 3.135 -3.765 1.00 0.16 H new ATOM 0 HD11 LEU A 9 3.920 1.232 -2.812 1.00 0.19 H new ATOM 0 HD12 LEU A 9 3.043 2.769 -2.619 1.00 0.19 H new ATOM 0 HD13 LEU A 9 2.545 1.612 -3.875 1.00 0.19 H new ATOM 0 HD21 LEU A 9 5.416 0.878 -4.708 1.00 0.15 H new ATOM 0 HD22 LEU A 9 4.119 1.231 -5.875 1.00 0.15 H new ATOM 0 HD23 LEU A 9 5.643 2.147 -5.935 1.00 0.15 H new ATOM 774 N ASP A 10 1.930 4.738 -7.585 1.00 0.14 N ATOM 775 CA ASP A 10 1.496 5.810 -8.479 1.00 0.15 C ATOM 776 C ASP A 10 -0.020 5.962 -8.470 1.00 0.15 C ATOM 777 O ASP A 10 -0.547 7.068 -8.342 1.00 0.18 O ATOM 778 CB ASP A 10 1.983 5.520 -9.903 1.00 0.19 C ATOM 779 CG ASP A 10 1.452 6.504 -10.928 1.00 0.48 C ATOM 780 OD1 ASP A 10 0.366 6.255 -11.491 1.00 1.19 O ATOM 781 OD2 ASP A 10 2.132 7.512 -11.198 1.00 1.18 O ATOM 0 H ASP A 10 2.471 4.007 -8.046 1.00 0.14 H new ATOM 0 HA ASP A 10 1.929 6.746 -8.125 1.00 0.15 H new ATOM 0 HB2 ASP A 10 3.073 5.541 -9.919 1.00 0.19 H new ATOM 0 HB3 ASP A 10 1.680 4.512 -10.186 1.00 0.19 H new ATOM 786 N VAL A 11 -0.717 4.844 -8.575 1.00 0.16 N ATOM 787 CA VAL A 11 -2.161 4.860 -8.704 1.00 0.18 C ATOM 788 C VAL A 11 -2.845 5.199 -7.391 1.00 0.18 C ATOM 789 O VAL A 11 -3.949 5.729 -7.398 1.00 0.23 O ATOM 790 CB VAL A 11 -2.711 3.526 -9.237 1.00 0.20 C ATOM 791 CG1 VAL A 11 -2.006 3.150 -10.527 1.00 0.23 C ATOM 792 CG2 VAL A 11 -2.583 2.425 -8.198 1.00 0.18 C ATOM 0 H VAL A 11 -0.303 3.912 -8.573 1.00 0.16 H new ATOM 0 HA VAL A 11 -2.386 5.642 -9.429 1.00 0.18 H new ATOM 0 HB VAL A 11 -3.773 3.649 -9.448 1.00 0.20 H new ATOM 0 HG11 VAL A 11 -2.403 2.204 -10.896 1.00 0.23 H new ATOM 0 HG12 VAL A 11 -2.171 3.928 -11.272 1.00 0.23 H new ATOM 0 HG13 VAL A 11 -0.937 3.047 -10.341 1.00 0.23 H new ATOM 0 HG21 VAL A 11 -2.980 1.494 -8.603 1.00 0.18 H new ATOM 0 HG22 VAL A 11 -1.533 2.289 -7.939 1.00 0.18 H new ATOM 0 HG23 VAL A 11 -3.144 2.700 -7.305 1.00 0.18 H new ATOM 802 N MET A 12 -2.197 4.908 -6.262 1.00 0.16 N ATOM 803 CA MET A 12 -2.781 5.248 -4.969 1.00 0.20 C ATOM 804 C MET A 12 -3.081 6.739 -4.918 1.00 0.24 C ATOM 805 O MET A 12 -4.228 7.138 -4.745 1.00 0.40 O ATOM 806 CB MET A 12 -1.867 4.866 -3.799 1.00 0.25 C ATOM 807 CG MET A 12 -1.668 3.370 -3.616 1.00 0.17 C ATOM 808 SD MET A 12 -1.074 2.952 -1.965 1.00 0.72 S ATOM 809 CE MET A 12 -0.764 1.203 -2.152 1.00 0.19 C ATOM 0 H MET A 12 -1.288 4.448 -6.218 1.00 0.16 H new ATOM 0 HA MET A 12 -3.702 4.675 -4.866 1.00 0.20 H new ATOM 0 HB2 MET A 12 -0.894 5.334 -3.947 1.00 0.25 H new ATOM 0 HB3 MET A 12 -2.283 5.279 -2.880 1.00 0.25 H new ATOM 0 HG2 MET A 12 -2.611 2.856 -3.801 1.00 0.17 H new ATOM 0 HG3 MET A 12 -0.956 3.007 -4.358 1.00 0.17 H new ATOM 0 HE1 MET A 12 -0.774 0.725 -1.172 1.00 0.19 H new ATOM 0 HE2 MET A 12 -1.538 0.761 -2.779 1.00 0.19 H new ATOM 0 HE3 MET A 12 0.210 1.054 -2.619 1.00 0.19 H new ATOM 819 N VAL A 13 -2.054 7.557 -5.128 1.00 0.17 N ATOM 820 CA VAL A 13 -2.209 9.007 -5.072 1.00 0.19 C ATOM 821 C VAL A 13 -2.949 9.544 -6.308 1.00 0.20 C ATOM 822 O VAL A 13 -3.502 10.641 -6.277 1.00 0.28 O ATOM 823 CB VAL A 13 -0.848 9.729 -4.927 1.00 0.18 C ATOM 824 CG1 VAL A 13 -0.204 9.417 -3.582 1.00 0.21 C ATOM 825 CG2 VAL A 13 0.094 9.356 -6.057 1.00 0.19 C ATOM 0 H VAL A 13 -1.107 7.241 -5.338 1.00 0.17 H new ATOM 0 HA VAL A 13 -2.807 9.218 -4.185 1.00 0.19 H new ATOM 0 HB VAL A 13 -1.040 10.801 -4.979 1.00 0.18 H new ATOM 0 HG11 VAL A 13 0.751 9.937 -3.506 1.00 0.21 H new ATOM 0 HG12 VAL A 13 -0.862 9.748 -2.778 1.00 0.21 H new ATOM 0 HG13 VAL A 13 -0.040 8.343 -3.498 1.00 0.21 H new ATOM 0 HG21 VAL A 13 1.042 9.879 -5.928 1.00 0.19 H new ATOM 0 HG22 VAL A 13 0.268 8.280 -6.045 1.00 0.19 H new ATOM 0 HG23 VAL A 13 -0.351 9.641 -7.010 1.00 0.19 H new ATOM 835 N SER A 14 -2.967 8.766 -7.388 1.00 0.19 N ATOM 836 CA SER A 14 -3.651 9.176 -8.614 1.00 0.22 C ATOM 837 C SER A 14 -5.159 8.943 -8.512 1.00 0.24 C ATOM 838 O SER A 14 -5.953 9.866 -8.707 1.00 0.28 O ATOM 839 CB SER A 14 -3.075 8.432 -9.817 1.00 0.24 C ATOM 840 OG SER A 14 -1.722 8.795 -10.029 1.00 1.12 O ATOM 0 H SER A 14 -2.518 7.852 -7.440 1.00 0.19 H new ATOM 0 HA SER A 14 -3.487 10.245 -8.750 1.00 0.22 H new ATOM 0 HB2 SER A 14 -3.147 7.357 -9.654 1.00 0.24 H new ATOM 0 HB3 SER A 14 -3.662 8.660 -10.707 1.00 0.24 H new ATOM 0 HG SER A 14 -1.136 8.150 -9.580 1.00 1.12 H new ATOM 846 N THR A 15 -5.545 7.714 -8.200 1.00 0.25 N ATOM 847 CA THR A 15 -6.941 7.366 -8.001 1.00 0.28 C ATOM 848 C THR A 15 -7.518 8.179 -6.832 1.00 0.30 C ATOM 849 O THR A 15 -8.722 8.428 -6.762 1.00 0.33 O ATOM 850 CB THR A 15 -7.100 5.844 -7.776 1.00 0.28 C ATOM 851 OG1 THR A 15 -6.454 5.139 -8.851 1.00 0.34 O ATOM 852 CG2 THR A 15 -8.560 5.427 -7.727 1.00 0.26 C ATOM 0 H THR A 15 -4.900 6.933 -8.078 1.00 0.25 H new ATOM 0 HA THR A 15 -7.505 7.617 -8.899 1.00 0.28 H new ATOM 0 HB THR A 15 -6.644 5.599 -6.817 1.00 0.28 H new ATOM 0 HG1 THR A 15 -5.486 5.127 -8.699 1.00 0.34 H new ATOM 0 HG21 THR A 15 -8.626 4.351 -7.568 1.00 0.26 H new ATOM 0 HG22 THR A 15 -9.059 5.946 -6.909 1.00 0.26 H new ATOM 0 HG23 THR A 15 -9.044 5.684 -8.669 1.00 0.26 H new ATOM 860 N PHE A 16 -6.633 8.589 -5.920 1.00 0.31 N ATOM 861 CA PHE A 16 -6.990 9.477 -4.814 1.00 0.37 C ATOM 862 C PHE A 16 -7.769 10.702 -5.295 1.00 0.42 C ATOM 863 O PHE A 16 -8.976 10.806 -5.069 1.00 0.54 O ATOM 864 CB PHE A 16 -5.726 9.961 -4.107 1.00 0.45 C ATOM 865 CG PHE A 16 -5.611 9.511 -2.687 1.00 0.36 C ATOM 866 CD1 PHE A 16 -6.467 10.003 -1.725 1.00 1.24 C ATOM 867 CD2 PHE A 16 -4.641 8.604 -2.312 1.00 1.26 C ATOM 868 CE1 PHE A 16 -6.358 9.595 -0.413 1.00 1.39 C ATOM 869 CE2 PHE A 16 -4.528 8.192 -1.006 1.00 1.43 C ATOM 870 CZ PHE A 16 -5.390 8.689 -0.054 1.00 0.99 C ATOM 0 H PHE A 16 -5.651 8.315 -5.928 1.00 0.31 H new ATOM 0 HA PHE A 16 -7.620 8.905 -4.133 1.00 0.37 H new ATOM 0 HB2 PHE A 16 -4.856 9.608 -4.660 1.00 0.45 H new ATOM 0 HB3 PHE A 16 -5.702 11.050 -4.135 1.00 0.45 H new ATOM 0 HD1 PHE A 16 -7.230 10.715 -2.002 1.00 1.24 H new ATOM 0 HD2 PHE A 16 -3.962 8.213 -3.055 1.00 1.26 H new ATOM 0 HE1 PHE A 16 -7.034 9.988 0.333 1.00 1.39 H new ATOM 0 HE2 PHE A 16 -3.765 7.480 -0.727 1.00 1.43 H new ATOM 0 HZ PHE A 16 -5.305 8.367 0.973 1.00 0.99 H new ATOM 880 N HIS A 17 -7.076 11.620 -5.975 1.00 0.44 N ATOM 881 CA HIS A 17 -7.691 12.866 -6.439 1.00 0.54 C ATOM 882 C HIS A 17 -8.766 12.603 -7.489 1.00 0.47 C ATOM 883 O HIS A 17 -9.569 13.483 -7.802 1.00 0.52 O ATOM 884 CB HIS A 17 -6.633 13.844 -6.981 1.00 0.72 C ATOM 885 CG HIS A 17 -5.829 13.341 -8.147 1.00 1.09 C ATOM 886 ND1 HIS A 17 -6.228 13.487 -9.460 1.00 2.16 N ATOM 887 CD2 HIS A 17 -4.630 12.711 -8.193 1.00 1.23 C ATOM 888 CE1 HIS A 17 -5.316 12.971 -10.257 1.00 2.80 C ATOM 889 NE2 HIS A 17 -4.337 12.494 -9.517 1.00 2.27 N ATOM 0 H HIS A 17 -6.090 11.523 -6.216 1.00 0.44 H new ATOM 0 HA HIS A 17 -8.171 13.328 -5.576 1.00 0.54 H new ATOM 0 HB2 HIS A 17 -7.133 14.766 -7.277 1.00 0.72 H new ATOM 0 HB3 HIS A 17 -5.948 14.098 -6.172 1.00 0.72 H new ATOM 0 HD1 HIS A 17 -7.096 13.927 -9.766 1.00 2.16 H new ATOM 0 HD2 HIS A 17 -4.019 12.432 -7.347 1.00 1.23 H new ATOM 0 HE1 HIS A 17 -5.363 12.944 -11.336 1.00 2.80 H new ATOM 898 N LYS A 18 -8.781 11.386 -8.012 1.00 0.43 N ATOM 899 CA LYS A 18 -9.789 10.968 -8.975 1.00 0.46 C ATOM 900 C LYS A 18 -11.175 10.928 -8.320 1.00 0.44 C ATOM 901 O LYS A 18 -12.188 11.178 -8.976 1.00 0.62 O ATOM 902 CB LYS A 18 -9.413 9.592 -9.532 1.00 0.55 C ATOM 903 CG LYS A 18 -10.360 9.047 -10.585 1.00 0.77 C ATOM 904 CD LYS A 18 -9.979 7.628 -10.965 1.00 0.73 C ATOM 905 CE LYS A 18 -10.961 7.016 -11.948 1.00 1.41 C ATOM 906 NZ LYS A 18 -10.821 7.584 -13.313 1.00 1.69 N ATOM 0 H LYS A 18 -8.099 10.664 -7.782 1.00 0.43 H new ATOM 0 HA LYS A 18 -9.828 11.687 -9.793 1.00 0.46 H new ATOM 0 HB2 LYS A 18 -8.412 9.651 -9.960 1.00 0.55 H new ATOM 0 HB3 LYS A 18 -9.365 8.883 -8.706 1.00 0.55 H new ATOM 0 HG2 LYS A 18 -11.382 9.066 -10.207 1.00 0.77 H new ATOM 0 HG3 LYS A 18 -10.335 9.685 -11.469 1.00 0.77 H new ATOM 0 HD2 LYS A 18 -8.981 7.626 -11.402 1.00 0.73 H new ATOM 0 HD3 LYS A 18 -9.935 7.012 -10.067 1.00 0.73 H new ATOM 0 HE2 LYS A 18 -10.807 5.938 -11.988 1.00 1.41 H new ATOM 0 HE3 LYS A 18 -11.978 7.180 -11.591 1.00 1.41 H new ATOM 0 HZ1 LYS A 18 -11.512 7.136 -13.948 1.00 1.69 H new ATOM 0 HZ2 LYS A 18 -10.994 8.609 -13.282 1.00 1.69 H new ATOM 0 HZ3 LYS A 18 -9.859 7.406 -13.666 1.00 1.69 H new ATOM 920 N TYR A 19 -11.210 10.630 -7.021 1.00 0.37 N ATOM 921 CA TYR A 19 -12.475 10.546 -6.293 1.00 0.41 C ATOM 922 C TYR A 19 -12.536 11.545 -5.138 1.00 0.48 C ATOM 923 O TYR A 19 -13.472 12.329 -5.045 1.00 0.73 O ATOM 924 CB TYR A 19 -12.702 9.128 -5.774 1.00 0.43 C ATOM 925 CG TYR A 19 -12.831 8.108 -6.879 1.00 0.38 C ATOM 926 CD1 TYR A 19 -14.044 7.894 -7.521 1.00 1.18 C ATOM 927 CD2 TYR A 19 -11.733 7.368 -7.288 1.00 1.14 C ATOM 928 CE1 TYR A 19 -14.154 6.966 -8.541 1.00 1.21 C ATOM 929 CE2 TYR A 19 -11.835 6.443 -8.303 1.00 1.14 C ATOM 930 CZ TYR A 19 -13.044 6.245 -8.926 1.00 0.48 C ATOM 931 OH TYR A 19 -13.139 5.328 -9.947 1.00 0.59 O ATOM 0 H TYR A 19 -10.382 10.444 -6.455 1.00 0.37 H new ATOM 0 HA TYR A 19 -13.269 10.801 -6.994 1.00 0.41 H new ATOM 0 HB2 TYR A 19 -11.873 8.848 -5.124 1.00 0.43 H new ATOM 0 HB3 TYR A 19 -13.605 9.111 -5.164 1.00 0.43 H new ATOM 0 HD1 TYR A 19 -14.913 8.460 -7.220 1.00 1.18 H new ATOM 0 HD2 TYR A 19 -10.780 7.519 -6.802 1.00 1.14 H new ATOM 0 HE1 TYR A 19 -15.103 6.808 -9.032 1.00 1.21 H new ATOM 0 HE2 TYR A 19 -10.968 5.875 -8.608 1.00 1.14 H new ATOM 0 HH TYR A 19 -12.265 4.909 -10.092 1.00 0.59 H new ATOM 941 N SER A 20 -11.537 11.538 -4.266 1.00 0.38 N ATOM 942 CA SER A 20 -11.550 12.433 -3.112 1.00 0.45 C ATOM 943 C SER A 20 -11.420 13.888 -3.561 1.00 0.54 C ATOM 944 O SER A 20 -11.939 14.797 -2.917 1.00 0.68 O ATOM 945 CB SER A 20 -10.440 12.067 -2.127 1.00 0.47 C ATOM 946 OG SER A 20 -9.175 12.081 -2.760 1.00 0.52 O ATOM 0 H SER A 20 -10.718 10.933 -4.331 1.00 0.38 H new ATOM 0 HA SER A 20 -12.505 12.317 -2.600 1.00 0.45 H new ATOM 0 HB2 SER A 20 -10.442 12.770 -1.294 1.00 0.47 H new ATOM 0 HB3 SER A 20 -10.631 11.078 -1.710 1.00 0.47 H new ATOM 0 HG SER A 20 -9.188 11.477 -3.531 1.00 0.52 H new ATOM 952 N GLY A 21 -10.745 14.095 -4.691 1.00 0.54 N ATOM 953 CA GLY A 21 -10.658 15.422 -5.274 1.00 0.65 C ATOM 954 C GLY A 21 -11.998 15.882 -5.813 1.00 0.68 C ATOM 955 O GLY A 21 -12.218 17.073 -6.034 1.00 0.82 O ATOM 0 H GLY A 21 -10.257 13.366 -5.212 1.00 0.54 H new ATOM 0 HA2 GLY A 21 -10.305 16.128 -4.522 1.00 0.65 H new ATOM 0 HA3 GLY A 21 -9.923 15.419 -6.079 1.00 0.65 H new ATOM 1057 N LYS A 28 -8.387 12.706 0.860 1.00 0.67 N ATOM 1058 CA LYS A 28 -9.289 12.236 1.901 1.00 0.64 C ATOM 1059 C LYS A 28 -10.634 11.843 1.311 1.00 0.48 C ATOM 1060 O LYS A 28 -11.342 12.679 0.748 1.00 0.54 O ATOM 1061 CB LYS A 28 -9.495 13.334 2.934 1.00 0.87 C ATOM 1062 CG LYS A 28 -10.329 12.906 4.125 1.00 1.00 C ATOM 1063 CD LYS A 28 -11.024 14.099 4.743 1.00 1.04 C ATOM 1064 CE LYS A 28 -12.383 14.348 4.114 1.00 1.55 C ATOM 1065 NZ LYS A 28 -12.280 14.796 2.699 1.00 2.03 N ATOM 0 HA LYS A 28 -8.843 11.361 2.374 1.00 0.64 H new ATOM 0 HB2 LYS A 28 -8.522 13.674 3.288 1.00 0.87 H new ATOM 0 HB3 LYS A 28 -9.975 14.186 2.454 1.00 0.87 H new ATOM 0 HG2 LYS A 28 -11.069 12.169 3.812 1.00 1.00 H new ATOM 0 HG3 LYS A 28 -9.693 12.424 4.867 1.00 1.00 H new ATOM 0 HD2 LYS A 28 -11.144 13.935 5.814 1.00 1.04 H new ATOM 0 HD3 LYS A 28 -10.400 14.985 4.624 1.00 1.04 H new ATOM 0 HE2 LYS A 28 -12.975 13.434 4.161 1.00 1.55 H new ATOM 0 HE3 LYS A 28 -12.916 15.102 4.693 1.00 1.55 H new ATOM 0 HZ1 LYS A 28 -13.205 15.146 2.377 1.00 2.03 H new ATOM 0 HZ2 LYS A 28 -11.577 15.559 2.627 1.00 2.03 H new ATOM 0 HZ3 LYS A 28 -11.986 13.997 2.102 1.00 2.03 H new ATOM 1079 N LEU A 29 -10.996 10.586 1.477 1.00 0.36 N ATOM 1080 CA LEU A 29 -12.210 10.049 0.857 1.00 0.32 C ATOM 1081 C LEU A 29 -13.276 9.700 1.891 1.00 0.34 C ATOM 1082 O LEU A 29 -12.990 9.052 2.900 1.00 0.40 O ATOM 1083 CB LEU A 29 -11.903 8.791 0.034 1.00 0.30 C ATOM 1084 CG LEU A 29 -10.936 8.966 -1.140 1.00 0.30 C ATOM 1085 CD1 LEU A 29 -9.487 8.911 -0.668 1.00 0.32 C ATOM 1086 CD2 LEU A 29 -11.197 7.908 -2.199 1.00 0.33 C ATOM 0 H LEU A 29 -10.473 9.911 2.034 1.00 0.36 H new ATOM 0 HA LEU A 29 -12.591 10.836 0.206 1.00 0.32 H new ATOM 0 HB2 LEU A 29 -11.494 8.035 0.704 1.00 0.30 H new ATOM 0 HB3 LEU A 29 -12.843 8.398 -0.353 1.00 0.30 H new ATOM 0 HG LEU A 29 -11.106 9.948 -1.580 1.00 0.30 H new ATOM 0 HD11 LEU A 29 -8.821 9.038 -1.522 1.00 0.32 H new ATOM 0 HD12 LEU A 29 -9.309 9.709 0.053 1.00 0.32 H new ATOM 0 HD13 LEU A 29 -9.294 7.947 -0.198 1.00 0.32 H new ATOM 0 HD21 LEU A 29 -10.503 8.044 -3.028 1.00 0.33 H new ATOM 0 HD22 LEU A 29 -11.056 6.918 -1.766 1.00 0.33 H new ATOM 0 HD23 LEU A 29 -12.220 8.002 -2.563 1.00 0.33 H new ATOM 1098 N ASN A 30 -14.504 10.133 1.637 1.00 0.35 N ATOM 1099 CA ASN A 30 -15.647 9.695 2.432 1.00 0.35 C ATOM 1100 C ASN A 30 -16.180 8.373 1.879 1.00 0.31 C ATOM 1101 O ASN A 30 -15.583 7.792 0.967 1.00 0.29 O ATOM 1102 CB ASN A 30 -16.758 10.757 2.434 1.00 0.41 C ATOM 1103 CG ASN A 30 -17.587 10.761 1.159 1.00 0.62 C ATOM 1104 OD1 ASN A 30 -18.626 10.107 1.077 1.00 1.20 O ATOM 1105 ND2 ASN A 30 -17.132 11.489 0.157 1.00 0.63 N ATOM 0 H ASN A 30 -14.735 10.786 0.888 1.00 0.35 H new ATOM 0 HA ASN A 30 -15.319 9.551 3.461 1.00 0.35 H new ATOM 0 HB2 ASN A 30 -17.415 10.584 3.286 1.00 0.41 H new ATOM 0 HB3 ASN A 30 -16.310 11.741 2.571 1.00 0.41 H new ATOM 0 HD21 ASN A 30 -17.646 11.523 -0.723 1.00 0.63 H new ATOM 0 HD22 ASN A 30 -16.266 12.018 0.263 1.00 0.63 H new ATOM 1112 N LYS A 31 -17.299 7.911 2.431 1.00 0.32 N ATOM 1113 CA LYS A 31 -17.907 6.636 2.035 1.00 0.31 C ATOM 1114 C LYS A 31 -18.083 6.537 0.518 1.00 0.30 C ATOM 1115 O LYS A 31 -17.576 5.611 -0.117 1.00 0.31 O ATOM 1116 CB LYS A 31 -19.286 6.464 2.677 1.00 0.35 C ATOM 1117 CG LYS A 31 -19.439 7.102 4.046 1.00 0.45 C ATOM 1118 CD LYS A 31 -20.848 6.892 4.580 1.00 0.56 C ATOM 1119 CE LYS A 31 -21.195 7.876 5.687 1.00 1.22 C ATOM 1120 NZ LYS A 31 -20.247 7.797 6.828 1.00 1.70 N ATOM 0 H LYS A 31 -17.811 8.405 3.162 1.00 0.32 H new ATOM 0 HA LYS A 31 -17.228 5.855 2.376 1.00 0.31 H new ATOM 0 HB2 LYS A 31 -20.037 6.887 2.009 1.00 0.35 H new ATOM 0 HB3 LYS A 31 -19.500 5.399 2.763 1.00 0.35 H new ATOM 0 HG2 LYS A 31 -18.714 6.671 4.737 1.00 0.45 H new ATOM 0 HG3 LYS A 31 -19.224 8.169 3.982 1.00 0.45 H new ATOM 0 HD2 LYS A 31 -21.563 6.998 3.764 1.00 0.56 H new ATOM 0 HD3 LYS A 31 -20.944 5.874 4.958 1.00 0.56 H new ATOM 0 HE2 LYS A 31 -21.192 8.889 5.284 1.00 1.22 H new ATOM 0 HE3 LYS A 31 -22.206 7.678 6.043 1.00 1.22 H new ATOM 0 HZ1 LYS A 31 -20.562 8.436 7.586 1.00 1.70 H new ATOM 0 HZ2 LYS A 31 -20.217 6.822 7.188 1.00 1.70 H new ATOM 0 HZ3 LYS A 31 -19.297 8.078 6.510 1.00 1.70 H new ATOM 1134 N SER A 32 -18.804 7.498 -0.052 1.00 0.32 N ATOM 1135 CA SER A 32 -19.205 7.459 -1.437 1.00 0.34 C ATOM 1136 C SER A 32 -18.014 7.450 -2.395 1.00 0.31 C ATOM 1137 O SER A 32 -18.062 6.798 -3.440 1.00 0.34 O ATOM 1138 CB SER A 32 -20.097 8.659 -1.703 1.00 0.43 C ATOM 1139 OG SER A 32 -21.176 8.698 -0.782 1.00 1.29 O ATOM 0 H SER A 32 -19.124 8.328 0.446 1.00 0.32 H new ATOM 0 HA SER A 32 -19.744 6.529 -1.618 1.00 0.34 H new ATOM 0 HB2 SER A 32 -19.513 9.576 -1.625 1.00 0.43 H new ATOM 0 HB3 SER A 32 -20.483 8.612 -2.721 1.00 0.43 H new ATOM 0 HG SER A 32 -21.738 9.479 -0.969 1.00 1.29 H new ATOM 1145 N GLU A 33 -16.938 8.138 -2.031 1.00 0.30 N ATOM 1146 CA GLU A 33 -15.781 8.220 -2.906 1.00 0.31 C ATOM 1147 C GLU A 33 -15.034 6.906 -2.894 1.00 0.26 C ATOM 1148 O GLU A 33 -14.578 6.427 -3.932 1.00 0.27 O ATOM 1149 CB GLU A 33 -14.850 9.361 -2.497 1.00 0.37 C ATOM 1150 CG GLU A 33 -15.451 10.743 -2.721 1.00 0.51 C ATOM 1151 CD GLU A 33 -16.250 10.832 -4.012 1.00 0.88 C ATOM 1152 OE1 GLU A 33 -15.749 10.399 -5.073 1.00 1.68 O ATOM 1153 OE2 GLU A 33 -17.398 11.317 -3.964 1.00 1.46 O ATOM 0 H GLU A 33 -16.845 8.640 -1.148 1.00 0.30 H new ATOM 0 HA GLU A 33 -16.134 8.426 -3.916 1.00 0.31 H new ATOM 0 HB2 GLU A 33 -14.594 9.251 -1.443 1.00 0.37 H new ATOM 0 HB3 GLU A 33 -13.921 9.281 -3.061 1.00 0.37 H new ATOM 0 HG2 GLU A 33 -16.097 10.994 -1.880 1.00 0.51 H new ATOM 0 HG3 GLU A 33 -14.652 11.484 -2.741 1.00 0.51 H new ATOM 1160 N LEU A 34 -14.932 6.317 -1.713 1.00 0.23 N ATOM 1161 CA LEU A 34 -14.324 5.010 -1.572 1.00 0.20 C ATOM 1162 C LEU A 34 -15.133 3.962 -2.306 1.00 0.20 C ATOM 1163 O LEU A 34 -14.575 3.129 -3.014 1.00 0.23 O ATOM 1164 CB LEU A 34 -14.192 4.643 -0.102 1.00 0.18 C ATOM 1165 CG LEU A 34 -12.909 5.133 0.551 1.00 0.18 C ATOM 1166 CD1 LEU A 34 -13.006 5.019 2.055 1.00 0.21 C ATOM 1167 CD2 LEU A 34 -11.731 4.341 0.018 1.00 0.18 C ATOM 0 H LEU A 34 -15.264 6.726 -0.840 1.00 0.23 H new ATOM 0 HA LEU A 34 -13.328 5.046 -2.013 1.00 0.20 H new ATOM 0 HB2 LEU A 34 -15.043 5.054 0.441 1.00 0.18 H new ATOM 0 HB3 LEU A 34 -14.245 3.559 -0.004 1.00 0.18 H new ATOM 0 HG LEU A 34 -12.759 6.185 0.306 1.00 0.18 H new ATOM 0 HD11 LEU A 34 -12.080 5.374 2.507 1.00 0.21 H new ATOM 0 HD12 LEU A 34 -13.839 5.624 2.413 1.00 0.21 H new ATOM 0 HD13 LEU A 34 -13.169 3.977 2.331 1.00 0.21 H new ATOM 0 HD21 LEU A 34 -10.813 4.694 0.487 1.00 0.18 H new ATOM 0 HD22 LEU A 34 -11.871 3.284 0.244 1.00 0.18 H new ATOM 0 HD23 LEU A 34 -11.661 4.475 -1.061 1.00 0.18 H new ATOM 1179 N LYS A 35 -16.450 4.015 -2.151 1.00 0.23 N ATOM 1180 CA LYS A 35 -17.314 3.060 -2.818 1.00 0.29 C ATOM 1181 C LYS A 35 -17.086 3.090 -4.314 1.00 0.25 C ATOM 1182 O LYS A 35 -16.774 2.066 -4.910 1.00 0.27 O ATOM 1183 CB LYS A 35 -18.790 3.311 -2.512 1.00 0.42 C ATOM 1184 CG LYS A 35 -19.697 2.258 -3.135 1.00 0.60 C ATOM 1185 CD LYS A 35 -21.065 2.219 -2.476 1.00 0.71 C ATOM 1186 CE LYS A 35 -21.925 3.386 -2.906 1.00 0.53 C ATOM 1187 NZ LYS A 35 -23.212 3.425 -2.167 1.00 0.89 N ATOM 0 H LYS A 35 -16.935 4.703 -1.575 1.00 0.23 H new ATOM 0 HA LYS A 35 -17.057 2.073 -2.433 1.00 0.29 H new ATOM 0 HB2 LYS A 35 -18.938 3.322 -1.432 1.00 0.42 H new ATOM 0 HB3 LYS A 35 -19.073 4.296 -2.882 1.00 0.42 H new ATOM 0 HG2 LYS A 35 -19.814 2.464 -4.199 1.00 0.60 H new ATOM 0 HG3 LYS A 35 -19.226 1.279 -3.050 1.00 0.60 H new ATOM 0 HD2 LYS A 35 -21.565 1.285 -2.731 1.00 0.71 H new ATOM 0 HD3 LYS A 35 -20.948 2.233 -1.392 1.00 0.71 H new ATOM 0 HE2 LYS A 35 -21.383 4.317 -2.741 1.00 0.53 H new ATOM 0 HE3 LYS A 35 -22.122 3.317 -3.976 1.00 0.53 H new ATOM 0 HZ1 LYS A 35 -23.549 4.407 -2.108 1.00 0.89 H new ATOM 0 HZ2 LYS A 35 -23.917 2.847 -2.667 1.00 0.89 H new ATOM 0 HZ3 LYS A 35 -23.073 3.048 -1.208 1.00 0.89 H new ATOM 1201 N GLU A 36 -17.204 4.266 -4.909 1.00 0.25 N ATOM 1202 CA GLU A 36 -17.039 4.399 -6.343 1.00 0.28 C ATOM 1203 C GLU A 36 -15.643 3.942 -6.754 1.00 0.28 C ATOM 1204 O GLU A 36 -15.483 3.228 -7.741 1.00 0.34 O ATOM 1205 CB GLU A 36 -17.283 5.837 -6.782 1.00 0.32 C ATOM 1206 CG GLU A 36 -17.641 5.956 -8.251 1.00 0.66 C ATOM 1207 CD GLU A 36 -17.933 7.381 -8.666 1.00 0.77 C ATOM 1208 OE1 GLU A 36 -19.087 7.824 -8.499 1.00 1.28 O ATOM 1209 OE2 GLU A 36 -17.015 8.067 -9.163 1.00 1.49 O ATOM 0 H GLU A 36 -17.413 5.137 -4.422 1.00 0.25 H new ATOM 0 HA GLU A 36 -17.775 3.765 -6.838 1.00 0.28 H new ATOM 0 HB2 GLU A 36 -18.087 6.263 -6.182 1.00 0.32 H new ATOM 0 HB3 GLU A 36 -16.389 6.428 -6.582 1.00 0.32 H new ATOM 0 HG2 GLU A 36 -16.820 5.567 -8.854 1.00 0.66 H new ATOM 0 HG3 GLU A 36 -18.512 5.335 -8.460 1.00 0.66 H new ATOM 1216 N LEU A 37 -14.647 4.330 -5.968 1.00 0.25 N ATOM 1217 CA LEU A 37 -13.268 3.913 -6.190 1.00 0.27 C ATOM 1218 C LEU A 37 -13.184 2.396 -6.299 1.00 0.23 C ATOM 1219 O LEU A 37 -12.701 1.858 -7.300 1.00 0.24 O ATOM 1220 CB LEU A 37 -12.395 4.429 -5.042 1.00 0.32 C ATOM 1221 CG LEU A 37 -10.887 4.413 -5.287 1.00 0.40 C ATOM 1222 CD1 LEU A 37 -10.237 5.590 -4.583 1.00 0.33 C ATOM 1223 CD2 LEU A 37 -10.277 3.114 -4.794 1.00 0.74 C ATOM 0 H LEU A 37 -14.771 4.941 -5.161 1.00 0.25 H new ATOM 0 HA LEU A 37 -12.906 4.334 -7.128 1.00 0.27 H new ATOM 0 HB2 LEU A 37 -12.695 5.452 -4.815 1.00 0.32 H new ATOM 0 HB3 LEU A 37 -12.605 3.831 -4.155 1.00 0.32 H new ATOM 0 HG LEU A 37 -10.710 4.492 -6.360 1.00 0.40 H new ATOM 0 HD11 LEU A 37 -9.162 5.572 -4.762 1.00 0.33 H new ATOM 0 HD12 LEU A 37 -10.654 6.520 -4.969 1.00 0.33 H new ATOM 0 HD13 LEU A 37 -10.428 5.524 -3.512 1.00 0.33 H new ATOM 0 HD21 LEU A 37 -9.203 3.124 -4.978 1.00 0.74 H new ATOM 0 HD22 LEU A 37 -10.461 3.008 -3.725 1.00 0.74 H new ATOM 0 HD23 LEU A 37 -10.729 2.276 -5.324 1.00 0.74 H new ATOM 1235 N LEU A 38 -13.693 1.712 -5.285 1.00 0.20 N ATOM 1236 CA LEU A 38 -13.690 0.259 -5.267 1.00 0.20 C ATOM 1237 C LEU A 38 -14.569 -0.314 -6.380 1.00 0.22 C ATOM 1238 O LEU A 38 -14.164 -1.228 -7.075 1.00 0.24 O ATOM 1239 CB LEU A 38 -14.133 -0.271 -3.898 1.00 0.19 C ATOM 1240 CG LEU A 38 -13.043 -0.277 -2.819 1.00 0.18 C ATOM 1241 CD1 LEU A 38 -13.380 0.690 -1.699 1.00 0.19 C ATOM 1242 CD2 LEU A 38 -12.853 -1.681 -2.266 1.00 0.21 C ATOM 0 H LEU A 38 -14.114 2.143 -4.462 1.00 0.20 H new ATOM 0 HA LEU A 38 -12.667 -0.071 -5.448 1.00 0.20 H new ATOM 0 HB2 LEU A 38 -14.969 0.333 -3.545 1.00 0.19 H new ATOM 0 HB3 LEU A 38 -14.505 -1.288 -4.022 1.00 0.19 H new ATOM 0 HG LEU A 38 -12.110 0.049 -3.279 1.00 0.18 H new ATOM 0 HD11 LEU A 38 -12.591 0.666 -0.948 1.00 0.19 H new ATOM 0 HD12 LEU A 38 -13.466 1.699 -2.103 1.00 0.19 H new ATOM 0 HD13 LEU A 38 -14.326 0.401 -1.241 1.00 0.19 H new ATOM 0 HD21 LEU A 38 -12.076 -1.669 -1.501 1.00 0.21 H new ATOM 0 HD22 LEU A 38 -13.788 -2.029 -1.828 1.00 0.21 H new ATOM 0 HD23 LEU A 38 -12.558 -2.353 -3.072 1.00 0.21 H new ATOM 1254 N THR A 39 -15.752 0.244 -6.572 1.00 0.23 N ATOM 1255 CA THR A 39 -16.687 -0.278 -7.579 1.00 0.26 C ATOM 1256 C THR A 39 -16.087 -0.231 -8.984 1.00 0.27 C ATOM 1257 O THR A 39 -16.429 -1.044 -9.847 1.00 0.30 O ATOM 1258 CB THR A 39 -18.036 0.483 -7.589 1.00 0.29 C ATOM 1259 OG1 THR A 39 -17.825 1.877 -7.845 1.00 0.33 O ATOM 1260 CG2 THR A 39 -18.771 0.316 -6.270 1.00 0.30 C ATOM 0 H THR A 39 -16.095 1.053 -6.053 1.00 0.23 H new ATOM 0 HA THR A 39 -16.873 -1.314 -7.295 1.00 0.26 H new ATOM 0 HB THR A 39 -18.647 0.058 -8.385 1.00 0.29 H new ATOM 0 HG1 THR A 39 -16.864 2.068 -7.842 1.00 0.33 H new ATOM 0 HG21 THR A 39 -19.714 0.861 -6.307 1.00 0.30 H new ATOM 0 HG22 THR A 39 -18.970 -0.741 -6.096 1.00 0.30 H new ATOM 0 HG23 THR A 39 -18.157 0.708 -5.459 1.00 0.30 H new ATOM 1268 N ARG A 40 -15.188 0.716 -9.205 1.00 0.27 N ATOM 1269 CA ARG A 40 -14.582 0.901 -10.513 1.00 0.30 C ATOM 1270 C ARG A 40 -13.313 0.073 -10.657 1.00 0.29 C ATOM 1271 O ARG A 40 -13.208 -0.775 -11.543 1.00 0.33 O ATOM 1272 CB ARG A 40 -14.255 2.380 -10.738 1.00 0.34 C ATOM 1273 CG ARG A 40 -15.469 3.293 -10.683 1.00 0.36 C ATOM 1274 CD ARG A 40 -16.412 3.050 -11.843 1.00 0.47 C ATOM 1275 NE ARG A 40 -15.859 3.521 -13.111 1.00 0.67 N ATOM 1276 CZ ARG A 40 -16.112 2.953 -14.291 1.00 0.90 C ATOM 1277 NH1 ARG A 40 -16.807 1.824 -14.356 1.00 1.24 N ATOM 1278 NH2 ARG A 40 -15.653 3.512 -15.404 1.00 1.09 N ATOM 0 H ARG A 40 -14.862 1.369 -8.493 1.00 0.27 H new ATOM 0 HA ARG A 40 -15.299 0.566 -11.262 1.00 0.30 H new ATOM 0 HB2 ARG A 40 -13.536 2.702 -9.985 1.00 0.34 H new ATOM 0 HB3 ARG A 40 -13.772 2.492 -11.709 1.00 0.34 H new ATOM 0 HG2 ARG A 40 -16.000 3.135 -9.744 1.00 0.36 H new ATOM 0 HG3 ARG A 40 -15.142 4.333 -10.693 1.00 0.36 H new ATOM 0 HD2 ARG A 40 -16.628 1.984 -11.916 1.00 0.47 H new ATOM 0 HD3 ARG A 40 -17.359 3.555 -11.651 1.00 0.47 H new ATOM 0 HE ARG A 40 -15.242 4.333 -13.093 1.00 0.67 H new ATOM 0 HH11 ARG A 40 -17.150 1.387 -13.501 1.00 1.24 H new ATOM 0 HH12 ARG A 40 -16.998 1.394 -15.261 1.00 1.24 H new ATOM 0 HH21 ARG A 40 -15.109 4.373 -15.355 1.00 1.09 H new ATOM 0 HH22 ARG A 40 -15.845 3.080 -16.308 1.00 1.09 H new ATOM 1292 N GLU A 41 -12.345 0.327 -9.790 1.00 0.29 N ATOM 1293 CA GLU A 41 -11.019 -0.253 -9.940 1.00 0.32 C ATOM 1294 C GLU A 41 -10.773 -1.448 -9.020 1.00 0.35 C ATOM 1295 O GLU A 41 -9.775 -2.145 -9.170 1.00 0.46 O ATOM 1296 CB GLU A 41 -9.965 0.829 -9.729 1.00 0.38 C ATOM 1297 CG GLU A 41 -9.843 1.760 -10.920 1.00 0.47 C ATOM 1298 CD GLU A 41 -9.050 3.017 -10.636 1.00 0.83 C ATOM 1299 OE1 GLU A 41 -7.824 2.923 -10.431 1.00 1.60 O ATOM 1300 OE2 GLU A 41 -9.653 4.109 -10.641 1.00 1.54 O ATOM 0 H GLU A 41 -12.453 0.931 -8.975 1.00 0.29 H new ATOM 0 HA GLU A 41 -10.948 -0.645 -10.955 1.00 0.32 H new ATOM 0 HB2 GLU A 41 -10.218 1.410 -8.842 1.00 0.38 H new ATOM 0 HB3 GLU A 41 -9.000 0.360 -9.538 1.00 0.38 H new ATOM 0 HG2 GLU A 41 -9.371 1.222 -11.742 1.00 0.47 H new ATOM 0 HG3 GLU A 41 -10.842 2.040 -11.254 1.00 0.47 H new ATOM 1307 N LEU A 42 -11.672 -1.696 -8.078 1.00 0.28 N ATOM 1308 CA LEU A 42 -11.516 -2.835 -7.166 1.00 0.29 C ATOM 1309 C LEU A 42 -12.798 -3.676 -7.085 1.00 0.28 C ATOM 1310 O LEU A 42 -13.181 -4.100 -5.996 1.00 0.26 O ATOM 1311 CB LEU A 42 -11.167 -2.358 -5.744 1.00 0.27 C ATOM 1312 CG LEU A 42 -9.957 -1.435 -5.605 1.00 0.27 C ATOM 1313 CD1 LEU A 42 -10.308 -0.009 -6.014 1.00 0.27 C ATOM 1314 CD2 LEU A 42 -9.435 -1.471 -4.177 1.00 0.31 C ATOM 0 H LEU A 42 -12.509 -1.135 -7.921 1.00 0.28 H new ATOM 0 HA LEU A 42 -10.707 -3.445 -7.568 1.00 0.29 H new ATOM 0 HB2 LEU A 42 -12.036 -1.843 -5.336 1.00 0.27 H new ATOM 0 HB3 LEU A 42 -10.997 -3.237 -5.123 1.00 0.27 H new ATOM 0 HG LEU A 42 -9.173 -1.790 -6.274 1.00 0.27 H new ATOM 0 HD11 LEU A 42 -9.430 0.627 -5.906 1.00 0.27 H new ATOM 0 HD12 LEU A 42 -10.637 0.001 -7.053 1.00 0.27 H new ATOM 0 HD13 LEU A 42 -11.108 0.366 -5.376 1.00 0.27 H new ATOM 0 HD21 LEU A 42 -8.573 -0.810 -4.088 1.00 0.31 H new ATOM 0 HD22 LEU A 42 -10.218 -1.140 -3.495 1.00 0.31 H new ATOM 0 HD23 LEU A 42 -9.140 -2.489 -3.923 1.00 0.31 H new ATOM 1326 N PRO A 43 -13.468 -3.975 -8.217 1.00 0.32 N ATOM 1327 CA PRO A 43 -14.787 -4.604 -8.175 1.00 0.34 C ATOM 1328 C PRO A 43 -14.702 -6.074 -7.791 1.00 0.35 C ATOM 1329 O PRO A 43 -15.646 -6.644 -7.237 1.00 0.38 O ATOM 1330 CB PRO A 43 -15.311 -4.437 -9.598 1.00 0.43 C ATOM 1331 CG PRO A 43 -14.092 -4.372 -10.453 1.00 0.52 C ATOM 1332 CD PRO A 43 -12.993 -3.784 -9.603 1.00 0.36 C ATOM 0 HA PRO A 43 -15.437 -4.153 -7.425 1.00 0.34 H new ATOM 0 HB2 PRO A 43 -15.950 -5.273 -9.884 1.00 0.43 H new ATOM 0 HB3 PRO A 43 -15.909 -3.531 -9.694 1.00 0.43 H new ATOM 0 HG2 PRO A 43 -13.816 -5.365 -10.809 1.00 0.52 H new ATOM 0 HG3 PRO A 43 -14.271 -3.756 -11.334 1.00 0.52 H new ATOM 0 HD2 PRO A 43 -12.043 -4.291 -9.772 1.00 0.36 H new ATOM 0 HD3 PRO A 43 -12.836 -2.729 -9.829 1.00 0.36 H new ATOM 1340 N SER A 44 -13.555 -6.675 -8.071 1.00 0.37 N ATOM 1341 CA SER A 44 -13.301 -8.049 -7.696 1.00 0.41 C ATOM 1342 C SER A 44 -13.111 -8.147 -6.186 1.00 0.37 C ATOM 1343 O SER A 44 -13.351 -9.190 -5.584 1.00 0.42 O ATOM 1344 CB SER A 44 -12.071 -8.566 -8.446 1.00 0.48 C ATOM 1345 OG SER A 44 -11.017 -7.617 -8.407 1.00 1.09 O ATOM 0 H SER A 44 -12.782 -6.224 -8.561 1.00 0.37 H new ATOM 0 HA SER A 44 -14.154 -8.670 -7.969 1.00 0.41 H new ATOM 0 HB2 SER A 44 -11.737 -9.504 -8.002 1.00 0.48 H new ATOM 0 HB3 SER A 44 -12.335 -8.780 -9.482 1.00 0.48 H new ATOM 0 HG SER A 44 -10.241 -7.970 -8.891 1.00 1.09 H new ATOM 1351 N PHE A 45 -12.735 -7.026 -5.583 1.00 0.33 N ATOM 1352 CA PHE A 45 -12.498 -6.954 -4.148 1.00 0.34 C ATOM 1353 C PHE A 45 -13.767 -6.529 -3.412 1.00 0.36 C ATOM 1354 O PHE A 45 -13.716 -6.133 -2.250 1.00 0.40 O ATOM 1355 CB PHE A 45 -11.366 -5.967 -3.846 1.00 0.33 C ATOM 1356 CG PHE A 45 -10.079 -6.282 -4.557 1.00 0.35 C ATOM 1357 CD1 PHE A 45 -9.249 -7.292 -4.100 1.00 1.31 C ATOM 1358 CD2 PHE A 45 -9.698 -5.561 -5.677 1.00 1.17 C ATOM 1359 CE1 PHE A 45 -8.065 -7.579 -4.752 1.00 1.36 C ATOM 1360 CE2 PHE A 45 -8.516 -5.845 -6.332 1.00 1.15 C ATOM 1361 CZ PHE A 45 -7.698 -6.855 -5.868 1.00 0.46 C ATOM 0 H PHE A 45 -12.586 -6.144 -6.074 1.00 0.33 H new ATOM 0 HA PHE A 45 -12.209 -7.946 -3.800 1.00 0.34 H new ATOM 0 HB2 PHE A 45 -11.688 -4.964 -4.125 1.00 0.33 H new ATOM 0 HB3 PHE A 45 -11.183 -5.956 -2.771 1.00 0.33 H new ATOM 0 HD1 PHE A 45 -9.530 -7.861 -3.226 1.00 1.31 H new ATOM 0 HD2 PHE A 45 -10.333 -4.767 -6.042 1.00 1.17 H new ATOM 0 HE1 PHE A 45 -7.426 -8.370 -4.388 1.00 1.36 H new ATOM 0 HE2 PHE A 45 -8.232 -5.278 -7.206 1.00 1.15 H new ATOM 0 HZ PHE A 45 -6.772 -7.078 -6.377 1.00 0.46 H new ATOM 1371 N LEU A 46 -14.895 -6.556 -4.110 1.00 0.36 N ATOM 1372 CA LEU A 46 -16.172 -6.191 -3.504 1.00 0.40 C ATOM 1373 C LEU A 46 -17.182 -7.325 -3.575 1.00 0.55 C ATOM 1374 O LEU A 46 -18.199 -7.310 -2.875 1.00 0.70 O ATOM 1375 CB LEU A 46 -16.756 -4.968 -4.204 1.00 0.35 C ATOM 1376 CG LEU A 46 -15.911 -3.707 -4.098 1.00 0.32 C ATOM 1377 CD1 LEU A 46 -16.567 -2.572 -4.860 1.00 0.34 C ATOM 1378 CD2 LEU A 46 -15.712 -3.335 -2.640 1.00 0.30 C ATOM 0 H LEU A 46 -14.954 -6.825 -5.092 1.00 0.36 H new ATOM 0 HA LEU A 46 -15.975 -5.970 -2.455 1.00 0.40 H new ATOM 0 HB2 LEU A 46 -16.900 -5.205 -5.258 1.00 0.35 H new ATOM 0 HB3 LEU A 46 -17.742 -4.764 -3.786 1.00 0.35 H new ATOM 0 HG LEU A 46 -14.933 -3.895 -4.541 1.00 0.32 H new ATOM 0 HD11 LEU A 46 -15.953 -1.675 -4.777 1.00 0.34 H new ATOM 0 HD12 LEU A 46 -16.666 -2.848 -5.910 1.00 0.34 H new ATOM 0 HD13 LEU A 46 -17.554 -2.376 -4.442 1.00 0.34 H new ATOM 0 HD21 LEU A 46 -15.106 -2.431 -2.575 1.00 0.30 H new ATOM 0 HD22 LEU A 46 -16.681 -3.156 -2.174 1.00 0.30 H new ATOM 0 HD23 LEU A 46 -15.206 -4.150 -2.122 1.00 0.30 H new ATOM 1390 N GLY A 47 -16.914 -8.293 -4.438 1.00 0.64 N ATOM 1391 CA GLY A 47 -17.896 -9.322 -4.718 1.00 0.82 C ATOM 1392 C GLY A 47 -18.988 -8.804 -5.636 1.00 0.87 C ATOM 1393 O GLY A 47 -19.998 -9.472 -5.854 1.00 1.23 O ATOM 0 H GLY A 47 -16.036 -8.385 -4.949 1.00 0.64 H new ATOM 0 HA2 GLY A 47 -17.406 -10.180 -5.179 1.00 0.82 H new ATOM 0 HA3 GLY A 47 -18.337 -9.671 -3.784 1.00 0.82 H new ATOM 1397 N LYS A 48 -18.774 -7.589 -6.158 1.00 0.79 N ATOM 1398 CA LYS A 48 -19.698 -6.933 -7.094 1.00 0.95 C ATOM 1399 C LYS A 48 -21.062 -6.657 -6.458 1.00 0.73 C ATOM 1400 O LYS A 48 -22.015 -6.285 -7.139 1.00 0.97 O ATOM 1401 CB LYS A 48 -19.889 -7.766 -8.362 1.00 1.43 C ATOM 1402 CG LYS A 48 -18.659 -7.836 -9.264 1.00 2.17 C ATOM 1403 CD LYS A 48 -17.639 -8.856 -8.772 1.00 2.32 C ATOM 1404 CE LYS A 48 -18.201 -10.271 -8.801 1.00 2.88 C ATOM 1405 NZ LYS A 48 -18.505 -10.723 -10.184 1.00 3.51 N ATOM 0 H LYS A 48 -17.949 -7.029 -5.941 1.00 0.79 H new ATOM 0 HA LYS A 48 -19.242 -5.979 -7.357 1.00 0.95 H new ATOM 0 HB2 LYS A 48 -20.173 -8.779 -8.077 1.00 1.43 H new ATOM 0 HB3 LYS A 48 -20.720 -7.351 -8.933 1.00 1.43 H new ATOM 0 HG2 LYS A 48 -18.968 -8.094 -10.277 1.00 2.17 H new ATOM 0 HG3 LYS A 48 -18.191 -6.853 -9.314 1.00 2.17 H new ATOM 0 HD2 LYS A 48 -16.745 -8.806 -9.394 1.00 2.32 H new ATOM 0 HD3 LYS A 48 -17.335 -8.606 -7.756 1.00 2.32 H new ATOM 0 HE2 LYS A 48 -17.484 -10.955 -8.346 1.00 2.88 H new ATOM 0 HE3 LYS A 48 -19.108 -10.313 -8.199 1.00 2.88 H new ATOM 0 HZ1 LYS A 48 -18.706 -11.743 -10.179 1.00 3.51 H new ATOM 0 HZ2 LYS A 48 -19.334 -10.208 -10.543 1.00 3.51 H new ATOM 0 HZ3 LYS A 48 -17.688 -10.534 -10.799 1.00 3.51 H new ATOM 1419 N ARG A 49 -21.130 -6.808 -5.154 1.00 0.73 N ATOM 1420 CA ARG A 49 -22.382 -6.680 -4.417 1.00 0.70 C ATOM 1421 C ARG A 49 -22.208 -5.763 -3.211 1.00 0.61 C ATOM 1422 O ARG A 49 -22.719 -6.032 -2.121 1.00 0.75 O ATOM 1423 CB ARG A 49 -22.829 -8.072 -3.980 1.00 0.97 C ATOM 1424 CG ARG A 49 -21.793 -8.788 -3.133 1.00 1.10 C ATOM 1425 CD ARG A 49 -22.161 -10.233 -2.880 1.00 1.54 C ATOM 1426 NE ARG A 49 -22.099 -11.029 -4.106 1.00 2.02 N ATOM 1427 CZ ARG A 49 -22.475 -12.304 -4.199 1.00 2.68 C ATOM 1428 NH1 ARG A 49 -22.984 -12.937 -3.147 1.00 3.06 N ATOM 1429 NH2 ARG A 49 -22.337 -12.949 -5.352 1.00 3.24 N ATOM 0 H ARG A 49 -20.323 -7.023 -4.568 1.00 0.73 H new ATOM 0 HA ARG A 49 -23.143 -6.234 -5.057 1.00 0.70 H new ATOM 0 HB2 ARG A 49 -23.758 -7.989 -3.415 1.00 0.97 H new ATOM 0 HB3 ARG A 49 -23.046 -8.672 -4.864 1.00 0.97 H new ATOM 0 HG2 ARG A 49 -20.825 -8.743 -3.632 1.00 1.10 H new ATOM 0 HG3 ARG A 49 -21.685 -8.270 -2.180 1.00 1.10 H new ATOM 0 HD2 ARG A 49 -21.485 -10.656 -2.137 1.00 1.54 H new ATOM 0 HD3 ARG A 49 -23.167 -10.285 -2.463 1.00 1.54 H new ATOM 0 HE ARG A 49 -21.743 -10.577 -4.948 1.00 2.02 H new ATOM 0 HH11 ARG A 49 -23.090 -12.447 -2.259 1.00 3.06 H new ATOM 0 HH12 ARG A 49 -23.269 -13.913 -3.228 1.00 3.06 H new ATOM 0 HH21 ARG A 49 -21.945 -12.468 -6.162 1.00 3.24 H new ATOM 0 HH22 ARG A 49 -22.623 -13.925 -5.428 1.00 3.24 H new ATOM 1443 N THR A 50 -21.509 -4.667 -3.420 1.00 0.55 N ATOM 1444 CA THR A 50 -21.163 -3.772 -2.335 1.00 0.50 C ATOM 1445 C THR A 50 -22.136 -2.626 -2.168 1.00 0.50 C ATOM 1446 O THR A 50 -22.273 -1.767 -3.039 1.00 0.56 O ATOM 1447 CB THR A 50 -19.768 -3.206 -2.538 1.00 0.54 C ATOM 1448 OG1 THR A 50 -19.408 -3.326 -3.920 1.00 0.91 O ATOM 1449 CG2 THR A 50 -18.779 -3.943 -1.656 1.00 0.51 C ATOM 0 H THR A 50 -21.168 -4.373 -4.335 1.00 0.55 H new ATOM 0 HA THR A 50 -21.206 -4.374 -1.427 1.00 0.50 H new ATOM 0 HB THR A 50 -19.751 -2.152 -2.260 1.00 0.54 H new ATOM 0 HG1 THR A 50 -19.690 -2.521 -4.403 1.00 0.91 H new ATOM 0 HG21 THR A 50 -17.781 -3.532 -1.807 1.00 0.51 H new ATOM 0 HG22 THR A 50 -19.066 -3.826 -0.611 1.00 0.51 H new ATOM 0 HG23 THR A 50 -18.779 -5.002 -1.916 1.00 0.51 H new ATOM 1457 N ASP A 51 -22.806 -2.633 -1.040 1.00 0.49 N ATOM 1458 CA ASP A 51 -23.634 -1.517 -0.625 1.00 0.51 C ATOM 1459 C ASP A 51 -22.983 -0.864 0.594 1.00 0.44 C ATOM 1460 O ASP A 51 -21.838 -1.183 0.928 1.00 0.43 O ATOM 1461 CB ASP A 51 -25.053 -2.006 -0.308 1.00 0.60 C ATOM 1462 CG ASP A 51 -26.050 -0.874 -0.162 1.00 1.15 C ATOM 1463 OD1 ASP A 51 -26.453 -0.292 -1.187 1.00 1.72 O ATOM 1464 OD2 ASP A 51 -26.433 -0.561 0.980 1.00 1.94 O ATOM 0 H ASP A 51 -22.795 -3.411 -0.381 1.00 0.49 H new ATOM 0 HA ASP A 51 -23.714 -0.781 -1.425 1.00 0.51 H new ATOM 0 HB2 ASP A 51 -25.386 -2.676 -1.100 1.00 0.60 H new ATOM 0 HB3 ASP A 51 -25.034 -2.587 0.614 1.00 0.60 H new ATOM 1469 N GLU A 52 -23.705 0.015 1.274 1.00 0.47 N ATOM 1470 CA GLU A 52 -23.176 0.699 2.447 1.00 0.46 C ATOM 1471 C GLU A 52 -22.969 -0.293 3.589 1.00 0.46 C ATOM 1472 O GLU A 52 -22.266 -0.012 4.558 1.00 0.46 O ATOM 1473 CB GLU A 52 -24.138 1.803 2.884 1.00 0.49 C ATOM 1474 CG GLU A 52 -24.555 2.734 1.757 1.00 0.52 C ATOM 1475 CD GLU A 52 -23.431 3.620 1.267 1.00 0.71 C ATOM 1476 OE1 GLU A 52 -22.668 3.186 0.384 1.00 1.44 O ATOM 1477 OE2 GLU A 52 -23.332 4.775 1.738 1.00 1.27 O ATOM 0 H GLU A 52 -24.662 0.272 1.033 1.00 0.47 H new ATOM 0 HA GLU A 52 -22.215 1.144 2.190 1.00 0.46 H new ATOM 0 HB2 GLU A 52 -25.029 1.346 3.314 1.00 0.49 H new ATOM 0 HB3 GLU A 52 -23.668 2.390 3.673 1.00 0.49 H new ATOM 0 HG2 GLU A 52 -24.930 2.140 0.924 1.00 0.52 H new ATOM 0 HG3 GLU A 52 -25.380 3.360 2.098 1.00 0.52 H new ATOM 1484 N ALA A 53 -23.600 -1.457 3.465 1.00 0.52 N ATOM 1485 CA ALA A 53 -23.468 -2.517 4.454 1.00 0.58 C ATOM 1486 C ALA A 53 -22.050 -3.075 4.470 1.00 0.57 C ATOM 1487 O ALA A 53 -21.402 -3.116 5.518 1.00 0.68 O ATOM 1488 CB ALA A 53 -24.472 -3.625 4.173 1.00 0.65 C ATOM 0 H ALA A 53 -24.212 -1.689 2.682 1.00 0.52 H new ATOM 0 HA ALA A 53 -23.675 -2.095 5.437 1.00 0.58 H new ATOM 0 HB1 ALA A 53 -24.364 -4.412 4.919 1.00 0.65 H new ATOM 0 HB2 ALA A 53 -25.483 -3.220 4.217 1.00 0.65 H new ATOM 0 HB3 ALA A 53 -24.290 -4.038 3.181 1.00 0.65 H new ATOM 1494 N ALA A 54 -21.563 -3.490 3.301 1.00 0.49 N ATOM 1495 CA ALA A 54 -20.213 -4.028 3.185 1.00 0.50 C ATOM 1496 C ALA A 54 -19.182 -2.946 3.492 1.00 0.45 C ATOM 1497 O ALA A 54 -18.152 -3.201 4.121 1.00 0.52 O ATOM 1498 CB ALA A 54 -19.976 -4.608 1.790 1.00 0.49 C ATOM 0 H ALA A 54 -22.084 -3.463 2.424 1.00 0.49 H new ATOM 0 HA ALA A 54 -20.103 -4.833 3.912 1.00 0.50 H new ATOM 0 HB1 ALA A 54 -18.962 -5.003 1.728 1.00 0.49 H new ATOM 0 HB2 ALA A 54 -20.690 -5.410 1.603 1.00 0.49 H new ATOM 0 HB3 ALA A 54 -20.107 -3.825 1.043 1.00 0.49 H new ATOM 1504 N PHE A 55 -19.480 -1.728 3.067 1.00 0.36 N ATOM 1505 CA PHE A 55 -18.548 -0.618 3.206 1.00 0.32 C ATOM 1506 C PHE A 55 -18.426 -0.128 4.642 1.00 0.34 C ATOM 1507 O PHE A 55 -17.433 0.508 4.992 1.00 0.34 O ATOM 1508 CB PHE A 55 -18.952 0.525 2.280 1.00 0.31 C ATOM 1509 CG PHE A 55 -18.351 0.385 0.918 1.00 0.28 C ATOM 1510 CD1 PHE A 55 -18.968 -0.378 -0.057 1.00 1.20 C ATOM 1511 CD2 PHE A 55 -17.148 0.999 0.623 1.00 1.20 C ATOM 1512 CE1 PHE A 55 -18.394 -0.528 -1.303 1.00 1.20 C ATOM 1513 CE2 PHE A 55 -16.573 0.856 -0.621 1.00 1.21 C ATOM 1514 CZ PHE A 55 -17.194 0.090 -1.586 1.00 0.31 C ATOM 0 H PHE A 55 -20.364 -1.482 2.621 1.00 0.36 H new ATOM 0 HA PHE A 55 -17.563 -0.987 2.918 1.00 0.32 H new ATOM 0 HB2 PHE A 55 -20.038 0.555 2.195 1.00 0.31 H new ATOM 0 HB3 PHE A 55 -18.640 1.473 2.718 1.00 0.31 H new ATOM 0 HD1 PHE A 55 -19.909 -0.862 0.159 1.00 1.20 H new ATOM 0 HD2 PHE A 55 -16.654 1.597 1.375 1.00 1.20 H new ATOM 0 HE1 PHE A 55 -18.884 -1.128 -2.055 1.00 1.20 H new ATOM 0 HE2 PHE A 55 -15.635 1.344 -0.841 1.00 1.21 H new ATOM 0 HZ PHE A 55 -16.742 -0.025 -2.560 1.00 0.31 H new ATOM 1524 N GLN A 56 -19.409 -0.440 5.475 1.00 0.37 N ATOM 1525 CA GLN A 56 -19.400 0.005 6.863 1.00 0.40 C ATOM 1526 C GLN A 56 -18.187 -0.552 7.613 1.00 0.37 C ATOM 1527 O GLN A 56 -17.593 0.135 8.447 1.00 0.42 O ATOM 1528 CB GLN A 56 -20.695 -0.409 7.560 1.00 0.46 C ATOM 1529 CG GLN A 56 -20.894 0.245 8.917 1.00 0.58 C ATOM 1530 CD GLN A 56 -22.239 -0.085 9.536 1.00 0.68 C ATOM 1531 OE1 GLN A 56 -22.730 -1.290 9.295 1.00 1.42 O flip ATOM 1532 NE2 GLN A 56 -22.823 0.733 10.245 1.00 1.00 N flip ATOM 0 H GLN A 56 -20.222 -0.999 5.215 1.00 0.37 H new ATOM 0 HA GLN A 56 -19.329 1.093 6.870 1.00 0.40 H new ATOM 0 HB2 GLN A 56 -21.539 -0.158 6.918 1.00 0.46 H new ATOM 0 HB3 GLN A 56 -20.700 -1.492 7.684 1.00 0.46 H new ATOM 0 HG2 GLN A 56 -20.100 -0.077 9.591 1.00 0.58 H new ATOM 0 HG3 GLN A 56 -20.803 1.326 8.811 1.00 0.58 H new ATOM 0 HE21 GLN A 56 -22.412 1.652 10.407 1.00 1.00 H new ATOM 0 HE22 GLN A 56 -23.718 0.492 10.671 1.00 1.00 H new ATOM 1541 N LYS A 57 -17.811 -1.791 7.300 1.00 0.34 N ATOM 1542 CA LYS A 57 -16.657 -2.424 7.934 1.00 0.35 C ATOM 1543 C LYS A 57 -15.374 -1.912 7.303 1.00 0.29 C ATOM 1544 O LYS A 57 -14.382 -1.669 7.990 1.00 0.34 O ATOM 1545 CB LYS A 57 -16.728 -3.946 7.785 1.00 0.47 C ATOM 1546 CG LYS A 57 -16.806 -4.720 9.100 1.00 0.85 C ATOM 1547 CD LYS A 57 -15.498 -4.697 9.893 1.00 0.57 C ATOM 1548 CE LYS A 57 -15.362 -3.450 10.754 1.00 0.63 C ATOM 1549 NZ LYS A 57 -14.235 -3.559 11.718 1.00 0.92 N ATOM 0 H LYS A 57 -18.288 -2.375 6.613 1.00 0.34 H new ATOM 0 HA LYS A 57 -16.667 -2.173 8.995 1.00 0.35 H new ATOM 0 HB2 LYS A 57 -17.600 -4.197 7.181 1.00 0.47 H new ATOM 0 HB3 LYS A 57 -15.850 -4.283 7.234 1.00 0.47 H new ATOM 0 HG2 LYS A 57 -17.603 -4.300 9.714 1.00 0.85 H new ATOM 0 HG3 LYS A 57 -17.077 -5.754 8.889 1.00 0.85 H new ATOM 0 HD2 LYS A 57 -15.446 -5.581 10.528 1.00 0.57 H new ATOM 0 HD3 LYS A 57 -14.657 -4.751 9.202 1.00 0.57 H new ATOM 0 HE2 LYS A 57 -15.208 -2.582 10.113 1.00 0.63 H new ATOM 0 HE3 LYS A 57 -16.291 -3.283 11.299 1.00 0.63 H new ATOM 0 HZ1 LYS A 57 -14.494 -3.090 12.610 1.00 0.92 H new ATOM 0 HZ2 LYS A 57 -14.030 -4.562 11.901 1.00 0.92 H new ATOM 0 HZ3 LYS A 57 -13.391 -3.101 11.319 1.00 0.92 H new ATOM 1563 N LEU A 58 -15.417 -1.747 5.990 1.00 0.24 N ATOM 1564 CA LEU A 58 -14.280 -1.256 5.223 1.00 0.20 C ATOM 1565 C LEU A 58 -13.849 0.113 5.736 1.00 0.20 C ATOM 1566 O LEU A 58 -12.761 0.262 6.291 1.00 0.22 O ATOM 1567 CB LEU A 58 -14.671 -1.187 3.744 1.00 0.20 C ATOM 1568 CG LEU A 58 -13.657 -0.530 2.812 1.00 0.19 C ATOM 1569 CD1 LEU A 58 -12.281 -1.135 3.004 1.00 0.20 C ATOM 1570 CD2 LEU A 58 -14.105 -0.669 1.368 1.00 0.23 C ATOM 0 H LEU A 58 -16.241 -1.950 5.425 1.00 0.24 H new ATOM 0 HA LEU A 58 -13.436 -1.936 5.338 1.00 0.20 H new ATOM 0 HB2 LEU A 58 -14.855 -2.201 3.390 1.00 0.20 H new ATOM 0 HB3 LEU A 58 -15.613 -0.645 3.663 1.00 0.20 H new ATOM 0 HG LEU A 58 -13.598 0.530 3.058 1.00 0.19 H new ATOM 0 HD11 LEU A 58 -11.574 -0.652 2.330 1.00 0.20 H new ATOM 0 HD12 LEU A 58 -11.959 -0.987 4.035 1.00 0.20 H new ATOM 0 HD13 LEU A 58 -12.319 -2.202 2.786 1.00 0.20 H new ATOM 0 HD21 LEU A 58 -13.373 -0.196 0.713 1.00 0.23 H new ATOM 0 HD22 LEU A 58 -14.191 -1.725 1.114 1.00 0.23 H new ATOM 0 HD23 LEU A 58 -15.073 -0.185 1.239 1.00 0.23 H new ATOM 1582 N MET A 59 -14.727 1.084 5.535 1.00 0.21 N ATOM 1583 CA MET A 59 -14.591 2.443 6.061 1.00 0.26 C ATOM 1584 C MET A 59 -13.939 2.476 7.447 1.00 0.27 C ATOM 1585 O MET A 59 -12.948 3.169 7.662 1.00 0.33 O ATOM 1586 CB MET A 59 -15.988 3.058 6.171 1.00 0.36 C ATOM 1587 CG MET A 59 -15.985 4.565 6.253 1.00 0.34 C ATOM 1588 SD MET A 59 -15.891 5.321 4.627 1.00 0.72 S ATOM 1589 CE MET A 59 -14.969 6.785 5.035 1.00 0.32 C ATOM 0 H MET A 59 -15.577 0.950 4.988 1.00 0.21 H new ATOM 0 HA MET A 59 -13.950 3.001 5.379 1.00 0.26 H new ATOM 0 HB2 MET A 59 -16.579 2.752 5.308 1.00 0.36 H new ATOM 0 HB3 MET A 59 -16.483 2.656 7.055 1.00 0.36 H new ATOM 0 HG2 MET A 59 -16.889 4.903 6.759 1.00 0.34 H new ATOM 0 HG3 MET A 59 -15.139 4.895 6.857 1.00 0.34 H new ATOM 0 HE1 MET A 59 -14.293 7.029 4.216 1.00 0.32 H new ATOM 0 HE2 MET A 59 -15.657 7.615 5.197 1.00 0.32 H new ATOM 0 HE3 MET A 59 -14.391 6.610 5.942 1.00 0.32 H new ATOM 1599 N SER A 60 -14.506 1.707 8.367 1.00 0.28 N ATOM 1600 CA SER A 60 -14.083 1.696 9.766 1.00 0.35 C ATOM 1601 C SER A 60 -12.644 1.217 9.934 1.00 0.32 C ATOM 1602 O SER A 60 -11.866 1.794 10.692 1.00 0.36 O ATOM 1603 CB SER A 60 -14.987 0.756 10.541 1.00 0.41 C ATOM 1604 OG SER A 60 -14.719 0.793 11.933 1.00 0.64 O ATOM 0 H SER A 60 -15.276 1.069 8.165 1.00 0.28 H new ATOM 0 HA SER A 60 -14.147 2.719 10.137 1.00 0.35 H new ATOM 0 HB2 SER A 60 -16.028 1.026 10.364 1.00 0.41 H new ATOM 0 HB3 SER A 60 -14.854 -0.261 10.173 1.00 0.41 H new ATOM 0 HG SER A 60 -15.322 0.176 12.399 1.00 0.64 H new ATOM 1610 N ASN A 61 -12.317 0.130 9.253 1.00 0.30 N ATOM 1611 CA ASN A 61 -11.000 -0.479 9.367 1.00 0.31 C ATOM 1612 C ASN A 61 -9.939 0.428 8.771 1.00 0.31 C ATOM 1613 O ASN A 61 -8.795 0.440 9.217 1.00 0.39 O ATOM 1614 CB ASN A 61 -10.990 -1.836 8.678 1.00 0.34 C ATOM 1615 CG ASN A 61 -11.667 -2.921 9.486 1.00 0.43 C ATOM 1616 OD1 ASN A 61 -11.739 -2.852 10.713 1.00 0.95 O ATOM 1617 ND2 ASN A 61 -12.154 -3.949 8.807 1.00 0.57 N ATOM 0 H ASN A 61 -12.949 -0.351 8.612 1.00 0.30 H new ATOM 0 HA ASN A 61 -10.772 -0.621 10.423 1.00 0.31 H new ATOM 0 HB2 ASN A 61 -11.486 -1.749 7.711 1.00 0.34 H new ATOM 0 HB3 ASN A 61 -9.959 -2.129 8.481 1.00 0.34 H new ATOM 0 HD21 ASN A 61 -12.607 -4.718 9.301 1.00 0.57 H new ATOM 0 HD22 ASN A 61 -12.076 -3.972 7.790 1.00 0.57 H new ATOM 1624 N LEU A 62 -10.338 1.178 7.758 1.00 0.30 N ATOM 1625 CA LEU A 62 -9.468 2.208 7.178 1.00 0.33 C ATOM 1626 C LEU A 62 -9.255 3.334 8.164 1.00 0.33 C ATOM 1627 O LEU A 62 -8.141 3.588 8.616 1.00 0.38 O ATOM 1628 CB LEU A 62 -10.081 2.812 5.917 1.00 0.37 C ATOM 1629 CG LEU A 62 -9.745 2.105 4.620 1.00 0.24 C ATOM 1630 CD1 LEU A 62 -10.202 0.674 4.678 1.00 0.52 C ATOM 1631 CD2 LEU A 62 -10.382 2.823 3.445 1.00 0.28 C ATOM 0 H LEU A 62 -11.254 1.100 7.316 1.00 0.30 H new ATOM 0 HA LEU A 62 -8.523 1.722 6.933 1.00 0.33 H new ATOM 0 HB2 LEU A 62 -11.165 2.825 6.032 1.00 0.37 H new ATOM 0 HB3 LEU A 62 -9.757 3.850 5.838 1.00 0.37 H new ATOM 0 HG LEU A 62 -8.664 2.119 4.482 1.00 0.24 H new ATOM 0 HD11 LEU A 62 -9.956 0.175 3.741 1.00 0.52 H new ATOM 0 HD12 LEU A 62 -9.702 0.165 5.502 1.00 0.52 H new ATOM 0 HD13 LEU A 62 -11.280 0.642 4.833 1.00 0.52 H new ATOM 0 HD21 LEU A 62 -10.131 2.302 2.521 1.00 0.28 H new ATOM 0 HD22 LEU A 62 -11.465 2.837 3.571 1.00 0.28 H new ATOM 0 HD23 LEU A 62 -10.009 3.846 3.398 1.00 0.28 H new ATOM 1643 N ASP A 63 -10.355 4.002 8.457 1.00 0.37 N ATOM 1644 CA ASP A 63 -10.388 5.144 9.348 1.00 0.43 C ATOM 1645 C ASP A 63 -9.958 4.738 10.755 1.00 0.38 C ATOM 1646 O ASP A 63 -10.790 4.403 11.592 1.00 0.43 O ATOM 1647 CB ASP A 63 -11.816 5.695 9.337 1.00 0.56 C ATOM 1648 CG ASP A 63 -12.046 6.829 10.297 1.00 0.85 C ATOM 1649 OD1 ASP A 63 -11.145 7.668 10.474 1.00 1.56 O ATOM 1650 OD2 ASP A 63 -13.153 6.895 10.864 1.00 1.35 O ATOM 0 H ASP A 63 -11.269 3.760 8.074 1.00 0.37 H new ATOM 0 HA ASP A 63 -9.691 5.914 9.016 1.00 0.43 H new ATOM 0 HB2 ASP A 63 -12.055 6.033 8.329 1.00 0.56 H new ATOM 0 HB3 ASP A 63 -12.507 4.887 9.575 1.00 0.56 H new ATOM 1655 N SER A 64 -8.650 4.764 11.004 1.00 0.37 N ATOM 1656 CA SER A 64 -8.093 4.210 12.229 1.00 0.41 C ATOM 1657 C SER A 64 -8.182 5.216 13.370 1.00 0.52 C ATOM 1658 O SER A 64 -8.056 4.861 14.545 1.00 0.64 O ATOM 1659 CB SER A 64 -6.638 3.771 12.003 1.00 0.45 C ATOM 1660 OG SER A 64 -5.760 4.881 11.929 1.00 0.58 O ATOM 0 H SER A 64 -7.958 5.164 10.370 1.00 0.37 H new ATOM 0 HA SER A 64 -8.679 3.334 12.507 1.00 0.41 H new ATOM 0 HB2 SER A 64 -6.326 3.114 12.815 1.00 0.45 H new ATOM 0 HB3 SER A 64 -6.572 3.193 11.081 1.00 0.45 H new ATOM 0 HG SER A 64 -6.231 5.645 11.534 1.00 0.58 H new ATOM 1666 N ASN A 65 -8.405 6.471 13.023 1.00 0.60 N ATOM 1667 CA ASN A 65 -8.579 7.516 14.020 1.00 0.83 C ATOM 1668 C ASN A 65 -10.061 7.701 14.328 1.00 0.89 C ATOM 1669 O ASN A 65 -10.430 8.415 15.260 1.00 1.10 O ATOM 1670 CB ASN A 65 -7.955 8.830 13.542 1.00 0.95 C ATOM 1671 CG ASN A 65 -8.566 9.336 12.251 1.00 0.99 C ATOM 1672 OD1 ASN A 65 -9.523 10.110 12.266 1.00 1.52 O ATOM 1673 ND2 ASN A 65 -8.020 8.902 11.127 1.00 1.44 N ATOM 0 H ASN A 65 -8.470 6.793 12.057 1.00 0.60 H new ATOM 0 HA ASN A 65 -8.068 7.216 14.935 1.00 0.83 H new ATOM 0 HB2 ASN A 65 -8.076 9.587 14.317 1.00 0.95 H new ATOM 0 HB3 ASN A 65 -6.884 8.687 13.400 1.00 0.95 H new ATOM 0 HD21 ASN A 65 -8.392 9.209 10.228 1.00 1.44 H new ATOM 0 HD22 ASN A 65 -7.227 8.261 11.159 1.00 1.44 H new ATOM 1680 N ARG A 66 -10.895 7.030 13.537 1.00 0.79 N ATOM 1681 CA ARG A 66 -12.347 7.039 13.706 1.00 0.98 C ATOM 1682 C ARG A 66 -12.926 8.453 13.666 1.00 1.05 C ATOM 1683 O ARG A 66 -13.210 9.059 14.699 1.00 1.34 O ATOM 1684 CB ARG A 66 -12.779 6.302 14.982 1.00 1.26 C ATOM 1685 CG ARG A 66 -12.788 4.782 14.839 1.00 1.46 C ATOM 1686 CD ARG A 66 -11.384 4.193 14.842 1.00 1.25 C ATOM 1687 NE ARG A 66 -11.248 3.079 13.900 1.00 1.91 N ATOM 1688 CZ ARG A 66 -10.222 2.223 13.885 1.00 2.60 C ATOM 1689 NH1 ARG A 66 -9.317 2.235 14.854 1.00 2.85 N ATOM 1690 NH2 ARG A 66 -10.103 1.347 12.899 1.00 3.45 N ATOM 0 H ARG A 66 -10.579 6.459 12.753 1.00 0.79 H new ATOM 0 HA ARG A 66 -12.759 6.497 12.855 1.00 0.98 H new ATOM 0 HB2 ARG A 66 -12.108 6.578 15.795 1.00 1.26 H new ATOM 0 HB3 ARG A 66 -13.777 6.638 15.265 1.00 1.26 H new ATOM 0 HG2 ARG A 66 -13.364 4.346 15.655 1.00 1.46 H new ATOM 0 HG3 ARG A 66 -13.292 4.509 13.912 1.00 1.46 H new ATOM 0 HD2 ARG A 66 -10.665 4.972 14.587 1.00 1.25 H new ATOM 0 HD3 ARG A 66 -11.139 3.849 15.847 1.00 1.25 H new ATOM 0 HE ARG A 66 -11.987 2.948 13.209 1.00 1.91 H new ATOM 0 HH11 ARG A 66 -9.400 2.902 15.621 1.00 2.85 H new ATOM 0 HH12 ARG A 66 -8.538 1.577 14.832 1.00 2.85 H new ATOM 0 HH21 ARG A 66 -10.795 1.325 12.150 1.00 3.45 H new ATOM 0 HH22 ARG A 66 -9.319 0.694 12.889 1.00 3.45 H new ATOM 1704 N ASP A 67 -13.072 8.967 12.454 1.00 0.86 N ATOM 1705 CA ASP A 67 -13.703 10.259 12.211 1.00 1.00 C ATOM 1706 C ASP A 67 -14.780 10.116 11.131 1.00 0.88 C ATOM 1707 O ASP A 67 -15.529 11.054 10.854 1.00 0.94 O ATOM 1708 CB ASP A 67 -12.652 11.294 11.785 1.00 1.13 C ATOM 1709 CG ASP A 67 -13.199 12.711 11.743 1.00 1.57 C ATOM 1710 OD1 ASP A 67 -13.298 13.348 12.814 1.00 2.08 O ATOM 1711 OD2 ASP A 67 -13.529 13.200 10.643 1.00 2.02 O ATOM 0 H ASP A 67 -12.755 8.498 11.606 1.00 0.86 H new ATOM 0 HA ASP A 67 -14.171 10.604 13.133 1.00 1.00 H new ATOM 0 HB2 ASP A 67 -11.811 11.255 12.477 1.00 1.13 H new ATOM 0 HB3 ASP A 67 -12.267 11.029 10.800 1.00 1.13 H new ATOM 1716 N ASN A 68 -14.842 8.918 10.534 1.00 0.77 N ATOM 1717 CA ASN A 68 -15.826 8.563 9.492 1.00 0.74 C ATOM 1718 C ASN A 68 -15.429 9.113 8.129 1.00 0.65 C ATOM 1719 O ASN A 68 -16.177 8.992 7.160 1.00 0.66 O ATOM 1720 CB ASN A 68 -17.249 9.015 9.855 1.00 0.92 C ATOM 1721 CG ASN A 68 -17.801 8.300 11.074 1.00 1.13 C ATOM 1722 OD1 ASN A 68 -17.440 7.156 11.359 1.00 1.54 O ATOM 1723 ND2 ASN A 68 -18.694 8.962 11.794 1.00 1.75 N ATOM 0 H ASN A 68 -14.204 8.156 10.761 1.00 0.77 H new ATOM 0 HA ASN A 68 -15.827 7.474 9.435 1.00 0.74 H new ATOM 0 HB2 ASN A 68 -17.248 10.089 10.039 1.00 0.92 H new ATOM 0 HB3 ASN A 68 -17.909 8.838 9.006 1.00 0.92 H new ATOM 0 HD21 ASN A 68 -19.109 8.526 12.618 1.00 1.75 H new ATOM 0 HD22 ASN A 68 -18.966 9.907 11.525 1.00 1.75 H new ATOM 1730 N GLU A 69 -14.249 9.697 8.054 1.00 0.64 N ATOM 1731 CA GLU A 69 -13.695 10.163 6.793 1.00 0.63 C ATOM 1732 C GLU A 69 -12.250 9.715 6.703 1.00 0.54 C ATOM 1733 O GLU A 69 -11.430 10.119 7.522 1.00 0.65 O ATOM 1734 CB GLU A 69 -13.775 11.687 6.677 1.00 0.82 C ATOM 1735 CG GLU A 69 -15.190 12.233 6.708 1.00 0.95 C ATOM 1736 CD GLU A 69 -15.230 13.736 6.546 1.00 1.13 C ATOM 1737 OE1 GLU A 69 -14.878 14.452 7.505 1.00 1.59 O ATOM 1738 OE2 GLU A 69 -15.610 14.214 5.460 1.00 1.65 O ATOM 0 H GLU A 69 -13.647 9.862 8.861 1.00 0.64 H new ATOM 0 HA GLU A 69 -14.277 9.739 5.975 1.00 0.63 H new ATOM 0 HB2 GLU A 69 -13.206 12.134 7.492 1.00 0.82 H new ATOM 0 HB3 GLU A 69 -13.297 11.996 5.747 1.00 0.82 H new ATOM 0 HG2 GLU A 69 -15.774 11.769 5.913 1.00 0.95 H new ATOM 0 HG3 GLU A 69 -15.662 11.959 7.652 1.00 0.95 H new ATOM 1745 N VAL A 70 -11.943 8.883 5.718 1.00 0.40 N ATOM 1746 CA VAL A 70 -10.627 8.271 5.623 1.00 0.31 C ATOM 1747 C VAL A 70 -9.565 9.295 5.266 1.00 0.33 C ATOM 1748 O VAL A 70 -9.537 9.823 4.149 1.00 0.39 O ATOM 1749 CB VAL A 70 -10.605 7.123 4.593 1.00 0.28 C ATOM 1750 CG1 VAL A 70 -9.205 6.555 4.427 1.00 0.32 C ATOM 1751 CG2 VAL A 70 -11.570 6.028 5.008 1.00 0.29 C ATOM 0 H VAL A 70 -12.588 8.617 4.974 1.00 0.40 H new ATOM 0 HA VAL A 70 -10.403 7.859 6.607 1.00 0.31 H new ATOM 0 HB VAL A 70 -10.918 7.529 3.631 1.00 0.28 H new ATOM 0 HG11 VAL A 70 -9.224 5.748 3.694 1.00 0.32 H new ATOM 0 HG12 VAL A 70 -8.532 7.341 4.084 1.00 0.32 H new ATOM 0 HG13 VAL A 70 -8.853 6.168 5.384 1.00 0.32 H new ATOM 0 HG21 VAL A 70 -11.545 5.223 4.273 1.00 0.29 H new ATOM 0 HG22 VAL A 70 -11.280 5.637 5.983 1.00 0.29 H new ATOM 0 HG23 VAL A 70 -12.579 6.435 5.066 1.00 0.29 H new ATOM 1761 N ASP A 71 -8.714 9.579 6.238 1.00 0.36 N ATOM 1762 CA ASP A 71 -7.560 10.438 6.037 1.00 0.40 C ATOM 1763 C ASP A 71 -6.601 9.777 5.058 1.00 0.32 C ATOM 1764 O ASP A 71 -6.660 8.564 4.850 1.00 0.29 O ATOM 1765 CB ASP A 71 -6.864 10.696 7.381 1.00 0.49 C ATOM 1766 CG ASP A 71 -5.616 11.549 7.253 1.00 0.61 C ATOM 1767 OD1 ASP A 71 -5.728 12.793 7.327 1.00 1.32 O ATOM 1768 OD2 ASP A 71 -4.514 10.981 7.087 1.00 1.22 O ATOM 0 H ASP A 71 -8.804 9.220 7.189 1.00 0.36 H new ATOM 0 HA ASP A 71 -7.882 11.394 5.624 1.00 0.40 H new ATOM 0 HB2 ASP A 71 -7.564 11.187 8.057 1.00 0.49 H new ATOM 0 HB3 ASP A 71 -6.599 9.741 7.835 1.00 0.49 H new ATOM 1773 N PHE A 72 -5.727 10.575 4.465 1.00 0.36 N ATOM 1774 CA PHE A 72 -4.770 10.096 3.475 1.00 0.36 C ATOM 1775 C PHE A 72 -4.080 8.801 3.904 1.00 0.30 C ATOM 1776 O PHE A 72 -4.002 7.835 3.143 1.00 0.39 O ATOM 1777 CB PHE A 72 -3.709 11.162 3.225 1.00 0.51 C ATOM 1778 CG PHE A 72 -2.687 10.689 2.259 1.00 0.58 C ATOM 1779 CD1 PHE A 72 -3.060 10.398 0.969 1.00 1.26 C ATOM 1780 CD2 PHE A 72 -1.375 10.487 2.640 1.00 1.38 C ATOM 1781 CE1 PHE A 72 -2.156 9.914 0.062 1.00 1.29 C ATOM 1782 CE2 PHE A 72 -0.460 10.015 1.739 1.00 1.46 C ATOM 1783 CZ PHE A 72 -0.846 9.722 0.445 1.00 0.78 C ATOM 0 H PHE A 72 -5.660 11.575 4.656 1.00 0.36 H new ATOM 0 HA PHE A 72 -5.332 9.889 2.564 1.00 0.36 H new ATOM 0 HB2 PHE A 72 -4.182 12.067 2.843 1.00 0.51 H new ATOM 0 HB3 PHE A 72 -3.228 11.427 4.166 1.00 0.51 H new ATOM 0 HD1 PHE A 72 -4.085 10.554 0.665 1.00 1.26 H new ATOM 0 HD2 PHE A 72 -1.070 10.703 3.653 1.00 1.38 H new ATOM 0 HE1 PHE A 72 -2.467 9.684 -0.946 1.00 1.29 H new ATOM 0 HE2 PHE A 72 0.567 9.871 2.040 1.00 1.46 H new ATOM 0 HZ PHE A 72 -0.124 9.344 -0.264 1.00 0.78 H new ATOM 1793 N GLN A 73 -3.603 8.786 5.133 1.00 0.30 N ATOM 1794 CA GLN A 73 -2.783 7.693 5.628 1.00 0.41 C ATOM 1795 C GLN A 73 -3.617 6.437 5.826 1.00 0.38 C ATOM 1796 O GLN A 73 -3.110 5.317 5.720 1.00 0.44 O ATOM 1797 CB GLN A 73 -2.119 8.084 6.948 1.00 0.61 C ATOM 1798 CG GLN A 73 -1.416 9.435 6.905 1.00 0.85 C ATOM 1799 CD GLN A 73 -0.635 9.720 8.172 1.00 0.83 C ATOM 1800 OE1 GLN A 73 -0.077 8.678 8.767 1.00 1.20 O flip ATOM 1801 NE2 GLN A 73 -0.520 10.869 8.602 1.00 1.48 N flip ATOM 0 H GLN A 73 -3.770 9.526 5.815 1.00 0.30 H new ATOM 0 HA GLN A 73 -2.012 7.486 4.886 1.00 0.41 H new ATOM 0 HB2 GLN A 73 -2.875 8.103 7.733 1.00 0.61 H new ATOM 0 HB3 GLN A 73 -1.395 7.316 7.221 1.00 0.61 H new ATOM 0 HG2 GLN A 73 -0.740 9.463 6.051 1.00 0.85 H new ATOM 0 HG3 GLN A 73 -2.155 10.221 6.752 1.00 0.85 H new ATOM 0 HE21 GLN A 73 -0.967 11.644 8.112 1.00 1.48 H new ATOM 0 HE22 GLN A 73 0.022 11.045 9.448 1.00 1.48 H new ATOM 1810 N GLU A 74 -4.905 6.626 6.076 1.00 0.34 N ATOM 1811 CA GLU A 74 -5.791 5.513 6.361 1.00 0.37 C ATOM 1812 C GLU A 74 -6.116 4.791 5.060 1.00 0.32 C ATOM 1813 O GLU A 74 -6.595 3.658 5.052 1.00 0.36 O ATOM 1814 CB GLU A 74 -7.083 6.011 7.017 1.00 0.44 C ATOM 1815 CG GLU A 74 -6.903 7.209 7.940 1.00 0.52 C ATOM 1816 CD GLU A 74 -6.054 6.927 9.160 1.00 0.58 C ATOM 1817 OE1 GLU A 74 -4.818 7.096 9.081 1.00 1.29 O ATOM 1818 OE2 GLU A 74 -6.621 6.574 10.212 1.00 1.16 O ATOM 0 H GLU A 74 -5.357 7.540 6.087 1.00 0.34 H new ATOM 0 HA GLU A 74 -5.297 4.828 7.051 1.00 0.37 H new ATOM 0 HB2 GLU A 74 -7.794 6.275 6.234 1.00 0.44 H new ATOM 0 HB3 GLU A 74 -7.525 5.193 7.586 1.00 0.44 H new ATOM 0 HG2 GLU A 74 -6.450 8.024 7.376 1.00 0.52 H new ATOM 0 HG3 GLU A 74 -7.884 7.554 8.265 1.00 0.52 H new ATOM 1825 N TYR A 75 -5.832 5.461 3.954 1.00 0.26 N ATOM 1826 CA TYR A 75 -6.123 4.922 2.636 1.00 0.25 C ATOM 1827 C TYR A 75 -4.971 4.051 2.126 1.00 0.24 C ATOM 1828 O TYR A 75 -5.188 3.055 1.436 1.00 0.28 O ATOM 1829 CB TYR A 75 -6.408 6.067 1.665 1.00 0.25 C ATOM 1830 CG TYR A 75 -6.733 5.615 0.261 1.00 0.26 C ATOM 1831 CD1 TYR A 75 -5.721 5.254 -0.616 1.00 1.17 C ATOM 1832 CD2 TYR A 75 -8.047 5.546 -0.182 1.00 1.27 C ATOM 1833 CE1 TYR A 75 -5.999 4.836 -1.896 1.00 1.17 C ATOM 1834 CE2 TYR A 75 -8.336 5.124 -1.469 1.00 1.30 C ATOM 1835 CZ TYR A 75 -7.305 4.771 -2.320 1.00 0.38 C ATOM 1836 OH TYR A 75 -7.578 4.350 -3.597 1.00 0.47 O ATOM 0 H TYR A 75 -5.398 6.384 3.944 1.00 0.26 H new ATOM 0 HA TYR A 75 -7.006 4.286 2.707 1.00 0.25 H new ATOM 0 HB2 TYR A 75 -7.241 6.656 2.048 1.00 0.25 H new ATOM 0 HB3 TYR A 75 -5.541 6.726 1.632 1.00 0.25 H new ATOM 0 HD1 TYR A 75 -4.694 5.302 -0.287 1.00 1.17 H new ATOM 0 HD2 TYR A 75 -8.851 5.824 0.483 1.00 1.27 H new ATOM 0 HE1 TYR A 75 -5.196 4.560 -2.564 1.00 1.17 H new ATOM 0 HE2 TYR A 75 -9.361 5.071 -1.806 1.00 1.30 H new ATOM 0 HH TYR A 75 -7.383 3.393 -3.674 1.00 0.47 H new ATOM 1846 N CYS A 76 -3.747 4.421 2.459 1.00 0.22 N ATOM 1847 CA CYS A 76 -2.582 3.656 2.021 1.00 0.21 C ATOM 1848 C CYS A 76 -2.564 2.281 2.660 1.00 0.15 C ATOM 1849 O CYS A 76 -2.190 1.290 2.024 1.00 0.17 O ATOM 1850 CB CYS A 76 -1.305 4.426 2.336 1.00 0.27 C ATOM 1851 SG CYS A 76 -1.242 6.050 1.551 1.00 1.65 S ATOM 0 H CYS A 76 -3.530 5.240 3.027 1.00 0.22 H new ATOM 0 HA CYS A 76 -2.643 3.514 0.942 1.00 0.21 H new ATOM 0 HB2 CYS A 76 -1.219 4.548 3.416 1.00 0.27 H new ATOM 0 HB3 CYS A 76 -0.445 3.839 2.012 1.00 0.27 H new ATOM 0 HG CYS A 76 -2.214 6.787 2.000 1.00 1.65 H new ATOM 1857 N VAL A 77 -2.992 2.220 3.903 1.00 0.16 N ATOM 1858 CA VAL A 77 -3.076 0.958 4.609 1.00 0.17 C ATOM 1859 C VAL A 77 -4.278 0.166 4.133 1.00 0.17 C ATOM 1860 O VAL A 77 -4.269 -1.058 4.175 1.00 0.19 O ATOM 1861 CB VAL A 77 -3.132 1.181 6.121 1.00 0.20 C ATOM 1862 CG1 VAL A 77 -1.869 1.889 6.556 1.00 0.23 C ATOM 1863 CG2 VAL A 77 -4.361 1.984 6.519 1.00 0.19 C ATOM 0 H VAL A 77 -3.288 3.031 4.447 1.00 0.16 H new ATOM 0 HA VAL A 77 -2.177 0.382 4.391 1.00 0.17 H new ATOM 0 HB VAL A 77 -3.205 0.215 6.620 1.00 0.20 H new ATOM 0 HG11 VAL A 77 -1.897 2.054 7.633 1.00 0.23 H new ATOM 0 HG12 VAL A 77 -1.003 1.276 6.305 1.00 0.23 H new ATOM 0 HG13 VAL A 77 -1.795 2.848 6.044 1.00 0.23 H new ATOM 0 HG21 VAL A 77 -4.370 2.124 7.600 1.00 0.19 H new ATOM 0 HG22 VAL A 77 -4.335 2.956 6.027 1.00 0.19 H new ATOM 0 HG23 VAL A 77 -5.260 1.448 6.215 1.00 0.19 H new ATOM 1873 N PHE A 78 -5.295 0.880 3.662 1.00 0.20 N ATOM 1874 CA PHE A 78 -6.415 0.261 2.982 1.00 0.22 C ATOM 1875 C PHE A 78 -5.882 -0.636 1.882 1.00 0.19 C ATOM 1876 O PHE A 78 -6.046 -1.846 1.936 1.00 0.18 O ATOM 1877 CB PHE A 78 -7.332 1.361 2.425 1.00 0.30 C ATOM 1878 CG PHE A 78 -8.236 0.969 1.287 1.00 0.22 C ATOM 1879 CD1 PHE A 78 -9.232 0.022 1.444 1.00 1.21 C ATOM 1880 CD2 PHE A 78 -8.097 1.588 0.055 1.00 1.19 C ATOM 1881 CE1 PHE A 78 -10.069 -0.305 0.394 1.00 1.20 C ATOM 1882 CE2 PHE A 78 -8.930 1.271 -0.996 1.00 1.21 C ATOM 1883 CZ PHE A 78 -9.919 0.323 -0.829 1.00 0.22 C ATOM 0 H PHE A 78 -5.362 1.895 3.742 1.00 0.20 H new ATOM 0 HA PHE A 78 -7.000 -0.351 3.668 1.00 0.22 H new ATOM 0 HB2 PHE A 78 -7.952 1.734 3.240 1.00 0.30 H new ATOM 0 HB3 PHE A 78 -6.707 2.191 2.094 1.00 0.30 H new ATOM 0 HD1 PHE A 78 -9.357 -0.468 2.398 1.00 1.21 H new ATOM 0 HD2 PHE A 78 -7.324 2.330 -0.084 1.00 1.19 H new ATOM 0 HE1 PHE A 78 -10.839 -1.050 0.528 1.00 1.20 H new ATOM 0 HE2 PHE A 78 -8.809 1.764 -1.949 1.00 1.21 H new ATOM 0 HZ PHE A 78 -10.574 0.072 -1.651 1.00 0.22 H new ATOM 1893 N LEU A 79 -5.165 -0.040 0.944 1.00 0.20 N ATOM 1894 CA LEU A 79 -4.677 -0.757 -0.222 1.00 0.19 C ATOM 1895 C LEU A 79 -3.638 -1.805 0.108 1.00 0.16 C ATOM 1896 O LEU A 79 -3.773 -2.953 -0.282 1.00 0.18 O ATOM 1897 CB LEU A 79 -4.117 0.213 -1.243 1.00 0.22 C ATOM 1898 CG LEU A 79 -5.194 0.878 -2.078 1.00 0.15 C ATOM 1899 CD1 LEU A 79 -4.581 1.666 -3.218 1.00 0.16 C ATOM 1900 CD2 LEU A 79 -6.153 -0.187 -2.580 1.00 0.16 C ATOM 0 H LEU A 79 -4.906 0.946 0.968 1.00 0.20 H new ATOM 0 HA LEU A 79 -5.537 -1.283 -0.636 1.00 0.19 H new ATOM 0 HB2 LEU A 79 -3.538 0.980 -0.729 1.00 0.22 H new ATOM 0 HB3 LEU A 79 -3.429 -0.317 -1.902 1.00 0.22 H new ATOM 0 HG LEU A 79 -5.749 1.590 -1.467 1.00 0.15 H new ATOM 0 HD11 LEU A 79 -5.372 2.134 -3.803 1.00 0.16 H new ATOM 0 HD12 LEU A 79 -3.923 2.436 -2.815 1.00 0.16 H new ATOM 0 HD13 LEU A 79 -4.006 0.995 -3.856 1.00 0.16 H new ATOM 0 HD21 LEU A 79 -6.932 0.280 -3.182 1.00 0.16 H new ATOM 0 HD22 LEU A 79 -5.609 -0.909 -3.188 1.00 0.16 H new ATOM 0 HD23 LEU A 79 -6.607 -0.697 -1.731 1.00 0.16 H new ATOM 1912 N SER A 80 -2.610 -1.422 0.819 1.00 0.15 N ATOM 1913 CA SER A 80 -1.513 -2.334 1.075 1.00 0.15 C ATOM 1914 C SER A 80 -1.999 -3.577 1.815 1.00 0.15 C ATOM 1915 O SER A 80 -1.462 -4.669 1.651 1.00 0.18 O ATOM 1916 CB SER A 80 -0.437 -1.610 1.850 1.00 0.17 C ATOM 1917 OG SER A 80 -0.071 -0.419 1.178 1.00 0.23 O ATOM 0 H SER A 80 -2.504 -0.495 1.230 1.00 0.15 H new ATOM 0 HA SER A 80 -1.094 -2.673 0.128 1.00 0.15 H new ATOM 0 HB2 SER A 80 -0.795 -1.376 2.852 1.00 0.17 H new ATOM 0 HB3 SER A 80 0.435 -2.254 1.965 1.00 0.17 H new ATOM 0 HG SER A 80 0.663 -0.607 0.556 1.00 0.23 H new ATOM 1923 N CYS A 81 -3.045 -3.410 2.598 1.00 0.14 N ATOM 1924 CA CYS A 81 -3.650 -4.527 3.286 1.00 0.15 C ATOM 1925 C CYS A 81 -4.549 -5.331 2.354 1.00 0.14 C ATOM 1926 O CYS A 81 -4.885 -6.479 2.643 1.00 0.16 O ATOM 1927 CB CYS A 81 -4.403 -4.036 4.510 1.00 0.17 C ATOM 1928 SG CYS A 81 -3.300 -3.484 5.824 1.00 0.22 S ATOM 0 H CYS A 81 -3.493 -2.510 2.773 1.00 0.14 H new ATOM 0 HA CYS A 81 -2.861 -5.201 3.619 1.00 0.15 H new ATOM 0 HB2 CYS A 81 -5.060 -3.215 4.223 1.00 0.17 H new ATOM 0 HB3 CYS A 81 -5.039 -4.837 4.887 1.00 0.17 H new ATOM 0 HG CYS A 81 -2.485 -2.586 5.357 1.00 0.22 H new ATOM 1934 N ILE A 82 -4.921 -4.741 1.221 1.00 0.13 N ATOM 1935 CA ILE A 82 -5.701 -5.468 0.234 1.00 0.14 C ATOM 1936 C ILE A 82 -4.775 -6.329 -0.614 1.00 0.17 C ATOM 1937 O ILE A 82 -5.235 -7.238 -1.271 1.00 0.21 O ATOM 1938 CB ILE A 82 -6.552 -4.568 -0.696 1.00 0.15 C ATOM 1939 CG1 ILE A 82 -7.296 -3.508 0.093 1.00 0.15 C ATOM 1940 CG2 ILE A 82 -7.575 -5.406 -1.449 1.00 0.16 C ATOM 1941 CD1 ILE A 82 -8.151 -2.619 -0.776 1.00 0.18 C ATOM 0 H ILE A 82 -4.698 -3.778 0.970 1.00 0.13 H new ATOM 0 HA ILE A 82 -6.405 -6.078 0.799 1.00 0.14 H new ATOM 0 HB ILE A 82 -5.868 -4.085 -1.394 1.00 0.15 H new ATOM 0 HG12 ILE A 82 -7.926 -3.993 0.838 1.00 0.15 H new ATOM 0 HG13 ILE A 82 -6.576 -2.894 0.635 1.00 0.15 H new ATOM 0 HG21 ILE A 82 -8.166 -4.761 -2.099 1.00 0.16 H new ATOM 0 HG22 ILE A 82 -7.060 -6.154 -2.052 1.00 0.16 H new ATOM 0 HG23 ILE A 82 -8.233 -5.904 -0.737 1.00 0.16 H new ATOM 0 HD11 ILE A 82 -8.658 -1.881 -0.154 1.00 0.18 H new ATOM 0 HD12 ILE A 82 -7.521 -2.108 -1.505 1.00 0.18 H new ATOM 0 HD13 ILE A 82 -8.892 -3.224 -1.298 1.00 0.18 H new ATOM 1953 N ALA A 83 -3.471 -6.035 -0.637 1.00 0.18 N ATOM 1954 CA ALA A 83 -2.518 -7.003 -1.168 1.00 0.23 C ATOM 1955 C ALA A 83 -2.595 -8.290 -0.379 1.00 0.20 C ATOM 1956 O ALA A 83 -2.833 -9.365 -0.929 1.00 0.21 O ATOM 1957 CB ALA A 83 -1.115 -6.479 -1.084 1.00 0.30 C ATOM 0 H ALA A 83 -3.064 -5.161 -0.304 1.00 0.18 H new ATOM 0 HA ALA A 83 -2.774 -7.182 -2.212 1.00 0.23 H new ATOM 0 HB1 ALA A 83 -0.425 -7.221 -1.487 1.00 0.30 H new ATOM 0 HB2 ALA A 83 -1.035 -5.558 -1.662 1.00 0.30 H new ATOM 0 HB3 ALA A 83 -0.864 -6.277 -0.043 1.00 0.30 H new ATOM 1963 N MET A 84 -2.385 -8.158 0.926 1.00 0.22 N ATOM 1964 CA MET A 84 -2.483 -9.291 1.835 1.00 0.25 C ATOM 1965 C MET A 84 -3.832 -9.968 1.679 1.00 0.24 C ATOM 1966 O MET A 84 -3.932 -11.193 1.667 1.00 0.28 O ATOM 1967 CB MET A 84 -2.291 -8.841 3.282 1.00 0.30 C ATOM 1968 CG MET A 84 -0.887 -8.353 3.583 1.00 0.34 C ATOM 1969 SD MET A 84 -0.693 -7.836 5.294 1.00 0.36 S ATOM 1970 CE MET A 84 -1.784 -6.419 5.341 1.00 0.20 C ATOM 0 H MET A 84 -2.145 -7.275 1.378 1.00 0.22 H new ATOM 0 HA MET A 84 -1.694 -10.001 1.586 1.00 0.25 H new ATOM 0 HB2 MET A 84 -3.000 -8.043 3.503 1.00 0.30 H new ATOM 0 HB3 MET A 84 -2.529 -9.671 3.947 1.00 0.30 H new ATOM 0 HG2 MET A 84 -0.174 -9.148 3.363 1.00 0.34 H new ATOM 0 HG3 MET A 84 -0.646 -7.518 2.925 1.00 0.34 H new ATOM 0 HE1 MET A 84 -1.829 -6.028 6.357 1.00 0.20 H new ATOM 0 HE2 MET A 84 -1.406 -5.647 4.671 1.00 0.20 H new ATOM 0 HE3 MET A 84 -2.783 -6.718 5.023 1.00 0.20 H new ATOM 1980 N MET A 85 -4.863 -9.155 1.528 1.00 0.25 N ATOM 1981 CA MET A 85 -6.209 -9.653 1.340 1.00 0.36 C ATOM 1982 C MET A 85 -6.378 -10.295 -0.048 1.00 0.33 C ATOM 1983 O MET A 85 -7.038 -11.327 -0.186 1.00 0.43 O ATOM 1984 CB MET A 85 -7.214 -8.517 1.533 1.00 0.62 C ATOM 1985 CG MET A 85 -8.648 -8.977 1.382 1.00 0.77 C ATOM 1986 SD MET A 85 -9.374 -8.424 -0.167 1.00 0.67 S ATOM 1987 CE MET A 85 -10.051 -6.853 0.352 1.00 0.30 C ATOM 0 H MET A 85 -4.789 -8.138 1.533 1.00 0.25 H new ATOM 0 HA MET A 85 -6.397 -10.426 2.085 1.00 0.36 H new ATOM 0 HB2 MET A 85 -7.078 -8.081 2.523 1.00 0.62 H new ATOM 0 HB3 MET A 85 -7.011 -7.730 0.807 1.00 0.62 H new ATOM 0 HG2 MET A 85 -8.687 -10.065 1.432 1.00 0.77 H new ATOM 0 HG3 MET A 85 -9.240 -8.598 2.215 1.00 0.77 H new ATOM 0 HE1 MET A 85 -10.511 -6.355 -0.502 1.00 0.30 H new ATOM 0 HE2 MET A 85 -10.803 -7.018 1.124 1.00 0.30 H new ATOM 0 HE3 MET A 85 -9.253 -6.227 0.751 1.00 0.30 H new ATOM 1997 N CYS A 86 -5.764 -9.693 -1.067 1.00 0.32 N ATOM 1998 CA CYS A 86 -5.811 -10.207 -2.435 1.00 0.43 C ATOM 1999 C CYS A 86 -5.158 -11.580 -2.530 1.00 0.43 C ATOM 2000 O CYS A 86 -5.358 -12.299 -3.503 1.00 0.58 O ATOM 2001 CB CYS A 86 -5.120 -9.237 -3.402 1.00 0.49 C ATOM 2002 SG CYS A 86 -5.190 -9.731 -5.141 1.00 0.57 S ATOM 0 H CYS A 86 -5.220 -8.836 -0.967 1.00 0.32 H new ATOM 0 HA CYS A 86 -6.860 -10.302 -2.715 1.00 0.43 H new ATOM 0 HB2 CYS A 86 -5.578 -8.253 -3.298 1.00 0.49 H new ATOM 0 HB3 CYS A 86 -4.075 -9.135 -3.109 1.00 0.49 H new ATOM 0 HG CYS A 86 -5.268 -11.026 -5.221 1.00 0.57 H new ATOM 2008 N ASN A 87 -4.371 -11.934 -1.522 1.00 0.36 N ATOM 2009 CA ASN A 87 -3.757 -13.256 -1.453 1.00 0.44 C ATOM 2010 C ASN A 87 -4.841 -14.341 -1.419 1.00 0.47 C ATOM 2011 O ASN A 87 -4.612 -15.484 -1.814 1.00 0.54 O ATOM 2012 CB ASN A 87 -2.860 -13.347 -0.217 1.00 0.54 C ATOM 2013 CG ASN A 87 -2.119 -14.667 -0.102 1.00 0.72 C ATOM 2014 OD1 ASN A 87 -1.793 -15.308 -1.103 1.00 1.43 O ATOM 2015 ND2 ASN A 87 -1.846 -15.076 1.128 1.00 1.23 N ATOM 0 H ASN A 87 -4.142 -11.323 -0.738 1.00 0.36 H new ATOM 0 HA ASN A 87 -3.144 -13.414 -2.340 1.00 0.44 H new ATOM 0 HB2 ASN A 87 -2.135 -12.534 -0.243 1.00 0.54 H new ATOM 0 HB3 ASN A 87 -3.469 -13.202 0.675 1.00 0.54 H new ATOM 0 HD21 ASN A 87 -1.347 -15.953 1.275 1.00 1.23 H new ATOM 0 HD22 ASN A 87 -2.135 -14.513 1.928 1.00 1.23 H new ATOM 2022 N GLU A 88 -6.031 -13.964 -0.961 1.00 0.56 N ATOM 2023 CA GLU A 88 -7.183 -14.857 -0.995 1.00 0.70 C ATOM 2024 C GLU A 88 -7.637 -15.068 -2.438 1.00 0.73 C ATOM 2025 O GLU A 88 -7.979 -16.180 -2.846 1.00 0.82 O ATOM 2026 CB GLU A 88 -8.325 -14.276 -0.155 1.00 0.96 C ATOM 2027 CG GLU A 88 -9.573 -15.140 -0.129 1.00 1.81 C ATOM 2028 CD GLU A 88 -10.635 -14.601 0.803 1.00 2.18 C ATOM 2029 OE1 GLU A 88 -10.463 -14.723 2.037 1.00 2.60 O ATOM 2030 OE2 GLU A 88 -11.647 -14.058 0.314 1.00 2.78 O ATOM 0 H GLU A 88 -6.222 -13.045 -0.562 1.00 0.56 H new ATOM 0 HA GLU A 88 -6.898 -15.821 -0.574 1.00 0.70 H new ATOM 0 HB2 GLU A 88 -7.974 -14.132 0.867 1.00 0.96 H new ATOM 0 HB3 GLU A 88 -8.585 -13.292 -0.545 1.00 0.96 H new ATOM 0 HG2 GLU A 88 -9.982 -15.211 -1.137 1.00 1.81 H new ATOM 0 HG3 GLU A 88 -9.304 -16.151 0.178 1.00 1.81 H new ATOM 2285 N ALA B 2 -3.512 -0.371 -17.714 1.00 0.34 N ATOM 2286 CA ALA B 2 -4.230 -1.402 -16.997 1.00 0.30 C ATOM 2287 C ALA B 2 -5.126 -0.731 -15.971 1.00 0.27 C ATOM 2288 O ALA B 2 -5.023 0.480 -15.780 1.00 0.36 O ATOM 2289 CB ALA B 2 -3.247 -2.351 -16.323 1.00 0.30 C ATOM 0 HA ALA B 2 -4.839 -1.989 -17.684 1.00 0.30 H new ATOM 0 HB1 ALA B 2 -3.797 -3.124 -15.786 1.00 0.30 H new ATOM 0 HB2 ALA B 2 -2.614 -2.816 -17.079 1.00 0.30 H new ATOM 0 HB3 ALA B 2 -2.626 -1.794 -15.622 1.00 0.30 H new ATOM 2295 N CYS B 3 -6.008 -1.487 -15.332 1.00 0.25 N ATOM 2296 CA CYS B 3 -6.820 -0.950 -14.251 1.00 0.23 C ATOM 2297 C CYS B 3 -5.907 -0.554 -13.100 1.00 0.17 C ATOM 2298 O CYS B 3 -5.376 -1.410 -12.395 1.00 0.17 O ATOM 2299 CB CYS B 3 -7.864 -1.970 -13.798 1.00 0.28 C ATOM 2300 SG CYS B 3 -9.016 -2.458 -15.102 1.00 0.39 S ATOM 0 H CYS B 3 -6.179 -2.470 -15.543 1.00 0.25 H new ATOM 0 HA CYS B 3 -7.359 -0.070 -14.602 1.00 0.23 H new ATOM 0 HB2 CYS B 3 -7.354 -2.858 -13.425 1.00 0.28 H new ATOM 0 HB3 CYS B 3 -8.428 -1.553 -12.964 1.00 0.28 H new ATOM 0 HG CYS B 3 -9.863 -3.325 -14.631 1.00 0.39 H new ATOM 2306 N PRO B 4 -5.709 0.755 -12.919 1.00 0.16 N ATOM 2307 CA PRO B 4 -4.673 1.300 -12.034 1.00 0.13 C ATOM 2308 C PRO B 4 -4.745 0.771 -10.609 1.00 0.12 C ATOM 2309 O PRO B 4 -3.820 0.105 -10.139 1.00 0.12 O ATOM 2310 CB PRO B 4 -4.966 2.799 -12.063 1.00 0.17 C ATOM 2311 CG PRO B 4 -5.611 3.021 -13.378 1.00 0.20 C ATOM 2312 CD PRO B 4 -6.489 1.827 -13.566 1.00 0.20 C ATOM 0 HA PRO B 4 -3.673 1.022 -12.367 1.00 0.13 H new ATOM 0 HB2 PRO B 4 -5.622 3.092 -11.244 1.00 0.17 H new ATOM 0 HB3 PRO B 4 -4.052 3.385 -11.964 1.00 0.17 H new ATOM 0 HG2 PRO B 4 -6.189 3.945 -13.386 1.00 0.20 H new ATOM 0 HG3 PRO B 4 -4.872 3.100 -14.175 1.00 0.20 H new ATOM 0 HD2 PRO B 4 -7.463 1.961 -13.096 1.00 0.20 H new ATOM 0 HD3 PRO B 4 -6.670 1.618 -14.620 1.00 0.20 H new ATOM 2320 N LEU B 5 -5.848 1.042 -9.932 1.00 0.13 N ATOM 2321 CA LEU B 5 -6.003 0.638 -8.547 1.00 0.14 C ATOM 2322 C LEU B 5 -6.063 -0.884 -8.435 1.00 0.16 C ATOM 2323 O LEU B 5 -5.575 -1.457 -7.465 1.00 0.22 O ATOM 2324 CB LEU B 5 -7.256 1.281 -7.951 1.00 0.15 C ATOM 2325 CG LEU B 5 -7.106 1.853 -6.541 1.00 0.16 C ATOM 2326 CD1 LEU B 5 -6.915 0.742 -5.542 1.00 0.18 C ATOM 2327 CD2 LEU B 5 -5.944 2.831 -6.471 1.00 0.17 C ATOM 0 H LEU B 5 -6.649 1.540 -10.320 1.00 0.13 H new ATOM 0 HA LEU B 5 -5.137 0.981 -7.981 1.00 0.14 H new ATOM 0 HB2 LEU B 5 -7.581 2.082 -8.615 1.00 0.15 H new ATOM 0 HB3 LEU B 5 -8.052 0.536 -7.937 1.00 0.15 H new ATOM 0 HG LEU B 5 -8.020 2.393 -6.295 1.00 0.16 H new ATOM 0 HD11 LEU B 5 -6.810 1.165 -4.543 1.00 0.18 H new ATOM 0 HD12 LEU B 5 -7.780 0.079 -5.566 1.00 0.18 H new ATOM 0 HD13 LEU B 5 -6.017 0.177 -5.793 1.00 0.18 H new ATOM 0 HD21 LEU B 5 -5.859 3.223 -5.458 1.00 0.17 H new ATOM 0 HD22 LEU B 5 -5.020 2.319 -6.740 1.00 0.17 H new ATOM 0 HD23 LEU B 5 -6.118 3.653 -7.165 1.00 0.17 H new ATOM 2339 N GLU B 6 -6.641 -1.536 -9.442 1.00 0.16 N ATOM 2340 CA GLU B 6 -6.687 -2.994 -9.473 1.00 0.20 C ATOM 2341 C GLU B 6 -5.273 -3.567 -9.484 1.00 0.18 C ATOM 2342 O GLU B 6 -4.954 -4.482 -8.721 1.00 0.23 O ATOM 2343 CB GLU B 6 -7.454 -3.495 -10.699 1.00 0.29 C ATOM 2344 CG GLU B 6 -7.553 -5.010 -10.769 1.00 0.43 C ATOM 2345 CD GLU B 6 -8.285 -5.495 -12.000 1.00 0.90 C ATOM 2346 OE1 GLU B 6 -7.666 -5.551 -13.084 1.00 1.79 O ATOM 2347 OE2 GLU B 6 -9.480 -5.831 -11.896 1.00 1.39 O ATOM 0 H GLU B 6 -7.081 -1.080 -10.242 1.00 0.16 H new ATOM 0 HA GLU B 6 -7.208 -3.331 -8.577 1.00 0.20 H new ATOM 0 HB2 GLU B 6 -8.459 -3.072 -10.688 1.00 0.29 H new ATOM 0 HB3 GLU B 6 -6.964 -3.128 -11.601 1.00 0.29 H new ATOM 0 HG2 GLU B 6 -6.550 -5.436 -10.758 1.00 0.43 H new ATOM 0 HG3 GLU B 6 -8.065 -5.377 -9.880 1.00 0.43 H new ATOM 2354 N LYS B 7 -4.429 -3.014 -10.354 1.00 0.16 N ATOM 2355 CA LYS B 7 -3.042 -3.435 -10.448 1.00 0.18 C ATOM 2356 C LYS B 7 -2.332 -3.267 -9.114 1.00 0.17 C ATOM 2357 O LYS B 7 -1.569 -4.130 -8.721 1.00 0.19 O ATOM 2358 CB LYS B 7 -2.303 -2.649 -11.543 1.00 0.25 C ATOM 2359 CG LYS B 7 -2.596 -3.118 -12.963 1.00 0.41 C ATOM 2360 CD LYS B 7 -1.818 -4.380 -13.326 1.00 0.90 C ATOM 2361 CE LYS B 7 -2.416 -5.635 -12.705 1.00 0.84 C ATOM 2362 NZ LYS B 7 -3.668 -6.062 -13.387 1.00 1.18 N ATOM 0 H LYS B 7 -4.688 -2.271 -11.004 1.00 0.16 H new ATOM 0 HA LYS B 7 -3.034 -4.492 -10.714 1.00 0.18 H new ATOM 0 HB2 LYS B 7 -2.570 -1.595 -11.459 1.00 0.25 H new ATOM 0 HB3 LYS B 7 -1.230 -2.722 -11.364 1.00 0.25 H new ATOM 0 HG2 LYS B 7 -3.664 -3.309 -13.067 1.00 0.41 H new ATOM 0 HG3 LYS B 7 -2.344 -2.323 -13.665 1.00 0.41 H new ATOM 0 HD2 LYS B 7 -1.797 -4.490 -14.410 1.00 0.90 H new ATOM 0 HD3 LYS B 7 -0.785 -4.273 -12.996 1.00 0.90 H new ATOM 0 HE2 LYS B 7 -1.686 -6.443 -12.751 1.00 0.84 H new ATOM 0 HE3 LYS B 7 -2.624 -5.452 -11.651 1.00 0.84 H new ATOM 0 HZ1 LYS B 7 -3.992 -6.965 -12.985 1.00 1.18 H new ATOM 0 HZ2 LYS B 7 -4.402 -5.339 -13.249 1.00 1.18 H new ATOM 0 HZ3 LYS B 7 -3.486 -6.181 -14.404 1.00 1.18 H new ATOM 2376 N ALA B 8 -2.617 -2.175 -8.416 1.00 0.17 N ATOM 2377 CA ALA B 8 -1.971 -1.880 -7.135 1.00 0.17 C ATOM 2378 C ALA B 8 -1.939 -3.094 -6.201 1.00 0.17 C ATOM 2379 O ALA B 8 -0.883 -3.442 -5.680 1.00 0.22 O ATOM 2380 CB ALA B 8 -2.659 -0.712 -6.448 1.00 0.18 C ATOM 0 H ALA B 8 -3.294 -1.473 -8.714 1.00 0.17 H new ATOM 0 HA ALA B 8 -0.938 -1.613 -7.357 1.00 0.17 H new ATOM 0 HB1 ALA B 8 -2.166 -0.507 -5.498 1.00 0.18 H new ATOM 0 HB2 ALA B 8 -2.601 0.171 -7.085 1.00 0.18 H new ATOM 0 HB3 ALA B 8 -3.705 -0.961 -6.268 1.00 0.18 H new ATOM 2386 N LEU B 9 -3.083 -3.742 -5.999 1.00 0.13 N ATOM 2387 CA LEU B 9 -3.138 -4.903 -5.106 1.00 0.12 C ATOM 2388 C LEU B 9 -2.638 -6.147 -5.824 1.00 0.14 C ATOM 2389 O LEU B 9 -1.927 -6.970 -5.244 1.00 0.18 O ATOM 2390 CB LEU B 9 -4.558 -5.157 -4.569 1.00 0.13 C ATOM 2391 CG LEU B 9 -5.243 -3.965 -3.892 1.00 0.13 C ATOM 2392 CD1 LEU B 9 -4.254 -3.194 -3.047 1.00 0.15 C ATOM 2393 CD2 LEU B 9 -5.898 -3.047 -4.906 1.00 0.13 C ATOM 0 H LEU B 9 -3.972 -3.491 -6.432 1.00 0.13 H new ATOM 0 HA LEU B 9 -2.493 -4.682 -4.256 1.00 0.12 H new ATOM 0 HB2 LEU B 9 -5.184 -5.488 -5.397 1.00 0.13 H new ATOM 0 HB3 LEU B 9 -4.513 -5.979 -3.854 1.00 0.13 H new ATOM 0 HG LEU B 9 -6.027 -4.360 -3.246 1.00 0.13 H new ATOM 0 HD11 LEU B 9 -4.759 -2.351 -2.574 1.00 0.15 H new ATOM 0 HD12 LEU B 9 -3.844 -3.849 -2.278 1.00 0.15 H new ATOM 0 HD13 LEU B 9 -3.446 -2.825 -3.678 1.00 0.15 H new ATOM 0 HD21 LEU B 9 -6.373 -2.214 -4.389 1.00 0.13 H new ATOM 0 HD22 LEU B 9 -5.142 -2.665 -5.592 1.00 0.13 H new ATOM 0 HD23 LEU B 9 -6.650 -3.602 -5.467 1.00 0.13 H new ATOM 2405 N ASP B 10 -3.006 -6.261 -7.093 1.00 0.14 N ATOM 2406 CA ASP B 10 -2.623 -7.400 -7.921 1.00 0.16 C ATOM 2407 C ASP B 10 -1.106 -7.550 -7.988 1.00 0.15 C ATOM 2408 O ASP B 10 -0.569 -8.644 -7.813 1.00 0.19 O ATOM 2409 CB ASP B 10 -3.192 -7.225 -9.332 1.00 0.20 C ATOM 2410 CG ASP B 10 -2.714 -8.288 -10.304 1.00 0.51 C ATOM 2411 OD1 ASP B 10 -1.665 -8.086 -10.944 1.00 1.22 O ATOM 2412 OD2 ASP B 10 -3.402 -9.317 -10.456 1.00 1.19 O ATOM 0 H ASP B 10 -3.577 -5.569 -7.578 1.00 0.14 H new ATOM 0 HA ASP B 10 -3.032 -8.304 -7.469 1.00 0.16 H new ATOM 0 HB2 ASP B 10 -4.281 -7.249 -9.284 1.00 0.20 H new ATOM 0 HB3 ASP B 10 -2.911 -6.242 -9.711 1.00 0.20 H new ATOM 2417 N VAL B 11 -0.422 -6.442 -8.221 1.00 0.15 N ATOM 2418 CA VAL B 11 1.014 -6.465 -8.437 1.00 0.16 C ATOM 2419 C VAL B 11 1.782 -6.688 -7.142 1.00 0.16 C ATOM 2420 O VAL B 11 2.885 -7.216 -7.177 1.00 0.20 O ATOM 2421 CB VAL B 11 1.515 -5.173 -9.111 1.00 0.18 C ATOM 2422 CG1 VAL B 11 0.729 -4.905 -10.382 1.00 0.21 C ATOM 2423 CG2 VAL B 11 1.436 -3.989 -8.157 1.00 0.17 C ATOM 0 H VAL B 11 -0.840 -5.513 -8.265 1.00 0.15 H new ATOM 0 HA VAL B 11 1.203 -7.306 -9.105 1.00 0.16 H new ATOM 0 HB VAL B 11 2.563 -5.309 -9.377 1.00 0.18 H new ATOM 0 HG11 VAL B 11 1.093 -3.989 -10.848 1.00 0.21 H new ATOM 0 HG12 VAL B 11 0.857 -5.739 -11.072 1.00 0.21 H new ATOM 0 HG13 VAL B 11 -0.328 -4.794 -10.140 1.00 0.21 H new ATOM 0 HG21 VAL B 11 1.796 -3.092 -8.660 1.00 0.17 H new ATOM 0 HG22 VAL B 11 0.402 -3.841 -7.846 1.00 0.17 H new ATOM 0 HG23 VAL B 11 2.054 -4.186 -7.281 1.00 0.17 H new ATOM 2433 N MET B 12 1.206 -6.298 -6.005 1.00 0.16 N ATOM 2434 CA MET B 12 1.865 -6.534 -4.722 1.00 0.20 C ATOM 2435 C MET B 12 2.171 -8.019 -4.571 1.00 0.23 C ATOM 2436 O MET B 12 3.328 -8.408 -4.439 1.00 0.39 O ATOM 2437 CB MET B 12 1.017 -6.057 -3.546 1.00 0.27 C ATOM 2438 CG MET B 12 0.827 -4.545 -3.475 1.00 0.16 C ATOM 2439 SD MET B 12 0.333 -3.994 -1.833 1.00 0.78 S ATOM 2440 CE MET B 12 -0.007 -2.276 -2.120 1.00 0.19 C ATOM 0 H MET B 12 0.303 -5.827 -5.945 1.00 0.16 H new ATOM 0 HA MET B 12 2.791 -5.959 -4.713 1.00 0.20 H new ATOM 0 HB2 MET B 12 0.037 -6.531 -3.605 1.00 0.27 H new ATOM 0 HB3 MET B 12 1.480 -6.396 -2.619 1.00 0.27 H new ATOM 0 HG2 MET B 12 1.757 -4.051 -3.757 1.00 0.16 H new ATOM 0 HG3 MET B 12 0.072 -4.242 -4.200 1.00 0.16 H new ATOM 0 HE1 MET B 12 0.555 -1.670 -1.409 1.00 0.19 H new ATOM 0 HE2 MET B 12 0.288 -2.011 -3.136 1.00 0.19 H new ATOM 0 HE3 MET B 12 -1.073 -2.090 -1.992 1.00 0.19 H new ATOM 2450 N VAL B 13 1.135 -8.851 -4.661 1.00 0.18 N ATOM 2451 CA VAL B 13 1.300 -10.295 -4.502 1.00 0.19 C ATOM 2452 C VAL B 13 1.971 -10.930 -5.728 1.00 0.19 C ATOM 2453 O VAL B 13 2.528 -12.025 -5.640 1.00 0.25 O ATOM 2454 CB VAL B 13 -0.044 -11.008 -4.226 1.00 0.20 C ATOM 2455 CG1 VAL B 13 -0.605 -10.585 -2.882 1.00 0.21 C ATOM 2456 CG2 VAL B 13 -1.058 -10.737 -5.328 1.00 0.22 C ATOM 0 H VAL B 13 0.177 -8.552 -4.842 1.00 0.18 H new ATOM 0 HA VAL B 13 1.948 -10.429 -3.636 1.00 0.19 H new ATOM 0 HB VAL B 13 0.151 -12.080 -4.207 1.00 0.20 H new ATOM 0 HG11 VAL B 13 -1.551 -11.097 -2.705 1.00 0.21 H new ATOM 0 HG12 VAL B 13 0.102 -10.846 -2.094 1.00 0.21 H new ATOM 0 HG13 VAL B 13 -0.770 -9.508 -2.879 1.00 0.21 H new ATOM 0 HG21 VAL B 13 -1.990 -11.254 -5.100 1.00 0.22 H new ATOM 0 HG22 VAL B 13 -1.245 -9.665 -5.395 1.00 0.22 H new ATOM 0 HG23 VAL B 13 -0.667 -11.097 -6.279 1.00 0.22 H new ATOM 2466 N SER B 14 1.923 -10.242 -6.865 1.00 0.18 N ATOM 2467 CA SER B 14 2.536 -10.750 -8.090 1.00 0.21 C ATOM 2468 C SER B 14 4.044 -10.507 -8.097 1.00 0.23 C ATOM 2469 O SER B 14 4.830 -11.445 -8.258 1.00 0.26 O ATOM 2470 CB SER B 14 1.883 -10.111 -9.317 1.00 0.23 C ATOM 2471 OG SER B 14 0.515 -10.477 -9.408 1.00 1.12 O ATOM 0 H SER B 14 1.468 -9.335 -6.965 1.00 0.18 H new ATOM 0 HA SER B 14 2.372 -11.827 -8.127 1.00 0.21 H new ATOM 0 HB2 SER B 14 1.971 -9.026 -9.258 1.00 0.23 H new ATOM 0 HB3 SER B 14 2.409 -10.424 -10.219 1.00 0.23 H new ATOM 0 HG SER B 14 -0.001 -9.982 -8.738 1.00 1.12 H new ATOM 2477 N THR B 15 4.445 -9.255 -7.903 1.00 0.24 N ATOM 2478 CA THR B 15 5.856 -8.900 -7.827 1.00 0.26 C ATOM 2479 C THR B 15 6.502 -9.589 -6.616 1.00 0.28 C ATOM 2480 O THR B 15 7.714 -9.804 -6.578 1.00 0.31 O ATOM 2481 CB THR B 15 6.026 -7.362 -7.750 1.00 0.27 C ATOM 2482 OG1 THR B 15 5.302 -6.748 -8.829 1.00 0.33 O ATOM 2483 CG2 THR B 15 7.489 -6.944 -7.839 1.00 0.25 C ATOM 0 H THR B 15 3.808 -8.466 -7.795 1.00 0.24 H new ATOM 0 HA THR B 15 6.359 -9.245 -8.730 1.00 0.26 H new ATOM 0 HB THR B 15 5.637 -7.035 -6.786 1.00 0.27 H new ATOM 0 HG1 THR B 15 5.884 -6.111 -9.293 1.00 0.33 H new ATOM 0 HG21 THR B 15 7.561 -5.858 -7.781 1.00 0.25 H new ATOM 0 HG22 THR B 15 8.045 -7.389 -7.014 1.00 0.25 H new ATOM 0 HG23 THR B 15 7.908 -7.285 -8.786 1.00 0.25 H new ATOM 2491 N PHE B 16 5.664 -9.958 -5.645 1.00 0.30 N ATOM 2492 CA PHE B 16 6.092 -10.743 -4.490 1.00 0.36 C ATOM 2493 C PHE B 16 6.855 -11.996 -4.915 1.00 0.40 C ATOM 2494 O PHE B 16 8.074 -12.078 -4.750 1.00 0.51 O ATOM 2495 CB PHE B 16 4.875 -11.172 -3.673 1.00 0.44 C ATOM 2496 CG PHE B 16 4.840 -10.618 -2.287 1.00 0.34 C ATOM 2497 CD1 PHE B 16 5.756 -11.030 -1.341 1.00 1.27 C ATOM 2498 CD2 PHE B 16 3.881 -9.695 -1.925 1.00 1.21 C ATOM 2499 CE1 PHE B 16 5.714 -10.528 -0.057 1.00 1.42 C ATOM 2500 CE2 PHE B 16 3.837 -9.190 -0.650 1.00 1.38 C ATOM 2501 CZ PHE B 16 4.755 -9.608 0.288 1.00 0.97 C ATOM 0 H PHE B 16 4.672 -9.721 -5.639 1.00 0.30 H new ATOM 0 HA PHE B 16 6.752 -10.113 -3.893 1.00 0.36 H new ATOM 0 HB2 PHE B 16 3.972 -10.862 -4.199 1.00 0.44 H new ATOM 0 HB3 PHE B 16 4.854 -12.260 -3.617 1.00 0.44 H new ATOM 0 HD1 PHE B 16 6.513 -11.752 -1.608 1.00 1.27 H new ATOM 0 HD2 PHE B 16 3.156 -9.366 -2.654 1.00 1.21 H new ATOM 0 HE1 PHE B 16 6.435 -10.858 0.676 1.00 1.42 H new ATOM 0 HE2 PHE B 16 3.083 -8.465 -0.382 1.00 1.38 H new ATOM 0 HZ PHE B 16 4.721 -9.213 1.293 1.00 0.97 H new ATOM 2511 N HIS B 17 6.131 -12.962 -5.486 1.00 0.41 N ATOM 2512 CA HIS B 17 6.722 -14.246 -5.878 1.00 0.51 C ATOM 2513 C HIS B 17 7.735 -14.067 -7.004 1.00 0.45 C ATOM 2514 O HIS B 17 8.530 -14.960 -7.289 1.00 0.51 O ATOM 2515 CB HIS B 17 5.641 -15.269 -6.276 1.00 0.68 C ATOM 2516 CG HIS B 17 4.769 -14.868 -7.429 1.00 1.09 C ATOM 2517 ND1 HIS B 17 5.086 -15.123 -8.747 1.00 2.16 N ATOM 2518 CD2 HIS B 17 3.568 -14.246 -7.451 1.00 1.26 C ATOM 2519 CE1 HIS B 17 4.121 -14.671 -9.526 1.00 2.82 C ATOM 2520 NE2 HIS B 17 3.188 -14.135 -8.764 1.00 2.30 N ATOM 0 H HIS B 17 5.134 -12.880 -5.688 1.00 0.41 H new ATOM 0 HA HIS B 17 7.248 -14.638 -5.007 1.00 0.51 H new ATOM 0 HB2 HIS B 17 6.130 -16.211 -6.523 1.00 0.68 H new ATOM 0 HB3 HIS B 17 5.006 -15.457 -5.410 1.00 0.68 H new ATOM 0 HD1 HIS B 17 5.934 -15.589 -9.070 1.00 2.16 H new ATOM 0 HD2 HIS B 17 3.011 -13.900 -6.593 1.00 1.26 H new ATOM 0 HE1 HIS B 17 4.099 -14.730 -10.604 1.00 2.82 H new ATOM 2529 N LYS B 18 7.706 -12.900 -7.628 1.00 0.42 N ATOM 2530 CA LYS B 18 8.653 -12.559 -8.677 1.00 0.46 C ATOM 2531 C LYS B 18 10.073 -12.466 -8.109 1.00 0.45 C ATOM 2532 O LYS B 18 11.048 -12.764 -8.799 1.00 0.62 O ATOM 2533 CB LYS B 18 8.236 -11.232 -9.315 1.00 0.55 C ATOM 2534 CG LYS B 18 9.112 -10.773 -10.468 1.00 0.76 C ATOM 2535 CD LYS B 18 8.698 -9.393 -10.940 1.00 0.71 C ATOM 2536 CE LYS B 18 9.618 -8.867 -12.024 1.00 1.40 C ATOM 2537 NZ LYS B 18 9.397 -9.544 -13.328 1.00 1.67 N ATOM 0 H LYS B 18 7.028 -12.166 -7.423 1.00 0.42 H new ATOM 0 HA LYS B 18 8.650 -13.340 -9.438 1.00 0.46 H new ATOM 0 HB2 LYS B 18 7.210 -11.324 -9.672 1.00 0.55 H new ATOM 0 HB3 LYS B 18 8.238 -10.459 -8.546 1.00 0.55 H new ATOM 0 HG2 LYS B 18 10.156 -10.757 -10.154 1.00 0.76 H new ATOM 0 HG3 LYS B 18 9.038 -11.482 -11.292 1.00 0.76 H new ATOM 0 HD2 LYS B 18 7.676 -9.430 -11.317 1.00 0.71 H new ATOM 0 HD3 LYS B 18 8.701 -8.704 -10.095 1.00 0.71 H new ATOM 0 HE2 LYS B 18 9.461 -7.795 -12.142 1.00 1.40 H new ATOM 0 HE3 LYS B 18 10.655 -9.005 -11.716 1.00 1.40 H new ATOM 0 HZ1 LYS B 18 10.048 -9.152 -14.038 1.00 1.67 H new ATOM 0 HZ2 LYS B 18 9.572 -10.564 -13.224 1.00 1.67 H new ATOM 0 HZ3 LYS B 18 8.416 -9.391 -13.637 1.00 1.67 H new ATOM 2551 N TYR B 19 10.183 -12.066 -6.842 1.00 0.39 N ATOM 2552 CA TYR B 19 11.488 -11.922 -6.200 1.00 0.43 C ATOM 2553 C TYR B 19 11.625 -12.821 -4.975 1.00 0.50 C ATOM 2554 O TYR B 19 12.578 -13.585 -4.867 1.00 0.74 O ATOM 2555 CB TYR B 19 11.736 -10.466 -5.809 1.00 0.46 C ATOM 2556 CG TYR B 19 11.793 -9.538 -6.997 1.00 0.41 C ATOM 2557 CD1 TYR B 19 12.967 -9.376 -7.721 1.00 1.17 C ATOM 2558 CD2 TYR B 19 10.670 -8.834 -7.399 1.00 1.17 C ATOM 2559 CE1 TYR B 19 13.011 -8.534 -8.818 1.00 1.21 C ATOM 2560 CE2 TYR B 19 10.709 -7.993 -8.490 1.00 1.17 C ATOM 2561 CZ TYR B 19 11.880 -7.846 -9.193 1.00 0.50 C ATOM 2562 OH TYR B 19 11.917 -7.018 -10.290 1.00 0.61 O ATOM 0 H TYR B 19 9.389 -11.837 -6.244 1.00 0.39 H new ATOM 0 HA TYR B 19 12.239 -12.233 -6.926 1.00 0.43 H new ATOM 0 HB2 TYR B 19 10.945 -10.137 -5.135 1.00 0.46 H new ATOM 0 HB3 TYR B 19 12.673 -10.398 -5.257 1.00 0.46 H new ATOM 0 HD1 TYR B 19 13.856 -9.913 -7.424 1.00 1.17 H new ATOM 0 HD2 TYR B 19 9.748 -8.946 -6.848 1.00 1.17 H new ATOM 0 HE1 TYR B 19 13.928 -8.417 -9.377 1.00 1.21 H new ATOM 0 HE2 TYR B 19 9.824 -7.452 -8.791 1.00 1.17 H new ATOM 0 HH TYR B 19 11.037 -6.608 -10.420 1.00 0.61 H new ATOM 2572 N SER B 20 10.674 -12.752 -4.057 1.00 0.41 N ATOM 2573 CA SER B 20 10.758 -13.546 -2.838 1.00 0.48 C ATOM 2574 C SER B 20 10.614 -15.033 -3.156 1.00 0.57 C ATOM 2575 O SER B 20 11.183 -15.882 -2.470 1.00 0.70 O ATOM 2576 CB SER B 20 9.704 -13.099 -1.832 1.00 0.49 C ATOM 2577 OG SER B 20 8.406 -13.163 -2.384 1.00 0.53 O ATOM 0 H SER B 20 9.844 -12.163 -4.129 1.00 0.41 H new ATOM 0 HA SER B 20 11.739 -13.389 -2.390 1.00 0.48 H new ATOM 0 HB2 SER B 20 9.755 -13.730 -0.944 1.00 0.49 H new ATOM 0 HB3 SER B 20 9.915 -12.079 -1.511 1.00 0.49 H new ATOM 0 HG SER B 20 8.323 -12.501 -3.102 1.00 0.53 H new ATOM 2583 N GLY B 21 9.867 -15.340 -4.214 1.00 0.57 N ATOM 2584 CA GLY B 21 9.761 -16.711 -4.683 1.00 0.68 C ATOM 2585 C GLY B 21 11.073 -17.210 -5.255 1.00 0.71 C ATOM 2586 O GLY B 21 11.300 -18.413 -5.369 1.00 0.86 O ATOM 0 H GLY B 21 9.332 -14.661 -4.756 1.00 0.57 H new ATOM 0 HA2 GLY B 21 9.455 -17.355 -3.859 1.00 0.68 H new ATOM 0 HA3 GLY B 21 8.984 -16.776 -5.444 1.00 0.68 H new ATOM 2688 N LYS B 28 7.841 -13.491 1.342 1.00 0.69 N ATOM 2689 CA LYS B 28 8.807 -12.941 2.284 1.00 0.68 C ATOM 2690 C LYS B 28 10.114 -12.596 1.579 1.00 0.50 C ATOM 2691 O LYS B 28 10.783 -13.478 1.040 1.00 0.54 O ATOM 2692 CB LYS B 28 9.085 -13.958 3.381 1.00 0.92 C ATOM 2693 CG LYS B 28 9.967 -13.432 4.494 1.00 0.93 C ATOM 2694 CD LYS B 28 10.713 -14.560 5.179 1.00 0.98 C ATOM 2695 CE LYS B 28 12.027 -14.874 4.474 1.00 1.51 C ATOM 2696 NZ LYS B 28 11.835 -15.432 3.108 1.00 1.98 N ATOM 0 HA LYS B 28 8.389 -12.031 2.715 1.00 0.68 H new ATOM 0 HB2 LYS B 28 8.137 -14.288 3.806 1.00 0.92 H new ATOM 0 HB3 LYS B 28 9.558 -14.835 2.939 1.00 0.92 H new ATOM 0 HG2 LYS B 28 10.680 -12.714 4.089 1.00 0.93 H new ATOM 0 HG3 LYS B 28 9.358 -12.899 5.224 1.00 0.93 H new ATOM 0 HD2 LYS B 28 10.912 -14.289 6.216 1.00 0.98 H new ATOM 0 HD3 LYS B 28 10.087 -15.452 5.197 1.00 0.98 H new ATOM 0 HE2 LYS B 28 12.624 -13.964 4.408 1.00 1.51 H new ATOM 0 HE3 LYS B 28 12.594 -15.585 5.075 1.00 1.51 H new ATOM 0 HZ1 LYS B 28 12.720 -15.873 2.786 1.00 1.98 H new ATOM 0 HZ2 LYS B 28 11.079 -16.146 3.128 1.00 1.98 H new ATOM 0 HZ3 LYS B 28 11.571 -14.667 2.454 1.00 1.98 H new ATOM 2710 N LEU B 29 10.492 -11.326 1.617 1.00 0.38 N ATOM 2711 CA LEU B 29 11.658 -10.853 0.876 1.00 0.32 C ATOM 2712 C LEU B 29 12.777 -10.410 1.807 1.00 0.33 C ATOM 2713 O LEU B 29 12.550 -9.652 2.745 1.00 0.42 O ATOM 2714 CB LEU B 29 11.292 -9.667 -0.020 1.00 0.29 C ATOM 2715 CG LEU B 29 10.263 -9.938 -1.115 1.00 0.29 C ATOM 2716 CD1 LEU B 29 8.854 -9.850 -0.561 1.00 0.34 C ATOM 2717 CD2 LEU B 29 10.446 -8.964 -2.265 1.00 0.31 C ATOM 0 H LEU B 29 10.010 -10.603 2.152 1.00 0.38 H new ATOM 0 HA LEU B 29 12.000 -11.693 0.271 1.00 0.32 H new ATOM 0 HB2 LEU B 29 10.914 -8.864 0.613 1.00 0.29 H new ATOM 0 HB3 LEU B 29 12.204 -9.300 -0.491 1.00 0.29 H new ATOM 0 HG LEU B 29 10.418 -10.950 -1.490 1.00 0.29 H new ATOM 0 HD11 LEU B 29 8.137 -10.046 -1.358 1.00 0.34 H new ATOM 0 HD12 LEU B 29 8.728 -10.588 0.231 1.00 0.34 H new ATOM 0 HD13 LEU B 29 8.683 -8.852 -0.157 1.00 0.34 H new ATOM 0 HD21 LEU B 29 9.705 -9.170 -3.038 1.00 0.31 H new ATOM 0 HD22 LEU B 29 10.318 -7.944 -1.902 1.00 0.31 H new ATOM 0 HD23 LEU B 29 11.447 -9.078 -2.682 1.00 0.31 H new ATOM 2729 N ASN B 30 13.987 -10.874 1.538 1.00 0.31 N ATOM 2730 CA ASN B 30 15.165 -10.369 2.233 1.00 0.31 C ATOM 2731 C ASN B 30 15.658 -9.094 1.545 1.00 0.27 C ATOM 2732 O ASN B 30 14.997 -8.578 0.640 1.00 0.26 O ATOM 2733 CB ASN B 30 16.280 -11.421 2.262 1.00 0.35 C ATOM 2734 CG ASN B 30 17.029 -11.518 0.946 1.00 0.58 C ATOM 2735 OD1 ASN B 30 18.062 -10.876 0.755 1.00 1.17 O ATOM 2736 ND2 ASN B 30 16.518 -12.308 0.031 1.00 0.60 N ATOM 0 H ASN B 30 14.181 -11.597 0.846 1.00 0.31 H new ATOM 0 HA ASN B 30 14.891 -10.143 3.263 1.00 0.31 H new ATOM 0 HB2 ASN B 30 16.983 -11.177 3.058 1.00 0.35 H new ATOM 0 HB3 ASN B 30 15.850 -12.393 2.503 1.00 0.35 H new ATOM 0 HD21 ASN B 30 16.979 -12.405 -0.874 1.00 0.60 H new ATOM 0 HD22 ASN B 30 15.660 -12.825 0.225 1.00 0.60 H new ATOM 2743 N LYS B 31 16.817 -8.600 1.974 1.00 0.27 N ATOM 2744 CA LYS B 31 17.378 -7.353 1.450 1.00 0.26 C ATOM 2745 C LYS B 31 17.463 -7.376 -0.078 1.00 0.25 C ATOM 2746 O LYS B 31 16.907 -6.514 -0.759 1.00 0.28 O ATOM 2747 CB LYS B 31 18.791 -7.119 1.996 1.00 0.29 C ATOM 2748 CG LYS B 31 19.034 -7.645 3.399 1.00 0.40 C ATOM 2749 CD LYS B 31 20.470 -7.385 3.825 1.00 0.49 C ATOM 2750 CE LYS B 31 20.897 -8.280 4.977 1.00 1.20 C ATOM 2751 NZ LYS B 31 20.024 -8.119 6.167 1.00 1.72 N ATOM 0 H LYS B 31 17.391 -9.047 2.689 1.00 0.27 H new ATOM 0 HA LYS B 31 16.711 -6.552 1.769 1.00 0.26 H new ATOM 0 HB2 LYS B 31 19.507 -7.587 1.320 1.00 0.29 H new ATOM 0 HB3 LYS B 31 18.995 -6.048 1.986 1.00 0.29 H new ATOM 0 HG2 LYS B 31 18.349 -7.164 4.097 1.00 0.40 H new ATOM 0 HG3 LYS B 31 18.826 -8.714 3.434 1.00 0.40 H new ATOM 0 HD2 LYS B 31 21.134 -7.546 2.976 1.00 0.49 H new ATOM 0 HD3 LYS B 31 20.577 -6.341 4.119 1.00 0.49 H new ATOM 0 HE2 LYS B 31 20.878 -9.320 4.653 1.00 1.20 H new ATOM 0 HE3 LYS B 31 21.927 -8.050 5.251 1.00 1.20 H new ATOM 0 HZ1 LYS B 31 20.438 -8.629 6.973 1.00 1.72 H new ATOM 0 HZ2 LYS B 31 19.940 -7.109 6.402 1.00 1.72 H new ATOM 0 HZ3 LYS B 31 19.081 -8.506 5.961 1.00 1.72 H new ATOM 2765 N SER B 32 18.157 -8.378 -0.600 1.00 0.25 N ATOM 2766 CA SER B 32 18.483 -8.451 -2.016 1.00 0.27 C ATOM 2767 C SER B 32 17.238 -8.522 -2.897 1.00 0.24 C ATOM 2768 O SER B 32 17.216 -7.958 -3.995 1.00 0.27 O ATOM 2769 CB SER B 32 19.374 -9.664 -2.268 1.00 0.35 C ATOM 2770 OG SER B 32 20.518 -9.627 -1.431 1.00 1.27 O ATOM 0 H SER B 32 18.510 -9.163 -0.053 1.00 0.25 H new ATOM 0 HA SER B 32 19.010 -7.535 -2.284 1.00 0.27 H new ATOM 0 HB2 SER B 32 18.812 -10.579 -2.084 1.00 0.35 H new ATOM 0 HB3 SER B 32 19.682 -9.684 -3.313 1.00 0.35 H new ATOM 0 HG SER B 32 21.076 -10.413 -1.605 1.00 1.27 H new ATOM 2776 N GLU B 33 16.199 -9.196 -2.421 1.00 0.25 N ATOM 2777 CA GLU B 33 14.981 -9.334 -3.208 1.00 0.27 C ATOM 2778 C GLU B 33 14.229 -8.018 -3.247 1.00 0.24 C ATOM 2779 O GLU B 33 13.707 -7.623 -4.290 1.00 0.26 O ATOM 2780 CB GLU B 33 14.082 -10.445 -2.667 1.00 0.34 C ATOM 2781 CG GLU B 33 14.688 -11.830 -2.807 1.00 0.47 C ATOM 2782 CD GLU B 33 15.410 -12.022 -4.131 1.00 0.83 C ATOM 2783 OE1 GLU B 33 14.847 -11.674 -5.189 1.00 1.65 O ATOM 2784 OE2 GLU B 33 16.567 -12.495 -4.113 1.00 1.43 O ATOM 0 H GLU B 33 16.174 -9.649 -1.508 1.00 0.25 H new ATOM 0 HA GLU B 33 15.271 -9.609 -4.222 1.00 0.27 H new ATOM 0 HB2 GLU B 33 13.872 -10.253 -1.615 1.00 0.34 H new ATOM 0 HB3 GLU B 33 13.128 -10.419 -3.193 1.00 0.34 H new ATOM 0 HG2 GLU B 33 15.387 -12.001 -1.988 1.00 0.47 H new ATOM 0 HG3 GLU B 33 13.900 -12.578 -2.715 1.00 0.47 H new ATOM 2791 N LEU B 34 14.192 -7.331 -2.111 1.00 0.21 N ATOM 2792 CA LEU B 34 13.579 -6.019 -2.048 1.00 0.21 C ATOM 2793 C LEU B 34 14.330 -5.030 -2.918 1.00 0.20 C ATOM 2794 O LEU B 34 13.719 -4.265 -3.660 1.00 0.24 O ATOM 2795 CB LEU B 34 13.529 -5.524 -0.610 1.00 0.21 C ATOM 2796 CG LEU B 34 12.280 -5.941 0.150 1.00 0.21 C ATOM 2797 CD1 LEU B 34 12.456 -5.702 1.638 1.00 0.24 C ATOM 2798 CD2 LEU B 34 11.074 -5.178 -0.383 1.00 0.21 C ATOM 0 H LEU B 34 14.579 -7.663 -1.227 1.00 0.21 H new ATOM 0 HA LEU B 34 12.560 -6.102 -2.425 1.00 0.21 H new ATOM 0 HB2 LEU B 34 14.405 -5.896 -0.079 1.00 0.21 H new ATOM 0 HB3 LEU B 34 13.595 -4.436 -0.610 1.00 0.21 H new ATOM 0 HG LEU B 34 12.113 -7.008 0.000 1.00 0.21 H new ATOM 0 HD11 LEU B 34 11.552 -6.007 2.165 1.00 0.24 H new ATOM 0 HD12 LEU B 34 13.302 -6.285 2.003 1.00 0.24 H new ATOM 0 HD13 LEU B 34 12.641 -4.643 1.817 1.00 0.24 H new ATOM 0 HD21 LEU B 34 10.181 -5.480 0.165 1.00 0.21 H new ATOM 0 HD22 LEU B 34 11.234 -4.108 -0.253 1.00 0.21 H new ATOM 0 HD23 LEU B 34 10.942 -5.400 -1.442 1.00 0.21 H new ATOM 2810 N LYS B 35 15.654 -5.060 -2.838 1.00 0.21 N ATOM 2811 CA LYS B 35 16.475 -4.167 -3.636 1.00 0.26 C ATOM 2812 C LYS B 35 16.151 -4.314 -5.102 1.00 0.22 C ATOM 2813 O LYS B 35 15.793 -3.344 -5.757 1.00 0.24 O ATOM 2814 CB LYS B 35 17.967 -4.415 -3.423 1.00 0.37 C ATOM 2815 CG LYS B 35 18.828 -3.429 -4.194 1.00 0.54 C ATOM 2816 CD LYS B 35 20.231 -3.324 -3.617 1.00 0.68 C ATOM 2817 CE LYS B 35 21.073 -4.531 -3.965 1.00 0.61 C ATOM 2818 NZ LYS B 35 22.402 -4.486 -3.305 1.00 0.95 N ATOM 0 H LYS B 35 16.178 -5.691 -2.231 1.00 0.21 H new ATOM 0 HA LYS B 35 16.247 -3.153 -3.308 1.00 0.26 H new ATOM 0 HB2 LYS B 35 18.198 -4.343 -2.360 1.00 0.37 H new ATOM 0 HB3 LYS B 35 18.213 -5.430 -3.734 1.00 0.37 H new ATOM 0 HG2 LYS B 35 18.888 -3.739 -5.237 1.00 0.54 H new ATOM 0 HG3 LYS B 35 18.356 -2.447 -4.179 1.00 0.54 H new ATOM 0 HD2 LYS B 35 20.713 -2.423 -3.996 1.00 0.68 H new ATOM 0 HD3 LYS B 35 20.172 -3.222 -2.533 1.00 0.68 H new ATOM 0 HE2 LYS B 35 20.549 -5.438 -3.665 1.00 0.61 H new ATOM 0 HE3 LYS B 35 21.206 -4.582 -5.046 1.00 0.61 H new ATOM 0 HZ1 LYS B 35 22.949 -5.330 -3.568 1.00 0.95 H new ATOM 0 HZ2 LYS B 35 22.913 -3.633 -3.611 1.00 0.95 H new ATOM 0 HZ3 LYS B 35 22.276 -4.463 -2.273 1.00 0.95 H new ATOM 2832 N GLU B 36 16.251 -5.533 -5.606 1.00 0.22 N ATOM 2833 CA GLU B 36 16.006 -5.779 -7.010 1.00 0.24 C ATOM 2834 C GLU B 36 14.585 -5.365 -7.377 1.00 0.25 C ATOM 2835 O GLU B 36 14.362 -4.739 -8.410 1.00 0.32 O ATOM 2836 CB GLU B 36 16.225 -7.243 -7.341 1.00 0.28 C ATOM 2837 CG GLU B 36 16.515 -7.478 -8.809 1.00 0.65 C ATOM 2838 CD GLU B 36 16.760 -8.937 -9.137 1.00 0.77 C ATOM 2839 OE1 GLU B 36 17.921 -9.384 -9.021 1.00 1.30 O ATOM 2840 OE2 GLU B 36 15.801 -9.645 -9.510 1.00 1.48 O ATOM 0 H GLU B 36 16.499 -6.361 -5.064 1.00 0.22 H new ATOM 0 HA GLU B 36 16.709 -5.183 -7.592 1.00 0.24 H new ATOM 0 HB2 GLU B 36 17.055 -7.625 -6.746 1.00 0.28 H new ATOM 0 HB3 GLU B 36 15.340 -7.811 -7.055 1.00 0.28 H new ATOM 0 HG2 GLU B 36 15.676 -7.114 -9.402 1.00 0.65 H new ATOM 0 HG3 GLU B 36 17.388 -6.894 -9.099 1.00 0.65 H new ATOM 2847 N LEU B 37 13.639 -5.694 -6.507 1.00 0.23 N ATOM 2848 CA LEU B 37 12.245 -5.304 -6.685 1.00 0.26 C ATOM 2849 C LEU B 37 12.149 -3.799 -6.910 1.00 0.22 C ATOM 2850 O LEU B 37 11.604 -3.342 -7.920 1.00 0.22 O ATOM 2851 CB LEU B 37 11.443 -5.710 -5.447 1.00 0.32 C ATOM 2852 CG LEU B 37 9.922 -5.726 -5.602 1.00 0.41 C ATOM 2853 CD1 LEU B 37 9.324 -6.843 -4.765 1.00 0.34 C ATOM 2854 CD2 LEU B 37 9.330 -4.394 -5.181 1.00 0.74 C ATOM 0 H LEU B 37 13.814 -6.236 -5.661 1.00 0.23 H new ATOM 0 HA LEU B 37 11.834 -5.810 -7.558 1.00 0.26 H new ATOM 0 HB2 LEU B 37 11.766 -6.705 -5.141 1.00 0.32 H new ATOM 0 HB3 LEU B 37 11.697 -5.028 -4.636 1.00 0.32 H new ATOM 0 HG LEU B 37 9.684 -5.898 -6.652 1.00 0.41 H new ATOM 0 HD11 LEU B 37 8.240 -6.846 -4.883 1.00 0.34 H new ATOM 0 HD12 LEU B 37 9.727 -7.801 -5.095 1.00 0.34 H new ATOM 0 HD13 LEU B 37 9.575 -6.686 -3.716 1.00 0.34 H new ATOM 0 HD21 LEU B 37 8.247 -4.424 -5.298 1.00 0.74 H new ATOM 0 HD22 LEU B 37 9.577 -4.200 -4.137 1.00 0.74 H new ATOM 0 HD23 LEU B 37 9.740 -3.600 -5.805 1.00 0.74 H new ATOM 2866 N LEU B 38 12.714 -3.036 -5.982 1.00 0.19 N ATOM 2867 CA LEU B 38 12.711 -1.586 -6.075 1.00 0.19 C ATOM 2868 C LEU B 38 13.523 -1.101 -7.281 1.00 0.19 C ATOM 2869 O LEU B 38 13.071 -0.241 -8.018 1.00 0.21 O ATOM 2870 CB LEU B 38 13.236 -0.956 -4.778 1.00 0.19 C ATOM 2871 CG LEU B 38 12.218 -0.848 -3.636 1.00 0.19 C ATOM 2872 CD1 LEU B 38 12.630 -1.715 -2.456 1.00 0.20 C ATOM 2873 CD2 LEU B 38 12.066 0.606 -3.198 1.00 0.20 C ATOM 0 H LEU B 38 13.182 -3.403 -5.153 1.00 0.19 H new ATOM 0 HA LEU B 38 11.679 -1.266 -6.219 1.00 0.19 H new ATOM 0 HB2 LEU B 38 14.086 -1.542 -4.429 1.00 0.19 H new ATOM 0 HB3 LEU B 38 13.608 0.043 -5.005 1.00 0.19 H new ATOM 0 HG LEU B 38 11.256 -1.208 -4.002 1.00 0.19 H new ATOM 0 HD11 LEU B 38 11.892 -1.621 -1.660 1.00 0.20 H new ATOM 0 HD12 LEU B 38 12.691 -2.756 -2.773 1.00 0.20 H new ATOM 0 HD13 LEU B 38 13.603 -1.390 -2.088 1.00 0.20 H new ATOM 0 HD21 LEU B 38 11.340 0.668 -2.387 1.00 0.20 H new ATOM 0 HD22 LEU B 38 13.028 0.985 -2.854 1.00 0.20 H new ATOM 0 HD23 LEU B 38 11.721 1.205 -4.040 1.00 0.20 H new ATOM 2885 N THR B 39 14.702 -1.670 -7.503 1.00 0.20 N ATOM 2886 CA THR B 39 15.560 -1.232 -8.609 1.00 0.22 C ATOM 2887 C THR B 39 14.868 -1.392 -9.963 1.00 0.23 C ATOM 2888 O THR B 39 15.144 -0.647 -10.908 1.00 0.27 O ATOM 2889 CB THR B 39 16.900 -1.999 -8.641 1.00 0.25 C ATOM 2890 OG1 THR B 39 16.680 -3.408 -8.786 1.00 0.30 O ATOM 2891 CG2 THR B 39 17.696 -1.752 -7.378 1.00 0.27 C ATOM 0 H THR B 39 15.087 -2.429 -6.941 1.00 0.20 H new ATOM 0 HA THR B 39 15.759 -0.175 -8.430 1.00 0.22 H new ATOM 0 HB THR B 39 17.463 -1.632 -9.499 1.00 0.25 H new ATOM 0 HG1 THR B 39 15.725 -3.603 -8.681 1.00 0.30 H new ATOM 0 HG21 THR B 39 18.635 -2.303 -7.426 1.00 0.27 H new ATOM 0 HG22 THR B 39 17.905 -0.687 -7.282 1.00 0.27 H new ATOM 0 HG23 THR B 39 17.122 -2.088 -6.515 1.00 0.27 H new ATOM 2899 N ARG B 40 13.967 -2.357 -10.050 1.00 0.24 N ATOM 2900 CA ARG B 40 13.285 -2.650 -11.299 1.00 0.27 C ATOM 2901 C ARG B 40 12.004 -1.834 -11.431 1.00 0.27 C ATOM 2902 O ARG B 40 11.856 -1.036 -12.355 1.00 0.30 O ATOM 2903 CB ARG B 40 12.957 -4.141 -11.381 1.00 0.31 C ATOM 2904 CG ARG B 40 14.179 -5.045 -11.335 1.00 0.34 C ATOM 2905 CD ARG B 40 15.050 -4.894 -12.564 1.00 0.44 C ATOM 2906 NE ARG B 40 14.425 -5.462 -13.760 1.00 0.64 N ATOM 2907 CZ ARG B 40 14.608 -4.994 -14.993 1.00 0.87 C ATOM 2908 NH1 ARG B 40 15.292 -3.874 -15.192 1.00 1.22 N ATOM 2909 NH2 ARG B 40 14.082 -5.638 -16.027 1.00 1.06 N ATOM 0 H ARG B 40 13.691 -2.952 -9.269 1.00 0.24 H new ATOM 0 HA ARG B 40 13.951 -2.379 -12.118 1.00 0.27 H new ATOM 0 HB2 ARG B 40 12.293 -4.403 -10.557 1.00 0.31 H new ATOM 0 HB3 ARG B 40 12.410 -4.332 -12.304 1.00 0.31 H new ATOM 0 HG2 ARG B 40 14.766 -4.815 -10.446 1.00 0.34 H new ATOM 0 HG3 ARG B 40 13.858 -6.083 -11.245 1.00 0.34 H new ATOM 0 HD2 ARG B 40 15.258 -3.837 -12.732 1.00 0.44 H new ATOM 0 HD3 ARG B 40 16.008 -5.383 -12.390 1.00 0.44 H new ATOM 0 HE ARG B 40 13.810 -6.267 -13.641 1.00 0.64 H new ATOM 0 HH11 ARG B 40 15.681 -3.366 -14.398 1.00 1.22 H new ATOM 0 HH12 ARG B 40 15.428 -3.521 -16.139 1.00 1.22 H new ATOM 0 HH21 ARG B 40 13.540 -6.488 -15.876 1.00 1.06 H new ATOM 0 HH22 ARG B 40 14.220 -5.283 -16.973 1.00 1.06 H new ATOM 2923 N GLU B 41 11.087 -2.028 -10.496 1.00 0.27 N ATOM 2924 CA GLU B 41 9.753 -1.462 -10.618 1.00 0.30 C ATOM 2925 C GLU B 41 9.561 -0.199 -9.778 1.00 0.34 C ATOM 2926 O GLU B 41 8.561 0.490 -9.924 1.00 0.46 O ATOM 2927 CB GLU B 41 8.713 -2.522 -10.258 1.00 0.36 C ATOM 2928 CG GLU B 41 8.524 -3.557 -11.357 1.00 0.45 C ATOM 2929 CD GLU B 41 7.755 -4.778 -10.905 1.00 0.83 C ATOM 2930 OE1 GLU B 41 6.546 -4.653 -10.618 1.00 1.59 O ATOM 2931 OE2 GLU B 41 8.352 -5.871 -10.845 1.00 1.54 O ATOM 0 H GLU B 41 11.241 -2.571 -9.647 1.00 0.27 H new ATOM 0 HA GLU B 41 9.620 -1.155 -11.656 1.00 0.30 H new ATOM 0 HB2 GLU B 41 9.016 -3.025 -9.339 1.00 0.36 H new ATOM 0 HB3 GLU B 41 7.759 -2.035 -10.055 1.00 0.36 H new ATOM 0 HG2 GLU B 41 8.000 -3.096 -12.194 1.00 0.45 H new ATOM 0 HG3 GLU B 41 9.502 -3.868 -11.725 1.00 0.45 H new ATOM 2938 N LEU B 42 10.510 0.118 -8.903 1.00 0.27 N ATOM 2939 CA LEU B 42 10.399 1.332 -8.086 1.00 0.28 C ATOM 2940 C LEU B 42 11.673 2.183 -8.148 1.00 0.27 C ATOM 2941 O LEU B 42 12.112 2.698 -7.123 1.00 0.26 O ATOM 2942 CB LEU B 42 10.137 0.981 -6.612 1.00 0.27 C ATOM 2943 CG LEU B 42 8.920 0.101 -6.326 1.00 0.27 C ATOM 2944 CD1 LEU B 42 9.221 -1.347 -6.647 1.00 0.26 C ATOM 2945 CD2 LEU B 42 8.496 0.242 -4.875 1.00 0.32 C ATOM 0 H LEU B 42 11.352 -0.434 -8.739 1.00 0.27 H new ATOM 0 HA LEU B 42 9.564 1.900 -8.496 1.00 0.28 H new ATOM 0 HB2 LEU B 42 11.021 0.479 -6.219 1.00 0.27 H new ATOM 0 HB3 LEU B 42 10.024 1.911 -6.055 1.00 0.27 H new ATOM 0 HG LEU B 42 8.100 0.431 -6.964 1.00 0.27 H new ATOM 0 HD11 LEU B 42 8.342 -1.957 -6.437 1.00 0.26 H new ATOM 0 HD12 LEU B 42 9.483 -1.439 -7.701 1.00 0.26 H new ATOM 0 HD13 LEU B 42 10.055 -1.690 -6.035 1.00 0.26 H new ATOM 0 HD21 LEU B 42 7.628 -0.390 -4.686 1.00 0.32 H new ATOM 0 HD22 LEU B 42 9.316 -0.064 -4.225 1.00 0.32 H new ATOM 0 HD23 LEU B 42 8.239 1.281 -4.670 1.00 0.32 H new ATOM 2957 N PRO B 43 12.276 2.393 -9.337 1.00 0.31 N ATOM 2958 CA PRO B 43 13.585 3.030 -9.415 1.00 0.33 C ATOM 2959 C PRO B 43 13.504 4.529 -9.156 1.00 0.33 C ATOM 2960 O PRO B 43 14.474 5.154 -8.722 1.00 0.36 O ATOM 2961 CB PRO B 43 14.038 2.749 -10.838 1.00 0.41 C ATOM 2962 CG PRO B 43 12.777 2.616 -11.625 1.00 0.51 C ATOM 2963 CD PRO B 43 11.730 2.087 -10.675 1.00 0.35 C ATOM 0 HA PRO B 43 14.274 2.648 -8.662 1.00 0.33 H new ATOM 0 HB2 PRO B 43 14.659 3.558 -11.222 1.00 0.41 H new ATOM 0 HB3 PRO B 43 14.634 1.838 -10.890 1.00 0.41 H new ATOM 0 HG2 PRO B 43 12.475 3.578 -12.038 1.00 0.51 H new ATOM 0 HG3 PRO B 43 12.915 1.937 -12.467 1.00 0.51 H new ATOM 0 HD2 PRO B 43 10.766 2.571 -10.833 1.00 0.35 H new ATOM 0 HD3 PRO B 43 11.575 1.016 -10.808 1.00 0.35 H new ATOM 2971 N SER B 44 12.338 5.097 -9.420 1.00 0.36 N ATOM 2972 CA SER B 44 12.087 6.497 -9.148 1.00 0.39 C ATOM 2973 C SER B 44 11.932 6.713 -7.651 1.00 0.35 C ATOM 2974 O SER B 44 12.430 7.694 -7.099 1.00 0.40 O ATOM 2975 CB SER B 44 10.828 6.947 -9.883 1.00 0.46 C ATOM 2976 OG SER B 44 9.785 5.999 -9.722 1.00 1.09 O ATOM 0 H SER B 44 11.545 4.601 -9.827 1.00 0.36 H new ATOM 0 HA SER B 44 12.931 7.090 -9.501 1.00 0.39 H new ATOM 0 HB2 SER B 44 10.506 7.917 -9.503 1.00 0.46 H new ATOM 0 HB3 SER B 44 11.047 7.077 -10.943 1.00 0.46 H new ATOM 0 HG SER B 44 8.986 6.307 -10.199 1.00 1.09 H new ATOM 2982 N PHE B 45 11.272 5.758 -6.995 1.00 0.30 N ATOM 2983 CA PHE B 45 11.021 5.825 -5.559 1.00 0.28 C ATOM 2984 C PHE B 45 12.280 5.491 -4.776 1.00 0.28 C ATOM 2985 O PHE B 45 12.210 5.039 -3.642 1.00 0.27 O ATOM 2986 CB PHE B 45 9.904 4.857 -5.151 1.00 0.31 C ATOM 2987 CG PHE B 45 8.704 4.881 -6.049 1.00 0.28 C ATOM 2988 CD1 PHE B 45 8.030 6.060 -6.317 1.00 1.28 C ATOM 2989 CD2 PHE B 45 8.243 3.706 -6.613 1.00 1.17 C ATOM 2990 CE1 PHE B 45 6.917 6.061 -7.134 1.00 1.34 C ATOM 2991 CE2 PHE B 45 7.136 3.700 -7.432 1.00 1.18 C ATOM 2992 CZ PHE B 45 6.471 4.875 -7.693 1.00 0.47 C ATOM 0 H PHE B 45 10.899 4.921 -7.443 1.00 0.30 H new ATOM 0 HA PHE B 45 10.712 6.845 -5.329 1.00 0.28 H new ATOM 0 HB2 PHE B 45 10.307 3.844 -5.131 1.00 0.31 H new ATOM 0 HB3 PHE B 45 9.587 5.094 -4.135 1.00 0.31 H new ATOM 0 HD1 PHE B 45 8.377 6.986 -5.884 1.00 1.28 H new ATOM 0 HD2 PHE B 45 8.759 2.779 -6.408 1.00 1.17 H new ATOM 0 HE1 PHE B 45 6.395 6.985 -7.337 1.00 1.34 H new ATOM 0 HE2 PHE B 45 6.791 2.774 -7.868 1.00 1.18 H new ATOM 0 HZ PHE B 45 5.601 4.873 -8.334 1.00 0.47 H new ATOM 3002 N LEU B 46 13.429 5.724 -5.377 1.00 0.32 N ATOM 3003 CA LEU B 46 14.683 5.566 -4.680 1.00 0.33 C ATOM 3004 C LEU B 46 15.250 6.940 -4.337 1.00 0.39 C ATOM 3005 O LEU B 46 16.007 7.089 -3.382 1.00 0.47 O ATOM 3006 CB LEU B 46 15.671 4.758 -5.530 1.00 0.35 C ATOM 3007 CG LEU B 46 15.141 3.403 -6.020 1.00 0.32 C ATOM 3008 CD1 LEU B 46 16.232 2.631 -6.746 1.00 0.41 C ATOM 3009 CD2 LEU B 46 14.596 2.581 -4.861 1.00 0.30 C ATOM 0 H LEU B 46 13.517 6.024 -6.348 1.00 0.32 H new ATOM 0 HA LEU B 46 14.515 5.015 -3.754 1.00 0.33 H new ATOM 0 HB2 LEU B 46 15.956 5.355 -6.396 1.00 0.35 H new ATOM 0 HB3 LEU B 46 16.576 4.589 -4.947 1.00 0.35 H new ATOM 0 HG LEU B 46 14.326 3.594 -6.718 1.00 0.32 H new ATOM 0 HD11 LEU B 46 15.836 1.674 -7.085 1.00 0.41 H new ATOM 0 HD12 LEU B 46 16.575 3.207 -7.605 1.00 0.41 H new ATOM 0 HD13 LEU B 46 17.068 2.458 -6.068 1.00 0.41 H new ATOM 0 HD21 LEU B 46 14.227 1.626 -5.234 1.00 0.30 H new ATOM 0 HD22 LEU B 46 15.390 2.404 -4.135 1.00 0.30 H new ATOM 0 HD23 LEU B 46 13.781 3.123 -4.382 1.00 0.30 H new ATOM 3021 N GLY B 47 14.849 7.946 -5.114 1.00 0.41 N ATOM 3022 CA GLY B 47 15.343 9.314 -4.945 1.00 0.49 C ATOM 3023 C GLY B 47 16.829 9.463 -5.252 1.00 0.53 C ATOM 3024 O GLY B 47 17.263 10.488 -5.782 1.00 0.60 O ATOM 0 H GLY B 47 14.177 7.838 -5.874 1.00 0.41 H new ATOM 0 HA2 GLY B 47 14.776 9.980 -5.596 1.00 0.49 H new ATOM 0 HA3 GLY B 47 15.157 9.636 -3.920 1.00 0.49 H new ATOM 3028 N LYS B 48 17.594 8.436 -4.932 1.00 0.54 N ATOM 3029 CA LYS B 48 18.991 8.347 -5.315 1.00 0.67 C ATOM 3030 C LYS B 48 19.196 7.076 -6.123 1.00 0.70 C ATOM 3031 O LYS B 48 19.302 7.109 -7.350 1.00 1.18 O ATOM 3032 CB LYS B 48 19.902 8.287 -4.080 1.00 0.82 C ATOM 3033 CG LYS B 48 19.796 9.460 -3.126 1.00 1.41 C ATOM 3034 CD LYS B 48 20.479 9.125 -1.805 1.00 2.04 C ATOM 3035 CE LYS B 48 21.951 8.784 -2.001 1.00 2.61 C ATOM 3036 NZ LYS B 48 22.489 7.951 -0.890 1.00 3.21 N ATOM 0 H LYS B 48 17.261 7.635 -4.395 1.00 0.54 H new ATOM 0 HA LYS B 48 19.246 9.232 -5.898 1.00 0.67 H new ATOM 0 HB2 LYS B 48 19.677 7.374 -3.530 1.00 0.82 H new ATOM 0 HB3 LYS B 48 20.936 8.209 -4.417 1.00 0.82 H new ATOM 0 HG2 LYS B 48 20.258 10.342 -3.569 1.00 1.41 H new ATOM 0 HG3 LYS B 48 18.748 9.703 -2.951 1.00 1.41 H new ATOM 0 HD2 LYS B 48 20.389 9.972 -1.124 1.00 2.04 H new ATOM 0 HD3 LYS B 48 19.970 8.283 -1.336 1.00 2.04 H new ATOM 0 HE2 LYS B 48 22.076 8.253 -2.945 1.00 2.61 H new ATOM 0 HE3 LYS B 48 22.529 9.705 -2.075 1.00 2.61 H new ATOM 0 HZ1 LYS B 48 23.414 8.322 -0.594 1.00 3.21 H new ATOM 0 HZ2 LYS B 48 21.831 7.979 -0.085 1.00 3.21 H new ATOM 0 HZ3 LYS B 48 22.597 6.969 -1.214 1.00 3.21 H new ATOM 3050 N ARG B 49 19.181 5.962 -5.393 1.00 0.54 N ATOM 3051 CA ARG B 49 19.476 4.631 -5.901 1.00 0.54 C ATOM 3052 C ARG B 49 19.839 3.773 -4.701 1.00 0.51 C ATOM 3053 O ARG B 49 20.364 4.292 -3.717 1.00 0.55 O ATOM 3054 CB ARG B 49 20.647 4.647 -6.893 1.00 0.66 C ATOM 3055 CG ARG B 49 20.931 3.301 -7.539 1.00 0.74 C ATOM 3056 CD ARG B 49 19.729 2.783 -8.312 1.00 0.73 C ATOM 3057 NE ARG B 49 19.286 3.719 -9.346 1.00 1.28 N ATOM 3058 CZ ARG B 49 18.631 3.354 -10.445 1.00 1.46 C ATOM 3059 NH1 ARG B 49 18.444 2.067 -10.714 1.00 1.43 N ATOM 3060 NH2 ARG B 49 18.196 4.278 -11.294 1.00 2.26 N ATOM 0 H ARG B 49 18.955 5.966 -4.398 1.00 0.54 H new ATOM 0 HA ARG B 49 18.610 4.240 -6.435 1.00 0.54 H new ATOM 0 HB2 ARG B 49 20.437 5.376 -7.675 1.00 0.66 H new ATOM 0 HB3 ARG B 49 21.544 4.986 -6.374 1.00 0.66 H new ATOM 0 HG2 ARG B 49 21.784 3.393 -8.211 1.00 0.74 H new ATOM 0 HG3 ARG B 49 21.208 2.580 -6.770 1.00 0.74 H new ATOM 0 HD2 ARG B 49 19.981 1.828 -8.774 1.00 0.73 H new ATOM 0 HD3 ARG B 49 18.908 2.595 -7.620 1.00 0.73 H new ATOM 0 HE ARG B 49 19.492 4.710 -9.217 1.00 1.28 H new ATOM 0 HH11 ARG B 49 18.803 1.356 -10.077 1.00 1.43 H new ATOM 0 HH12 ARG B 49 17.941 1.790 -11.557 1.00 1.43 H new ATOM 0 HH21 ARG B 49 18.364 5.266 -11.103 1.00 2.26 H new ATOM 0 HH22 ARG B 49 17.694 4.000 -12.137 1.00 2.26 H new ATOM 3074 N THR B 50 19.546 2.487 -4.759 1.00 0.51 N ATOM 3075 CA THR B 50 19.873 1.591 -3.666 1.00 0.51 C ATOM 3076 C THR B 50 21.386 1.483 -3.483 1.00 0.61 C ATOM 3077 O THR B 50 22.071 0.819 -4.267 1.00 0.82 O ATOM 3078 CB THR B 50 19.276 0.199 -3.908 1.00 0.57 C ATOM 3079 OG1 THR B 50 19.599 -0.235 -5.235 1.00 0.69 O ATOM 3080 CG2 THR B 50 17.763 0.221 -3.726 1.00 0.57 C ATOM 0 H THR B 50 19.083 2.040 -5.550 1.00 0.51 H new ATOM 0 HA THR B 50 19.441 2.006 -2.755 1.00 0.51 H new ATOM 0 HB THR B 50 19.699 -0.494 -3.181 1.00 0.57 H new ATOM 0 HG1 THR B 50 20.547 -0.063 -5.414 1.00 0.69 H new ATOM 0 HG21 THR B 50 17.361 -0.777 -3.902 1.00 0.57 H new ATOM 0 HG22 THR B 50 17.523 0.534 -2.710 1.00 0.57 H new ATOM 0 HG23 THR B 50 17.321 0.921 -4.435 1.00 0.57 H new ATOM 3088 N ASP B 51 21.906 2.170 -2.470 1.00 0.58 N ATOM 3089 CA ASP B 51 23.332 2.140 -2.175 1.00 0.72 C ATOM 3090 C ASP B 51 23.694 0.850 -1.459 1.00 0.60 C ATOM 3091 O ASP B 51 22.853 -0.030 -1.271 1.00 0.58 O ATOM 3092 CB ASP B 51 23.751 3.328 -1.299 1.00 0.91 C ATOM 3093 CG ASP B 51 23.471 4.676 -1.936 1.00 1.35 C ATOM 3094 OD1 ASP B 51 24.260 5.097 -2.812 1.00 1.91 O ATOM 3095 OD2 ASP B 51 22.481 5.332 -1.552 1.00 1.98 O ATOM 0 H ASP B 51 21.358 2.755 -1.839 1.00 0.58 H new ATOM 0 HA ASP B 51 23.862 2.201 -3.126 1.00 0.72 H new ATOM 0 HB2 ASP B 51 23.226 3.269 -0.345 1.00 0.91 H new ATOM 0 HB3 ASP B 51 24.816 3.252 -1.082 1.00 0.91 H new ATOM 3100 N GLU B 52 24.947 0.746 -1.058 1.00 0.68 N ATOM 3101 CA GLU B 52 25.421 -0.426 -0.350 1.00 0.66 C ATOM 3102 C GLU B 52 25.180 -0.279 1.152 1.00 0.55 C ATOM 3103 O GLU B 52 24.396 -1.025 1.740 1.00 0.50 O ATOM 3104 CB GLU B 52 26.906 -0.638 -0.632 1.00 0.83 C ATOM 3105 CG GLU B 52 27.474 -1.874 0.028 1.00 1.57 C ATOM 3106 CD GLU B 52 28.960 -2.023 -0.210 1.00 2.22 C ATOM 3107 OE1 GLU B 52 29.347 -2.592 -1.251 1.00 2.79 O ATOM 3108 OE2 GLU B 52 29.750 -1.565 0.644 1.00 2.89 O ATOM 0 H GLU B 52 25.657 1.462 -1.212 1.00 0.68 H new ATOM 0 HA GLU B 52 24.867 -1.296 -0.701 1.00 0.66 H new ATOM 0 HB2 GLU B 52 27.057 -0.709 -1.709 1.00 0.83 H new ATOM 0 HB3 GLU B 52 27.461 0.235 -0.289 1.00 0.83 H new ATOM 0 HG2 GLU B 52 27.283 -1.830 1.100 1.00 1.57 H new ATOM 0 HG3 GLU B 52 26.958 -2.755 -0.352 1.00 1.57 H new ATOM 3115 N ALA B 53 25.826 0.714 1.754 1.00 0.58 N ATOM 3116 CA ALA B 53 25.742 0.926 3.197 1.00 0.58 C ATOM 3117 C ALA B 53 24.373 1.457 3.599 1.00 0.53 C ATOM 3118 O ALA B 53 24.009 1.441 4.770 1.00 0.58 O ATOM 3119 CB ALA B 53 26.834 1.880 3.657 1.00 0.70 C ATOM 0 H ALA B 53 26.416 1.387 1.264 1.00 0.58 H new ATOM 0 HA ALA B 53 25.886 -0.038 3.686 1.00 0.58 H new ATOM 0 HB1 ALA B 53 26.758 2.028 4.734 1.00 0.70 H new ATOM 0 HB2 ALA B 53 27.810 1.459 3.416 1.00 0.70 H new ATOM 0 HB3 ALA B 53 26.717 2.838 3.150 1.00 0.70 H new ATOM 3125 N ALA B 54 23.619 1.936 2.626 1.00 0.52 N ATOM 3126 CA ALA B 54 22.268 2.409 2.880 1.00 0.51 C ATOM 3127 C ALA B 54 21.311 1.241 3.017 1.00 0.39 C ATOM 3128 O ALA B 54 20.350 1.293 3.780 1.00 0.35 O ATOM 3129 CB ALA B 54 21.795 3.301 1.756 1.00 0.63 C ATOM 0 H ALA B 54 23.918 2.008 1.653 1.00 0.52 H new ATOM 0 HA ALA B 54 22.285 2.977 3.810 1.00 0.51 H new ATOM 0 HB1 ALA B 54 20.782 3.644 1.966 1.00 0.63 H new ATOM 0 HB2 ALA B 54 22.459 4.161 1.670 1.00 0.63 H new ATOM 0 HB3 ALA B 54 21.802 2.742 0.820 1.00 0.63 H new ATOM 3135 N PHE B 55 21.571 0.184 2.267 1.00 0.38 N ATOM 3136 CA PHE B 55 20.650 -0.937 2.218 1.00 0.32 C ATOM 3137 C PHE B 55 20.694 -1.774 3.492 1.00 0.31 C ATOM 3138 O PHE B 55 19.683 -2.356 3.888 1.00 0.31 O ATOM 3139 CB PHE B 55 20.903 -1.818 1.003 1.00 0.41 C ATOM 3140 CG PHE B 55 19.626 -2.398 0.489 1.00 0.36 C ATOM 3141 CD1 PHE B 55 19.015 -3.455 1.141 1.00 1.23 C ATOM 3142 CD2 PHE B 55 19.011 -1.853 -0.620 1.00 1.25 C ATOM 3143 CE1 PHE B 55 17.812 -3.954 0.699 1.00 1.30 C ATOM 3144 CE2 PHE B 55 17.812 -2.353 -1.072 1.00 1.22 C ATOM 3145 CZ PHE B 55 17.209 -3.404 -0.410 1.00 0.46 C ATOM 0 H PHE B 55 22.405 0.079 1.689 1.00 0.38 H new ATOM 0 HA PHE B 55 19.651 -0.509 2.133 1.00 0.32 H new ATOM 0 HB2 PHE B 55 21.383 -1.233 0.218 1.00 0.41 H new ATOM 0 HB3 PHE B 55 21.591 -2.621 1.268 1.00 0.41 H new ATOM 0 HD1 PHE B 55 19.489 -3.893 2.007 1.00 1.23 H new ATOM 0 HD2 PHE B 55 19.475 -1.027 -1.137 1.00 1.25 H new ATOM 0 HE1 PHE B 55 17.342 -4.775 1.220 1.00 1.30 H new ATOM 0 HE2 PHE B 55 17.342 -1.924 -1.945 1.00 1.22 H new ATOM 0 HZ PHE B 55 16.265 -3.794 -0.762 1.00 0.46 H new ATOM 3155 N GLN B 56 21.850 -1.824 4.148 1.00 0.35 N ATOM 3156 CA GLN B 56 21.947 -2.505 5.436 1.00 0.41 C ATOM 3157 C GLN B 56 21.084 -1.778 6.463 1.00 0.42 C ATOM 3158 O GLN B 56 20.758 -2.313 7.524 1.00 0.52 O ATOM 3159 CB GLN B 56 23.401 -2.591 5.917 1.00 0.51 C ATOM 3160 CG GLN B 56 24.063 -1.241 6.124 1.00 0.53 C ATOM 3161 CD GLN B 56 25.455 -1.350 6.721 1.00 0.69 C ATOM 3162 OE1 GLN B 56 26.138 -2.450 6.450 1.00 1.15 O flip ATOM 3163 NE2 GLN B 56 25.911 -0.447 7.422 1.00 1.53 N flip ATOM 0 H GLN B 56 22.720 -1.408 3.816 1.00 0.35 H new ATOM 0 HA GLN B 56 21.583 -3.526 5.316 1.00 0.41 H new ATOM 0 HB2 GLN B 56 23.431 -3.146 6.854 1.00 0.51 H new ATOM 0 HB3 GLN B 56 23.980 -3.161 5.190 1.00 0.51 H new ATOM 0 HG2 GLN B 56 24.123 -0.721 5.168 1.00 0.53 H new ATOM 0 HG3 GLN B 56 23.439 -0.633 6.779 1.00 0.53 H new ATOM 0 HE21 GLN B 56 25.352 0.386 7.608 1.00 1.53 H new ATOM 0 HE22 GLN B 56 26.848 -0.532 7.817 1.00 1.53 H new ATOM 3172 N LYS B 57 20.728 -0.544 6.130 1.00 0.36 N ATOM 3173 CA LYS B 57 19.795 0.232 6.924 1.00 0.39 C ATOM 3174 C LYS B 57 18.374 -0.001 6.422 1.00 0.34 C ATOM 3175 O LYS B 57 17.463 -0.202 7.211 1.00 0.41 O ATOM 3176 CB LYS B 57 20.140 1.720 6.838 1.00 0.44 C ATOM 3177 CG LYS B 57 21.599 2.018 7.140 1.00 0.54 C ATOM 3178 CD LYS B 57 21.939 3.475 6.883 1.00 0.61 C ATOM 3179 CE LYS B 57 23.431 3.717 7.031 1.00 0.79 C ATOM 3180 NZ LYS B 57 23.793 5.145 6.847 1.00 1.27 N ATOM 0 H LYS B 57 21.078 -0.058 5.305 1.00 0.36 H new ATOM 0 HA LYS B 57 19.865 -0.086 7.964 1.00 0.39 H new ATOM 0 HB2 LYS B 57 19.902 2.084 5.839 1.00 0.44 H new ATOM 0 HB3 LYS B 57 19.512 2.272 7.537 1.00 0.44 H new ATOM 0 HG2 LYS B 57 21.813 1.772 8.180 1.00 0.54 H new ATOM 0 HG3 LYS B 57 22.235 1.382 6.525 1.00 0.54 H new ATOM 0 HD2 LYS B 57 21.619 3.756 5.880 1.00 0.61 H new ATOM 0 HD3 LYS B 57 21.393 4.109 7.581 1.00 0.61 H new ATOM 0 HE2 LYS B 57 23.754 3.387 8.019 1.00 0.79 H new ATOM 0 HE3 LYS B 57 23.969 3.112 6.301 1.00 0.79 H new ATOM 0 HZ1 LYS B 57 24.821 5.260 6.957 1.00 1.27 H new ATOM 0 HZ2 LYS B 57 23.510 5.455 5.895 1.00 1.27 H new ATOM 0 HZ3 LYS B 57 23.302 5.722 7.559 1.00 1.27 H new ATOM 3194 N LEU B 58 18.216 -0.010 5.095 1.00 0.27 N ATOM 3195 CA LEU B 58 16.900 -0.110 4.454 1.00 0.25 C ATOM 3196 C LEU B 58 16.108 -1.322 4.935 1.00 0.24 C ATOM 3197 O LEU B 58 14.976 -1.186 5.394 1.00 0.26 O ATOM 3198 CB LEU B 58 17.037 -0.172 2.930 1.00 0.22 C ATOM 3199 CG LEU B 58 15.701 -0.213 2.191 1.00 0.22 C ATOM 3200 CD1 LEU B 58 14.931 1.057 2.452 1.00 0.26 C ATOM 3201 CD2 LEU B 58 15.896 -0.397 0.702 1.00 0.23 C ATOM 0 H LEU B 58 18.993 0.052 4.437 1.00 0.27 H new ATOM 0 HA LEU B 58 16.352 0.788 4.739 1.00 0.25 H new ATOM 0 HB2 LEU B 58 17.603 0.695 2.590 1.00 0.22 H new ATOM 0 HB3 LEU B 58 17.617 -1.056 2.663 1.00 0.22 H new ATOM 0 HG LEU B 58 15.137 -1.068 2.565 1.00 0.22 H new ATOM 0 HD11 LEU B 58 13.979 1.021 1.922 1.00 0.26 H new ATOM 0 HD12 LEU B 58 14.747 1.158 3.522 1.00 0.26 H new ATOM 0 HD13 LEU B 58 15.509 1.912 2.101 1.00 0.26 H new ATOM 0 HD21 LEU B 58 14.925 -0.422 0.208 1.00 0.23 H new ATOM 0 HD22 LEU B 58 16.483 0.432 0.307 1.00 0.23 H new ATOM 0 HD23 LEU B 58 16.421 -1.334 0.517 1.00 0.23 H new ATOM 3213 N MET B 59 16.694 -2.504 4.800 1.00 0.24 N ATOM 3214 CA MET B 59 16.055 -3.734 5.265 1.00 0.27 C ATOM 3215 C MET B 59 15.617 -3.611 6.724 1.00 0.34 C ATOM 3216 O MET B 59 14.510 -4.005 7.088 1.00 0.41 O ATOM 3217 CB MET B 59 17.012 -4.921 5.075 1.00 0.28 C ATOM 3218 CG MET B 59 16.704 -6.143 5.937 1.00 0.30 C ATOM 3219 SD MET B 59 14.996 -6.715 5.826 1.00 0.31 S ATOM 3220 CE MET B 59 14.823 -7.002 4.072 1.00 0.25 C ATOM 0 H MET B 59 17.610 -2.640 4.373 1.00 0.24 H new ATOM 0 HA MET B 59 15.158 -3.907 4.670 1.00 0.27 H new ATOM 0 HB2 MET B 59 16.992 -5.220 4.027 1.00 0.28 H new ATOM 0 HB3 MET B 59 18.027 -4.588 5.292 1.00 0.28 H new ATOM 0 HG2 MET B 59 17.368 -6.957 5.644 1.00 0.30 H new ATOM 0 HG3 MET B 59 16.929 -5.906 6.977 1.00 0.30 H new ATOM 0 HE1 MET B 59 13.877 -7.507 3.878 1.00 0.25 H new ATOM 0 HE2 MET B 59 14.841 -6.049 3.544 1.00 0.25 H new ATOM 0 HE3 MET B 59 15.646 -7.626 3.723 1.00 0.25 H new ATOM 3230 N SER B 60 16.465 -3.016 7.541 1.00 0.39 N ATOM 3231 CA SER B 60 16.188 -2.889 8.961 1.00 0.51 C ATOM 3232 C SER B 60 15.276 -1.683 9.227 1.00 0.44 C ATOM 3233 O SER B 60 14.874 -1.429 10.361 1.00 0.51 O ATOM 3234 CB SER B 60 17.510 -2.776 9.723 1.00 0.70 C ATOM 3235 OG SER B 60 17.358 -3.084 11.101 1.00 1.36 O ATOM 0 H SER B 60 17.354 -2.612 7.246 1.00 0.39 H new ATOM 0 HA SER B 60 15.659 -3.775 9.313 1.00 0.51 H new ATOM 0 HB2 SER B 60 18.243 -3.450 9.280 1.00 0.70 H new ATOM 0 HB3 SER B 60 17.903 -1.765 9.619 1.00 0.70 H new ATOM 0 HG SER B 60 18.235 -3.284 11.490 1.00 1.36 H new ATOM 3241 N ASN B 61 14.951 -0.943 8.168 1.00 0.37 N ATOM 3242 CA ASN B 61 14.015 0.170 8.259 1.00 0.42 C ATOM 3243 C ASN B 61 12.615 -0.317 7.974 1.00 0.44 C ATOM 3244 O ASN B 61 11.649 0.147 8.579 1.00 0.64 O ATOM 3245 CB ASN B 61 14.385 1.301 7.297 1.00 0.46 C ATOM 3246 CG ASN B 61 15.416 2.245 7.881 1.00 0.47 C ATOM 3247 OD1 ASN B 61 16.276 1.846 8.665 1.00 0.96 O ATOM 3248 ND2 ASN B 61 15.330 3.515 7.518 1.00 0.92 N ATOM 0 H ASN B 61 15.326 -1.098 7.232 1.00 0.37 H new ATOM 0 HA ASN B 61 14.065 0.570 9.272 1.00 0.42 H new ATOM 0 HB2 ASN B 61 14.771 0.874 6.371 1.00 0.46 H new ATOM 0 HB3 ASN B 61 13.487 1.863 7.039 1.00 0.46 H new ATOM 0 HD21 ASN B 61 15.990 4.198 7.891 1.00 0.92 H new ATOM 0 HD22 ASN B 61 14.604 3.811 6.866 1.00 0.92 H new ATOM 3255 N LEU B 62 12.505 -1.265 7.058 1.00 0.33 N ATOM 3256 CA LEU B 62 11.223 -1.864 6.761 1.00 0.39 C ATOM 3257 C LEU B 62 10.847 -2.833 7.849 1.00 0.54 C ATOM 3258 O LEU B 62 9.883 -2.613 8.577 1.00 1.18 O ATOM 3259 CB LEU B 62 11.247 -2.586 5.417 1.00 0.35 C ATOM 3260 CG LEU B 62 10.897 -1.717 4.224 1.00 0.25 C ATOM 3261 CD1 LEU B 62 9.569 -1.014 4.472 1.00 0.24 C ATOM 3262 CD2 LEU B 62 12.001 -0.717 3.939 1.00 0.22 C ATOM 0 H LEU B 62 13.285 -1.632 6.513 1.00 0.33 H new ATOM 0 HA LEU B 62 10.482 -1.066 6.707 1.00 0.39 H new ATOM 0 HB2 LEU B 62 12.241 -3.007 5.264 1.00 0.35 H new ATOM 0 HB3 LEU B 62 10.549 -3.423 5.457 1.00 0.35 H new ATOM 0 HG LEU B 62 10.797 -2.351 3.343 1.00 0.25 H new ATOM 0 HD11 LEU B 62 9.321 -0.391 3.613 1.00 0.24 H new ATOM 0 HD12 LEU B 62 8.786 -1.758 4.619 1.00 0.24 H new ATOM 0 HD13 LEU B 62 9.648 -0.390 5.362 1.00 0.24 H new ATOM 0 HD21 LEU B 62 11.726 -0.106 3.079 1.00 0.22 H new ATOM 0 HD22 LEU B 62 12.144 -0.076 4.809 1.00 0.22 H new ATOM 0 HD23 LEU B 62 12.928 -1.249 3.724 1.00 0.22 H new ATOM 3274 N ASP B 63 11.648 -3.877 7.970 1.00 0.31 N ATOM 3275 CA ASP B 63 11.392 -4.944 8.915 1.00 0.33 C ATOM 3276 C ASP B 63 11.348 -4.395 10.335 1.00 0.37 C ATOM 3277 O ASP B 63 12.382 -4.089 10.932 1.00 0.43 O ATOM 3278 CB ASP B 63 12.477 -6.011 8.785 1.00 0.40 C ATOM 3279 CG ASP B 63 12.144 -7.285 9.526 1.00 0.38 C ATOM 3280 OD1 ASP B 63 11.126 -7.321 10.249 1.00 1.15 O ATOM 3281 OD2 ASP B 63 12.920 -8.252 9.398 1.00 1.08 O ATOM 0 H ASP B 63 12.494 -4.007 7.415 1.00 0.31 H new ATOM 0 HA ASP B 63 10.424 -5.394 8.695 1.00 0.33 H new ATOM 0 HB2 ASP B 63 12.629 -6.240 7.730 1.00 0.40 H new ATOM 0 HB3 ASP B 63 13.418 -5.612 9.164 1.00 0.40 H new ATOM 3286 N SER B 64 10.142 -4.259 10.863 1.00 0.43 N ATOM 3287 CA SER B 64 9.942 -3.723 12.194 1.00 0.52 C ATOM 3288 C SER B 64 10.222 -4.804 13.231 1.00 0.58 C ATOM 3289 O SER B 64 10.359 -4.528 14.423 1.00 0.71 O ATOM 3290 CB SER B 64 8.520 -3.174 12.327 1.00 0.67 C ATOM 3291 OG SER B 64 8.243 -2.229 11.298 1.00 1.14 O ATOM 0 H SER B 64 9.280 -4.516 10.382 1.00 0.43 H new ATOM 0 HA SER B 64 10.636 -2.900 12.367 1.00 0.52 H new ATOM 0 HB2 SER B 64 7.803 -3.993 12.277 1.00 0.67 H new ATOM 0 HB3 SER B 64 8.397 -2.703 13.302 1.00 0.67 H new ATOM 0 HG SER B 64 7.899 -2.697 10.509 1.00 1.14 H new ATOM 3297 N ASN B 65 10.322 -6.043 12.758 1.00 0.60 N ATOM 3298 CA ASN B 65 10.756 -7.151 13.596 1.00 0.75 C ATOM 3299 C ASN B 65 12.272 -7.130 13.656 1.00 0.76 C ATOM 3300 O ASN B 65 12.886 -7.676 14.573 1.00 0.91 O ATOM 3301 CB ASN B 65 10.306 -8.496 13.013 1.00 0.89 C ATOM 3302 CG ASN B 65 8.872 -8.490 12.527 1.00 1.52 C ATOM 3303 OD1 ASN B 65 7.945 -8.799 13.275 1.00 1.87 O ATOM 3304 ND2 ASN B 65 8.682 -8.146 11.263 1.00 2.34 N ATOM 0 H ASN B 65 10.107 -6.303 11.795 1.00 0.60 H new ATOM 0 HA ASN B 65 10.315 -7.041 14.587 1.00 0.75 H new ATOM 0 HB2 ASN B 65 10.962 -8.762 12.184 1.00 0.89 H new ATOM 0 HB3 ASN B 65 10.422 -9.270 13.772 1.00 0.89 H new ATOM 0 HD21 ASN B 65 7.739 -8.130 10.875 1.00 2.34 H new ATOM 0 HD22 ASN B 65 9.479 -7.897 10.677 1.00 2.34 H new ATOM 3311 N ARG B 66 12.854 -6.467 12.657 1.00 0.68 N ATOM 3312 CA ARG B 66 14.298 -6.371 12.491 1.00 0.81 C ATOM 3313 C ARG B 66 14.906 -7.767 12.453 1.00 0.88 C ATOM 3314 O ARG B 66 15.823 -8.095 13.209 1.00 1.11 O ATOM 3315 CB ARG B 66 14.920 -5.509 13.597 1.00 1.04 C ATOM 3316 CG ARG B 66 14.192 -4.186 13.797 1.00 1.10 C ATOM 3317 CD ARG B 66 15.041 -3.169 14.540 1.00 1.39 C ATOM 3318 NE ARG B 66 16.086 -2.604 13.687 1.00 2.08 N ATOM 3319 CZ ARG B 66 16.559 -1.363 13.805 1.00 2.77 C ATOM 3320 NH1 ARG B 66 16.086 -0.541 14.738 1.00 2.86 N ATOM 3321 NH2 ARG B 66 17.493 -0.936 12.970 1.00 3.79 N ATOM 0 H ARG B 66 12.327 -5.977 11.934 1.00 0.68 H new ATOM 0 HA ARG B 66 14.516 -5.879 11.543 1.00 0.81 H new ATOM 0 HB2 ARG B 66 14.913 -6.067 14.533 1.00 1.04 H new ATOM 0 HB3 ARG B 66 15.963 -5.310 13.352 1.00 1.04 H new ATOM 0 HG2 ARG B 66 13.908 -3.779 12.826 1.00 1.10 H new ATOM 0 HG3 ARG B 66 13.270 -4.361 14.351 1.00 1.10 H new ATOM 0 HD2 ARG B 66 14.404 -2.367 14.913 1.00 1.39 H new ATOM 0 HD3 ARG B 66 15.498 -3.643 15.409 1.00 1.39 H new ATOM 0 HE ARG B 66 16.478 -3.197 12.955 1.00 2.08 H new ATOM 0 HH11 ARG B 66 15.353 -0.858 15.373 1.00 2.86 H new ATOM 0 HH12 ARG B 66 16.456 0.406 14.818 1.00 2.86 H new ATOM 0 HH21 ARG B 66 17.847 -1.555 12.241 1.00 3.79 H new ATOM 0 HH22 ARG B 66 17.859 0.012 13.055 1.00 3.79 H new ATOM 3335 N ASP B 67 14.379 -8.583 11.551 1.00 0.75 N ATOM 3336 CA ASP B 67 14.786 -9.973 11.429 1.00 0.88 C ATOM 3337 C ASP B 67 15.610 -10.148 10.159 1.00 0.77 C ATOM 3338 O ASP B 67 16.220 -11.194 9.936 1.00 0.96 O ATOM 3339 CB ASP B 67 13.549 -10.873 11.406 1.00 1.00 C ATOM 3340 CG ASP B 67 13.887 -12.348 11.440 1.00 1.39 C ATOM 3341 OD1 ASP B 67 14.493 -12.798 12.432 1.00 1.95 O ATOM 3342 OD2 ASP B 67 13.519 -13.069 10.491 1.00 1.93 O ATOM 0 H ASP B 67 13.660 -8.300 10.886 1.00 0.75 H new ATOM 0 HA ASP B 67 15.399 -10.256 12.285 1.00 0.88 H new ATOM 0 HB2 ASP B 67 12.916 -10.632 12.260 1.00 1.00 H new ATOM 0 HB3 ASP B 67 12.969 -10.660 10.508 1.00 1.00 H new ATOM 3347 N ASN B 68 15.605 -9.094 9.338 1.00 0.62 N ATOM 3348 CA ASN B 68 16.433 -8.999 8.129 1.00 0.55 C ATOM 3349 C ASN B 68 15.789 -9.736 6.964 1.00 0.43 C ATOM 3350 O ASN B 68 16.465 -10.153 6.020 1.00 0.57 O ATOM 3351 CB ASN B 68 17.867 -9.500 8.371 1.00 0.77 C ATOM 3352 CG ASN B 68 18.709 -8.531 9.188 1.00 1.30 C ATOM 3353 OD1 ASN B 68 19.919 -8.429 8.991 1.00 1.41 O ATOM 3354 ND2 ASN B 68 18.081 -7.814 10.105 1.00 2.22 N ATOM 0 H ASN B 68 15.020 -8.273 9.494 1.00 0.62 H new ATOM 0 HA ASN B 68 16.499 -7.942 7.869 1.00 0.55 H new ATOM 0 HB2 ASN B 68 17.828 -10.460 8.885 1.00 0.77 H new ATOM 0 HB3 ASN B 68 18.352 -9.672 7.410 1.00 0.77 H new ATOM 0 HD21 ASN B 68 18.602 -7.149 10.677 1.00 2.22 H new ATOM 0 HD22 ASN B 68 17.076 -7.926 10.240 1.00 2.22 H new ATOM 3361 N GLU B 69 14.469 -9.837 7.016 1.00 0.42 N ATOM 3362 CA GLU B 69 13.683 -10.443 5.955 1.00 0.42 C ATOM 3363 C GLU B 69 12.211 -10.091 6.147 1.00 0.39 C ATOM 3364 O GLU B 69 11.567 -10.515 7.107 1.00 0.54 O ATOM 3365 CB GLU B 69 13.920 -11.959 5.869 1.00 0.60 C ATOM 3366 CG GLU B 69 13.937 -12.682 7.206 1.00 1.04 C ATOM 3367 CD GLU B 69 14.667 -14.009 7.128 1.00 1.44 C ATOM 3368 OE1 GLU B 69 14.097 -14.979 6.586 1.00 2.09 O ATOM 3369 OE2 GLU B 69 15.827 -14.087 7.590 1.00 1.84 O ATOM 0 H GLU B 69 13.911 -9.499 7.800 1.00 0.42 H new ATOM 0 HA GLU B 69 14.006 -10.037 4.996 1.00 0.42 H new ATOM 0 HB2 GLU B 69 13.142 -12.399 5.245 1.00 0.60 H new ATOM 0 HB3 GLU B 69 14.870 -12.135 5.365 1.00 0.60 H new ATOM 0 HG2 GLU B 69 14.415 -12.049 7.954 1.00 1.04 H new ATOM 0 HG3 GLU B 69 12.913 -12.851 7.539 1.00 1.04 H new ATOM 3376 N VAL B 70 11.707 -9.294 5.221 1.00 0.28 N ATOM 3377 CA VAL B 70 10.402 -8.661 5.334 1.00 0.25 C ATOM 3378 C VAL B 70 9.260 -9.608 4.965 1.00 0.25 C ATOM 3379 O VAL B 70 9.306 -10.295 3.941 1.00 0.33 O ATOM 3380 CB VAL B 70 10.361 -7.393 4.449 1.00 0.26 C ATOM 3381 CG1 VAL B 70 8.940 -6.956 4.154 1.00 0.29 C ATOM 3382 CG2 VAL B 70 11.124 -6.264 5.121 1.00 0.30 C ATOM 0 H VAL B 70 12.198 -9.064 4.357 1.00 0.28 H new ATOM 0 HA VAL B 70 10.257 -8.386 6.379 1.00 0.25 H new ATOM 0 HB VAL B 70 10.835 -7.638 3.499 1.00 0.26 H new ATOM 0 HG11 VAL B 70 8.956 -6.062 3.530 1.00 0.29 H new ATOM 0 HG12 VAL B 70 8.415 -7.755 3.630 1.00 0.29 H new ATOM 0 HG13 VAL B 70 8.425 -6.736 5.089 1.00 0.29 H new ATOM 0 HG21 VAL B 70 11.089 -5.376 4.490 1.00 0.30 H new ATOM 0 HG22 VAL B 70 10.669 -6.042 6.086 1.00 0.30 H new ATOM 0 HG23 VAL B 70 12.161 -6.564 5.269 1.00 0.30 H new ATOM 3392 N ASP B 71 8.236 -9.628 5.813 1.00 0.25 N ATOM 3393 CA ASP B 71 7.065 -10.476 5.615 1.00 0.29 C ATOM 3394 C ASP B 71 5.954 -9.715 4.893 1.00 0.22 C ATOM 3395 O ASP B 71 6.147 -8.578 4.473 1.00 0.21 O ATOM 3396 CB ASP B 71 6.541 -10.995 6.958 1.00 0.42 C ATOM 3397 CG ASP B 71 5.972 -9.885 7.821 1.00 1.18 C ATOM 3398 OD1 ASP B 71 6.740 -9.278 8.592 1.00 2.06 O ATOM 3399 OD2 ASP B 71 4.754 -9.620 7.737 1.00 1.72 O ATOM 0 H ASP B 71 8.195 -9.057 6.657 1.00 0.25 H new ATOM 0 HA ASP B 71 7.370 -11.322 4.999 1.00 0.29 H new ATOM 0 HB2 ASP B 71 5.770 -11.745 6.780 1.00 0.42 H new ATOM 0 HB3 ASP B 71 7.350 -11.491 7.494 1.00 0.42 H new ATOM 3404 N PHE B 72 4.788 -10.350 4.769 1.00 0.21 N ATOM 3405 CA PHE B 72 3.690 -9.821 3.964 1.00 0.19 C ATOM 3406 C PHE B 72 3.263 -8.411 4.393 1.00 0.15 C ATOM 3407 O PHE B 72 3.269 -7.493 3.568 1.00 0.14 O ATOM 3408 CB PHE B 72 2.485 -10.766 4.012 1.00 0.21 C ATOM 3409 CG PHE B 72 1.692 -10.792 2.730 1.00 0.20 C ATOM 3410 CD1 PHE B 72 1.787 -9.753 1.816 1.00 1.18 C ATOM 3411 CD2 PHE B 72 0.863 -11.861 2.433 1.00 1.19 C ATOM 3412 CE1 PHE B 72 1.075 -9.778 0.632 1.00 1.20 C ATOM 3413 CE2 PHE B 72 0.145 -11.891 1.252 1.00 1.20 C ATOM 3414 CZ PHE B 72 0.252 -10.849 0.352 1.00 0.32 C ATOM 0 H PHE B 72 4.580 -11.240 5.221 1.00 0.21 H new ATOM 0 HA PHE B 72 4.061 -9.750 2.942 1.00 0.19 H new ATOM 0 HB2 PHE B 72 2.833 -11.775 4.236 1.00 0.21 H new ATOM 0 HB3 PHE B 72 1.830 -10.466 4.830 1.00 0.21 H new ATOM 0 HD1 PHE B 72 2.428 -8.911 2.033 1.00 1.18 H new ATOM 0 HD2 PHE B 72 0.777 -12.680 3.132 1.00 1.19 H new ATOM 0 HE1 PHE B 72 1.162 -8.963 -0.071 1.00 1.20 H new ATOM 0 HE2 PHE B 72 -0.500 -12.729 1.033 1.00 1.20 H new ATOM 0 HZ PHE B 72 -0.309 -10.873 -0.571 1.00 0.32 H new ATOM 3424 N GLN B 73 2.892 -8.219 5.664 1.00 0.15 N ATOM 3425 CA GLN B 73 2.397 -6.908 6.093 1.00 0.14 C ATOM 3426 C GLN B 73 3.520 -5.890 6.034 1.00 0.12 C ATOM 3427 O GLN B 73 3.307 -4.755 5.618 1.00 0.13 O ATOM 3428 CB GLN B 73 1.789 -6.925 7.504 1.00 0.16 C ATOM 3429 CG GLN B 73 0.771 -5.816 7.719 1.00 0.26 C ATOM 3430 CD GLN B 73 0.380 -5.641 9.170 1.00 0.22 C ATOM 3431 OE1 GLN B 73 -0.554 -6.273 9.661 1.00 0.68 O ATOM 3432 NE2 GLN B 73 1.091 -4.774 9.867 1.00 0.60 N ATOM 0 H GLN B 73 2.923 -8.931 6.393 1.00 0.15 H new ATOM 0 HA GLN B 73 1.597 -6.633 5.405 1.00 0.14 H new ATOM 0 HB2 GLN B 73 1.311 -7.889 7.678 1.00 0.16 H new ATOM 0 HB3 GLN B 73 2.587 -6.827 8.240 1.00 0.16 H new ATOM 0 HG2 GLN B 73 1.180 -4.878 7.344 1.00 0.26 H new ATOM 0 HG3 GLN B 73 -0.122 -6.032 7.132 1.00 0.26 H new ATOM 0 HE21 GLN B 73 1.858 -4.270 9.423 1.00 0.60 H new ATOM 0 HE22 GLN B 73 0.873 -4.609 10.850 1.00 0.60 H new ATOM 3441 N GLU B 74 4.722 -6.320 6.411 1.00 0.14 N ATOM 3442 CA GLU B 74 5.889 -5.449 6.406 1.00 0.17 C ATOM 3443 C GLU B 74 6.213 -5.009 4.978 1.00 0.14 C ATOM 3444 O GLU B 74 6.733 -3.920 4.744 1.00 0.16 O ATOM 3445 CB GLU B 74 7.088 -6.180 7.004 1.00 0.27 C ATOM 3446 CG GLU B 74 8.120 -5.256 7.619 1.00 0.38 C ATOM 3447 CD GLU B 74 7.703 -4.768 8.989 1.00 0.43 C ATOM 3448 OE1 GLU B 74 7.854 -5.533 9.964 1.00 1.21 O ATOM 3449 OE2 GLU B 74 7.223 -3.626 9.112 1.00 1.10 O ATOM 0 H GLU B 74 4.911 -7.272 6.725 1.00 0.14 H new ATOM 0 HA GLU B 74 5.670 -4.567 7.008 1.00 0.17 H new ATOM 0 HB2 GLU B 74 6.735 -6.875 7.766 1.00 0.27 H new ATOM 0 HB3 GLU B 74 7.565 -6.776 6.225 1.00 0.27 H new ATOM 0 HG2 GLU B 74 9.074 -5.778 7.696 1.00 0.38 H new ATOM 0 HG3 GLU B 74 8.277 -4.400 6.962 1.00 0.38 H new ATOM 3456 N TYR B 75 5.901 -5.874 4.028 1.00 0.14 N ATOM 3457 CA TYR B 75 6.114 -5.583 2.622 1.00 0.14 C ATOM 3458 C TYR B 75 5.090 -4.577 2.124 1.00 0.11 C ATOM 3459 O TYR B 75 5.401 -3.696 1.332 1.00 0.13 O ATOM 3460 CB TYR B 75 6.015 -6.874 1.808 1.00 0.16 C ATOM 3461 CG TYR B 75 6.101 -6.683 0.310 1.00 0.17 C ATOM 3462 CD1 TYR B 75 4.980 -6.325 -0.432 1.00 1.19 C ATOM 3463 CD2 TYR B 75 7.297 -6.874 -0.363 1.00 1.21 C ATOM 3464 CE1 TYR B 75 5.048 -6.161 -1.797 1.00 1.20 C ATOM 3465 CE2 TYR B 75 7.375 -6.710 -1.735 1.00 1.22 C ATOM 3466 CZ TYR B 75 6.246 -6.355 -2.446 1.00 0.22 C ATOM 3467 OH TYR B 75 6.316 -6.190 -3.809 1.00 0.26 O ATOM 0 H TYR B 75 5.495 -6.792 4.209 1.00 0.14 H new ATOM 0 HA TYR B 75 7.108 -5.153 2.500 1.00 0.14 H new ATOM 0 HB2 TYR B 75 6.813 -7.547 2.121 1.00 0.16 H new ATOM 0 HB3 TYR B 75 5.071 -7.366 2.045 1.00 0.16 H new ATOM 0 HD1 TYR B 75 4.038 -6.173 0.073 1.00 1.19 H new ATOM 0 HD2 TYR B 75 8.181 -7.155 0.191 1.00 1.21 H new ATOM 0 HE1 TYR B 75 4.167 -5.882 -2.355 1.00 1.20 H new ATOM 0 HE2 TYR B 75 8.314 -6.859 -2.247 1.00 1.22 H new ATOM 0 HH TYR B 75 6.693 -5.309 -4.013 1.00 0.26 H new ATOM 3477 N CYS B 76 3.865 -4.714 2.587 1.00 0.11 N ATOM 3478 CA CYS B 76 2.797 -3.868 2.112 1.00 0.12 C ATOM 3479 C CYS B 76 2.795 -2.522 2.835 1.00 0.12 C ATOM 3480 O CYS B 76 2.468 -1.498 2.244 1.00 0.13 O ATOM 3481 CB CYS B 76 1.463 -4.585 2.281 1.00 0.14 C ATOM 3482 SG CYS B 76 1.417 -6.225 1.525 1.00 0.22 S ATOM 0 H CYS B 76 3.588 -5.401 3.288 1.00 0.11 H new ATOM 0 HA CYS B 76 2.955 -3.664 1.053 1.00 0.12 H new ATOM 0 HB2 CYS B 76 1.244 -4.679 3.345 1.00 0.14 H new ATOM 0 HB3 CYS B 76 0.674 -3.972 1.846 1.00 0.14 H new ATOM 0 HG CYS B 76 2.194 -7.030 2.187 1.00 0.22 H new ATOM 3488 N VAL B 77 3.167 -2.511 4.110 1.00 0.13 N ATOM 3489 CA VAL B 77 3.322 -1.253 4.836 1.00 0.14 C ATOM 3490 C VAL B 77 4.457 -0.462 4.197 1.00 0.14 C ATOM 3491 O VAL B 77 4.445 0.764 4.172 1.00 0.19 O ATOM 3492 CB VAL B 77 3.606 -1.489 6.337 1.00 0.16 C ATOM 3493 CG1 VAL B 77 4.868 -2.294 6.490 1.00 0.14 C ATOM 3494 CG2 VAL B 77 3.710 -0.184 7.119 1.00 0.20 C ATOM 0 H VAL B 77 3.365 -3.348 4.658 1.00 0.13 H new ATOM 0 HA VAL B 77 2.390 -0.692 4.774 1.00 0.14 H new ATOM 0 HB VAL B 77 2.763 -2.041 6.753 1.00 0.16 H new ATOM 0 HG11 VAL B 77 5.068 -2.460 7.549 1.00 0.14 H new ATOM 0 HG12 VAL B 77 4.750 -3.254 5.988 1.00 0.14 H new ATOM 0 HG13 VAL B 77 5.702 -1.752 6.044 1.00 0.14 H new ATOM 0 HG21 VAL B 77 3.910 -0.403 8.168 1.00 0.20 H new ATOM 0 HG22 VAL B 77 4.522 0.420 6.713 1.00 0.20 H new ATOM 0 HG23 VAL B 77 2.772 0.366 7.036 1.00 0.20 H new ATOM 3504 N PHE B 78 5.431 -1.199 3.668 1.00 0.11 N ATOM 3505 CA PHE B 78 6.473 -0.640 2.823 1.00 0.11 C ATOM 3506 C PHE B 78 5.844 0.139 1.682 1.00 0.11 C ATOM 3507 O PHE B 78 6.248 1.258 1.368 1.00 0.11 O ATOM 3508 CB PHE B 78 7.331 -1.787 2.273 1.00 0.12 C ATOM 3509 CG PHE B 78 8.120 -1.458 1.037 1.00 0.12 C ATOM 3510 CD1 PHE B 78 7.576 -1.658 -0.226 1.00 1.17 C ATOM 3511 CD2 PHE B 78 9.407 -0.969 1.140 1.00 1.18 C ATOM 3512 CE1 PHE B 78 8.307 -1.372 -1.358 1.00 1.18 C ATOM 3513 CE2 PHE B 78 10.144 -0.678 0.015 1.00 1.18 C ATOM 3514 CZ PHE B 78 9.595 -0.879 -1.237 1.00 0.15 C ATOM 0 H PHE B 78 5.516 -2.205 3.817 1.00 0.11 H new ATOM 0 HA PHE B 78 7.100 0.038 3.402 1.00 0.11 H new ATOM 0 HB2 PHE B 78 8.023 -2.108 3.052 1.00 0.12 H new ATOM 0 HB3 PHE B 78 6.681 -2.634 2.055 1.00 0.12 H new ATOM 0 HD1 PHE B 78 6.571 -2.041 -0.321 1.00 1.17 H new ATOM 0 HD2 PHE B 78 9.841 -0.813 2.117 1.00 1.18 H new ATOM 0 HE1 PHE B 78 7.877 -1.532 -2.336 1.00 1.18 H new ATOM 0 HE2 PHE B 78 11.149 -0.294 0.110 1.00 1.18 H new ATOM 0 HZ PHE B 78 10.171 -0.651 -2.122 1.00 0.15 H new ATOM 3524 N LEU B 79 4.837 -0.469 1.084 1.00 0.14 N ATOM 3525 CA LEU B 79 4.160 0.113 -0.051 1.00 0.16 C ATOM 3526 C LEU B 79 3.365 1.337 0.337 1.00 0.17 C ATOM 3527 O LEU B 79 3.530 2.410 -0.246 1.00 0.20 O ATOM 3528 CB LEU B 79 3.241 -0.910 -0.694 1.00 0.15 C ATOM 3529 CG LEU B 79 3.918 -1.822 -1.698 1.00 0.15 C ATOM 3530 CD1 LEU B 79 3.795 -3.266 -1.276 1.00 0.19 C ATOM 3531 CD2 LEU B 79 3.295 -1.611 -3.045 1.00 0.14 C ATOM 0 H LEU B 79 4.469 -1.376 1.372 1.00 0.14 H new ATOM 0 HA LEU B 79 4.924 0.420 -0.765 1.00 0.16 H new ATOM 0 HB2 LEU B 79 2.795 -1.522 0.090 1.00 0.15 H new ATOM 0 HB3 LEU B 79 2.426 -0.385 -1.192 1.00 0.15 H new ATOM 0 HG LEU B 79 4.980 -1.581 -1.747 1.00 0.15 H new ATOM 0 HD11 LEU B 79 4.288 -3.903 -2.011 1.00 0.19 H new ATOM 0 HD12 LEU B 79 4.267 -3.402 -0.303 1.00 0.19 H new ATOM 0 HD13 LEU B 79 2.741 -3.537 -1.209 1.00 0.19 H new ATOM 0 HD21 LEU B 79 3.776 -2.263 -3.774 1.00 0.14 H new ATOM 0 HD22 LEU B 79 2.232 -1.845 -2.995 1.00 0.14 H new ATOM 0 HD23 LEU B 79 3.424 -0.572 -3.347 1.00 0.14 H new ATOM 3543 N SER B 80 2.501 1.173 1.317 1.00 0.19 N ATOM 3544 CA SER B 80 1.701 2.272 1.805 1.00 0.21 C ATOM 3545 C SER B 80 2.585 3.386 2.305 1.00 0.20 C ATOM 3546 O SER B 80 2.230 4.553 2.209 1.00 0.24 O ATOM 3547 CB SER B 80 0.764 1.796 2.896 1.00 0.22 C ATOM 3548 OG SER B 80 1.354 0.770 3.672 1.00 0.18 O ATOM 0 H SER B 80 2.336 0.285 1.791 1.00 0.19 H new ATOM 0 HA SER B 80 1.100 2.659 0.982 1.00 0.21 H new ATOM 0 HB2 SER B 80 0.498 2.634 3.540 1.00 0.22 H new ATOM 0 HB3 SER B 80 -0.161 1.431 2.450 1.00 0.22 H new ATOM 0 HG SER B 80 0.658 0.154 3.984 1.00 0.18 H new ATOM 3554 N CYS B 81 3.744 3.019 2.820 1.00 0.17 N ATOM 3555 CA CYS B 81 4.742 3.990 3.177 1.00 0.18 C ATOM 3556 C CYS B 81 5.085 4.839 1.975 1.00 0.33 C ATOM 3557 O CYS B 81 4.982 6.048 2.033 1.00 0.72 O ATOM 3558 CB CYS B 81 6.006 3.326 3.692 1.00 0.30 C ATOM 3559 SG CYS B 81 7.457 4.380 3.527 1.00 1.83 S ATOM 0 H CYS B 81 4.011 2.051 2.998 1.00 0.17 H new ATOM 0 HA CYS B 81 4.330 4.612 3.972 1.00 0.18 H new ATOM 0 HB2 CYS B 81 5.871 3.061 4.741 1.00 0.30 H new ATOM 0 HB3 CYS B 81 6.172 2.397 3.147 1.00 0.30 H new ATOM 0 HG CYS B 81 7.994 4.199 2.357 1.00 1.83 H new ATOM 3565 N ILE B 82 5.474 4.193 0.882 1.00 0.17 N ATOM 3566 CA ILE B 82 5.892 4.911 -0.309 1.00 0.19 C ATOM 3567 C ILE B 82 4.772 5.803 -0.832 1.00 0.21 C ATOM 3568 O ILE B 82 4.967 6.992 -1.043 1.00 0.28 O ATOM 3569 CB ILE B 82 6.360 3.964 -1.436 1.00 0.19 C ATOM 3570 CG1 ILE B 82 7.447 3.022 -0.918 1.00 0.24 C ATOM 3571 CG2 ILE B 82 6.882 4.779 -2.610 1.00 0.24 C ATOM 3572 CD1 ILE B 82 8.392 2.528 -1.993 1.00 0.41 C ATOM 0 H ILE B 82 5.508 3.177 0.799 1.00 0.17 H new ATOM 0 HA ILE B 82 6.741 5.527 -0.011 1.00 0.19 H new ATOM 0 HB ILE B 82 5.514 3.364 -1.770 1.00 0.19 H new ATOM 0 HG12 ILE B 82 8.024 3.536 -0.149 1.00 0.24 H new ATOM 0 HG13 ILE B 82 6.974 2.164 -0.441 1.00 0.24 H new ATOM 0 HG21 ILE B 82 7.211 4.106 -3.402 1.00 0.24 H new ATOM 0 HG22 ILE B 82 6.088 5.423 -2.987 1.00 0.24 H new ATOM 0 HG23 ILE B 82 7.722 5.392 -2.283 1.00 0.24 H new ATOM 0 HD11 ILE B 82 9.134 1.865 -1.548 1.00 0.41 H new ATOM 0 HD12 ILE B 82 7.828 1.985 -2.751 1.00 0.41 H new ATOM 0 HD13 ILE B 82 8.895 3.378 -2.454 1.00 0.41 H new ATOM 3584 N ALA B 83 3.593 5.234 -1.008 1.00 0.26 N ATOM 3585 CA ALA B 83 2.469 5.987 -1.542 1.00 0.32 C ATOM 3586 C ALA B 83 2.063 7.123 -0.608 1.00 0.32 C ATOM 3587 O ALA B 83 1.770 8.233 -1.055 1.00 0.35 O ATOM 3588 CB ALA B 83 1.295 5.066 -1.796 1.00 0.42 C ATOM 0 H ALA B 83 3.388 4.259 -0.791 1.00 0.26 H new ATOM 0 HA ALA B 83 2.782 6.431 -2.487 1.00 0.32 H new ATOM 0 HB1 ALA B 83 0.460 5.642 -2.196 1.00 0.42 H new ATOM 0 HB2 ALA B 83 1.583 4.299 -2.515 1.00 0.42 H new ATOM 0 HB3 ALA B 83 0.995 4.593 -0.861 1.00 0.42 H new ATOM 3594 N MET B 84 2.056 6.849 0.688 1.00 0.33 N ATOM 3595 CA MET B 84 1.715 7.856 1.678 1.00 0.36 C ATOM 3596 C MET B 84 2.816 8.902 1.786 1.00 0.36 C ATOM 3597 O MET B 84 2.551 10.100 1.914 1.00 0.48 O ATOM 3598 CB MET B 84 1.473 7.201 3.032 1.00 0.38 C ATOM 3599 CG MET B 84 1.259 8.172 4.175 1.00 0.44 C ATOM 3600 SD MET B 84 1.015 7.305 5.731 1.00 0.38 S ATOM 3601 CE MET B 84 2.293 6.065 5.578 1.00 0.22 C ATOM 0 H MET B 84 2.284 5.934 1.078 1.00 0.33 H new ATOM 0 HA MET B 84 0.800 8.355 1.359 1.00 0.36 H new ATOM 0 HB2 MET B 84 0.600 6.552 2.956 1.00 0.38 H new ATOM 0 HB3 MET B 84 2.324 6.563 3.269 1.00 0.38 H new ATOM 0 HG2 MET B 84 2.120 8.836 4.257 1.00 0.44 H new ATOM 0 HG3 MET B 84 0.392 8.799 3.965 1.00 0.44 H new ATOM 0 HE1 MET B 84 2.622 5.757 6.571 1.00 0.22 H new ATOM 0 HE2 MET B 84 1.900 5.201 5.042 1.00 0.22 H new ATOM 0 HE3 MET B 84 3.138 6.479 5.028 1.00 0.22 H new ATOM 3611 N MET B 85 4.053 8.437 1.722 1.00 0.28 N ATOM 3612 CA MET B 85 5.213 9.307 1.731 1.00 0.29 C ATOM 3613 C MET B 85 5.164 10.248 0.523 1.00 0.34 C ATOM 3614 O MET B 85 5.720 11.342 0.539 1.00 0.48 O ATOM 3615 CB MET B 85 6.479 8.461 1.685 1.00 0.28 C ATOM 3616 CG MET B 85 7.711 9.209 2.145 1.00 0.32 C ATOM 3617 SD MET B 85 9.211 8.717 1.265 1.00 0.29 S ATOM 3618 CE MET B 85 9.298 6.996 1.743 1.00 0.25 C ATOM 0 H MET B 85 4.279 7.444 1.662 1.00 0.28 H new ATOM 0 HA MET B 85 5.214 9.905 2.642 1.00 0.29 H new ATOM 0 HB2 MET B 85 6.342 7.579 2.311 1.00 0.28 H new ATOM 0 HB3 MET B 85 6.636 8.107 0.666 1.00 0.28 H new ATOM 0 HG2 MET B 85 7.551 10.279 2.008 1.00 0.32 H new ATOM 0 HG3 MET B 85 7.852 9.042 3.213 1.00 0.32 H new ATOM 0 HE1 MET B 85 10.305 6.619 1.565 1.00 0.25 H new ATOM 0 HE2 MET B 85 9.057 6.900 2.802 1.00 0.25 H new ATOM 0 HE3 MET B 85 8.585 6.418 1.154 1.00 0.25 H new ATOM 3628 N CYS B 86 4.448 9.801 -0.506 1.00 0.31 N ATOM 3629 CA CYS B 86 4.423 10.456 -1.804 1.00 0.34 C ATOM 3630 C CYS B 86 3.478 11.657 -1.873 1.00 0.39 C ATOM 3631 O CYS B 86 3.630 12.504 -2.751 1.00 0.46 O ATOM 3632 CB CYS B 86 4.021 9.435 -2.871 1.00 0.39 C ATOM 3633 SG CYS B 86 3.880 10.111 -4.538 1.00 0.94 S ATOM 0 H CYS B 86 3.865 8.966 -0.458 1.00 0.31 H new ATOM 0 HA CYS B 86 5.427 10.843 -1.979 1.00 0.34 H new ATOM 0 HB2 CYS B 86 4.755 8.630 -2.880 1.00 0.39 H new ATOM 0 HB3 CYS B 86 3.066 8.992 -2.590 1.00 0.39 H new ATOM 0 HG CYS B 86 4.138 11.385 -4.513 1.00 0.94 H new ATOM 3639 N ASN B 87 2.508 11.750 -0.970 1.00 0.45 N ATOM 3640 CA ASN B 87 1.475 12.787 -1.092 1.00 0.58 C ATOM 3641 C ASN B 87 2.084 14.183 -1.050 1.00 0.68 C ATOM 3642 O ASN B 87 1.600 15.101 -1.702 1.00 0.89 O ATOM 3643 CB ASN B 87 0.414 12.652 -0.004 1.00 0.72 C ATOM 3644 CG ASN B 87 -0.844 13.444 -0.325 1.00 1.10 C ATOM 3645 OD1 ASN B 87 -0.983 14.596 0.065 1.00 1.72 O ATOM 3646 ND2 ASN B 87 -1.769 12.828 -1.043 1.00 1.77 N ATOM 0 H ASN B 87 2.410 11.137 -0.160 1.00 0.45 H new ATOM 0 HA ASN B 87 0.996 12.644 -2.061 1.00 0.58 H new ATOM 0 HB2 ASN B 87 0.157 11.600 0.121 1.00 0.72 H new ATOM 0 HB3 ASN B 87 0.825 12.995 0.946 1.00 0.72 H new ATOM 0 HD21 ASN B 87 -2.632 13.314 -1.288 1.00 1.77 H new ATOM 0 HD22 ASN B 87 -1.619 11.867 -1.351 1.00 1.77 H new ATOM 3653 N GLU B 88 3.162 14.331 -0.305 1.00 0.70 N ATOM 3654 CA GLU B 88 3.856 15.607 -0.215 1.00 0.89 C ATOM 3655 C GLU B 88 4.602 15.911 -1.510 1.00 0.86 C ATOM 3656 O GLU B 88 4.840 17.069 -1.847 1.00 1.06 O ATOM 3657 CB GLU B 88 4.825 15.575 0.956 1.00 1.03 C ATOM 3658 CG GLU B 88 4.136 15.363 2.289 1.00 1.51 C ATOM 3659 CD GLU B 88 5.118 15.116 3.404 1.00 1.72 C ATOM 3660 OE1 GLU B 88 6.069 15.908 3.544 1.00 2.33 O ATOM 3661 OE2 GLU B 88 4.974 14.102 4.115 1.00 1.98 O ATOM 0 H GLU B 88 3.579 13.583 0.249 1.00 0.70 H new ATOM 0 HA GLU B 88 3.122 16.397 -0.056 1.00 0.89 H new ATOM 0 HB2 GLU B 88 5.551 14.778 0.798 1.00 1.03 H new ATOM 0 HB3 GLU B 88 5.381 16.512 0.986 1.00 1.03 H new ATOM 0 HG2 GLU B 88 3.531 16.238 2.527 1.00 1.51 H new ATOM 0 HG3 GLU B 88 3.454 14.516 2.213 1.00 1.51 H new ATOM 3668 N PHE B 89 4.945 14.859 -2.233 1.00 0.69 N ATOM 3669 CA PHE B 89 5.725 14.975 -3.455 1.00 0.71 C ATOM 3670 C PHE B 89 4.834 15.120 -4.685 1.00 0.73 C ATOM 3671 O PHE B 89 4.867 16.139 -5.372 1.00 0.88 O ATOM 3672 CB PHE B 89 6.619 13.748 -3.608 1.00 0.69 C ATOM 3673 CG PHE B 89 7.675 13.646 -2.543 1.00 0.91 C ATOM 3674 CD1 PHE B 89 8.843 14.385 -2.635 1.00 1.53 C ATOM 3675 CD2 PHE B 89 7.498 12.816 -1.449 1.00 1.65 C ATOM 3676 CE1 PHE B 89 9.812 14.297 -1.655 1.00 1.89 C ATOM 3677 CE2 PHE B 89 8.464 12.723 -0.468 1.00 1.99 C ATOM 3678 CZ PHE B 89 9.624 13.466 -0.570 1.00 1.81 C ATOM 0 H PHE B 89 4.692 13.901 -1.991 1.00 0.69 H new ATOM 0 HA PHE B 89 6.335 15.875 -3.379 1.00 0.71 H new ATOM 0 HB2 PHE B 89 6.000 12.851 -3.584 1.00 0.69 H new ATOM 0 HB3 PHE B 89 7.100 13.777 -4.586 1.00 0.69 H new ATOM 0 HD1 PHE B 89 8.997 15.037 -3.482 1.00 1.53 H new ATOM 0 HD2 PHE B 89 6.592 12.234 -1.362 1.00 1.65 H new ATOM 0 HE1 PHE B 89 10.718 14.879 -1.738 1.00 1.89 H new ATOM 0 HE2 PHE B 89 8.313 12.070 0.379 1.00 1.99 H new ATOM 0 HZ PHE B 89 10.381 13.397 0.197 1.00 1.81 H new ATOM 3688 N PHE B 90 4.036 14.096 -4.948 1.00 0.63 N ATOM 3689 CA PHE B 90 3.247 14.029 -6.172 1.00 0.66 C ATOM 3690 C PHE B 90 1.974 14.867 -6.070 1.00 0.69 C ATOM 3691 O PHE B 90 1.606 15.561 -7.018 1.00 0.83 O ATOM 3692 CB PHE B 90 2.907 12.568 -6.484 1.00 0.69 C ATOM 3693 CG PHE B 90 2.123 12.371 -7.752 1.00 0.95 C ATOM 3694 CD1 PHE B 90 2.769 12.320 -8.974 1.00 1.79 C ATOM 3695 CD2 PHE B 90 0.747 12.223 -7.719 1.00 1.44 C ATOM 3696 CE1 PHE B 90 2.059 12.127 -10.142 1.00 2.09 C ATOM 3697 CE2 PHE B 90 0.031 12.031 -8.883 1.00 1.68 C ATOM 3698 CZ PHE B 90 0.688 11.983 -10.097 1.00 1.67 C ATOM 0 H PHE B 90 3.917 13.295 -4.327 1.00 0.63 H new ATOM 0 HA PHE B 90 3.842 14.444 -6.985 1.00 0.66 H new ATOM 0 HB2 PHE B 90 3.834 11.998 -6.552 1.00 0.69 H new ATOM 0 HB3 PHE B 90 2.338 12.154 -5.651 1.00 0.69 H new ATOM 0 HD1 PHE B 90 3.842 12.433 -9.015 1.00 1.79 H new ATOM 0 HD2 PHE B 90 0.228 12.258 -6.772 1.00 1.44 H new ATOM 0 HE1 PHE B 90 2.576 12.089 -11.089 1.00 2.09 H new ATOM 0 HE2 PHE B 90 -1.042 11.918 -8.845 1.00 1.68 H new ATOM 0 HZ PHE B 90 0.129 11.833 -11.009 1.00 1.67 H new