USER MOD reduce.3.24.130724 H: found=0, std=0, add=1556, rem=0, adj=63 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 -80:sc= -12.2! USER MOD Set 1.2: B 85 MET CE :methyl -157:sc= -0.153 (180deg=-1.06) USER MOD Set 2.1: B 18 LYS NZ :NH3+ -146:sc= 0.0278 (180deg=0) USER MOD Set 2.2: B 19 TYR OH : rot -138:sc= 1.27 USER MOD Set 3.1: A 12 MET CE :methyl 163:sc= -0.272 (180deg=-0.784) USER MOD Set 3.2: A 80 SER OG : rot -80:sc= -0.545 USER MOD Set 3.3: B 12 MET CE :methyl 178:sc= -2.67 (180deg=-2.56) USER MOD Set 3.4: B 80 SER OG : rot -154:sc= -0.57! USER MOD Set 4.1: A 81 CYS SG : rot 38:sc= -5.46! USER MOD Set 4.2: A 84 MET CE :methyl -175:sc= -3.69! (180deg=-3.99!) USER MOD Set 4.3: C1910 MET CE :methyl -173:sc= -4.64! (180deg=-5.04!) USER MOD Set 5.1: A 73 GLN :FLIP amide:sc= -0.159 F(o=-1.9!,f=-0.16) USER MOD Set 5.2: C1915 SER OG : rot 180:sc= 0 USER MOD Set 6.1: A 64 SER OG : rot -9:sc= 1.21 USER MOD Set 6.2: C1911 ASN :FLIP amide:sc= -0.156 F(o=-0.59,f=1.1) USER MOD Set 7.1: A 57 LYS NZ :NH3+ -152:sc= 0 (180deg=0) USER MOD Set 7.2: A 61 ASN : amide:sc= -5.93! C(o=-5.9!,f=-6.4!) USER MOD Set 8.1: A 18 LYS NZ :NH3+ -147:sc= 0.0315 (180deg=0) USER MOD Set 8.2: A 19 TYR OH : rot -139:sc= 1.27 USER MOD Single : A 3 CYS SG : rot 180:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ 167:sc= 0.568 (180deg=0.452) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot 81:sc= 0.0082 USER MOD Single : A 17 HIS : no HD1:sc= -0.377 K(o=-0.38,f=-0.93) USER MOD Single : A 20 SER OG : rot -101:sc= 1.02 USER MOD Single : A 28 LYS NZ :NH3+ 159:sc= 1.12 (180deg=0.65) USER MOD Single : A 30 ASN : amide:sc= -1.52! C(o=-1.5!,f=-5.5!) USER MOD Single : A 31 LYS NZ :NH3+ 145:sc= -0.209 (180deg=-2.58!) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ -162:sc= 1.27 (180deg=0.967) USER MOD Single : A 39 THR OG1 : rot -6:sc= -0.266 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot 84:sc= -4.39! USER MOD Single : A 56 GLN : amide:sc= 0 K(o=0,f=-0.73) USER MOD Single : A 59 MET CE :methyl -175:sc= -3.3! (180deg=-3.31!) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 65 ASN : amide:sc= -2.03! C(o=-2!,f=-5.8!) USER MOD Single : A 68 ASN :FLIP amide:sc=-0.00906 F(o=-1.3!,f=-0.0091) USER MOD Single : A 75 TYR OH : rot 70:sc= -1.75! USER MOD Single : A 76 CYS SG : rot 60:sc= -4.12! USER MOD Single : A 85 MET CE :methyl 177:sc= -7.99 (180deg=-8.37!) USER MOD Single : A 86 CYS SG : rot -23:sc= 0.0377 USER MOD Single : A 87 ASN : amide:sc= 0 X(o=0,f=-0.014) USER MOD Single : B 3 CYS SG : rot 180:sc= 0 USER MOD Single : B 7 LYS NZ :NH3+ 170:sc= 0.563 (180deg=0.456) USER MOD Single : B 14 SER OG : rot 180:sc= 0 USER MOD Single : B 15 THR OG1 : rot 83:sc= 0.522 USER MOD Single : B 17 HIS : no HD1:sc= -0.322 K(o=-0.32,f=-0.89) USER MOD Single : B 20 SER OG : rot -101:sc= 1.04 USER MOD Single : B 28 LYS NZ :NH3+ -116:sc= 0.136 (180deg=-0.456) USER MOD Single : B 30 ASN : amide:sc= -1.76! C(o=-1.8!,f=-5.7!) USER MOD Single : B 31 LYS NZ :NH3+ 140:sc= -1.24 (180deg=-3.47!) 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 -8:sc= -0.225 USER MOD Single : B 44 SER OG : rot 180:sc= 0 USER MOD Single : B 48 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0337) USER MOD Single : B 50 THR OG1 : rot 49:sc= 0.0923 USER MOD Single : B 56 GLN :FLIP amide:sc= 0 F(o=-0.86,f=0) USER MOD Single : B 57 LYS NZ :NH3+ -167:sc= -0.0296 (180deg=-0.219) USER MOD Single : B 59 MET CE :methyl 172:sc= -2.45 (180deg=-2.85) USER MOD Single : B 60 SER OG : rot -32:sc= 0.295 USER MOD Single : B 61 ASN : amide:sc= -1.11! C(o=-1.1!,f=-5.4!) USER MOD Single : B 64 SER OG : rot 180:sc= 0 USER MOD Single : B 65 ASN : amide:sc= 1.18 K(o=1.2,f=-0.043) USER MOD Single : B 68 ASN :FLIP amide:sc= -0.0786 F(o=-1.7!,f=-0.079) USER MOD Single : B 73 GLN : amide:sc= 0.669 K(o=0.67,f=-1.9) USER MOD Single : B 75 TYR OH : rot 90:sc= -0.701 USER MOD Single : B 76 CYS SG : rot 71:sc= -0.291 USER MOD Single : B 84 MET CE :methyl 147:sc= -7.35! (180deg=-10.8!) USER MOD Single : B 86 CYS SG : rot 40:sc= -1.97! USER MOD Single : B 87 ASN : amide:sc= -0.121 X(o=-0.12,f=-0.016) USER MOD Single : C1904 THR OG1 : rot -80:sc= -1.55 USER MOD Single : C1906 THR OG1 : rot 180:sc= 0.059 USER MOD Single : C1916 SER OG : rot 180:sc= 0 USER MOD Single : C1918 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0204) USER MOD Single : C1919 ASN : amide:sc=-0.00581 X(o=-0.0058,f=0) USER MOD Single : C1920 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 44 N GLU C1899 -14.614 -8.844 2.306 1.00 0.40 N ATOM 45 CA GLU C1899 -13.200 -9.053 2.343 1.00 0.29 C ATOM 46 C GLU C1899 -12.574 -7.951 3.170 1.00 0.24 C ATOM 47 O GLU C1899 -11.608 -8.169 3.891 1.00 0.27 O ATOM 48 CB GLU C1899 -12.671 -9.000 0.918 1.00 0.30 C ATOM 49 CG GLU C1899 -13.226 -7.808 0.150 1.00 0.35 C ATOM 50 CD GLU C1899 -14.577 -8.091 -0.465 1.00 0.62 C ATOM 51 OE1 GLU C1899 -14.644 -8.735 -1.529 1.00 0.76 O ATOM 52 OE2 GLU C1899 -15.589 -7.684 0.148 1.00 0.97 O ATOM 0 HA GLU C1899 -12.958 -10.019 2.785 1.00 0.29 H new ATOM 0 HB2 GLU C1899 -11.583 -8.945 0.937 1.00 0.30 H new ATOM 0 HB3 GLU C1899 -12.935 -9.921 0.398 1.00 0.30 H new ATOM 0 HG2 GLU C1899 -13.309 -6.954 0.822 1.00 0.35 H new ATOM 0 HG3 GLU C1899 -12.524 -7.528 -0.636 1.00 0.35 H new ATOM 59 N LEU C1900 -13.189 -6.766 3.094 1.00 0.24 N ATOM 60 CA LEU C1900 -12.653 -5.582 3.739 1.00 0.25 C ATOM 61 C LEU C1900 -12.744 -5.684 5.264 1.00 0.28 C ATOM 62 O LEU C1900 -12.169 -4.865 5.972 1.00 0.44 O ATOM 63 CB LEU C1900 -13.345 -4.292 3.252 1.00 0.33 C ATOM 64 CG LEU C1900 -12.948 -3.762 1.867 1.00 0.20 C ATOM 65 CD1 LEU C1900 -11.450 -3.775 1.665 1.00 0.22 C ATOM 66 CD2 LEU C1900 -13.641 -4.503 0.765 1.00 0.31 C ATOM 0 H LEU C1900 -14.061 -6.610 2.588 1.00 0.24 H new ATOM 0 HA LEU C1900 -11.602 -5.526 3.456 1.00 0.25 H new ATOM 0 HB2 LEU C1900 -14.421 -4.466 3.251 1.00 0.33 H new ATOM 0 HB3 LEU C1900 -13.149 -3.507 3.983 1.00 0.33 H new ATOM 0 HG LEU C1900 -13.278 -2.724 1.827 1.00 0.20 H new ATOM 0 HD11 LEU C1900 -11.213 -3.392 0.672 1.00 0.22 H new ATOM 0 HD12 LEU C1900 -10.976 -3.147 2.419 1.00 0.22 H new ATOM 0 HD13 LEU C1900 -11.079 -4.796 1.758 1.00 0.22 H new ATOM 0 HD21 LEU C1900 -13.332 -4.096 -0.198 1.00 0.31 H new ATOM 0 HD22 LEU C1900 -13.377 -5.559 0.814 1.00 0.31 H new ATOM 0 HD23 LEU C1900 -14.720 -4.394 0.875 1.00 0.31 H new ATOM 78 N GLU C1901 -13.446 -6.699 5.766 1.00 0.27 N ATOM 79 CA GLU C1901 -13.551 -6.901 7.208 1.00 0.34 C ATOM 80 C GLU C1901 -12.212 -7.351 7.770 1.00 0.37 C ATOM 81 O GLU C1901 -11.739 -6.818 8.770 1.00 0.52 O ATOM 82 CB GLU C1901 -14.632 -7.932 7.544 1.00 0.48 C ATOM 83 CG GLU C1901 -14.774 -8.198 9.035 1.00 1.00 C ATOM 84 CD GLU C1901 -15.877 -9.185 9.359 1.00 1.11 C ATOM 85 OE1 GLU C1901 -17.041 -8.758 9.484 1.00 1.44 O ATOM 86 OE2 GLU C1901 -15.583 -10.386 9.510 1.00 1.48 O ATOM 0 H GLU C1901 -13.945 -7.387 5.202 1.00 0.27 H new ATOM 0 HA GLU C1901 -13.833 -5.952 7.663 1.00 0.34 H new ATOM 0 HB2 GLU C1901 -15.588 -7.585 7.152 1.00 0.48 H new ATOM 0 HB3 GLU C1901 -14.400 -8.868 7.036 1.00 0.48 H new ATOM 0 HG2 GLU C1901 -13.829 -8.578 9.422 1.00 1.00 H new ATOM 0 HG3 GLU C1901 -14.973 -7.258 9.549 1.00 1.00 H new ATOM 93 N ASP C1902 -11.606 -8.335 7.117 1.00 0.37 N ATOM 94 CA ASP C1902 -10.284 -8.808 7.505 1.00 0.46 C ATOM 95 C ASP C1902 -9.216 -8.031 6.744 1.00 0.44 C ATOM 96 O ASP C1902 -8.057 -7.967 7.155 1.00 0.58 O ATOM 97 CB ASP C1902 -10.154 -10.310 7.234 1.00 0.60 C ATOM 98 CG ASP C1902 -8.837 -10.882 7.725 1.00 1.18 C ATOM 99 OD1 ASP C1902 -8.548 -10.772 8.934 1.00 1.42 O ATOM 100 OD2 ASP C1902 -8.085 -11.454 6.907 1.00 2.01 O ATOM 0 H ASP C1902 -12.010 -8.821 6.316 1.00 0.37 H new ATOM 0 HA ASP C1902 -10.146 -8.642 8.573 1.00 0.46 H new ATOM 0 HB2 ASP C1902 -10.977 -10.835 7.719 1.00 0.60 H new ATOM 0 HB3 ASP C1902 -10.247 -10.491 6.163 1.00 0.60 H new ATOM 105 N ALA C1903 -9.633 -7.434 5.631 1.00 0.36 N ATOM 106 CA ALA C1903 -8.758 -6.615 4.799 1.00 0.46 C ATOM 107 C ALA C1903 -8.171 -5.463 5.575 1.00 0.37 C ATOM 108 O ALA C1903 -6.990 -5.441 5.912 1.00 0.37 O ATOM 109 CB ALA C1903 -9.537 -6.020 3.639 1.00 0.66 C ATOM 0 H ALA C1903 -10.588 -7.505 5.281 1.00 0.36 H new ATOM 0 HA ALA C1903 -7.961 -7.270 4.445 1.00 0.46 H new ATOM 0 HB1 ALA C1903 -8.871 -5.412 3.027 1.00 0.66 H new ATOM 0 HB2 ALA C1903 -9.955 -6.823 3.032 1.00 0.66 H new ATOM 0 HB3 ALA C1903 -10.345 -5.398 4.024 1.00 0.66 H new ATOM 115 N THR C1904 -9.030 -4.513 5.872 1.00 0.37 N ATOM 116 CA THR C1904 -8.604 -3.250 6.394 1.00 0.36 C ATOM 117 C THR C1904 -8.711 -3.224 7.906 1.00 0.34 C ATOM 118 O THR C1904 -8.462 -2.205 8.545 1.00 0.36 O ATOM 119 CB THR C1904 -9.412 -2.121 5.741 1.00 0.40 C ATOM 120 OG1 THR C1904 -10.813 -2.355 5.918 1.00 0.42 O ATOM 121 CG2 THR C1904 -9.100 -2.066 4.253 1.00 0.40 C ATOM 0 H THR C1904 -10.039 -4.602 5.756 1.00 0.37 H new ATOM 0 HA THR C1904 -7.552 -3.098 6.151 1.00 0.36 H new ATOM 0 HB THR C1904 -9.141 -1.175 6.211 1.00 0.40 H new ATOM 0 HG1 THR C1904 -11.122 -3.009 5.257 1.00 0.42 H new ATOM 0 HG21 THR C1904 -9.675 -1.264 3.790 1.00 0.40 H new ATOM 0 HG22 THR C1904 -8.036 -1.879 4.111 1.00 0.40 H new ATOM 0 HG23 THR C1904 -9.366 -3.016 3.790 1.00 0.40 H new ATOM 129 N GLU C1905 -9.080 -4.364 8.473 1.00 0.32 N ATOM 130 CA GLU C1905 -8.935 -4.577 9.899 1.00 0.32 C ATOM 131 C GLU C1905 -7.490 -4.319 10.261 1.00 0.28 C ATOM 132 O GLU C1905 -7.158 -3.544 11.159 1.00 0.32 O ATOM 133 CB GLU C1905 -9.251 -6.020 10.250 1.00 0.36 C ATOM 134 CG GLU C1905 -9.072 -6.344 11.726 1.00 0.62 C ATOM 135 CD GLU C1905 -10.035 -5.582 12.617 1.00 1.25 C ATOM 136 OE1 GLU C1905 -9.689 -4.466 13.052 1.00 2.06 O ATOM 137 OE2 GLU C1905 -11.142 -6.092 12.881 1.00 1.76 O ATOM 0 H GLU C1905 -9.481 -5.152 7.965 1.00 0.32 H new ATOM 0 HA GLU C1905 -9.613 -3.914 10.437 1.00 0.32 H new ATOM 0 HB2 GLU C1905 -10.279 -6.238 9.961 1.00 0.36 H new ATOM 0 HB3 GLU C1905 -8.609 -6.676 9.663 1.00 0.36 H new ATOM 0 HG2 GLU C1905 -9.213 -7.414 11.878 1.00 0.62 H new ATOM 0 HG3 GLU C1905 -8.049 -6.112 12.023 1.00 0.62 H new ATOM 144 N THR C1906 -6.638 -4.988 9.500 1.00 0.25 N ATOM 145 CA THR C1906 -5.213 -4.911 9.658 1.00 0.24 C ATOM 146 C THR C1906 -4.688 -3.573 9.154 1.00 0.21 C ATOM 147 O THR C1906 -3.546 -3.202 9.430 1.00 0.19 O ATOM 148 CB THR C1906 -4.549 -6.056 8.880 1.00 0.29 C ATOM 149 OG1 THR C1906 -5.484 -7.132 8.730 1.00 0.48 O ATOM 150 CG2 THR C1906 -3.328 -6.564 9.614 1.00 0.47 C ATOM 0 H THR C1906 -6.933 -5.607 8.745 1.00 0.25 H new ATOM 0 HA THR C1906 -4.972 -4.999 10.717 1.00 0.24 H new ATOM 0 HB THR C1906 -4.244 -5.681 7.903 1.00 0.29 H new ATOM 0 HG1 THR C1906 -5.063 -7.864 8.232 1.00 0.48 H new ATOM 0 HG21 THR C1906 -2.873 -7.375 9.045 1.00 0.47 H new ATOM 0 HG22 THR C1906 -2.609 -5.753 9.729 1.00 0.47 H new ATOM 0 HG23 THR C1906 -3.621 -6.931 10.598 1.00 0.47 H new ATOM 158 N ALA C1907 -5.528 -2.849 8.409 1.00 0.23 N ATOM 159 CA ALA C1907 -5.151 -1.530 7.924 1.00 0.21 C ATOM 160 C ALA C1907 -4.843 -0.608 9.092 1.00 0.21 C ATOM 161 O ALA C1907 -3.831 0.095 9.092 1.00 0.21 O ATOM 162 CB ALA C1907 -6.227 -0.919 7.035 1.00 0.22 C ATOM 0 H ALA C1907 -6.462 -3.154 8.134 1.00 0.23 H new ATOM 0 HA ALA C1907 -4.255 -1.649 7.315 1.00 0.21 H new ATOM 0 HB1 ALA C1907 -5.903 0.065 6.696 1.00 0.22 H new ATOM 0 HB2 ALA C1907 -6.395 -1.563 6.172 1.00 0.22 H new ATOM 0 HB3 ALA C1907 -7.154 -0.821 7.600 1.00 0.22 H new ATOM 168 N ASP C1908 -5.714 -0.638 10.092 1.00 0.24 N ATOM 169 CA ASP C1908 -5.521 0.145 11.308 1.00 0.26 C ATOM 170 C ASP C1908 -4.173 -0.184 11.962 1.00 0.27 C ATOM 171 O ASP C1908 -3.532 0.687 12.545 1.00 0.34 O ATOM 172 CB ASP C1908 -6.668 -0.118 12.288 1.00 0.33 C ATOM 173 CG ASP C1908 -6.597 0.750 13.528 1.00 0.44 C ATOM 174 OD1 ASP C1908 -6.999 1.929 13.456 1.00 0.58 O ATOM 175 OD2 ASP C1908 -6.116 0.267 14.577 1.00 0.68 O ATOM 0 H ASP C1908 -6.566 -1.199 10.086 1.00 0.24 H new ATOM 0 HA ASP C1908 -5.518 1.202 11.041 1.00 0.26 H new ATOM 0 HB2 ASP C1908 -7.618 0.057 11.783 1.00 0.33 H new ATOM 0 HB3 ASP C1908 -6.653 -1.167 12.584 1.00 0.33 H new ATOM 180 N ALA C1909 -3.737 -1.438 11.831 1.00 0.23 N ATOM 181 CA ALA C1909 -2.459 -1.871 12.399 1.00 0.24 C ATOM 182 C ALA C1909 -1.278 -1.335 11.590 1.00 0.22 C ATOM 183 O ALA C1909 -0.453 -0.581 12.113 1.00 0.24 O ATOM 184 CB ALA C1909 -2.399 -3.385 12.481 1.00 0.27 C ATOM 0 H ALA C1909 -4.248 -2.170 11.338 1.00 0.23 H new ATOM 0 HA ALA C1909 -2.388 -1.461 13.406 1.00 0.24 H new ATOM 0 HB1 ALA C1909 -1.442 -3.689 12.905 1.00 0.27 H new ATOM 0 HB2 ALA C1909 -3.208 -3.747 13.115 1.00 0.27 H new ATOM 0 HB3 ALA C1909 -2.503 -3.808 11.482 1.00 0.27 H new ATOM 190 N MET C1910 -1.191 -1.738 10.317 1.00 0.19 N ATOM 191 CA MET C1910 -0.174 -1.221 9.399 1.00 0.19 C ATOM 192 C MET C1910 -0.048 0.298 9.456 1.00 0.19 C ATOM 193 O MET C1910 1.039 0.823 9.338 1.00 0.22 O ATOM 194 CB MET C1910 -0.494 -1.658 7.965 1.00 0.18 C ATOM 195 CG MET C1910 0.206 -0.838 6.883 1.00 0.20 C ATOM 196 SD MET C1910 -0.248 -1.384 5.234 1.00 0.20 S ATOM 197 CE MET C1910 0.180 -3.116 5.346 1.00 0.14 C ATOM 0 H MET C1910 -1.818 -2.425 9.899 1.00 0.19 H new ATOM 0 HA MET C1910 0.782 -1.638 9.715 1.00 0.19 H new ATOM 0 HB2 MET C1910 -0.216 -2.705 7.847 1.00 0.18 H new ATOM 0 HB3 MET C1910 -1.571 -1.595 7.811 1.00 0.18 H new ATOM 0 HG2 MET C1910 -0.051 0.215 7.001 1.00 0.20 H new ATOM 0 HG3 MET C1910 1.286 -0.918 7.008 1.00 0.20 H new ATOM 0 HE1 MET C1910 0.077 -3.580 4.365 1.00 0.14 H new ATOM 0 HE2 MET C1910 1.210 -3.215 5.688 1.00 0.14 H new ATOM 0 HE3 MET C1910 -0.486 -3.610 6.053 1.00 0.14 H new ATOM 207 N ASN C1911 -1.147 1.000 9.654 1.00 0.21 N ATOM 208 CA ASN C1911 -1.129 2.465 9.656 1.00 0.22 C ATOM 209 C ASN C1911 -0.267 3.017 10.784 1.00 0.23 C ATOM 210 O ASN C1911 0.396 4.045 10.629 1.00 0.27 O ATOM 211 CB ASN C1911 -2.547 2.984 9.807 1.00 0.24 C ATOM 212 CG ASN C1911 -2.654 4.465 9.545 1.00 0.25 C ATOM 213 OD1 ASN C1911 -2.908 4.806 8.301 1.00 0.42 O flip ATOM 214 ND2 ASN C1911 -2.515 5.286 10.448 1.00 0.25 N flip ATOM 0 H ASN C1911 -2.066 0.588 9.816 1.00 0.21 H new ATOM 0 HA ASN C1911 -0.700 2.798 8.711 1.00 0.22 H new ATOM 0 HB2 ASN C1911 -3.201 2.449 9.118 1.00 0.24 H new ATOM 0 HB3 ASN C1911 -2.903 2.771 10.815 1.00 0.24 H new ATOM 0 HD21 ASN C1911 -2.319 4.971 11.398 1.00 0.25 H new ATOM 0 HD22 ASN C1911 -2.596 6.283 10.248 1.00 0.25 H new ATOM 221 N ARG C1912 -0.259 2.332 11.909 1.00 0.23 N ATOM 222 CA ARG C1912 0.487 2.793 13.068 1.00 0.26 C ATOM 223 C ARG C1912 1.974 2.680 12.797 1.00 0.28 C ATOM 224 O ARG C1912 2.749 3.597 13.078 1.00 0.38 O ATOM 225 CB ARG C1912 0.120 1.970 14.294 1.00 0.30 C ATOM 226 CG ARG C1912 -1.382 1.805 14.475 1.00 0.75 C ATOM 227 CD ARG C1912 -2.099 3.137 14.341 1.00 1.46 C ATOM 228 NE ARG C1912 -3.554 3.000 14.384 1.00 2.17 N ATOM 229 CZ ARG C1912 -4.373 3.935 14.864 1.00 2.91 C ATOM 230 NH1 ARG C1912 -3.877 5.044 15.399 1.00 3.13 N ATOM 231 NH2 ARG C1912 -5.687 3.762 14.817 1.00 3.76 N ATOM 0 H ARG C1912 -0.759 1.454 12.048 1.00 0.23 H new ATOM 0 HA ARG C1912 0.234 3.836 13.259 1.00 0.26 H new ATOM 0 HB2 ARG C1912 0.581 0.985 14.214 1.00 0.30 H new ATOM 0 HB3 ARG C1912 0.537 2.446 15.182 1.00 0.30 H new ATOM 0 HG2 ARG C1912 -1.766 1.106 13.732 1.00 0.75 H new ATOM 0 HG3 ARG C1912 -1.588 1.375 15.455 1.00 0.75 H new ATOM 0 HD2 ARG C1912 -1.777 3.801 15.143 1.00 1.46 H new ATOM 0 HD3 ARG C1912 -1.810 3.608 13.402 1.00 1.46 H new ATOM 0 HE ARG C1912 -3.966 2.139 14.026 1.00 2.17 H new ATOM 0 HH11 ARG C1912 -2.867 5.182 15.443 1.00 3.13 H new ATOM 0 HH12 ARG C1912 -4.506 5.759 15.766 1.00 3.13 H new ATOM 0 HH21 ARG C1912 -6.075 2.910 14.412 1.00 3.76 H new ATOM 0 HH22 ARG C1912 -6.310 4.481 15.186 1.00 3.76 H new ATOM 245 N GLU C1913 2.357 1.553 12.223 1.00 0.23 N ATOM 246 CA GLU C1913 3.742 1.306 11.881 1.00 0.25 C ATOM 247 C GLU C1913 4.118 2.032 10.597 1.00 0.22 C ATOM 248 O GLU C1913 5.256 2.423 10.431 1.00 0.27 O ATOM 249 CB GLU C1913 3.993 -0.191 11.728 1.00 0.29 C ATOM 250 CG GLU C1913 3.068 -0.858 10.727 1.00 0.29 C ATOM 251 CD GLU C1913 3.337 -2.338 10.575 1.00 0.39 C ATOM 252 OE1 GLU C1913 3.830 -2.960 11.537 1.00 0.79 O ATOM 253 OE2 GLU C1913 3.063 -2.887 9.487 1.00 0.57 O ATOM 0 H GLU C1913 1.722 0.792 11.984 1.00 0.23 H new ATOM 0 HA GLU C1913 4.365 1.687 12.690 1.00 0.25 H new ATOM 0 HB2 GLU C1913 5.026 -0.349 11.418 1.00 0.29 H new ATOM 0 HB3 GLU C1913 3.874 -0.673 12.698 1.00 0.29 H new ATOM 0 HG2 GLU C1913 2.035 -0.712 11.041 1.00 0.29 H new ATOM 0 HG3 GLU C1913 3.178 -0.372 9.758 1.00 0.29 H new ATOM 260 N VAL C1914 3.150 2.216 9.705 1.00 0.19 N ATOM 261 CA VAL C1914 3.395 2.824 8.400 1.00 0.20 C ATOM 262 C VAL C1914 3.689 4.308 8.535 1.00 0.18 C ATOM 263 O VAL C1914 4.518 4.855 7.812 1.00 0.20 O ATOM 264 CB VAL C1914 2.182 2.641 7.446 1.00 0.24 C ATOM 265 CG1 VAL C1914 1.116 3.695 7.671 1.00 0.26 C ATOM 266 CG2 VAL C1914 2.610 2.668 6.003 1.00 0.29 C ATOM 0 H VAL C1914 2.178 1.950 9.864 1.00 0.19 H new ATOM 0 HA VAL C1914 4.261 2.316 7.977 1.00 0.20 H new ATOM 0 HB VAL C1914 1.757 1.664 7.677 1.00 0.24 H new ATOM 0 HG11 VAL C1914 0.288 3.528 6.982 1.00 0.26 H new ATOM 0 HG12 VAL C1914 0.753 3.632 8.697 1.00 0.26 H new ATOM 0 HG13 VAL C1914 1.539 4.684 7.496 1.00 0.26 H new ATOM 0 HG21 VAL C1914 1.738 2.537 5.362 1.00 0.29 H new ATOM 0 HG22 VAL C1914 3.083 3.625 5.782 1.00 0.29 H new ATOM 0 HG23 VAL C1914 3.320 1.861 5.819 1.00 0.29 H new ATOM 276 N SER C1915 3.009 4.952 9.467 1.00 0.21 N ATOM 277 CA SER C1915 3.161 6.372 9.663 1.00 0.28 C ATOM 278 C SER C1915 4.497 6.643 10.328 1.00 0.28 C ATOM 279 O SER C1915 5.080 7.716 10.181 1.00 0.36 O ATOM 280 CB SER C1915 1.989 6.915 10.468 1.00 0.36 C ATOM 281 OG SER C1915 1.972 8.333 10.467 1.00 1.31 O ATOM 0 H SER C1915 2.345 4.506 10.100 1.00 0.21 H new ATOM 0 HA SER C1915 3.155 6.891 8.704 1.00 0.28 H new ATOM 0 HB2 SER C1915 1.055 6.538 10.052 1.00 0.36 H new ATOM 0 HB3 SER C1915 2.051 6.551 11.494 1.00 0.36 H new ATOM 0 HG SER C1915 1.207 8.651 10.991 1.00 1.31 H new ATOM 287 N SER C1916 4.983 5.664 11.076 1.00 0.25 N ATOM 288 CA SER C1916 6.354 5.707 11.536 1.00 0.27 C ATOM 289 C SER C1916 7.281 5.209 10.423 1.00 0.27 C ATOM 290 O SER C1916 8.407 5.677 10.287 1.00 0.29 O ATOM 291 CB SER C1916 6.530 4.863 12.802 1.00 0.31 C ATOM 292 OG SER C1916 7.805 5.075 13.381 1.00 1.04 O ATOM 0 H SER C1916 4.454 4.843 11.372 1.00 0.25 H new ATOM 0 HA SER C1916 6.613 6.736 11.784 1.00 0.27 H new ATOM 0 HB2 SER C1916 5.753 5.116 13.523 1.00 0.31 H new ATOM 0 HB3 SER C1916 6.408 3.807 12.559 1.00 0.31 H new ATOM 0 HG SER C1916 7.893 4.527 14.188 1.00 1.04 H new ATOM 298 N LEU C1917 6.773 4.287 9.601 1.00 0.30 N ATOM 299 CA LEU C1917 7.572 3.639 8.571 1.00 0.30 C ATOM 300 C LEU C1917 7.983 4.582 7.475 1.00 0.26 C ATOM 301 O LEU C1917 9.165 4.739 7.203 1.00 0.26 O ATOM 302 CB LEU C1917 6.854 2.483 7.904 1.00 0.42 C ATOM 303 CG LEU C1917 7.726 1.775 6.878 1.00 0.57 C ATOM 304 CD1 LEU C1917 8.958 1.245 7.549 1.00 1.25 C ATOM 305 CD2 LEU C1917 6.995 0.656 6.206 1.00 1.16 C ATOM 0 H LEU C1917 5.803 3.974 9.634 1.00 0.30 H new ATOM 0 HA LEU C1917 8.447 3.277 9.110 1.00 0.30 H new ATOM 0 HB2 LEU C1917 6.538 1.768 8.664 1.00 0.42 H new ATOM 0 HB3 LEU C1917 5.951 2.852 7.417 1.00 0.42 H new ATOM 0 HG LEU C1917 8.000 2.500 6.111 1.00 0.57 H new ATOM 0 HD11 LEU C1917 9.583 0.738 6.814 1.00 1.25 H new ATOM 0 HD12 LEU C1917 9.515 2.071 7.991 1.00 1.25 H new ATOM 0 HD13 LEU C1917 8.672 0.541 8.330 1.00 1.25 H new ATOM 0 HD21 LEU C1917 7.652 0.176 5.481 1.00 1.16 H new ATOM 0 HD22 LEU C1917 6.683 -0.075 6.952 1.00 1.16 H new ATOM 0 HD23 LEU C1917 6.117 1.050 5.695 1.00 1.16 H new ATOM 317 N LYS C1918 7.015 5.183 6.808 1.00 0.28 N ATOM 318 CA LYS C1918 7.346 6.065 5.708 1.00 0.29 C ATOM 319 C LYS C1918 8.224 7.224 6.214 1.00 0.32 C ATOM 320 O LYS C1918 8.852 7.925 5.436 1.00 0.38 O ATOM 321 CB LYS C1918 6.088 6.554 4.969 1.00 0.39 C ATOM 322 CG LYS C1918 5.623 7.937 5.346 1.00 0.29 C ATOM 323 CD LYS C1918 5.005 7.942 6.735 1.00 0.40 C ATOM 324 CE LYS C1918 5.560 9.056 7.585 1.00 0.69 C ATOM 325 NZ LYS C1918 5.290 10.407 7.025 1.00 1.36 N ATOM 0 H LYS C1918 6.019 5.080 7.002 1.00 0.28 H new ATOM 0 HA LYS C1918 7.923 5.506 4.971 1.00 0.29 H new ATOM 0 HB2 LYS C1918 6.284 6.533 3.897 1.00 0.39 H new ATOM 0 HB3 LYS C1918 5.277 5.850 5.159 1.00 0.39 H new ATOM 0 HG2 LYS C1918 6.465 8.629 5.316 1.00 0.29 H new ATOM 0 HG3 LYS C1918 4.893 8.291 4.618 1.00 0.29 H new ATOM 0 HD2 LYS C1918 3.924 8.051 6.652 1.00 0.40 H new ATOM 0 HD3 LYS C1918 5.193 6.985 7.221 1.00 0.40 H new ATOM 0 HE2 LYS C1918 5.130 8.991 8.585 1.00 0.69 H new ATOM 0 HE3 LYS C1918 6.636 8.922 7.692 1.00 0.69 H new ATOM 0 HZ1 LYS C1918 5.605 11.132 7.701 1.00 1.36 H new ATOM 0 HZ2 LYS C1918 5.806 10.521 6.129 1.00 1.36 H new ATOM 0 HZ3 LYS C1918 4.270 10.514 6.853 1.00 1.36 H new ATOM 339 N ASN C1919 8.278 7.370 7.544 1.00 0.31 N ATOM 340 CA ASN C1919 9.125 8.354 8.211 1.00 0.33 C ATOM 341 C ASN C1919 10.522 7.784 8.483 1.00 0.32 C ATOM 342 O ASN C1919 11.509 8.515 8.437 1.00 0.41 O ATOM 343 CB ASN C1919 8.470 8.806 9.523 1.00 0.37 C ATOM 344 CG ASN C1919 9.353 9.736 10.339 1.00 0.43 C ATOM 345 OD1 ASN C1919 9.386 10.943 10.105 1.00 1.05 O ATOM 346 ND2 ASN C1919 10.046 9.186 11.323 1.00 1.15 N ATOM 0 H ASN C1919 7.729 6.801 8.188 1.00 0.31 H new ATOM 0 HA ASN C1919 9.235 9.215 7.552 1.00 0.33 H new ATOM 0 HB2 ASN C1919 7.530 9.311 9.298 1.00 0.37 H new ATOM 0 HB3 ASN C1919 8.225 7.928 10.122 1.00 0.37 H new ATOM 0 HD21 ASN C1919 10.634 9.768 11.920 1.00 1.15 H new ATOM 0 HD22 ASN C1919 9.992 8.180 11.485 1.00 1.15 H new ATOM 353 N LYS C1920 10.614 6.478 8.753 1.00 0.28 N ATOM 354 CA LYS C1920 11.910 5.837 8.949 1.00 0.37 C ATOM 355 C LYS C1920 12.554 5.607 7.603 1.00 0.41 C ATOM 356 O LYS C1920 13.775 5.589 7.467 1.00 0.53 O ATOM 357 CB LYS C1920 11.817 4.516 9.746 1.00 0.48 C ATOM 358 CG LYS C1920 10.575 3.656 9.496 1.00 0.33 C ATOM 359 CD LYS C1920 10.560 2.441 10.408 1.00 0.44 C ATOM 360 CE LYS C1920 10.705 2.831 11.868 1.00 1.36 C ATOM 361 NZ LYS C1920 10.604 1.653 12.765 1.00 1.64 N ATOM 0 H LYS C1920 9.813 5.853 8.839 1.00 0.28 H new ATOM 0 HA LYS C1920 12.525 6.506 9.550 1.00 0.37 H new ATOM 0 HB2 LYS C1920 12.699 3.917 9.519 1.00 0.48 H new ATOM 0 HB3 LYS C1920 11.859 4.754 10.809 1.00 0.48 H new ATOM 0 HG2 LYS C1920 9.677 4.251 9.663 1.00 0.33 H new ATOM 0 HG3 LYS C1920 10.555 3.334 8.455 1.00 0.33 H new ATOM 0 HD2 LYS C1920 9.628 1.893 10.269 1.00 0.44 H new ATOM 0 HD3 LYS C1920 11.370 1.767 10.129 1.00 0.44 H new ATOM 0 HE2 LYS C1920 11.666 3.322 12.019 1.00 1.36 H new ATOM 0 HE3 LYS C1920 9.933 3.554 12.130 1.00 1.36 H new ATOM 0 HZ1 LYS C1920 10.708 1.959 13.753 1.00 1.64 H new ATOM 0 HZ2 LYS C1920 9.677 1.199 12.639 1.00 1.64 H new ATOM 0 HZ3 LYS C1920 11.356 0.974 12.532 1.00 1.64 H new ATOM 375 N LEU C1921 11.715 5.470 6.598 1.00 0.38 N ATOM 376 CA LEU C1921 12.183 5.378 5.239 1.00 0.46 C ATOM 377 C LEU C1921 12.474 6.779 4.706 1.00 0.59 C ATOM 378 O LEU C1921 13.111 6.956 3.675 1.00 0.92 O ATOM 379 CB LEU C1921 11.162 4.633 4.375 1.00 0.44 C ATOM 380 CG LEU C1921 10.755 3.246 4.904 1.00 0.38 C ATOM 381 CD1 LEU C1921 10.161 2.400 3.799 1.00 0.40 C ATOM 382 CD2 LEU C1921 11.934 2.523 5.529 1.00 0.48 C ATOM 0 H LEU C1921 10.702 5.420 6.702 1.00 0.38 H new ATOM 0 HA LEU C1921 13.110 4.806 5.204 1.00 0.46 H new ATOM 0 HB2 LEU C1921 10.267 5.248 4.284 1.00 0.44 H new ATOM 0 HB3 LEU C1921 11.572 4.517 3.372 1.00 0.44 H new ATOM 0 HG LEU C1921 10.000 3.402 5.675 1.00 0.38 H new ATOM 0 HD11 LEU C1921 9.881 1.425 4.198 1.00 0.40 H new ATOM 0 HD12 LEU C1921 9.277 2.895 3.397 1.00 0.40 H new ATOM 0 HD13 LEU C1921 10.896 2.270 3.005 1.00 0.40 H new ATOM 0 HD21 LEU C1921 11.611 1.547 5.892 1.00 0.48 H new ATOM 0 HD22 LEU C1921 12.717 2.392 4.783 1.00 0.48 H new ATOM 0 HD23 LEU C1921 12.321 3.110 6.362 1.00 0.48 H new ATOM 394 N ARG C1922 12.006 7.773 5.450 1.00 0.49 N ATOM 395 CA ARG C1922 12.332 9.170 5.190 1.00 0.66 C ATOM 396 C ARG C1922 13.517 9.624 6.039 1.00 0.65 C ATOM 397 O ARG C1922 13.897 10.793 6.001 1.00 0.78 O ATOM 398 CB ARG C1922 11.129 10.071 5.487 1.00 0.87 C ATOM 399 CG ARG C1922 10.218 10.332 4.299 1.00 1.15 C ATOM 400 CD ARG C1922 10.996 10.706 3.048 1.00 1.07 C ATOM 401 NE ARG C1922 10.139 11.323 2.038 1.00 1.64 N ATOM 402 CZ ARG C1922 10.447 11.391 0.748 1.00 2.45 C ATOM 403 NH1 ARG C1922 11.660 11.046 0.336 1.00 2.92 N ATOM 404 NH2 ARG C1922 9.554 11.827 -0.127 1.00 3.23 N ATOM 0 H ARG C1922 11.390 7.634 6.251 1.00 0.49 H new ATOM 0 HA ARG C1922 12.596 9.253 4.136 1.00 0.66 H new ATOM 0 HB2 ARG C1922 10.541 9.617 6.285 1.00 0.87 H new ATOM 0 HB3 ARG C1922 11.493 11.027 5.864 1.00 0.87 H new ATOM 0 HG2 ARG C1922 9.620 9.443 4.100 1.00 1.15 H new ATOM 0 HG3 ARG C1922 9.523 11.135 4.546 1.00 1.15 H new ATOM 0 HD2 ARG C1922 11.799 11.394 3.312 1.00 1.07 H new ATOM 0 HD3 ARG C1922 11.464 9.814 2.631 1.00 1.07 H new ATOM 0 HE ARG C1922 9.252 11.725 2.342 1.00 1.64 H new ATOM 0 HH11 ARG C1922 12.356 10.728 1.010 1.00 2.92 H new ATOM 0 HH12 ARG C1922 11.896 11.098 -0.655 1.00 2.92 H new ATOM 0 HH21 ARG C1922 8.627 12.112 0.189 1.00 3.23 H new ATOM 0 HH22 ARG C1922 9.793 11.878 -1.117 1.00 3.23 H new ATOM 461 N LEU C1926 18.078 5.368 4.653 1.00 0.64 N ATOM 462 CA LEU C1926 17.449 4.646 3.559 1.00 0.60 C ATOM 463 C LEU C1926 18.149 4.875 2.222 1.00 0.54 C ATOM 464 O LEU C1926 18.550 5.993 1.897 1.00 0.72 O ATOM 465 CB LEU C1926 15.988 5.077 3.440 1.00 0.93 C ATOM 466 CG LEU C1926 14.951 4.155 4.085 1.00 0.48 C ATOM 467 CD1 LEU C1926 13.955 3.726 3.027 1.00 0.56 C ATOM 468 CD2 LEU C1926 15.600 2.938 4.724 1.00 0.57 C ATOM 0 HA LEU C1926 17.523 3.583 3.789 1.00 0.60 H new ATOM 0 HB2 LEU C1926 15.887 6.068 3.884 1.00 0.93 H new ATOM 0 HB3 LEU C1926 15.746 5.175 2.382 1.00 0.93 H new ATOM 0 HG LEU C1926 14.443 4.702 4.879 1.00 0.48 H new ATOM 0 HD11 LEU C1926 13.210 3.068 3.474 1.00 0.56 H new ATOM 0 HD12 LEU C1926 13.461 4.606 2.614 1.00 0.56 H new ATOM 0 HD13 LEU C1926 14.476 3.195 2.230 1.00 0.56 H new ATOM 0 HD21 LEU C1926 14.831 2.308 5.171 1.00 0.57 H new ATOM 0 HD22 LEU C1926 16.137 2.371 3.964 1.00 0.57 H new ATOM 0 HD23 LEU C1926 16.298 3.261 5.496 1.00 0.57 H new ATOM 480 N PRO C1927 18.300 3.799 1.435 1.00 0.46 N ATOM 481 CA PRO C1927 18.837 3.862 0.079 1.00 0.55 C ATOM 482 C PRO C1927 17.770 4.219 -0.944 1.00 0.63 C ATOM 483 O PRO C1927 18.055 4.324 -2.135 1.00 1.12 O ATOM 484 CB PRO C1927 19.315 2.437 -0.164 1.00 0.54 C ATOM 485 CG PRO C1927 18.375 1.597 0.623 1.00 0.44 C ATOM 486 CD PRO C1927 17.982 2.414 1.827 1.00 0.41 C ATOM 0 HA PRO C1927 19.610 4.624 -0.020 1.00 0.55 H new ATOM 0 HB2 PRO C1927 19.285 2.182 -1.223 1.00 0.54 H new ATOM 0 HB3 PRO C1927 20.344 2.300 0.168 1.00 0.54 H new ATOM 0 HG2 PRO C1927 17.499 1.333 0.030 1.00 0.44 H new ATOM 0 HG3 PRO C1927 18.848 0.663 0.925 1.00 0.44 H new ATOM 0 HD2 PRO C1927 16.924 2.298 2.060 1.00 0.41 H new ATOM 0 HD3 PRO C1927 18.539 2.112 2.714 1.00 0.41 H new ATOM 494 N PHE C1928 16.541 4.389 -0.482 1.00 0.30 N ATOM 495 CA PHE C1928 15.441 4.654 -1.380 1.00 0.27 C ATOM 496 C PHE C1928 14.443 5.592 -0.737 1.00 0.27 C ATOM 497 O PHE C1928 14.308 5.598 0.482 1.00 0.31 O ATOM 498 CB PHE C1928 14.796 3.327 -1.824 1.00 0.24 C ATOM 499 CG PHE C1928 13.624 2.826 -1.041 1.00 0.23 C ATOM 500 CD1 PHE C1928 12.543 3.647 -0.843 1.00 0.30 C ATOM 501 CD2 PHE C1928 13.617 1.570 -0.472 1.00 0.26 C ATOM 502 CE1 PHE C1928 11.469 3.219 -0.102 1.00 0.33 C ATOM 503 CE2 PHE C1928 12.558 1.141 0.263 1.00 0.29 C ATOM 504 CZ PHE C1928 11.462 1.846 0.343 1.00 0.27 C ATOM 0 H PHE C1928 16.286 4.348 0.505 1.00 0.30 H new ATOM 0 HA PHE C1928 15.814 5.154 -2.274 1.00 0.27 H new ATOM 0 HB2 PHE C1928 14.483 3.437 -2.862 1.00 0.24 H new ATOM 0 HB3 PHE C1928 15.567 2.556 -1.804 1.00 0.24 H new ATOM 0 HD1 PHE C1928 12.537 4.638 -1.273 1.00 0.30 H new ATOM 0 HD2 PHE C1928 14.466 0.918 -0.613 1.00 0.26 H new ATOM 0 HE1 PHE C1928 10.656 3.888 0.140 1.00 0.33 H new ATOM 0 HE2 PHE C1928 12.624 0.201 0.790 1.00 0.29 H new ATOM 0 HZ PHE C1928 10.559 1.406 0.738 1.00 0.27 H new ATOM 514 N VAL C1929 13.732 6.343 -1.580 1.00 0.25 N ATOM 515 CA VAL C1929 12.737 7.328 -1.152 1.00 0.25 C ATOM 516 C VAL C1929 11.919 7.792 -2.334 1.00 0.25 C ATOM 517 O VAL C1929 12.316 7.603 -3.479 1.00 0.27 O ATOM 518 CB VAL C1929 13.385 8.575 -0.555 1.00 0.29 C ATOM 519 CG1 VAL C1929 13.840 8.309 0.852 1.00 0.62 C ATOM 520 CG2 VAL C1929 14.538 8.996 -1.438 1.00 0.62 C ATOM 0 H VAL C1929 13.833 6.283 -2.593 1.00 0.25 H new ATOM 0 HA VAL C1929 12.120 6.833 -0.402 1.00 0.25 H new ATOM 0 HB VAL C1929 12.658 9.386 -0.511 1.00 0.29 H new ATOM 0 HG11 VAL C1929 14.299 9.208 1.262 1.00 0.62 H new ATOM 0 HG12 VAL C1929 12.983 8.028 1.464 1.00 0.62 H new ATOM 0 HG13 VAL C1929 14.568 7.498 0.852 1.00 0.62 H new ATOM 0 HG21 VAL C1929 15.009 9.886 -1.021 1.00 0.62 H new ATOM 0 HG22 VAL C1929 15.269 8.189 -1.491 1.00 0.62 H new ATOM 0 HG23 VAL C1929 14.168 9.216 -2.439 1.00 0.62 H new ATOM 530 N VAL C1930 10.800 8.438 -2.067 1.00 0.26 N ATOM 531 CA VAL C1930 10.009 8.983 -3.145 1.00 0.26 C ATOM 532 C VAL C1930 10.476 10.386 -3.516 1.00 0.29 C ATOM 533 O VAL C1930 10.638 11.255 -2.651 1.00 0.32 O ATOM 534 CB VAL C1930 8.511 9.050 -2.827 1.00 0.28 C ATOM 535 CG1 VAL C1930 7.738 9.338 -4.103 1.00 0.34 C ATOM 536 CG2 VAL C1930 8.022 7.770 -2.177 1.00 0.32 C ATOM 0 H VAL C1930 10.426 8.595 -1.131 1.00 0.26 H new ATOM 0 HA VAL C1930 10.153 8.295 -3.978 1.00 0.26 H new ATOM 0 HB VAL C1930 8.342 9.856 -2.113 1.00 0.28 H new ATOM 0 HG11 VAL C1930 6.672 9.386 -3.880 1.00 0.34 H new ATOM 0 HG12 VAL C1930 8.065 10.291 -4.519 1.00 0.34 H new ATOM 0 HG13 VAL C1930 7.922 8.544 -4.827 1.00 0.34 H new ATOM 0 HG21 VAL C1930 6.956 7.853 -1.966 1.00 0.32 H new ATOM 0 HG22 VAL C1930 8.194 6.931 -2.851 1.00 0.32 H new ATOM 0 HG23 VAL C1930 8.564 7.604 -1.246 1.00 0.32 H new ATOM 546 N PRO C1931 10.739 10.594 -4.808 1.00 0.34 N ATOM 547 CA PRO C1931 10.982 11.918 -5.385 1.00 0.42 C ATOM 548 C PRO C1931 9.739 12.804 -5.301 1.00 0.45 C ATOM 549 O PRO C1931 8.666 12.347 -4.910 1.00 0.45 O ATOM 550 CB PRO C1931 11.332 11.622 -6.848 1.00 0.56 C ATOM 551 CG PRO C1931 10.767 10.268 -7.112 1.00 0.48 C ATOM 552 CD PRO C1931 10.843 9.529 -5.811 1.00 0.36 C ATOM 0 HA PRO C1931 11.767 12.459 -4.857 1.00 0.42 H new ATOM 0 HB2 PRO C1931 10.900 12.367 -7.516 1.00 0.56 H new ATOM 0 HB3 PRO C1931 12.410 11.638 -7.007 1.00 0.56 H new ATOM 0 HG2 PRO C1931 9.737 10.336 -7.463 1.00 0.48 H new ATOM 0 HG3 PRO C1931 11.334 9.753 -7.887 1.00 0.48 H new ATOM 0 HD2 PRO C1931 10.035 8.804 -5.713 1.00 0.36 H new ATOM 0 HD3 PRO C1931 11.779 8.978 -5.716 1.00 0.36 H new ATOM 560 N ARG C1932 9.892 14.077 -5.649 1.00 0.54 N ATOM 561 CA ARG C1932 8.786 15.030 -5.594 1.00 0.70 C ATOM 562 C ARG C1932 7.618 14.600 -6.490 1.00 0.89 C ATOM 563 O ARG C1932 6.477 15.018 -6.293 1.00 1.79 O ATOM 564 CB ARG C1932 9.269 16.428 -5.985 1.00 0.83 C ATOM 565 CG ARG C1932 8.188 17.493 -5.903 1.00 1.53 C ATOM 566 CD ARG C1932 8.740 18.872 -6.216 1.00 2.00 C ATOM 567 NE ARG C1932 9.366 18.932 -7.533 1.00 2.79 N ATOM 568 CZ ARG C1932 10.362 19.759 -7.845 1.00 3.62 C ATOM 569 NH1 ARG C1932 10.833 20.605 -6.936 1.00 3.88 N ATOM 570 NH2 ARG C1932 10.883 19.741 -9.064 1.00 4.56 N ATOM 0 H ARG C1932 10.773 14.475 -5.973 1.00 0.54 H new ATOM 0 HA ARG C1932 8.422 15.052 -4.567 1.00 0.70 H new ATOM 0 HB2 ARG C1932 10.096 16.712 -5.335 1.00 0.83 H new ATOM 0 HB3 ARG C1932 9.659 16.397 -7.002 1.00 0.83 H new ATOM 0 HG2 ARG C1932 7.386 17.254 -6.602 1.00 1.53 H new ATOM 0 HG3 ARG C1932 7.751 17.493 -4.904 1.00 1.53 H new ATOM 0 HD2 ARG C1932 7.934 19.604 -6.166 1.00 2.00 H new ATOM 0 HD3 ARG C1932 9.470 19.150 -5.456 1.00 2.00 H new ATOM 0 HE ARG C1932 9.020 18.303 -8.258 1.00 2.79 H new ATOM 0 HH11 ARG C1932 10.432 20.621 -5.998 1.00 3.88 H new ATOM 0 HH12 ARG C1932 11.596 21.238 -7.176 1.00 3.88 H new ATOM 0 HH21 ARG C1932 10.521 19.093 -9.764 1.00 4.56 H new ATOM 0 HH22 ARG C1932 11.646 20.375 -9.302 1.00 4.56 H new ATOM 584 N ARG C1933 7.911 13.764 -7.465 1.00 0.74 N ATOM 585 CA ARG C1933 6.895 13.237 -8.359 1.00 0.76 C ATOM 586 C ARG C1933 7.209 11.778 -8.661 1.00 0.65 C ATOM 587 O ARG C1933 8.010 11.167 -7.962 1.00 0.69 O ATOM 588 CB ARG C1933 6.840 14.066 -9.646 1.00 0.95 C ATOM 589 CG ARG C1933 8.174 14.162 -10.365 1.00 1.66 C ATOM 590 CD ARG C1933 8.054 14.961 -11.651 1.00 1.80 C ATOM 591 NE ARG C1933 9.307 14.971 -12.401 1.00 2.56 N ATOM 592 CZ ARG C1933 9.401 15.283 -13.693 1.00 2.86 C ATOM 593 NH1 ARG C1933 8.322 15.664 -14.368 1.00 2.53 N ATOM 594 NH2 ARG C1933 10.576 15.220 -14.307 1.00 3.92 N ATOM 0 H ARG C1933 8.855 13.431 -7.661 1.00 0.74 H new ATOM 0 HA ARG C1933 5.916 13.298 -7.883 1.00 0.76 H new ATOM 0 HB2 ARG C1933 6.104 13.627 -10.320 1.00 0.95 H new ATOM 0 HB3 ARG C1933 6.493 15.071 -9.406 1.00 0.95 H new ATOM 0 HG2 ARG C1933 8.909 14.631 -9.711 1.00 1.66 H new ATOM 0 HG3 ARG C1933 8.541 13.161 -10.590 1.00 1.66 H new ATOM 0 HD2 ARG C1933 7.263 14.537 -12.270 1.00 1.80 H new ATOM 0 HD3 ARG C1933 7.762 15.985 -11.417 1.00 1.80 H new ATOM 0 HE ARG C1933 10.163 14.724 -11.905 1.00 2.56 H new ATOM 0 HH11 ARG C1933 7.419 15.718 -13.897 1.00 2.53 H new ATOM 0 HH12 ARG C1933 8.397 15.902 -15.357 1.00 2.53 H new ATOM 0 HH21 ARG C1933 11.407 14.933 -13.790 1.00 3.92 H new ATOM 0 HH22 ARG C1933 10.648 15.459 -15.296 1.00 3.92 H new ATOM 654 N ALA A 2 1.781 -2.099 -17.688 1.00 0.37 N ATOM 655 CA ALA A 2 2.427 -1.049 -16.916 1.00 0.33 C ATOM 656 C ALA A 2 3.497 -1.639 -16.003 1.00 0.30 C ATOM 657 O ALA A 2 3.628 -2.860 -15.918 1.00 0.39 O ATOM 658 CB ALA A 2 1.386 -0.299 -16.102 1.00 0.33 C ATOM 0 HA ALA A 2 2.912 -0.352 -17.600 1.00 0.33 H new ATOM 0 HB1 ALA A 2 1.873 0.487 -15.525 1.00 0.33 H new ATOM 0 HB2 ALA A 2 0.651 0.146 -16.773 1.00 0.33 H new ATOM 0 HB3 ALA A 2 0.887 -0.991 -15.424 1.00 0.33 H new ATOM 664 N CYS A 3 4.274 -0.780 -15.344 1.00 0.29 N ATOM 665 CA CYS A 3 5.206 -1.221 -14.330 1.00 0.27 C ATOM 666 C CYS A 3 4.419 -1.544 -13.073 1.00 0.22 C ATOM 667 O CYS A 3 3.967 -0.645 -12.363 1.00 0.21 O ATOM 668 CB CYS A 3 6.256 -0.143 -14.054 1.00 0.32 C ATOM 669 SG CYS A 3 7.192 0.359 -15.518 1.00 0.43 S ATOM 0 H CYS A 3 4.269 0.228 -15.502 1.00 0.29 H new ATOM 0 HA CYS A 3 5.737 -2.109 -14.673 1.00 0.27 H new ATOM 0 HB2 CYS A 3 5.762 0.732 -13.633 1.00 0.32 H new ATOM 0 HB3 CYS A 3 6.951 -0.511 -13.299 1.00 0.32 H new ATOM 0 HG CYS A 3 8.054 1.275 -15.189 1.00 0.43 H new ATOM 675 N PRO A 4 4.234 -2.841 -12.807 1.00 0.20 N ATOM 676 CA PRO A 4 3.286 -3.335 -11.799 1.00 0.18 C ATOM 677 C PRO A 4 3.433 -2.666 -10.440 1.00 0.16 C ATOM 678 O PRO A 4 2.527 -1.968 -9.981 1.00 0.16 O ATOM 679 CB PRO A 4 3.671 -4.807 -11.693 1.00 0.21 C ATOM 680 CG PRO A 4 4.173 -5.150 -13.044 1.00 0.24 C ATOM 681 CD PRO A 4 4.950 -3.948 -13.473 1.00 0.24 C ATOM 0 HA PRO A 4 2.253 -3.138 -12.086 1.00 0.18 H new ATOM 0 HB2 PRO A 4 4.435 -4.965 -10.932 1.00 0.21 H new ATOM 0 HB3 PRO A 4 2.815 -5.424 -11.418 1.00 0.21 H new ATOM 0 HG2 PRO A 4 4.801 -6.040 -13.019 1.00 0.24 H new ATOM 0 HG3 PRO A 4 3.353 -5.358 -13.731 1.00 0.24 H new ATOM 0 HD2 PRO A 4 5.991 -4.005 -13.156 1.00 0.24 H new ATOM 0 HD3 PRO A 4 4.953 -3.834 -14.557 1.00 0.24 H new ATOM 689 N LEU A 5 4.587 -2.848 -9.817 1.00 0.16 N ATOM 690 CA LEU A 5 4.807 -2.342 -8.472 1.00 0.17 C ATOM 691 C LEU A 5 4.852 -0.819 -8.495 1.00 0.19 C ATOM 692 O LEU A 5 4.408 -0.167 -7.560 1.00 0.24 O ATOM 693 CB LEU A 5 6.103 -2.924 -7.894 1.00 0.17 C ATOM 694 CG LEU A 5 6.073 -3.264 -6.396 1.00 0.18 C ATOM 695 CD1 LEU A 5 5.924 -2.015 -5.549 1.00 0.20 C ATOM 696 CD2 LEU A 5 4.954 -4.246 -6.087 1.00 0.20 C ATOM 0 H LEU A 5 5.384 -3.341 -10.220 1.00 0.16 H new ATOM 0 HA LEU A 5 3.983 -2.652 -7.830 1.00 0.17 H new ATOM 0 HB2 LEU A 5 6.351 -3.829 -8.448 1.00 0.17 H new ATOM 0 HB3 LEU A 5 6.909 -2.212 -8.070 1.00 0.17 H new ATOM 0 HG LEU A 5 7.026 -3.731 -6.147 1.00 0.18 H new ATOM 0 HD11 LEU A 5 5.906 -2.290 -4.495 1.00 0.20 H new ATOM 0 HD12 LEU A 5 6.765 -1.347 -5.735 1.00 0.20 H new ATOM 0 HD13 LEU A 5 4.994 -1.509 -5.808 1.00 0.20 H new ATOM 0 HD21 LEU A 5 4.952 -4.472 -5.021 1.00 0.20 H new ATOM 0 HD22 LEU A 5 3.997 -3.806 -6.366 1.00 0.20 H new ATOM 0 HD23 LEU A 5 5.110 -5.165 -6.652 1.00 0.20 H new ATOM 708 N GLU A 6 5.357 -0.261 -9.590 1.00 0.19 N ATOM 709 CA GLU A 6 5.421 1.184 -9.746 1.00 0.23 C ATOM 710 C GLU A 6 4.030 1.794 -9.679 1.00 0.21 C ATOM 711 O GLU A 6 3.776 2.726 -8.911 1.00 0.25 O ATOM 712 CB GLU A 6 6.054 1.563 -11.080 1.00 0.32 C ATOM 713 CG GLU A 6 6.072 3.061 -11.335 1.00 0.47 C ATOM 714 CD GLU A 6 6.273 3.400 -12.792 1.00 0.90 C ATOM 715 OE1 GLU A 6 5.289 3.338 -13.561 1.00 1.78 O ATOM 716 OE2 GLU A 6 7.413 3.721 -13.179 1.00 1.39 O ATOM 0 H GLU A 6 5.727 -0.788 -10.381 1.00 0.19 H new ATOM 0 HA GLU A 6 6.033 1.571 -8.931 1.00 0.23 H new ATOM 0 HB2 GLU A 6 7.076 1.185 -11.110 1.00 0.32 H new ATOM 0 HB3 GLU A 6 5.509 1.071 -11.885 1.00 0.32 H new ATOM 0 HG2 GLU A 6 5.133 3.496 -10.991 1.00 0.47 H new ATOM 0 HG3 GLU A 6 6.869 3.516 -10.747 1.00 0.47 H new ATOM 723 N LYS A 7 3.136 1.255 -10.499 1.00 0.18 N ATOM 724 CA LYS A 7 1.782 1.763 -10.595 1.00 0.20 C ATOM 725 C LYS A 7 1.073 1.700 -9.254 1.00 0.17 C ATOM 726 O LYS A 7 0.281 2.574 -8.943 1.00 0.19 O ATOM 727 CB LYS A 7 0.994 0.994 -11.662 1.00 0.26 C ATOM 728 CG LYS A 7 1.380 1.355 -13.093 1.00 0.41 C ATOM 729 CD LYS A 7 0.729 2.655 -13.552 1.00 0.90 C ATOM 730 CE LYS A 7 1.366 3.886 -12.925 1.00 0.83 C ATOM 731 NZ LYS A 7 2.696 4.201 -13.513 1.00 1.16 N ATOM 0 H LYS A 7 3.331 0.461 -11.109 1.00 0.18 H new ATOM 0 HA LYS A 7 1.837 2.810 -10.892 1.00 0.20 H new ATOM 0 HB2 LYS A 7 1.147 -0.075 -11.513 1.00 0.26 H new ATOM 0 HB3 LYS A 7 -0.070 1.186 -11.523 1.00 0.26 H new ATOM 0 HG2 LYS A 7 2.464 1.448 -13.163 1.00 0.41 H new ATOM 0 HG3 LYS A 7 1.086 0.547 -13.762 1.00 0.41 H new ATOM 0 HD2 LYS A 7 0.799 2.728 -14.637 1.00 0.90 H new ATOM 0 HD3 LYS A 7 -0.332 2.633 -13.302 1.00 0.90 H new ATOM 0 HE2 LYS A 7 0.703 4.741 -13.056 1.00 0.83 H new ATOM 0 HE3 LYS A 7 1.475 3.728 -11.852 1.00 0.83 H new ATOM 0 HZ1 LYS A 7 2.988 5.155 -13.219 1.00 1.16 H new ATOM 0 HZ2 LYS A 7 3.396 3.507 -13.181 1.00 1.16 H new ATOM 0 HZ3 LYS A 7 2.635 4.162 -14.550 1.00 1.16 H new ATOM 745 N ALA A 8 1.391 0.688 -8.455 1.00 0.18 N ATOM 746 CA ALA A 8 0.783 0.521 -7.137 1.00 0.19 C ATOM 747 C ALA A 8 0.824 1.816 -6.327 1.00 0.17 C ATOM 748 O ALA A 8 -0.208 2.286 -5.858 1.00 0.21 O ATOM 749 CB ALA A 8 1.465 -0.606 -6.378 1.00 0.20 C ATOM 0 H ALA A 8 2.070 -0.034 -8.697 1.00 0.18 H new ATOM 0 HA ALA A 8 -0.265 0.262 -7.287 1.00 0.19 H new ATOM 0 HB1 ALA A 8 1.001 -0.718 -5.398 1.00 0.20 H new ATOM 0 HB2 ALA A 8 1.361 -1.536 -6.937 1.00 0.20 H new ATOM 0 HB3 ALA A 8 2.523 -0.373 -6.254 1.00 0.20 H new ATOM 755 N LEU A 9 2.006 2.410 -6.191 1.00 0.14 N ATOM 756 CA LEU A 9 2.148 3.629 -5.392 1.00 0.14 C ATOM 757 C LEU A 9 1.615 4.841 -6.152 1.00 0.13 C ATOM 758 O LEU A 9 0.989 5.727 -5.568 1.00 0.16 O ATOM 759 CB LEU A 9 3.609 3.883 -4.990 1.00 0.15 C ATOM 760 CG LEU A 9 4.325 2.732 -4.273 1.00 0.16 C ATOM 761 CD1 LEU A 9 3.410 2.067 -3.264 1.00 0.19 C ATOM 762 CD2 LEU A 9 4.855 1.711 -5.258 1.00 0.15 C ATOM 0 H LEU A 9 2.870 2.075 -6.616 1.00 0.14 H new ATOM 0 HA LEU A 9 1.562 3.482 -4.485 1.00 0.14 H new ATOM 0 HB2 LEU A 9 4.173 4.130 -5.889 1.00 0.15 H new ATOM 0 HB3 LEU A 9 3.639 4.760 -4.344 1.00 0.15 H new ATOM 0 HG LEU A 9 5.174 3.159 -3.740 1.00 0.16 H new ATOM 0 HD11 LEU A 9 3.943 1.254 -2.770 1.00 0.19 H new ATOM 0 HD12 LEU A 9 3.095 2.799 -2.521 1.00 0.19 H new ATOM 0 HD13 LEU A 9 2.533 1.669 -3.775 1.00 0.19 H new ATOM 0 HD21 LEU A 9 5.357 0.909 -4.716 1.00 0.15 H new ATOM 0 HD22 LEU A 9 4.027 1.297 -5.834 1.00 0.15 H new ATOM 0 HD23 LEU A 9 5.563 2.191 -5.934 1.00 0.15 H new ATOM 774 N ASP A 10 1.869 4.867 -7.457 1.00 0.14 N ATOM 775 CA ASP A 10 1.414 5.962 -8.316 1.00 0.15 C ATOM 776 C ASP A 10 -0.102 6.111 -8.257 1.00 0.15 C ATOM 777 O ASP A 10 -0.626 7.208 -8.059 1.00 0.18 O ATOM 778 CB ASP A 10 1.855 5.712 -9.763 1.00 0.19 C ATOM 779 CG ASP A 10 1.239 6.688 -10.753 1.00 0.48 C ATOM 780 OD1 ASP A 10 0.156 6.389 -11.294 1.00 1.18 O ATOM 781 OD2 ASP A 10 1.848 7.742 -11.022 1.00 1.19 O ATOM 0 H ASP A 10 2.390 4.140 -7.947 1.00 0.14 H new ATOM 0 HA ASP A 10 1.864 6.886 -7.954 1.00 0.15 H new ATOM 0 HB2 ASP A 10 2.941 5.781 -9.822 1.00 0.19 H new ATOM 0 HB3 ASP A 10 1.584 4.695 -10.048 1.00 0.19 H new ATOM 786 N VAL A 11 -0.800 4.995 -8.402 1.00 0.16 N ATOM 787 CA VAL A 11 -2.252 5.010 -8.452 1.00 0.18 C ATOM 788 C VAL A 11 -2.846 5.238 -7.069 1.00 0.18 C ATOM 789 O VAL A 11 -3.992 5.659 -6.947 1.00 0.23 O ATOM 790 CB VAL A 11 -2.816 3.709 -9.048 1.00 0.20 C ATOM 791 CG1 VAL A 11 -2.155 3.426 -10.384 1.00 0.23 C ATOM 792 CG2 VAL A 11 -2.638 2.540 -8.087 1.00 0.18 C ATOM 0 H VAL A 11 -0.383 4.068 -8.487 1.00 0.16 H new ATOM 0 HA VAL A 11 -2.536 5.837 -9.102 1.00 0.18 H new ATOM 0 HB VAL A 11 -3.887 3.835 -9.208 1.00 0.20 H new ATOM 0 HG11 VAL A 11 -2.558 2.503 -10.801 1.00 0.23 H new ATOM 0 HG12 VAL A 11 -2.352 4.251 -11.069 1.00 0.23 H new ATOM 0 HG13 VAL A 11 -1.079 3.320 -10.243 1.00 0.23 H new ATOM 0 HG21 VAL A 11 -3.046 1.635 -8.536 1.00 0.18 H new ATOM 0 HG22 VAL A 11 -1.577 2.397 -7.881 1.00 0.18 H new ATOM 0 HG23 VAL A 11 -3.163 2.752 -7.156 1.00 0.18 H new ATOM 802 N MET A 12 -2.065 4.958 -6.032 1.00 0.16 N ATOM 803 CA MET A 12 -2.502 5.189 -4.663 1.00 0.20 C ATOM 804 C MET A 12 -2.856 6.648 -4.443 1.00 0.24 C ATOM 805 O MET A 12 -3.863 6.955 -3.819 1.00 0.40 O ATOM 806 CB MET A 12 -1.421 4.762 -3.681 1.00 0.25 C ATOM 807 CG MET A 12 -1.475 3.291 -3.331 1.00 0.17 C ATOM 808 SD MET A 12 0.045 2.710 -2.573 1.00 0.72 S ATOM 809 CE MET A 12 -0.474 1.113 -1.990 1.00 0.19 C ATOM 0 H MET A 12 -1.125 4.570 -6.115 1.00 0.16 H new ATOM 0 HA MET A 12 -3.395 4.589 -4.490 1.00 0.20 H new ATOM 0 HB2 MET A 12 -0.444 4.991 -4.106 1.00 0.25 H new ATOM 0 HB3 MET A 12 -1.518 5.349 -2.768 1.00 0.25 H new ATOM 0 HG2 MET A 12 -2.308 3.113 -2.651 1.00 0.17 H new ATOM 0 HG3 MET A 12 -1.671 2.713 -4.234 1.00 0.17 H new ATOM 0 HE1 MET A 12 0.402 0.504 -1.770 1.00 0.19 H new ATOM 0 HE2 MET A 12 -1.070 1.232 -1.085 1.00 0.19 H new ATOM 0 HE3 MET A 12 -1.073 0.623 -2.757 1.00 0.19 H new ATOM 819 N VAL A 13 -2.027 7.545 -4.957 1.00 0.17 N ATOM 820 CA VAL A 13 -2.290 8.972 -4.831 1.00 0.19 C ATOM 821 C VAL A 13 -3.101 9.497 -6.019 1.00 0.20 C ATOM 822 O VAL A 13 -3.854 10.465 -5.887 1.00 0.28 O ATOM 823 CB VAL A 13 -0.989 9.790 -4.677 1.00 0.18 C ATOM 824 CG1 VAL A 13 -0.319 9.481 -3.349 1.00 0.21 C ATOM 825 CG2 VAL A 13 -0.032 9.520 -5.825 1.00 0.19 C ATOM 0 H VAL A 13 -1.172 7.313 -5.462 1.00 0.17 H new ATOM 0 HA VAL A 13 -2.878 9.100 -3.922 1.00 0.19 H new ATOM 0 HB VAL A 13 -1.255 10.847 -4.699 1.00 0.18 H new ATOM 0 HG11 VAL A 13 0.596 10.066 -3.258 1.00 0.21 H new ATOM 0 HG12 VAL A 13 -0.995 9.735 -2.533 1.00 0.21 H new ATOM 0 HG13 VAL A 13 -0.077 8.419 -3.302 1.00 0.21 H new ATOM 0 HG21 VAL A 13 0.875 10.110 -5.689 1.00 0.19 H new ATOM 0 HG22 VAL A 13 0.224 8.461 -5.844 1.00 0.19 H new ATOM 0 HG23 VAL A 13 -0.507 9.796 -6.767 1.00 0.19 H new ATOM 835 N SER A 14 -2.962 8.848 -7.169 1.00 0.19 N ATOM 836 CA SER A 14 -3.673 9.260 -8.374 1.00 0.22 C ATOM 837 C SER A 14 -5.169 8.948 -8.255 1.00 0.24 C ATOM 838 O SER A 14 -6.014 9.843 -8.363 1.00 0.28 O ATOM 839 CB SER A 14 -3.072 8.566 -9.604 1.00 0.24 C ATOM 840 OG SER A 14 -3.601 9.091 -10.811 1.00 1.12 O ATOM 0 H SER A 14 -2.362 8.032 -7.293 1.00 0.19 H new ATOM 0 HA SER A 14 -3.562 10.338 -8.492 1.00 0.22 H new ATOM 0 HB2 SER A 14 -1.989 8.687 -9.598 1.00 0.24 H new ATOM 0 HB3 SER A 14 -3.273 7.496 -9.553 1.00 0.24 H new ATOM 0 HG SER A 14 -3.196 8.628 -11.574 1.00 1.12 H new ATOM 846 N THR A 15 -5.488 7.681 -8.007 1.00 0.25 N ATOM 847 CA THR A 15 -6.870 7.241 -7.849 1.00 0.28 C ATOM 848 C THR A 15 -7.478 7.891 -6.607 1.00 0.30 C ATOM 849 O THR A 15 -8.683 8.150 -6.544 1.00 0.33 O ATOM 850 CB THR A 15 -6.933 5.705 -7.721 1.00 0.28 C ATOM 851 OG1 THR A 15 -6.066 5.105 -8.691 1.00 0.34 O ATOM 852 CG2 THR A 15 -8.342 5.177 -7.924 1.00 0.26 C ATOM 0 H THR A 15 -4.800 6.934 -7.910 1.00 0.25 H new ATOM 0 HA THR A 15 -7.438 7.541 -8.729 1.00 0.28 H new ATOM 0 HB THR A 15 -6.614 5.446 -6.711 1.00 0.28 H new ATOM 0 HG1 THR A 15 -5.144 5.118 -8.359 1.00 0.34 H new ATOM 0 HG21 THR A 15 -8.341 4.091 -7.826 1.00 0.26 H new ATOM 0 HG22 THR A 15 -9.004 5.609 -7.174 1.00 0.26 H new ATOM 0 HG23 THR A 15 -8.693 5.451 -8.919 1.00 0.26 H new ATOM 860 N PHE A 16 -6.608 8.157 -5.636 1.00 0.31 N ATOM 861 CA PHE A 16 -6.969 8.854 -4.407 1.00 0.37 C ATOM 862 C PHE A 16 -7.733 10.139 -4.712 1.00 0.42 C ATOM 863 O PHE A 16 -8.927 10.239 -4.432 1.00 0.54 O ATOM 864 CB PHE A 16 -5.686 9.169 -3.633 1.00 0.45 C ATOM 865 CG PHE A 16 -5.877 9.861 -2.318 1.00 0.36 C ATOM 866 CD1 PHE A 16 -6.350 9.171 -1.220 1.00 1.26 C ATOM 867 CD2 PHE A 16 -5.556 11.197 -2.177 1.00 1.24 C ATOM 868 CE1 PHE A 16 -6.506 9.802 -0.003 1.00 1.43 C ATOM 869 CE2 PHE A 16 -5.705 11.834 -0.963 1.00 1.39 C ATOM 870 CZ PHE A 16 -6.183 11.135 0.123 1.00 0.99 C ATOM 0 H PHE A 16 -5.624 7.892 -5.682 1.00 0.31 H new ATOM 0 HA PHE A 16 -7.621 8.218 -3.808 1.00 0.37 H new ATOM 0 HB2 PHE A 16 -5.150 8.236 -3.458 1.00 0.45 H new ATOM 0 HB3 PHE A 16 -5.047 9.790 -4.261 1.00 0.45 H new ATOM 0 HD1 PHE A 16 -6.601 8.125 -1.315 1.00 1.26 H new ATOM 0 HD2 PHE A 16 -5.184 11.749 -3.027 1.00 1.24 H new ATOM 0 HE1 PHE A 16 -6.880 9.252 0.848 1.00 1.43 H new ATOM 0 HE2 PHE A 16 -5.448 12.878 -0.864 1.00 1.39 H new ATOM 0 HZ PHE A 16 -6.305 11.632 1.074 1.00 0.99 H new ATOM 880 N HIS A 17 -7.039 11.104 -5.309 1.00 0.44 N ATOM 881 CA HIS A 17 -7.624 12.404 -5.629 1.00 0.54 C ATOM 882 C HIS A 17 -8.790 12.292 -6.617 1.00 0.47 C ATOM 883 O HIS A 17 -9.683 13.139 -6.618 1.00 0.52 O ATOM 884 CB HIS A 17 -6.564 13.345 -6.218 1.00 0.72 C ATOM 885 CG HIS A 17 -5.378 13.587 -5.333 1.00 1.09 C ATOM 886 ND1 HIS A 17 -5.481 13.919 -4.001 1.00 2.16 N ATOM 887 CD2 HIS A 17 -4.052 13.552 -5.606 1.00 1.23 C ATOM 888 CE1 HIS A 17 -4.271 14.089 -3.496 1.00 2.80 C ATOM 889 NE2 HIS A 17 -3.385 13.870 -4.449 1.00 2.27 N ATOM 0 H HIS A 17 -6.061 11.009 -5.583 1.00 0.44 H new ATOM 0 HA HIS A 17 -8.006 12.809 -4.692 1.00 0.54 H new ATOM 0 HB2 HIS A 17 -6.215 12.930 -7.164 1.00 0.72 H new ATOM 0 HB3 HIS A 17 -7.033 14.303 -6.443 1.00 0.72 H new ATOM 0 HD2 HIS A 17 -3.602 13.317 -6.559 1.00 1.23 H new ATOM 0 HE1 HIS A 17 -4.046 14.361 -2.475 1.00 2.80 H new ATOM 0 HE2 HIS A 17 -2.372 13.927 -4.343 1.00 2.27 H new ATOM 898 N LYS A 18 -8.779 11.254 -7.453 1.00 0.43 N ATOM 899 CA LYS A 18 -9.769 11.125 -8.523 1.00 0.46 C ATOM 900 C LYS A 18 -11.192 11.027 -7.971 1.00 0.44 C ATOM 901 O LYS A 18 -12.102 11.688 -8.470 1.00 0.62 O ATOM 902 CB LYS A 18 -9.484 9.898 -9.400 1.00 0.55 C ATOM 903 CG LYS A 18 -10.338 9.862 -10.667 1.00 0.77 C ATOM 904 CD LYS A 18 -10.559 8.463 -11.206 1.00 0.73 C ATOM 905 CE LYS A 18 -9.255 7.788 -11.511 1.00 1.41 C ATOM 906 NZ LYS A 18 -9.438 6.376 -11.952 1.00 1.69 N ATOM 0 H LYS A 18 -8.100 10.494 -7.411 1.00 0.43 H new ATOM 0 HA LYS A 18 -9.690 12.027 -9.129 1.00 0.46 H new ATOM 0 HB2 LYS A 18 -8.430 9.893 -9.678 1.00 0.55 H new ATOM 0 HB3 LYS A 18 -9.665 8.993 -8.820 1.00 0.55 H new ATOM 0 HG2 LYS A 18 -11.305 10.319 -10.457 1.00 0.77 H new ATOM 0 HG3 LYS A 18 -9.859 10.468 -11.436 1.00 0.77 H new ATOM 0 HD2 LYS A 18 -11.115 7.873 -10.477 1.00 0.73 H new ATOM 0 HD3 LYS A 18 -11.167 8.510 -12.109 1.00 0.73 H new ATOM 0 HE2 LYS A 18 -8.734 8.345 -12.290 1.00 1.41 H new ATOM 0 HE3 LYS A 18 -8.621 7.810 -10.625 1.00 1.41 H new ATOM 0 HZ1 LYS A 18 -8.632 5.804 -11.628 1.00 1.69 H new ATOM 0 HZ2 LYS A 18 -10.317 5.997 -11.546 1.00 1.69 H new ATOM 0 HZ3 LYS A 18 -9.493 6.341 -12.990 1.00 1.69 H new ATOM 920 N TYR A 19 -11.380 10.206 -6.947 1.00 0.37 N ATOM 921 CA TYR A 19 -12.723 9.928 -6.437 1.00 0.41 C ATOM 922 C TYR A 19 -13.054 10.767 -5.215 1.00 0.48 C ATOM 923 O TYR A 19 -14.216 11.045 -4.962 1.00 0.73 O ATOM 924 CB TYR A 19 -12.872 8.442 -6.115 1.00 0.43 C ATOM 925 CG TYR A 19 -12.722 7.552 -7.327 1.00 0.38 C ATOM 926 CD1 TYR A 19 -13.818 7.220 -8.111 1.00 1.18 C ATOM 927 CD2 TYR A 19 -11.481 7.055 -7.693 1.00 1.14 C ATOM 928 CE1 TYR A 19 -13.678 6.419 -9.228 1.00 1.21 C ATOM 929 CE2 TYR A 19 -11.336 6.251 -8.803 1.00 1.14 C ATOM 930 CZ TYR A 19 -12.433 5.938 -9.566 1.00 0.48 C ATOM 931 OH TYR A 19 -12.281 5.152 -10.683 1.00 0.59 O ATOM 0 H TYR A 19 -10.629 9.723 -6.454 1.00 0.37 H new ATOM 0 HA TYR A 19 -13.431 10.199 -7.221 1.00 0.41 H new ATOM 0 HB2 TYR A 19 -12.126 8.161 -5.372 1.00 0.43 H new ATOM 0 HB3 TYR A 19 -13.850 8.271 -5.665 1.00 0.43 H new ATOM 0 HD1 TYR A 19 -14.795 7.594 -7.844 1.00 1.18 H new ATOM 0 HD2 TYR A 19 -10.614 7.302 -7.099 1.00 1.14 H new ATOM 0 HE1 TYR A 19 -14.539 6.172 -9.832 1.00 1.21 H new ATOM 0 HE2 TYR A 19 -10.362 5.869 -9.071 1.00 1.14 H new ATOM 0 HH TYR A 19 -11.661 4.419 -10.486 1.00 0.59 H new ATOM 941 N SER A 20 -12.042 11.173 -4.465 1.00 0.38 N ATOM 942 CA SER A 20 -12.264 11.982 -3.272 1.00 0.45 C ATOM 943 C SER A 20 -12.687 13.396 -3.654 1.00 0.54 C ATOM 944 O SER A 20 -13.462 14.042 -2.950 1.00 0.68 O ATOM 945 CB SER A 20 -10.998 12.011 -2.424 1.00 0.47 C ATOM 946 OG SER A 20 -9.872 12.301 -3.229 1.00 0.52 O ATOM 0 H SER A 20 -11.064 10.959 -4.657 1.00 0.38 H new ATOM 0 HA SER A 20 -13.069 11.535 -2.688 1.00 0.45 H new ATOM 0 HB2 SER A 20 -11.095 12.762 -1.640 1.00 0.47 H new ATOM 0 HB3 SER A 20 -10.862 11.049 -1.930 1.00 0.47 H new ATOM 0 HG SER A 20 -9.388 11.472 -3.425 1.00 0.52 H new ATOM 952 N GLY A 21 -12.189 13.865 -4.793 1.00 0.54 N ATOM 953 CA GLY A 21 -12.534 15.191 -5.265 1.00 0.65 C ATOM 954 C GLY A 21 -13.840 15.208 -6.034 1.00 0.68 C ATOM 955 O GLY A 21 -13.995 15.969 -6.992 1.00 0.82 O ATOM 0 H GLY A 21 -11.551 13.348 -5.398 1.00 0.54 H new ATOM 0 HA2 GLY A 21 -12.607 15.869 -4.415 1.00 0.65 H new ATOM 0 HA3 GLY A 21 -11.734 15.566 -5.904 1.00 0.65 H new ATOM 1057 N LYS A 28 -9.778 13.464 0.991 1.00 0.67 N ATOM 1058 CA LYS A 28 -10.641 12.708 1.879 1.00 0.64 C ATOM 1059 C LYS A 28 -11.653 11.909 1.097 1.00 0.48 C ATOM 1060 O LYS A 28 -12.485 12.459 0.381 1.00 0.54 O ATOM 1061 CB LYS A 28 -11.380 13.638 2.848 1.00 0.87 C ATOM 1062 CG LYS A 28 -10.479 14.398 3.803 1.00 1.00 C ATOM 1063 CD LYS A 28 -9.675 13.453 4.674 1.00 1.04 C ATOM 1064 CE LYS A 28 -8.961 14.198 5.788 1.00 1.55 C ATOM 1065 NZ LYS A 28 -9.921 14.839 6.724 1.00 2.03 N ATOM 0 HA LYS A 28 -10.006 12.028 2.446 1.00 0.64 H new ATOM 0 HB2 LYS A 28 -11.962 14.355 2.270 1.00 0.87 H new ATOM 0 HB3 LYS A 28 -12.088 13.047 3.429 1.00 0.87 H new ATOM 0 HG2 LYS A 28 -9.802 15.038 3.236 1.00 1.00 H new ATOM 0 HG3 LYS A 28 -11.083 15.051 4.433 1.00 1.00 H new ATOM 0 HD2 LYS A 28 -10.336 12.700 5.103 1.00 1.04 H new ATOM 0 HD3 LYS A 28 -8.945 12.924 4.062 1.00 1.04 H new ATOM 0 HE2 LYS A 28 -8.323 13.506 6.338 1.00 1.55 H new ATOM 0 HE3 LYS A 28 -8.309 14.958 5.358 1.00 1.55 H new ATOM 0 HZ1 LYS A 28 -9.449 15.024 7.632 1.00 2.03 H new ATOM 0 HZ2 LYS A 28 -10.255 15.737 6.318 1.00 2.03 H new ATOM 0 HZ3 LYS A 28 -10.732 14.206 6.877 1.00 2.03 H new ATOM 1079 N LEU A 29 -11.584 10.607 1.248 1.00 0.36 N ATOM 1080 CA LEU A 29 -12.588 9.739 0.657 1.00 0.32 C ATOM 1081 C LEU A 29 -13.599 9.298 1.699 1.00 0.34 C ATOM 1082 O LEU A 29 -13.289 8.479 2.566 1.00 0.40 O ATOM 1083 CB LEU A 29 -11.970 8.504 -0.003 1.00 0.30 C ATOM 1084 CG LEU A 29 -11.160 8.771 -1.270 1.00 0.30 C ATOM 1085 CD1 LEU A 29 -9.704 9.024 -0.931 1.00 0.32 C ATOM 1086 CD2 LEU A 29 -11.298 7.611 -2.237 1.00 0.33 C ATOM 0 H LEU A 29 -10.852 10.124 1.769 1.00 0.36 H new ATOM 0 HA LEU A 29 -13.088 10.323 -0.116 1.00 0.32 H new ATOM 0 HB2 LEU A 29 -11.324 8.011 0.723 1.00 0.30 H new ATOM 0 HB3 LEU A 29 -12.770 7.804 -0.245 1.00 0.30 H new ATOM 0 HG LEU A 29 -11.553 9.667 -1.751 1.00 0.30 H new ATOM 0 HD11 LEU A 29 -9.144 9.212 -1.847 1.00 0.32 H new ATOM 0 HD12 LEU A 29 -9.629 9.891 -0.275 1.00 0.32 H new ATOM 0 HD13 LEU A 29 -9.291 8.151 -0.426 1.00 0.32 H new ATOM 0 HD21 LEU A 29 -10.716 7.815 -3.135 1.00 0.33 H new ATOM 0 HD22 LEU A 29 -10.931 6.699 -1.766 1.00 0.33 H new ATOM 0 HD23 LEU A 29 -12.347 7.484 -2.506 1.00 0.33 H new ATOM 1098 N ASN A 30 -14.797 9.860 1.633 1.00 0.35 N ATOM 1099 CA ASN A 30 -15.897 9.380 2.454 1.00 0.35 C ATOM 1100 C ASN A 30 -16.445 8.093 1.843 1.00 0.31 C ATOM 1101 O ASN A 30 -15.889 7.594 0.859 1.00 0.29 O ATOM 1102 CB ASN A 30 -17.009 10.439 2.582 1.00 0.41 C ATOM 1103 CG ASN A 30 -17.836 10.612 1.320 1.00 0.62 C ATOM 1104 OD1 ASN A 30 -18.831 9.918 1.114 1.00 1.20 O ATOM 1105 ND2 ASN A 30 -17.447 11.554 0.480 1.00 0.63 N ATOM 0 H ASN A 30 -15.031 10.644 1.023 1.00 0.35 H new ATOM 0 HA ASN A 30 -15.527 9.181 3.460 1.00 0.35 H new ATOM 0 HB2 ASN A 30 -17.670 10.162 3.403 1.00 0.41 H new ATOM 0 HB3 ASN A 30 -16.558 11.396 2.844 1.00 0.41 H new ATOM 0 HD21 ASN A 30 -17.977 11.726 -0.374 1.00 0.63 H new ATOM 0 HD22 ASN A 30 -16.616 12.109 0.685 1.00 0.63 H new ATOM 1112 N LYS A 31 -17.514 7.559 2.423 1.00 0.32 N ATOM 1113 CA LYS A 31 -18.122 6.315 1.938 1.00 0.31 C ATOM 1114 C LYS A 31 -18.321 6.329 0.422 1.00 0.30 C ATOM 1115 O LYS A 31 -17.922 5.397 -0.274 1.00 0.31 O ATOM 1116 CB LYS A 31 -19.474 6.074 2.611 1.00 0.35 C ATOM 1117 CG LYS A 31 -19.393 5.869 4.113 1.00 0.45 C ATOM 1118 CD LYS A 31 -20.745 5.487 4.710 1.00 0.56 C ATOM 1119 CE LYS A 31 -21.696 6.675 4.833 1.00 1.22 C ATOM 1120 NZ LYS A 31 -22.182 7.171 3.517 1.00 1.70 N ATOM 0 H LYS A 31 -17.982 7.966 3.233 1.00 0.32 H new ATOM 0 HA LYS A 31 -17.432 5.510 2.192 1.00 0.31 H new ATOM 0 HB2 LYS A 31 -20.126 6.923 2.406 1.00 0.35 H new ATOM 0 HB3 LYS A 31 -19.941 5.198 2.161 1.00 0.35 H new ATOM 0 HG2 LYS A 31 -18.665 5.088 4.334 1.00 0.45 H new ATOM 0 HG3 LYS A 31 -19.033 6.783 4.585 1.00 0.45 H new ATOM 0 HD2 LYS A 31 -21.208 4.720 4.088 1.00 0.56 H new ATOM 0 HD3 LYS A 31 -20.591 5.048 5.696 1.00 0.56 H new ATOM 0 HE2 LYS A 31 -22.551 6.387 5.444 1.00 1.22 H new ATOM 0 HE3 LYS A 31 -21.189 7.486 5.356 1.00 1.22 H new ATOM 0 HZ1 LYS A 31 -23.164 7.499 3.611 1.00 1.70 H new ATOM 0 HZ2 LYS A 31 -21.582 7.959 3.200 1.00 1.70 H new ATOM 0 HZ3 LYS A 31 -22.139 6.401 2.819 1.00 1.70 H new ATOM 1134 N SER A 32 -18.922 7.400 -0.077 1.00 0.32 N ATOM 1135 CA SER A 32 -19.292 7.493 -1.480 1.00 0.34 C ATOM 1136 C SER A 32 -18.061 7.495 -2.391 1.00 0.31 C ATOM 1137 O SER A 32 -18.060 6.851 -3.444 1.00 0.34 O ATOM 1138 CB SER A 32 -20.133 8.754 -1.708 1.00 0.43 C ATOM 1139 OG SER A 32 -20.844 8.686 -2.933 1.00 1.29 O ATOM 0 H SER A 32 -19.165 8.222 0.475 1.00 0.32 H new ATOM 0 HA SER A 32 -19.882 6.613 -1.736 1.00 0.34 H new ATOM 0 HB2 SER A 32 -20.836 8.879 -0.884 1.00 0.43 H new ATOM 0 HB3 SER A 32 -19.485 9.630 -1.710 1.00 0.43 H new ATOM 0 HG SER A 32 -21.372 9.503 -3.050 1.00 1.29 H new ATOM 1145 N GLU A 33 -17.000 8.180 -1.967 1.00 0.30 N ATOM 1146 CA GLU A 33 -15.809 8.331 -2.796 1.00 0.31 C ATOM 1147 C GLU A 33 -15.106 6.993 -2.910 1.00 0.26 C ATOM 1148 O GLU A 33 -14.728 6.554 -3.999 1.00 0.27 O ATOM 1149 CB GLU A 33 -14.840 9.353 -2.185 1.00 0.37 C ATOM 1150 CG GLU A 33 -15.497 10.609 -1.629 1.00 0.51 C ATOM 1151 CD GLU A 33 -16.360 11.352 -2.632 1.00 0.88 C ATOM 1152 OE1 GLU A 33 -17.517 10.935 -2.846 1.00 1.68 O ATOM 1153 OE2 GLU A 33 -15.896 12.369 -3.183 1.00 1.46 O ATOM 0 H GLU A 33 -16.942 8.637 -1.057 1.00 0.30 H new ATOM 0 HA GLU A 33 -16.117 8.685 -3.780 1.00 0.31 H new ATOM 0 HB2 GLU A 33 -14.282 8.868 -1.384 1.00 0.37 H new ATOM 0 HB3 GLU A 33 -14.117 9.646 -2.946 1.00 0.37 H new ATOM 0 HG2 GLU A 33 -16.110 10.336 -0.770 1.00 0.51 H new ATOM 0 HG3 GLU A 33 -14.720 11.282 -1.265 1.00 0.51 H new ATOM 1160 N LEU A 34 -14.945 6.344 -1.765 1.00 0.23 N ATOM 1161 CA LEU A 34 -14.334 5.031 -1.708 1.00 0.20 C ATOM 1162 C LEU A 34 -15.139 4.029 -2.508 1.00 0.20 C ATOM 1163 O LEU A 34 -14.575 3.229 -3.253 1.00 0.23 O ATOM 1164 CB LEU A 34 -14.216 4.560 -0.264 1.00 0.18 C ATOM 1165 CG LEU A 34 -12.964 5.020 0.464 1.00 0.18 C ATOM 1166 CD1 LEU A 34 -13.072 4.694 1.938 1.00 0.21 C ATOM 1167 CD2 LEU A 34 -11.741 4.358 -0.146 1.00 0.18 C ATOM 0 H LEU A 34 -15.233 6.712 -0.858 1.00 0.23 H new ATOM 0 HA LEU A 34 -13.336 5.105 -2.141 1.00 0.20 H new ATOM 0 HB2 LEU A 34 -15.088 4.910 0.288 1.00 0.18 H new ATOM 0 HB3 LEU A 34 -14.246 3.471 -0.250 1.00 0.18 H new ATOM 0 HG LEU A 34 -12.862 6.100 0.359 1.00 0.18 H new ATOM 0 HD11 LEU A 34 -12.170 5.027 2.451 1.00 0.21 H new ATOM 0 HD12 LEU A 34 -13.939 5.202 2.360 1.00 0.21 H new ATOM 0 HD13 LEU A 34 -13.185 3.617 2.065 1.00 0.21 H new ATOM 0 HD21 LEU A 34 -10.846 4.692 0.380 1.00 0.18 H new ATOM 0 HD22 LEU A 34 -11.831 3.275 -0.058 1.00 0.18 H new ATOM 0 HD23 LEU A 34 -11.666 4.631 -1.199 1.00 0.18 H new ATOM 1179 N LYS A 35 -16.456 4.084 -2.367 1.00 0.23 N ATOM 1180 CA LYS A 35 -17.321 3.143 -3.052 1.00 0.29 C ATOM 1181 C LYS A 35 -17.078 3.175 -4.543 1.00 0.25 C ATOM 1182 O LYS A 35 -16.791 2.144 -5.141 1.00 0.27 O ATOM 1183 CB LYS A 35 -18.797 3.413 -2.751 1.00 0.42 C ATOM 1184 CG LYS A 35 -19.725 2.373 -3.363 1.00 0.60 C ATOM 1185 CD LYS A 35 -21.099 2.385 -2.713 1.00 0.71 C ATOM 1186 CE LYS A 35 -21.898 3.603 -3.123 1.00 0.53 C ATOM 1187 NZ LYS A 35 -23.194 3.687 -2.399 1.00 0.89 N ATOM 0 H LYS A 35 -16.944 4.767 -1.787 1.00 0.23 H new ATOM 0 HA LYS A 35 -17.078 2.148 -2.679 1.00 0.29 H new ATOM 0 HB2 LYS A 35 -18.945 3.434 -1.671 1.00 0.42 H new ATOM 0 HB3 LYS A 35 -19.065 4.400 -3.129 1.00 0.42 H new ATOM 0 HG2 LYS A 35 -19.828 2.562 -4.432 1.00 0.60 H new ATOM 0 HG3 LYS A 35 -19.282 1.383 -3.256 1.00 0.60 H new ATOM 0 HD2 LYS A 35 -21.642 1.482 -2.992 1.00 0.71 H new ATOM 0 HD3 LYS A 35 -20.989 2.369 -1.629 1.00 0.71 H new ATOM 0 HE2 LYS A 35 -21.314 4.502 -2.927 1.00 0.53 H new ATOM 0 HE3 LYS A 35 -22.084 3.571 -4.197 1.00 0.53 H new ATOM 0 HZ1 LYS A 35 -23.833 4.333 -2.905 1.00 0.89 H new ATOM 0 HZ2 LYS A 35 -23.626 2.742 -2.349 1.00 0.89 H new ATOM 0 HZ3 LYS A 35 -23.031 4.044 -1.436 1.00 0.89 H new ATOM 1201 N GLU A 36 -17.150 4.355 -5.138 1.00 0.25 N ATOM 1202 CA GLU A 36 -16.963 4.470 -6.571 1.00 0.28 C ATOM 1203 C GLU A 36 -15.568 3.992 -6.958 1.00 0.28 C ATOM 1204 O GLU A 36 -15.399 3.286 -7.951 1.00 0.34 O ATOM 1205 CB GLU A 36 -17.170 5.900 -7.048 1.00 0.32 C ATOM 1206 CG GLU A 36 -17.423 5.967 -8.537 1.00 0.66 C ATOM 1207 CD GLU A 36 -17.545 7.373 -9.069 1.00 0.77 C ATOM 1208 OE1 GLU A 36 -18.559 8.039 -8.775 1.00 1.28 O ATOM 1209 OE2 GLU A 36 -16.644 7.805 -9.814 1.00 1.49 O ATOM 0 H GLU A 36 -17.334 5.235 -4.656 1.00 0.25 H new ATOM 0 HA GLU A 36 -17.710 3.841 -7.055 1.00 0.28 H new ATOM 0 HB2 GLU A 36 -18.013 6.341 -6.516 1.00 0.32 H new ATOM 0 HB3 GLU A 36 -16.291 6.496 -6.802 1.00 0.32 H new ATOM 0 HG2 GLU A 36 -16.610 5.460 -9.058 1.00 0.66 H new ATOM 0 HG3 GLU A 36 -18.338 5.421 -8.766 1.00 0.66 H new ATOM 1216 N LEU A 37 -14.586 4.358 -6.148 1.00 0.25 N ATOM 1217 CA LEU A 37 -13.209 3.935 -6.357 1.00 0.27 C ATOM 1218 C LEU A 37 -13.130 2.415 -6.452 1.00 0.23 C ATOM 1219 O LEU A 37 -12.581 1.866 -7.410 1.00 0.24 O ATOM 1220 CB LEU A 37 -12.344 4.451 -5.205 1.00 0.32 C ATOM 1221 CG LEU A 37 -10.836 4.387 -5.422 1.00 0.40 C ATOM 1222 CD1 LEU A 37 -10.180 5.603 -4.800 1.00 0.33 C ATOM 1223 CD2 LEU A 37 -10.254 3.115 -4.824 1.00 0.74 C ATOM 0 H LEU A 37 -14.720 4.954 -5.331 1.00 0.25 H new ATOM 0 HA LEU A 37 -12.839 4.350 -7.295 1.00 0.27 H new ATOM 0 HB2 LEU A 37 -12.619 5.487 -5.006 1.00 0.32 H new ATOM 0 HB3 LEU A 37 -12.587 3.879 -4.310 1.00 0.32 H new ATOM 0 HG LEU A 37 -10.639 4.378 -6.494 1.00 0.40 H new ATOM 0 HD11 LEU A 37 -9.102 5.555 -4.956 1.00 0.33 H new ATOM 0 HD12 LEU A 37 -10.574 6.507 -5.265 1.00 0.33 H new ATOM 0 HD13 LEU A 37 -10.391 5.623 -3.731 1.00 0.33 H new ATOM 0 HD21 LEU A 37 -9.177 3.093 -4.992 1.00 0.74 H new ATOM 0 HD22 LEU A 37 -10.455 3.092 -3.753 1.00 0.74 H new ATOM 0 HD23 LEU A 37 -10.713 2.247 -5.298 1.00 0.74 H new ATOM 1235 N LEU A 38 -13.711 1.744 -5.470 1.00 0.20 N ATOM 1236 CA LEU A 38 -13.722 0.292 -5.443 1.00 0.20 C ATOM 1237 C LEU A 38 -14.599 -0.280 -6.554 1.00 0.22 C ATOM 1238 O LEU A 38 -14.233 -1.252 -7.190 1.00 0.24 O ATOM 1239 CB LEU A 38 -14.174 -0.223 -4.072 1.00 0.19 C ATOM 1240 CG LEU A 38 -13.098 -0.222 -2.982 1.00 0.18 C ATOM 1241 CD1 LEU A 38 -13.435 0.774 -1.886 1.00 0.19 C ATOM 1242 CD2 LEU A 38 -12.933 -1.616 -2.396 1.00 0.21 C ATOM 0 H LEU A 38 -14.182 2.184 -4.680 1.00 0.20 H new ATOM 0 HA LEU A 38 -12.702 -0.050 -5.618 1.00 0.20 H new ATOM 0 HB2 LEU A 38 -15.012 0.386 -3.732 1.00 0.19 H new ATOM 0 HB3 LEU A 38 -14.547 -1.240 -4.190 1.00 0.19 H new ATOM 0 HG LEU A 38 -12.155 0.080 -3.439 1.00 0.18 H new ATOM 0 HD11 LEU A 38 -12.655 0.755 -1.125 1.00 0.19 H new ATOM 0 HD12 LEU A 38 -13.502 1.775 -2.312 1.00 0.19 H new ATOM 0 HD13 LEU A 38 -14.390 0.508 -1.434 1.00 0.19 H new ATOM 0 HD21 LEU A 38 -12.165 -1.597 -1.623 1.00 0.21 H new ATOM 0 HD22 LEU A 38 -13.878 -1.942 -1.961 1.00 0.21 H new ATOM 0 HD23 LEU A 38 -12.638 -2.309 -3.184 1.00 0.21 H new ATOM 1254 N THR A 39 -15.747 0.330 -6.803 1.00 0.23 N ATOM 1255 CA THR A 39 -16.663 -0.175 -7.833 1.00 0.26 C ATOM 1256 C THR A 39 -16.011 -0.146 -9.210 1.00 0.27 C ATOM 1257 O THR A 39 -16.337 -0.952 -10.081 1.00 0.30 O ATOM 1258 CB THR A 39 -17.991 0.615 -7.903 1.00 0.29 C ATOM 1259 OG1 THR A 39 -17.741 1.996 -8.189 1.00 0.33 O ATOM 1260 CG2 THR A 39 -18.779 0.498 -6.609 1.00 0.30 C ATOM 0 H THR A 39 -16.071 1.166 -6.317 1.00 0.23 H new ATOM 0 HA THR A 39 -16.890 -1.201 -7.543 1.00 0.26 H new ATOM 0 HB THR A 39 -18.585 0.181 -8.707 1.00 0.29 H new ATOM 0 HG1 THR A 39 -16.775 2.161 -8.184 1.00 0.33 H new ATOM 0 HG21 THR A 39 -19.706 1.065 -6.695 1.00 0.30 H new ATOM 0 HG22 THR A 39 -19.011 -0.550 -6.418 1.00 0.30 H new ATOM 0 HG23 THR A 39 -18.186 0.894 -5.785 1.00 0.30 H new ATOM 1268 N ARG A 40 -15.086 0.786 -9.398 1.00 0.27 N ATOM 1269 CA ARG A 40 -14.435 0.966 -10.683 1.00 0.30 C ATOM 1270 C ARG A 40 -13.210 0.069 -10.820 1.00 0.29 C ATOM 1271 O ARG A 40 -13.139 -0.757 -11.732 1.00 0.33 O ATOM 1272 CB ARG A 40 -14.034 2.430 -10.872 1.00 0.34 C ATOM 1273 CG ARG A 40 -15.216 3.379 -11.005 1.00 0.36 C ATOM 1274 CD ARG A 40 -16.060 3.053 -12.225 1.00 0.47 C ATOM 1275 NE ARG A 40 -15.282 3.112 -13.461 1.00 0.67 N ATOM 1276 CZ ARG A 40 -15.797 2.943 -14.678 1.00 0.90 C ATOM 1277 NH1 ARG A 40 -17.099 2.746 -14.834 1.00 1.24 N ATOM 1278 NH2 ARG A 40 -15.008 2.992 -15.742 1.00 1.09 N ATOM 0 H ARG A 40 -14.771 1.430 -8.672 1.00 0.27 H new ATOM 0 HA ARG A 40 -15.147 0.684 -11.458 1.00 0.30 H new ATOM 0 HB2 ARG A 40 -13.423 2.742 -10.025 1.00 0.34 H new ATOM 0 HB3 ARG A 40 -13.411 2.514 -11.762 1.00 0.34 H new ATOM 0 HG2 ARG A 40 -15.833 3.320 -10.109 1.00 0.36 H new ATOM 0 HG3 ARG A 40 -14.854 4.405 -11.076 1.00 0.36 H new ATOM 0 HD2 ARG A 40 -16.489 2.057 -12.114 1.00 0.47 H new ATOM 0 HD3 ARG A 40 -16.893 3.753 -12.287 1.00 0.47 H new ATOM 0 HE ARG A 40 -14.281 3.294 -13.387 1.00 0.67 H new ATOM 0 HH11 ARG A 40 -17.713 2.723 -14.019 1.00 1.24 H new ATOM 0 HH12 ARG A 40 -17.487 2.617 -15.769 1.00 1.24 H new ATOM 0 HH21 ARG A 40 -14.008 3.159 -15.628 1.00 1.09 H new ATOM 0 HH22 ARG A 40 -15.401 2.863 -16.674 1.00 1.09 H new ATOM 1292 N GLU A 41 -12.249 0.227 -9.921 1.00 0.29 N ATOM 1293 CA GLU A 41 -10.979 -0.478 -10.046 1.00 0.32 C ATOM 1294 C GLU A 41 -10.895 -1.725 -9.167 1.00 0.35 C ATOM 1295 O GLU A 41 -10.072 -2.599 -9.419 1.00 0.46 O ATOM 1296 CB GLU A 41 -9.812 0.447 -9.720 1.00 0.38 C ATOM 1297 CG GLU A 41 -9.308 1.267 -10.897 1.00 0.47 C ATOM 1298 CD GLU A 41 -10.250 2.382 -11.313 1.00 0.83 C ATOM 1299 OE1 GLU A 41 -10.320 3.410 -10.603 1.00 1.54 O ATOM 1300 OE2 GLU A 41 -10.906 2.244 -12.367 1.00 1.60 O ATOM 0 H GLU A 41 -12.322 0.832 -9.103 1.00 0.29 H new ATOM 0 HA GLU A 41 -10.919 -0.804 -11.085 1.00 0.32 H new ATOM 0 HB2 GLU A 41 -10.115 1.127 -8.924 1.00 0.38 H new ATOM 0 HB3 GLU A 41 -8.988 -0.152 -9.332 1.00 0.38 H new ATOM 0 HG2 GLU A 41 -8.340 1.698 -10.640 1.00 0.47 H new ATOM 0 HG3 GLU A 41 -9.146 0.604 -11.747 1.00 0.47 H new ATOM 1307 N LEU A 42 -11.733 -1.827 -8.146 1.00 0.28 N ATOM 1308 CA LEU A 42 -11.664 -2.981 -7.244 1.00 0.29 C ATOM 1309 C LEU A 42 -12.991 -3.759 -7.189 1.00 0.28 C ATOM 1310 O LEU A 42 -13.438 -4.121 -6.102 1.00 0.26 O ATOM 1311 CB LEU A 42 -11.292 -2.534 -5.816 1.00 0.27 C ATOM 1312 CG LEU A 42 -10.031 -1.677 -5.679 1.00 0.27 C ATOM 1313 CD1 LEU A 42 -10.349 -0.198 -5.887 1.00 0.27 C ATOM 1314 CD2 LEU A 42 -9.401 -1.903 -4.311 1.00 0.31 C ATOM 0 H LEU A 42 -12.456 -1.144 -7.919 1.00 0.28 H new ATOM 0 HA LEU A 42 -10.894 -3.640 -7.644 1.00 0.29 H new ATOM 0 HB2 LEU A 42 -12.132 -1.975 -5.403 1.00 0.27 H new ATOM 0 HB3 LEU A 42 -11.168 -3.425 -5.200 1.00 0.27 H new ATOM 0 HG LEU A 42 -9.322 -1.976 -6.451 1.00 0.27 H new ATOM 0 HD11 LEU A 42 -9.436 0.388 -5.784 1.00 0.27 H new ATOM 0 HD12 LEU A 42 -10.764 -0.052 -6.884 1.00 0.27 H new ATOM 0 HD13 LEU A 42 -11.074 0.127 -5.141 1.00 0.27 H new ATOM 0 HD21 LEU A 42 -8.504 -1.291 -4.218 1.00 0.31 H new ATOM 0 HD22 LEU A 42 -10.112 -1.625 -3.533 1.00 0.31 H new ATOM 0 HD23 LEU A 42 -9.136 -2.955 -4.202 1.00 0.31 H new ATOM 1326 N PRO A 43 -13.633 -4.074 -8.341 1.00 0.32 N ATOM 1327 CA PRO A 43 -14.939 -4.741 -8.339 1.00 0.34 C ATOM 1328 C PRO A 43 -14.836 -6.159 -7.803 1.00 0.35 C ATOM 1329 O PRO A 43 -15.788 -6.697 -7.233 1.00 0.38 O ATOM 1330 CB PRO A 43 -15.361 -4.755 -9.815 1.00 0.43 C ATOM 1331 CG PRO A 43 -14.430 -3.814 -10.504 1.00 0.52 C ATOM 1332 CD PRO A 43 -13.156 -3.843 -9.713 1.00 0.36 C ATOM 0 HA PRO A 43 -15.657 -4.229 -7.698 1.00 0.34 H new ATOM 0 HB2 PRO A 43 -15.287 -5.758 -10.235 1.00 0.43 H new ATOM 0 HB3 PRO A 43 -16.397 -4.437 -9.930 1.00 0.43 H new ATOM 0 HG2 PRO A 43 -14.256 -4.121 -11.535 1.00 0.52 H new ATOM 0 HG3 PRO A 43 -14.846 -2.807 -10.537 1.00 0.52 H new ATOM 0 HD2 PRO A 43 -12.489 -4.637 -10.049 1.00 0.36 H new ATOM 0 HD3 PRO A 43 -12.605 -2.906 -9.798 1.00 0.36 H new ATOM 1340 N SER A 44 -13.662 -6.749 -7.979 1.00 0.37 N ATOM 1341 CA SER A 44 -13.382 -8.078 -7.469 1.00 0.41 C ATOM 1342 C SER A 44 -13.350 -8.066 -5.944 1.00 0.37 C ATOM 1343 O SER A 44 -13.581 -9.084 -5.302 1.00 0.42 O ATOM 1344 CB SER A 44 -12.051 -8.575 -8.036 1.00 0.48 C ATOM 1345 OG SER A 44 -12.050 -8.496 -9.452 1.00 1.09 O ATOM 0 H SER A 44 -12.882 -6.320 -8.477 1.00 0.37 H new ATOM 0 HA SER A 44 -14.174 -8.758 -7.784 1.00 0.41 H new ATOM 0 HB2 SER A 44 -11.233 -7.979 -7.633 1.00 0.48 H new ATOM 0 HB3 SER A 44 -11.879 -9.605 -7.724 1.00 0.48 H new ATOM 0 HG SER A 44 -11.190 -8.816 -9.797 1.00 1.09 H new ATOM 1351 N PHE A 45 -13.101 -6.896 -5.373 1.00 0.33 N ATOM 1352 CA PHE A 45 -13.039 -6.754 -3.927 1.00 0.34 C ATOM 1353 C PHE A 45 -14.359 -6.215 -3.387 1.00 0.36 C ATOM 1354 O PHE A 45 -14.449 -5.796 -2.234 1.00 0.40 O ATOM 1355 CB PHE A 45 -11.884 -5.832 -3.531 1.00 0.33 C ATOM 1356 CG PHE A 45 -10.542 -6.320 -4.000 1.00 0.35 C ATOM 1357 CD1 PHE A 45 -9.941 -7.417 -3.405 1.00 1.31 C ATOM 1358 CD2 PHE A 45 -9.883 -5.681 -5.038 1.00 1.17 C ATOM 1359 CE1 PHE A 45 -8.708 -7.868 -3.836 1.00 1.36 C ATOM 1360 CE2 PHE A 45 -8.650 -6.127 -5.473 1.00 1.15 C ATOM 1361 CZ PHE A 45 -8.063 -7.221 -4.872 1.00 0.46 C ATOM 0 H PHE A 45 -12.939 -6.032 -5.890 1.00 0.33 H new ATOM 0 HA PHE A 45 -12.863 -7.737 -3.490 1.00 0.34 H new ATOM 0 HB2 PHE A 45 -12.065 -4.839 -3.942 1.00 0.33 H new ATOM 0 HB3 PHE A 45 -11.866 -5.730 -2.446 1.00 0.33 H new ATOM 0 HD1 PHE A 45 -10.442 -7.926 -2.595 1.00 1.31 H new ATOM 0 HD2 PHE A 45 -10.339 -4.824 -5.512 1.00 1.17 H new ATOM 0 HE1 PHE A 45 -8.250 -8.724 -3.364 1.00 1.36 H new ATOM 0 HE2 PHE A 45 -8.146 -5.620 -6.283 1.00 1.15 H new ATOM 0 HZ PHE A 45 -7.099 -7.572 -5.211 1.00 0.46 H new ATOM 1371 N LEU A 46 -15.377 -6.182 -4.239 1.00 0.36 N ATOM 1372 CA LEU A 46 -16.706 -5.780 -3.801 1.00 0.40 C ATOM 1373 C LEU A 46 -17.743 -6.865 -4.063 1.00 0.55 C ATOM 1374 O LEU A 46 -18.788 -6.908 -3.411 1.00 0.70 O ATOM 1375 CB LEU A 46 -17.144 -4.495 -4.491 1.00 0.35 C ATOM 1376 CG LEU A 46 -16.254 -3.285 -4.240 1.00 0.32 C ATOM 1377 CD1 LEU A 46 -16.869 -2.058 -4.878 1.00 0.34 C ATOM 1378 CD2 LEU A 46 -16.047 -3.067 -2.749 1.00 0.30 C ATOM 0 H LEU A 46 -15.308 -6.426 -5.227 1.00 0.36 H new ATOM 0 HA LEU A 46 -16.642 -5.612 -2.726 1.00 0.40 H new ATOM 0 HB2 LEU A 46 -17.189 -4.676 -5.565 1.00 0.35 H new ATOM 0 HB3 LEU A 46 -18.156 -4.254 -4.166 1.00 0.35 H new ATOM 0 HG LEU A 46 -15.278 -3.467 -4.690 1.00 0.32 H new ATOM 0 HD11 LEU A 46 -16.230 -1.194 -4.696 1.00 0.34 H new ATOM 0 HD12 LEU A 46 -16.968 -2.217 -5.952 1.00 0.34 H new ATOM 0 HD13 LEU A 46 -17.853 -1.878 -4.446 1.00 0.34 H new ATOM 0 HD21 LEU A 46 -15.408 -2.198 -2.594 1.00 0.30 H new ATOM 0 HD22 LEU A 46 -17.011 -2.900 -2.268 1.00 0.30 H new ATOM 0 HD23 LEU A 46 -15.573 -3.947 -2.315 1.00 0.30 H new ATOM 1390 N GLY A 47 -17.469 -7.722 -5.040 1.00 0.64 N ATOM 1391 CA GLY A 47 -18.412 -8.768 -5.397 1.00 0.82 C ATOM 1392 C GLY A 47 -19.592 -8.227 -6.186 1.00 0.87 C ATOM 1393 O GLY A 47 -20.582 -8.929 -6.396 1.00 1.23 O ATOM 0 H GLY A 47 -16.611 -7.712 -5.592 1.00 0.64 H new ATOM 0 HA2 GLY A 47 -17.902 -9.530 -5.986 1.00 0.82 H new ATOM 0 HA3 GLY A 47 -18.774 -9.254 -4.491 1.00 0.82 H new ATOM 1397 N LYS A 48 -19.476 -6.966 -6.613 1.00 0.79 N ATOM 1398 CA LYS A 48 -20.522 -6.283 -7.387 1.00 0.95 C ATOM 1399 C LYS A 48 -21.823 -6.144 -6.596 1.00 0.73 C ATOM 1400 O LYS A 48 -22.883 -5.873 -7.162 1.00 0.97 O ATOM 1401 CB LYS A 48 -20.800 -7.004 -8.706 1.00 1.43 C ATOM 1402 CG LYS A 48 -19.786 -6.712 -9.806 1.00 2.17 C ATOM 1403 CD LYS A 48 -18.511 -7.533 -9.660 1.00 2.32 C ATOM 1404 CE LYS A 48 -18.760 -9.008 -9.942 1.00 2.88 C ATOM 1405 NZ LYS A 48 -17.494 -9.784 -10.007 1.00 3.51 N ATOM 0 H LYS A 48 -18.655 -6.388 -6.433 1.00 0.79 H new ATOM 0 HA LYS A 48 -20.143 -5.284 -7.601 1.00 0.95 H new ATOM 0 HB2 LYS A 48 -20.820 -8.078 -8.522 1.00 1.43 H new ATOM 0 HB3 LYS A 48 -21.792 -6.722 -9.058 1.00 1.43 H new ATOM 0 HG2 LYS A 48 -20.238 -6.919 -10.776 1.00 2.17 H new ATOM 0 HG3 LYS A 48 -19.535 -5.651 -9.791 1.00 2.17 H new ATOM 0 HD2 LYS A 48 -17.753 -7.154 -10.345 1.00 2.32 H new ATOM 0 HD3 LYS A 48 -18.116 -7.416 -8.651 1.00 2.32 H new ATOM 0 HE2 LYS A 48 -19.400 -9.423 -9.163 1.00 2.88 H new ATOM 0 HE3 LYS A 48 -19.297 -9.111 -10.885 1.00 2.88 H new ATOM 0 HZ1 LYS A 48 -17.709 -10.783 -10.201 1.00 3.51 H new ATOM 0 HZ2 LYS A 48 -16.893 -9.405 -10.767 1.00 3.51 H new ATOM 0 HZ3 LYS A 48 -16.993 -9.707 -9.099 1.00 3.51 H new ATOM 1419 N ARG A 49 -21.728 -6.304 -5.292 1.00 0.73 N ATOM 1420 CA ARG A 49 -22.896 -6.246 -4.421 1.00 0.70 C ATOM 1421 C ARG A 49 -22.637 -5.324 -3.241 1.00 0.61 C ATOM 1422 O ARG A 49 -23.160 -5.529 -2.143 1.00 0.75 O ATOM 1423 CB ARG A 49 -23.245 -7.654 -3.936 1.00 0.97 C ATOM 1424 CG ARG A 49 -22.169 -8.290 -3.073 1.00 1.10 C ATOM 1425 CD ARG A 49 -22.531 -9.713 -2.685 1.00 1.54 C ATOM 1426 NE ARG A 49 -22.420 -10.635 -3.812 1.00 2.02 N ATOM 1427 CZ ARG A 49 -22.190 -11.941 -3.681 1.00 2.68 C ATOM 1428 NH1 ARG A 49 -22.146 -12.498 -2.476 1.00 3.06 N ATOM 1429 NH2 ARG A 49 -22.033 -12.697 -4.758 1.00 3.24 N ATOM 0 H ARG A 49 -20.849 -6.477 -4.804 1.00 0.73 H new ATOM 0 HA ARG A 49 -23.739 -5.845 -4.984 1.00 0.70 H new ATOM 0 HB2 ARG A 49 -24.175 -7.613 -3.369 1.00 0.97 H new ATOM 0 HB3 ARG A 49 -23.427 -8.291 -4.801 1.00 0.97 H new ATOM 0 HG2 ARG A 49 -21.222 -8.289 -3.612 1.00 1.10 H new ATOM 0 HG3 ARG A 49 -22.024 -7.693 -2.173 1.00 1.10 H new ATOM 0 HD2 ARG A 49 -21.877 -10.046 -1.879 1.00 1.54 H new ATOM 0 HD3 ARG A 49 -23.550 -9.735 -2.298 1.00 1.54 H new ATOM 0 HE ARG A 49 -22.525 -10.258 -4.754 1.00 2.02 H new ATOM 0 HH11 ARG A 49 -22.289 -11.925 -1.644 1.00 3.06 H new ATOM 0 HH12 ARG A 49 -21.970 -13.498 -2.383 1.00 3.06 H new ATOM 0 HH21 ARG A 49 -22.088 -12.279 -5.687 1.00 3.24 H new ATOM 0 HH22 ARG A 49 -21.857 -13.697 -4.658 1.00 3.24 H new ATOM 1443 N THR A 50 -21.867 -4.285 -3.486 1.00 0.55 N ATOM 1444 CA THR A 50 -21.459 -3.385 -2.430 1.00 0.50 C ATOM 1445 C THR A 50 -22.332 -2.156 -2.334 1.00 0.50 C ATOM 1446 O THR A 50 -22.363 -1.310 -3.227 1.00 0.56 O ATOM 1447 CB THR A 50 -20.008 -2.956 -2.601 1.00 0.54 C ATOM 1448 OG1 THR A 50 -19.649 -3.033 -3.983 1.00 0.91 O ATOM 1449 CG2 THR A 50 -19.103 -3.840 -1.762 1.00 0.51 C ATOM 0 H THR A 50 -21.510 -4.043 -4.410 1.00 0.55 H new ATOM 0 HA THR A 50 -21.569 -3.948 -1.503 1.00 0.50 H new ATOM 0 HB THR A 50 -19.889 -1.927 -2.263 1.00 0.54 H new ATOM 0 HG1 THR A 50 -19.929 -2.212 -4.440 1.00 0.91 H new ATOM 0 HG21 THR A 50 -18.067 -3.526 -1.890 1.00 0.51 H new ATOM 0 HG22 THR A 50 -19.381 -3.753 -0.712 1.00 0.51 H new ATOM 0 HG23 THR A 50 -19.210 -4.877 -2.081 1.00 0.51 H new ATOM 1457 N ASP A 51 -23.044 -2.088 -1.239 1.00 0.49 N ATOM 1458 CA ASP A 51 -23.794 -0.906 -0.868 1.00 0.51 C ATOM 1459 C ASP A 51 -23.137 -0.281 0.349 1.00 0.44 C ATOM 1460 O ASP A 51 -21.974 -0.566 0.647 1.00 0.43 O ATOM 1461 CB ASP A 51 -25.255 -1.254 -0.565 1.00 0.60 C ATOM 1462 CG ASP A 51 -26.051 -1.579 -1.811 1.00 1.15 C ATOM 1463 OD1 ASP A 51 -26.412 -0.636 -2.550 1.00 1.94 O ATOM 1464 OD2 ASP A 51 -26.328 -2.775 -2.053 1.00 1.72 O ATOM 0 H ASP A 51 -23.123 -2.855 -0.571 1.00 0.49 H new ATOM 0 HA ASP A 51 -23.791 -0.200 -1.699 1.00 0.51 H new ATOM 0 HB2 ASP A 51 -25.287 -2.106 0.114 1.00 0.60 H new ATOM 0 HB3 ASP A 51 -25.724 -0.417 -0.048 1.00 0.60 H new ATOM 1469 N GLU A 52 -23.880 0.535 1.076 1.00 0.47 N ATOM 1470 CA GLU A 52 -23.356 1.167 2.279 1.00 0.46 C ATOM 1471 C GLU A 52 -23.214 0.137 3.402 1.00 0.46 C ATOM 1472 O GLU A 52 -22.692 0.438 4.475 1.00 0.46 O ATOM 1473 CB GLU A 52 -24.280 2.302 2.718 1.00 0.49 C ATOM 1474 CG GLU A 52 -24.548 3.331 1.631 1.00 0.52 C ATOM 1475 CD GLU A 52 -23.332 4.162 1.283 1.00 0.71 C ATOM 1476 OE1 GLU A 52 -22.977 5.057 2.081 1.00 1.44 O ATOM 1477 OE2 GLU A 52 -22.749 3.948 0.201 1.00 1.27 O ATOM 0 H GLU A 52 -24.846 0.777 0.857 1.00 0.47 H new ATOM 0 HA GLU A 52 -22.371 1.578 2.059 1.00 0.46 H new ATOM 0 HB2 GLU A 52 -25.229 1.879 3.046 1.00 0.49 H new ATOM 0 HB3 GLU A 52 -23.840 2.804 3.580 1.00 0.49 H new ATOM 0 HG2 GLU A 52 -24.899 2.820 0.735 1.00 0.52 H new ATOM 0 HG3 GLU A 52 -25.351 3.992 1.956 1.00 0.52 H new ATOM 1484 N ALA A 53 -23.677 -1.082 3.138 1.00 0.52 N ATOM 1485 CA ALA A 53 -23.629 -2.159 4.120 1.00 0.58 C ATOM 1486 C ALA A 53 -22.235 -2.777 4.197 1.00 0.57 C ATOM 1487 O ALA A 53 -21.652 -2.865 5.277 1.00 0.68 O ATOM 1488 CB ALA A 53 -24.665 -3.218 3.789 1.00 0.65 C ATOM 0 H ALA A 53 -24.092 -1.349 2.245 1.00 0.52 H new ATOM 0 HA ALA A 53 -23.859 -1.736 5.098 1.00 0.58 H new ATOM 0 HB1 ALA A 53 -24.619 -4.016 4.530 1.00 0.65 H new ATOM 0 HB2 ALA A 53 -25.659 -2.771 3.799 1.00 0.65 H new ATOM 0 HB3 ALA A 53 -24.462 -3.629 2.800 1.00 0.65 H new ATOM 1494 N ALA A 54 -21.694 -3.201 3.057 1.00 0.49 N ATOM 1495 CA ALA A 54 -20.346 -3.761 3.030 1.00 0.50 C ATOM 1496 C ALA A 54 -19.332 -2.675 3.362 1.00 0.45 C ATOM 1497 O ALA A 54 -18.325 -2.918 4.031 1.00 0.52 O ATOM 1498 CB ALA A 54 -20.025 -4.389 1.673 1.00 0.49 C ATOM 0 H ALA A 54 -22.162 -3.168 2.151 1.00 0.49 H new ATOM 0 HA ALA A 54 -20.291 -4.551 3.779 1.00 0.50 H new ATOM 0 HB1 ALA A 54 -19.014 -4.795 1.690 1.00 0.49 H new ATOM 0 HB2 ALA A 54 -20.735 -5.190 1.466 1.00 0.49 H new ATOM 0 HB3 ALA A 54 -20.098 -3.630 0.894 1.00 0.49 H new ATOM 1504 N PHE A 55 -19.608 -1.466 2.904 1.00 0.36 N ATOM 1505 CA PHE A 55 -18.714 -0.342 3.135 1.00 0.32 C ATOM 1506 C PHE A 55 -18.744 0.113 4.587 1.00 0.34 C ATOM 1507 O PHE A 55 -17.838 0.807 5.041 1.00 0.34 O ATOM 1508 CB PHE A 55 -19.045 0.805 2.185 1.00 0.31 C ATOM 1509 CG PHE A 55 -18.419 0.615 0.837 1.00 0.28 C ATOM 1510 CD1 PHE A 55 -19.070 -0.099 -0.155 1.00 1.20 C ATOM 1511 CD2 PHE A 55 -17.162 1.127 0.572 1.00 1.20 C ATOM 1512 CE1 PHE A 55 -18.477 -0.295 -1.385 1.00 1.20 C ATOM 1513 CE2 PHE A 55 -16.567 0.937 -0.656 1.00 1.21 C ATOM 1514 CZ PHE A 55 -17.226 0.223 -1.637 1.00 0.31 C ATOM 0 H PHE A 55 -20.445 -1.236 2.369 1.00 0.36 H new ATOM 0 HA PHE A 55 -17.697 -0.674 2.929 1.00 0.32 H new ATOM 0 HB2 PHE A 55 -20.127 0.884 2.075 1.00 0.31 H new ATOM 0 HB3 PHE A 55 -18.699 1.744 2.616 1.00 0.31 H new ATOM 0 HD1 PHE A 55 -20.052 -0.506 0.036 1.00 1.20 H new ATOM 0 HD2 PHE A 55 -16.640 1.683 1.337 1.00 1.20 H new ATOM 0 HE1 PHE A 55 -18.994 -0.855 -2.150 1.00 1.20 H new ATOM 0 HE2 PHE A 55 -15.587 1.346 -0.851 1.00 1.21 H new ATOM 0 HZ PHE A 55 -16.761 0.071 -2.600 1.00 0.31 H new ATOM 1524 N GLN A 56 -19.778 -0.300 5.311 1.00 0.37 N ATOM 1525 CA GLN A 56 -19.896 -0.011 6.735 1.00 0.40 C ATOM 1526 C GLN A 56 -18.693 -0.561 7.501 1.00 0.37 C ATOM 1527 O GLN A 56 -18.172 0.089 8.408 1.00 0.42 O ATOM 1528 CB GLN A 56 -21.192 -0.614 7.274 1.00 0.46 C ATOM 1529 CG GLN A 56 -21.406 -0.419 8.763 1.00 0.58 C ATOM 1530 CD GLN A 56 -22.698 -1.048 9.236 1.00 0.68 C ATOM 1531 OE1 GLN A 56 -23.674 -1.124 8.488 1.00 1.42 O ATOM 1532 NE2 GLN A 56 -22.719 -1.505 10.474 1.00 1.00 N ATOM 0 H GLN A 56 -20.554 -0.842 4.930 1.00 0.37 H new ATOM 0 HA GLN A 56 -19.918 1.070 6.874 1.00 0.40 H new ATOM 0 HB2 GLN A 56 -22.033 -0.174 6.738 1.00 0.46 H new ATOM 0 HB3 GLN A 56 -21.199 -1.682 7.056 1.00 0.46 H new ATOM 0 HG2 GLN A 56 -20.569 -0.854 9.310 1.00 0.58 H new ATOM 0 HG3 GLN A 56 -21.416 0.647 8.991 1.00 0.58 H new ATOM 0 HE21 GLN A 56 -21.890 -1.423 11.062 1.00 1.00 H new ATOM 0 HE22 GLN A 56 -23.565 -1.940 10.843 1.00 1.00 H new ATOM 1541 N LYS A 57 -18.239 -1.755 7.124 1.00 0.34 N ATOM 1542 CA LYS A 57 -17.072 -2.349 7.761 1.00 0.35 C ATOM 1543 C LYS A 57 -15.818 -1.657 7.265 1.00 0.29 C ATOM 1544 O LYS A 57 -15.039 -1.143 8.058 1.00 0.34 O ATOM 1545 CB LYS A 57 -16.977 -3.850 7.464 1.00 0.47 C ATOM 1546 CG LYS A 57 -17.123 -4.758 8.685 1.00 0.85 C ATOM 1547 CD LYS A 57 -15.907 -4.734 9.620 1.00 0.57 C ATOM 1548 CE LYS A 57 -15.942 -3.563 10.590 1.00 0.63 C ATOM 1549 NZ LYS A 57 -14.914 -3.706 11.654 1.00 0.92 N ATOM 0 H LYS A 57 -18.659 -2.323 6.388 1.00 0.34 H new ATOM 0 HA LYS A 57 -17.171 -2.220 8.839 1.00 0.35 H new ATOM 0 HB2 LYS A 57 -17.749 -4.112 6.740 1.00 0.47 H new ATOM 0 HB3 LYS A 57 -16.016 -4.052 6.992 1.00 0.47 H new ATOM 0 HG2 LYS A 57 -18.008 -4.458 9.246 1.00 0.85 H new ATOM 0 HG3 LYS A 57 -17.291 -5.781 8.348 1.00 0.85 H new ATOM 0 HD2 LYS A 57 -15.867 -5.667 10.183 1.00 0.57 H new ATOM 0 HD3 LYS A 57 -14.996 -4.681 9.024 1.00 0.57 H new ATOM 0 HE2 LYS A 57 -15.777 -2.633 10.046 1.00 0.63 H new ATOM 0 HE3 LYS A 57 -16.930 -3.495 11.044 1.00 0.63 H new ATOM 0 HZ1 LYS A 57 -15.234 -3.217 12.514 1.00 0.92 H new ATOM 0 HZ2 LYS A 57 -14.769 -4.714 11.863 1.00 0.92 H new ATOM 0 HZ3 LYS A 57 -14.019 -3.287 11.330 1.00 0.92 H new ATOM 1563 N LEU A 58 -15.660 -1.624 5.943 1.00 0.24 N ATOM 1564 CA LEU A 58 -14.475 -1.051 5.311 1.00 0.20 C ATOM 1565 C LEU A 58 -14.136 0.311 5.892 1.00 0.20 C ATOM 1566 O LEU A 58 -13.100 0.474 6.529 1.00 0.22 O ATOM 1567 CB LEU A 58 -14.688 -0.920 3.803 1.00 0.20 C ATOM 1568 CG LEU A 58 -13.522 -0.273 3.069 1.00 0.19 C ATOM 1569 CD1 LEU A 58 -12.235 -0.989 3.427 1.00 0.20 C ATOM 1570 CD2 LEU A 58 -13.759 -0.283 1.564 1.00 0.23 C ATOM 0 H LEU A 58 -16.346 -1.992 5.284 1.00 0.24 H new ATOM 0 HA LEU A 58 -13.642 -1.726 5.507 1.00 0.20 H new ATOM 0 HB2 LEU A 58 -14.864 -1.911 3.383 1.00 0.20 H new ATOM 0 HB3 LEU A 58 -15.589 -0.333 3.623 1.00 0.20 H new ATOM 0 HG LEU A 58 -13.439 0.769 3.379 1.00 0.19 H new ATOM 0 HD11 LEU A 58 -11.401 -0.524 2.900 1.00 0.20 H new ATOM 0 HD12 LEU A 58 -12.068 -0.922 4.502 1.00 0.20 H new ATOM 0 HD13 LEU A 58 -12.309 -2.037 3.136 1.00 0.20 H new ATOM 0 HD21 LEU A 58 -12.913 0.184 1.059 1.00 0.23 H new ATOM 0 HD22 LEU A 58 -13.864 -1.312 1.219 1.00 0.23 H new ATOM 0 HD23 LEU A 58 -14.669 0.271 1.335 1.00 0.23 H new ATOM 1582 N MET A 59 -15.010 1.275 5.630 1.00 0.21 N ATOM 1583 CA MET A 59 -14.923 2.620 6.193 1.00 0.26 C ATOM 1584 C MET A 59 -14.474 2.606 7.656 1.00 0.27 C ATOM 1585 O MET A 59 -13.591 3.365 8.049 1.00 0.33 O ATOM 1586 CB MET A 59 -16.290 3.295 6.097 1.00 0.36 C ATOM 1587 CG MET A 59 -16.195 4.794 5.964 1.00 0.34 C ATOM 1588 SD MET A 59 -15.425 5.260 4.412 1.00 0.72 S ATOM 1589 CE MET A 59 -14.728 6.829 4.872 1.00 0.32 C ATOM 0 H MET A 59 -15.811 1.144 5.012 1.00 0.21 H new ATOM 0 HA MET A 59 -14.177 3.171 5.620 1.00 0.26 H new ATOM 0 HB2 MET A 59 -16.829 2.892 5.239 1.00 0.36 H new ATOM 0 HB3 MET A 59 -16.874 3.050 6.984 1.00 0.36 H new ATOM 0 HG2 MET A 59 -17.192 5.231 6.024 1.00 0.34 H new ATOM 0 HG3 MET A 59 -15.618 5.200 6.795 1.00 0.34 H new ATOM 0 HE1 MET A 59 -14.286 7.302 3.995 1.00 0.32 H new ATOM 0 HE2 MET A 59 -15.511 7.471 5.274 1.00 0.32 H new ATOM 0 HE3 MET A 59 -13.959 6.677 5.629 1.00 0.32 H new ATOM 1599 N SER A 60 -15.083 1.733 8.444 1.00 0.28 N ATOM 1600 CA SER A 60 -14.785 1.624 9.866 1.00 0.35 C ATOM 1601 C SER A 60 -13.337 1.195 10.098 1.00 0.32 C ATOM 1602 O SER A 60 -12.605 1.841 10.848 1.00 0.36 O ATOM 1603 CB SER A 60 -15.707 0.599 10.506 1.00 0.41 C ATOM 1604 OG SER A 60 -15.624 0.634 11.922 1.00 0.64 O ATOM 0 H SER A 60 -15.796 1.081 8.118 1.00 0.28 H new ATOM 0 HA SER A 60 -14.937 2.605 10.315 1.00 0.35 H new ATOM 0 HB2 SER A 60 -16.735 0.790 10.196 1.00 0.41 H new ATOM 0 HB3 SER A 60 -15.447 -0.398 10.150 1.00 0.41 H new ATOM 0 HG SER A 60 -16.230 -0.036 12.302 1.00 0.64 H new ATOM 1610 N ASN A 61 -12.939 0.097 9.457 1.00 0.30 N ATOM 1611 CA ASN A 61 -11.588 -0.436 9.599 1.00 0.31 C ATOM 1612 C ASN A 61 -10.593 0.581 9.097 1.00 0.31 C ATOM 1613 O ASN A 61 -9.566 0.851 9.716 1.00 0.39 O ATOM 1614 CB ASN A 61 -11.424 -1.707 8.773 1.00 0.34 C ATOM 1615 CG ASN A 61 -12.289 -2.858 9.224 1.00 0.43 C ATOM 1616 OD1 ASN A 61 -13.398 -3.051 8.740 1.00 0.95 O ATOM 1617 ND2 ASN A 61 -11.790 -3.638 10.152 1.00 0.57 N ATOM 0 H ASN A 61 -13.538 -0.442 8.831 1.00 0.30 H new ATOM 0 HA ASN A 61 -11.416 -0.659 10.652 1.00 0.31 H new ATOM 0 HB2 ASN A 61 -11.654 -1.482 7.732 1.00 0.34 H new ATOM 0 HB3 ASN A 61 -10.380 -2.017 8.809 1.00 0.34 H new ATOM 0 HD21 ASN A 61 -12.329 -4.434 10.493 1.00 0.57 H new ATOM 0 HD22 ASN A 61 -10.863 -3.448 10.533 1.00 0.57 H new ATOM 1624 N LEU A 62 -10.937 1.121 7.947 1.00 0.30 N ATOM 1625 CA LEU A 62 -10.126 2.107 7.261 1.00 0.33 C ATOM 1626 C LEU A 62 -9.846 3.331 8.119 1.00 0.33 C ATOM 1627 O LEU A 62 -8.694 3.709 8.308 1.00 0.38 O ATOM 1628 CB LEU A 62 -10.834 2.530 5.981 1.00 0.37 C ATOM 1629 CG LEU A 62 -9.950 2.522 4.751 1.00 0.24 C ATOM 1630 CD1 LEU A 62 -9.178 1.223 4.699 1.00 0.52 C ATOM 1631 CD2 LEU A 62 -10.779 2.690 3.493 1.00 0.28 C ATOM 0 H LEU A 62 -11.799 0.885 7.455 1.00 0.30 H new ATOM 0 HA LEU A 62 -9.164 1.647 7.036 1.00 0.33 H new ATOM 0 HB2 LEU A 62 -11.681 1.865 5.811 1.00 0.37 H new ATOM 0 HB3 LEU A 62 -11.239 3.533 6.117 1.00 0.37 H new ATOM 0 HG LEU A 62 -9.253 3.358 4.810 1.00 0.24 H new ATOM 0 HD11 LEU A 62 -8.541 1.214 3.815 1.00 0.52 H new ATOM 0 HD12 LEU A 62 -8.561 1.131 5.592 1.00 0.52 H new ATOM 0 HD13 LEU A 62 -9.876 0.387 4.652 1.00 0.52 H new ATOM 0 HD21 LEU A 62 -10.124 2.681 2.622 1.00 0.28 H new ATOM 0 HD22 LEU A 62 -11.495 1.871 3.417 1.00 0.28 H new ATOM 0 HD23 LEU A 62 -11.315 3.638 3.534 1.00 0.28 H new ATOM 1643 N ASP A 63 -10.903 3.948 8.624 1.00 0.37 N ATOM 1644 CA ASP A 63 -10.780 5.195 9.369 1.00 0.43 C ATOM 1645 C ASP A 63 -10.043 4.974 10.691 1.00 0.38 C ATOM 1646 O ASP A 63 -10.639 4.580 11.699 1.00 0.43 O ATOM 1647 CB ASP A 63 -12.163 5.794 9.617 1.00 0.56 C ATOM 1648 CG ASP A 63 -12.104 7.204 10.160 1.00 0.85 C ATOM 1649 OD1 ASP A 63 -10.998 7.771 10.248 1.00 1.35 O ATOM 1650 OD2 ASP A 63 -13.170 7.756 10.499 1.00 1.56 O ATOM 0 H ASP A 63 -11.859 3.606 8.532 1.00 0.37 H new ATOM 0 HA ASP A 63 -10.194 5.896 8.774 1.00 0.43 H new ATOM 0 HB2 ASP A 63 -12.727 5.792 8.684 1.00 0.56 H new ATOM 0 HB3 ASP A 63 -12.707 5.162 10.319 1.00 0.56 H new ATOM 1655 N SER A 64 -8.739 5.213 10.667 1.00 0.37 N ATOM 1656 CA SER A 64 -7.886 4.961 11.812 1.00 0.41 C ATOM 1657 C SER A 64 -7.765 6.195 12.710 1.00 0.52 C ATOM 1658 O SER A 64 -7.399 6.088 13.880 1.00 0.64 O ATOM 1659 CB SER A 64 -6.505 4.506 11.330 1.00 0.45 C ATOM 1660 OG SER A 64 -5.875 5.504 10.541 1.00 0.58 O ATOM 0 H SER A 64 -8.247 5.586 9.855 1.00 0.37 H new ATOM 0 HA SER A 64 -8.340 4.171 12.411 1.00 0.41 H new ATOM 0 HB2 SER A 64 -5.878 4.271 12.190 1.00 0.45 H new ATOM 0 HB3 SER A 64 -6.605 3.590 10.748 1.00 0.45 H new ATOM 0 HG SER A 64 -6.513 6.224 10.354 1.00 0.58 H new ATOM 1666 N ASN A 65 -8.071 7.365 12.159 1.00 0.60 N ATOM 1667 CA ASN A 65 -7.946 8.612 12.907 1.00 0.83 C ATOM 1668 C ASN A 65 -9.309 9.082 13.399 1.00 0.89 C ATOM 1669 O ASN A 65 -9.401 9.968 14.251 1.00 1.10 O ATOM 1670 CB ASN A 65 -7.293 9.700 12.040 1.00 0.95 C ATOM 1671 CG ASN A 65 -8.275 10.396 11.114 1.00 0.99 C ATOM 1672 OD1 ASN A 65 -8.800 11.461 11.434 1.00 1.52 O ATOM 1673 ND2 ASN A 65 -8.533 9.800 9.963 1.00 1.44 N ATOM 0 H ASN A 65 -8.406 7.476 11.202 1.00 0.60 H new ATOM 0 HA ASN A 65 -7.309 8.426 13.772 1.00 0.83 H new ATOM 0 HB2 ASN A 65 -6.827 10.442 12.689 1.00 0.95 H new ATOM 0 HB3 ASN A 65 -6.497 9.252 11.445 1.00 0.95 H new ATOM 0 HD21 ASN A 65 -9.187 10.223 9.305 1.00 1.44 H new ATOM 0 HD22 ASN A 65 -8.078 8.917 9.733 1.00 1.44 H new ATOM 1680 N ARG A 66 -10.356 8.469 12.852 1.00 0.79 N ATOM 1681 CA ARG A 66 -11.743 8.806 13.170 1.00 0.98 C ATOM 1682 C ARG A 66 -12.101 10.172 12.596 1.00 1.05 C ATOM 1683 O ARG A 66 -12.111 11.184 13.300 1.00 1.34 O ATOM 1684 CB ARG A 66 -12.029 8.745 14.675 1.00 1.26 C ATOM 1685 CG ARG A 66 -11.790 7.373 15.288 1.00 1.46 C ATOM 1686 CD ARG A 66 -12.474 6.273 14.488 1.00 1.25 C ATOM 1687 NE ARG A 66 -13.905 6.520 14.318 1.00 1.91 N ATOM 1688 CZ ARG A 66 -14.637 6.011 13.327 1.00 2.60 C ATOM 1689 NH1 ARG A 66 -14.083 5.209 12.425 1.00 2.85 N ATOM 1690 NH2 ARG A 66 -15.928 6.301 13.237 1.00 3.45 N ATOM 0 H ARG A 66 -10.265 7.717 12.169 1.00 0.79 H new ATOM 0 HA ARG A 66 -12.378 8.053 12.703 1.00 0.98 H new ATOM 0 HB2 ARG A 66 -11.401 9.475 15.185 1.00 1.26 H new ATOM 0 HB3 ARG A 66 -13.064 9.037 14.851 1.00 1.26 H new ATOM 0 HG2 ARG A 66 -10.719 7.177 15.335 1.00 1.46 H new ATOM 0 HG3 ARG A 66 -12.161 7.362 16.313 1.00 1.46 H new ATOM 0 HD2 ARG A 66 -12.002 6.192 13.509 1.00 1.25 H new ATOM 0 HD3 ARG A 66 -12.330 5.317 14.991 1.00 1.25 H new ATOM 0 HE ARG A 66 -14.372 7.118 14.999 1.00 1.91 H new ATOM 0 HH11 ARG A 66 -13.091 4.979 12.488 1.00 2.85 H new ATOM 0 HH12 ARG A 66 -14.649 4.823 11.669 1.00 2.85 H new ATOM 0 HH21 ARG A 66 -16.362 6.914 13.927 1.00 3.45 H new ATOM 0 HH22 ARG A 66 -16.487 5.911 12.478 1.00 3.45 H new ATOM 1704 N ASP A 67 -12.351 10.180 11.298 1.00 0.86 N ATOM 1705 CA ASP A 67 -12.659 11.403 10.566 1.00 1.00 C ATOM 1706 C ASP A 67 -13.911 11.207 9.704 1.00 0.88 C ATOM 1707 O ASP A 67 -14.519 12.175 9.241 1.00 0.94 O ATOM 1708 CB ASP A 67 -11.462 11.772 9.683 1.00 1.13 C ATOM 1709 CG ASP A 67 -11.523 13.187 9.148 1.00 1.57 C ATOM 1710 OD1 ASP A 67 -11.183 14.126 9.899 1.00 2.02 O ATOM 1711 OD2 ASP A 67 -11.876 13.370 7.968 1.00 2.08 O ATOM 0 H ASP A 67 -12.347 9.340 10.719 1.00 0.86 H new ATOM 0 HA ASP A 67 -12.854 12.209 11.273 1.00 1.00 H new ATOM 0 HB2 ASP A 67 -10.544 11.648 10.258 1.00 1.13 H new ATOM 0 HB3 ASP A 67 -11.410 11.077 8.845 1.00 1.13 H new ATOM 1716 N ASN A 68 -14.279 9.932 9.505 1.00 0.77 N ATOM 1717 CA ASN A 68 -15.402 9.521 8.640 1.00 0.74 C ATOM 1718 C ASN A 68 -15.070 9.734 7.170 1.00 0.65 C ATOM 1719 O ASN A 68 -15.894 9.491 6.288 1.00 0.66 O ATOM 1720 CB ASN A 68 -16.704 10.246 8.992 1.00 0.92 C ATOM 1721 CG ASN A 68 -17.214 9.916 10.383 1.00 1.13 C ATOM 1722 OD1 ASN A 68 -16.907 8.723 10.872 1.00 1.54 O flip ATOM 1723 ND2 ASN A 68 -17.875 10.735 11.021 1.00 1.75 N flip ATOM 0 H ASN A 68 -13.801 9.146 9.945 1.00 0.77 H new ATOM 0 HA ASN A 68 -15.556 8.457 8.819 1.00 0.74 H new ATOM 0 HB2 ASN A 68 -16.546 11.322 8.916 1.00 0.92 H new ATOM 0 HB3 ASN A 68 -17.468 9.984 8.260 1.00 0.92 H new ATOM 0 HD21 ASN A 68 -18.092 11.644 10.613 1.00 1.75 H new ATOM 0 HD22 ASN A 68 -18.205 10.505 11.958 1.00 1.75 H new ATOM 1730 N GLU A 69 -13.850 10.176 6.925 1.00 0.64 N ATOM 1731 CA GLU A 69 -13.344 10.382 5.585 1.00 0.63 C ATOM 1732 C GLU A 69 -11.885 9.981 5.559 1.00 0.54 C ATOM 1733 O GLU A 69 -11.074 10.517 6.317 1.00 0.65 O ATOM 1734 CB GLU A 69 -13.505 11.841 5.155 1.00 0.82 C ATOM 1735 CG GLU A 69 -14.951 12.271 5.006 1.00 0.95 C ATOM 1736 CD GLU A 69 -15.094 13.729 4.642 1.00 1.13 C ATOM 1737 OE1 GLU A 69 -15.100 14.574 5.557 1.00 1.65 O ATOM 1738 OE2 GLU A 69 -15.214 14.035 3.440 1.00 1.59 O ATOM 0 H GLU A 69 -13.179 10.403 7.658 1.00 0.64 H new ATOM 0 HA GLU A 69 -13.913 9.771 4.884 1.00 0.63 H new ATOM 0 HB2 GLU A 69 -13.017 12.484 5.888 1.00 0.82 H new ATOM 0 HB3 GLU A 69 -12.990 11.991 4.206 1.00 0.82 H new ATOM 0 HG2 GLU A 69 -15.429 11.661 4.239 1.00 0.95 H new ATOM 0 HG3 GLU A 69 -15.480 12.081 5.940 1.00 0.95 H new ATOM 1745 N VAL A 70 -11.558 9.026 4.713 1.00 0.40 N ATOM 1746 CA VAL A 70 -10.225 8.461 4.694 1.00 0.31 C ATOM 1747 C VAL A 70 -9.211 9.453 4.157 1.00 0.33 C ATOM 1748 O VAL A 70 -9.199 9.769 2.964 1.00 0.39 O ATOM 1749 CB VAL A 70 -10.167 7.164 3.866 1.00 0.28 C ATOM 1750 CG1 VAL A 70 -8.779 6.552 3.903 1.00 0.32 C ATOM 1751 CG2 VAL A 70 -11.197 6.172 4.368 1.00 0.29 C ATOM 0 H VAL A 70 -12.199 8.624 4.028 1.00 0.40 H new ATOM 0 HA VAL A 70 -9.973 8.223 5.727 1.00 0.31 H new ATOM 0 HB VAL A 70 -10.396 7.414 2.830 1.00 0.28 H new ATOM 0 HG11 VAL A 70 -8.769 5.638 3.310 1.00 0.32 H new ATOM 0 HG12 VAL A 70 -8.058 7.259 3.492 1.00 0.32 H new ATOM 0 HG13 VAL A 70 -8.512 6.319 4.934 1.00 0.32 H new ATOM 0 HG21 VAL A 70 -11.144 5.260 3.773 1.00 0.29 H new ATOM 0 HG22 VAL A 70 -10.996 5.936 5.413 1.00 0.29 H new ATOM 0 HG23 VAL A 70 -12.193 6.606 4.280 1.00 0.29 H new ATOM 1761 N ASP A 71 -8.400 9.968 5.067 1.00 0.36 N ATOM 1762 CA ASP A 71 -7.231 10.750 4.712 1.00 0.40 C ATOM 1763 C ASP A 71 -6.226 9.819 4.050 1.00 0.32 C ATOM 1764 O ASP A 71 -6.329 8.600 4.201 1.00 0.29 O ATOM 1765 CB ASP A 71 -6.636 11.380 5.977 1.00 0.49 C ATOM 1766 CG ASP A 71 -5.476 12.320 5.705 1.00 0.61 C ATOM 1767 OD1 ASP A 71 -4.326 11.843 5.621 1.00 1.32 O ATOM 1768 OD2 ASP A 71 -5.704 13.543 5.614 1.00 1.22 O ATOM 0 H ASP A 71 -8.535 9.855 6.072 1.00 0.36 H new ATOM 0 HA ASP A 71 -7.494 11.553 4.023 1.00 0.40 H new ATOM 0 HB2 ASP A 71 -7.419 11.927 6.502 1.00 0.49 H new ATOM 0 HB3 ASP A 71 -6.300 10.586 6.644 1.00 0.49 H new ATOM 1773 N PHE A 72 -5.261 10.364 3.327 1.00 0.36 N ATOM 1774 CA PHE A 72 -4.310 9.527 2.609 1.00 0.36 C ATOM 1775 C PHE A 72 -3.581 8.585 3.559 1.00 0.30 C ATOM 1776 O PHE A 72 -3.199 7.479 3.174 1.00 0.39 O ATOM 1777 CB PHE A 72 -3.300 10.357 1.837 1.00 0.51 C ATOM 1778 CG PHE A 72 -2.530 9.496 0.901 1.00 0.58 C ATOM 1779 CD1 PHE A 72 -3.195 8.764 -0.065 1.00 1.38 C ATOM 1780 CD2 PHE A 72 -1.165 9.377 1.006 1.00 1.26 C ATOM 1781 CE1 PHE A 72 -2.510 7.933 -0.914 1.00 1.46 C ATOM 1782 CE2 PHE A 72 -0.477 8.542 0.162 1.00 1.29 C ATOM 1783 CZ PHE A 72 -1.139 7.825 -0.791 1.00 0.78 C ATOM 0 H PHE A 72 -5.115 11.368 3.221 1.00 0.36 H new ATOM 0 HA PHE A 72 -4.885 8.937 1.896 1.00 0.36 H new ATOM 0 HB2 PHE A 72 -3.813 11.142 1.281 1.00 0.51 H new ATOM 0 HB3 PHE A 72 -2.619 10.851 2.530 1.00 0.51 H new ATOM 0 HD1 PHE A 72 -4.268 8.848 -0.152 1.00 1.38 H new ATOM 0 HD2 PHE A 72 -0.632 9.943 1.756 1.00 1.26 H new ATOM 0 HE1 PHE A 72 -3.037 7.370 -1.670 1.00 1.46 H new ATOM 0 HE2 PHE A 72 0.595 8.452 0.253 1.00 1.29 H new ATOM 0 HZ PHE A 72 -0.589 7.171 -1.451 1.00 0.78 H new ATOM 1793 N GLN A 73 -3.410 9.028 4.796 1.00 0.30 N ATOM 1794 CA GLN A 73 -2.796 8.217 5.839 1.00 0.41 C ATOM 1795 C GLN A 73 -3.435 6.832 5.898 1.00 0.38 C ATOM 1796 O GLN A 73 -2.753 5.817 5.737 1.00 0.44 O ATOM 1797 CB GLN A 73 -2.934 8.910 7.196 1.00 0.61 C ATOM 1798 CG GLN A 73 -2.142 10.202 7.312 1.00 0.85 C ATOM 1799 CD GLN A 73 -0.644 9.970 7.360 1.00 0.83 C ATOM 1800 OE1 GLN A 73 -0.235 8.869 7.970 1.00 1.20 O flip ATOM 1801 NE2 GLN A 73 0.140 10.790 6.884 1.00 1.48 N flip ATOM 0 H GLN A 73 -3.692 9.958 5.105 1.00 0.30 H new ATOM 0 HA GLN A 73 -1.739 8.101 5.601 1.00 0.41 H new ATOM 0 HB2 GLN A 73 -3.987 9.124 7.378 1.00 0.61 H new ATOM 0 HB3 GLN A 73 -2.608 8.224 7.978 1.00 0.61 H new ATOM 0 HG2 GLN A 73 -2.379 10.845 6.464 1.00 0.85 H new ATOM 0 HG3 GLN A 73 -2.452 10.733 8.212 1.00 0.85 H new ATOM 0 HE21 GLN A 73 -0.216 11.627 6.421 1.00 1.48 H new ATOM 0 HE22 GLN A 73 1.146 10.633 6.952 1.00 1.48 H new ATOM 1810 N GLU A 74 -4.749 6.787 6.097 1.00 0.34 N ATOM 1811 CA GLU A 74 -5.451 5.516 6.200 1.00 0.37 C ATOM 1812 C GLU A 74 -5.734 4.938 4.820 1.00 0.32 C ATOM 1813 O GLU A 74 -6.125 3.781 4.686 1.00 0.36 O ATOM 1814 CB GLU A 74 -6.762 5.648 6.984 1.00 0.44 C ATOM 1815 CG GLU A 74 -7.282 7.070 7.125 1.00 0.52 C ATOM 1816 CD GLU A 74 -6.778 7.740 8.383 1.00 0.58 C ATOM 1817 OE1 GLU A 74 -7.305 7.435 9.471 1.00 1.16 O ATOM 1818 OE2 GLU A 74 -5.856 8.573 8.297 1.00 1.29 O ATOM 0 H GLU A 74 -5.344 7.610 6.189 1.00 0.34 H new ATOM 0 HA GLU A 74 -4.796 4.837 6.746 1.00 0.37 H new ATOM 0 HB2 GLU A 74 -7.525 5.045 6.492 1.00 0.44 H new ATOM 0 HB3 GLU A 74 -6.617 5.229 7.980 1.00 0.44 H new ATOM 0 HG2 GLU A 74 -6.977 7.654 6.257 1.00 0.52 H new ATOM 0 HG3 GLU A 74 -8.372 7.057 7.134 1.00 0.52 H new ATOM 1825 N TYR A 75 -5.528 5.742 3.792 1.00 0.26 N ATOM 1826 CA TYR A 75 -5.750 5.285 2.435 1.00 0.25 C ATOM 1827 C TYR A 75 -4.607 4.363 1.999 1.00 0.24 C ATOM 1828 O TYR A 75 -4.816 3.400 1.262 1.00 0.28 O ATOM 1829 CB TYR A 75 -5.895 6.474 1.480 1.00 0.25 C ATOM 1830 CG TYR A 75 -6.356 6.068 0.106 1.00 0.26 C ATOM 1831 CD1 TYR A 75 -5.474 5.469 -0.781 1.00 1.17 C ATOM 1832 CD2 TYR A 75 -7.673 6.258 -0.292 1.00 1.27 C ATOM 1833 CE1 TYR A 75 -5.880 5.069 -2.032 1.00 1.17 C ATOM 1834 CE2 TYR A 75 -8.090 5.853 -1.548 1.00 1.30 C ATOM 1835 CZ TYR A 75 -7.184 5.259 -2.411 1.00 0.38 C ATOM 1836 OH TYR A 75 -7.581 4.851 -3.658 1.00 0.47 O ATOM 0 H TYR A 75 -5.210 6.708 3.871 1.00 0.26 H new ATOM 0 HA TYR A 75 -6.681 4.719 2.402 1.00 0.25 H new ATOM 0 HB2 TYR A 75 -6.605 7.187 1.900 1.00 0.25 H new ATOM 0 HB3 TYR A 75 -4.937 6.988 1.399 1.00 0.25 H new ATOM 0 HD1 TYR A 75 -4.448 5.314 -0.483 1.00 1.17 H new ATOM 0 HD2 TYR A 75 -8.376 6.724 0.383 1.00 1.27 H new ATOM 0 HE1 TYR A 75 -5.177 4.609 -2.711 1.00 1.17 H new ATOM 0 HE2 TYR A 75 -9.116 5.999 -1.853 1.00 1.30 H new ATOM 0 HH TYR A 75 -7.589 3.872 -3.695 1.00 0.47 H new ATOM 1846 N CYS A 76 -3.403 4.656 2.465 1.00 0.22 N ATOM 1847 CA CYS A 76 -2.250 3.801 2.203 1.00 0.21 C ATOM 1848 C CYS A 76 -2.482 2.406 2.744 1.00 0.15 C ATOM 1849 O CYS A 76 -2.269 1.410 2.050 1.00 0.17 O ATOM 1850 CB CYS A 76 -1.003 4.403 2.833 1.00 0.27 C ATOM 1851 SG CYS A 76 -0.623 6.061 2.247 1.00 1.65 S ATOM 0 H CYS A 76 -3.196 5.481 3.028 1.00 0.22 H new ATOM 0 HA CYS A 76 -2.110 3.733 1.124 1.00 0.21 H new ATOM 0 HB2 CYS A 76 -1.131 4.430 3.915 1.00 0.27 H new ATOM 0 HB3 CYS A 76 -0.153 3.752 2.629 1.00 0.27 H new ATOM 0 HG CYS A 76 -1.616 6.855 2.519 1.00 1.65 H new ATOM 1857 N VAL A 77 -2.945 2.336 3.975 1.00 0.16 N ATOM 1858 CA VAL A 77 -3.159 1.060 4.620 1.00 0.17 C ATOM 1859 C VAL A 77 -4.403 0.377 4.081 1.00 0.17 C ATOM 1860 O VAL A 77 -4.572 -0.824 4.256 1.00 0.19 O ATOM 1861 CB VAL A 77 -3.234 1.209 6.144 1.00 0.20 C ATOM 1862 CG1 VAL A 77 -1.924 1.771 6.651 1.00 0.23 C ATOM 1863 CG2 VAL A 77 -4.395 2.097 6.560 1.00 0.19 C ATOM 0 H VAL A 77 -3.180 3.147 4.547 1.00 0.16 H new ATOM 0 HA VAL A 77 -2.301 0.429 4.390 1.00 0.17 H new ATOM 0 HB VAL A 77 -3.406 0.227 6.585 1.00 0.20 H new ATOM 0 HG11 VAL A 77 -1.970 1.880 7.735 1.00 0.23 H new ATOM 0 HG12 VAL A 77 -1.112 1.094 6.388 1.00 0.23 H new ATOM 0 HG13 VAL A 77 -1.746 2.745 6.196 1.00 0.23 H new ATOM 0 HG21 VAL A 77 -4.418 2.181 7.647 1.00 0.19 H new ATOM 0 HG22 VAL A 77 -4.270 3.088 6.122 1.00 0.19 H new ATOM 0 HG23 VAL A 77 -5.330 1.661 6.210 1.00 0.19 H new ATOM 1873 N PHE A 78 -5.262 1.145 3.417 1.00 0.20 N ATOM 1874 CA PHE A 78 -6.368 0.578 2.680 1.00 0.22 C ATOM 1875 C PHE A 78 -5.827 -0.441 1.698 1.00 0.19 C ATOM 1876 O PHE A 78 -6.009 -1.639 1.876 1.00 0.18 O ATOM 1877 CB PHE A 78 -7.128 1.693 1.938 1.00 0.30 C ATOM 1878 CG PHE A 78 -8.227 1.231 1.030 1.00 0.22 C ATOM 1879 CD1 PHE A 78 -9.175 0.313 1.446 1.00 1.19 C ATOM 1880 CD2 PHE A 78 -8.310 1.741 -0.252 1.00 1.21 C ATOM 1881 CE1 PHE A 78 -10.186 -0.086 0.596 1.00 1.21 C ATOM 1882 CE2 PHE A 78 -9.310 1.345 -1.107 1.00 1.20 C ATOM 1883 CZ PHE A 78 -10.252 0.429 -0.686 1.00 0.22 C ATOM 0 H PHE A 78 -5.206 2.163 3.379 1.00 0.20 H new ATOM 0 HA PHE A 78 -7.062 0.089 3.364 1.00 0.22 H new ATOM 0 HB2 PHE A 78 -7.552 2.373 2.677 1.00 0.30 H new ATOM 0 HB3 PHE A 78 -6.412 2.267 1.350 1.00 0.30 H new ATOM 0 HD1 PHE A 78 -9.123 -0.095 2.445 1.00 1.19 H new ATOM 0 HD2 PHE A 78 -7.578 2.461 -0.587 1.00 1.21 H new ATOM 0 HE1 PHE A 78 -10.925 -0.799 0.931 1.00 1.21 H new ATOM 0 HE2 PHE A 78 -9.359 1.750 -2.107 1.00 1.20 H new ATOM 0 HZ PHE A 78 -11.039 0.115 -1.356 1.00 0.22 H new ATOM 1893 N LEU A 79 -5.077 0.046 0.728 1.00 0.20 N ATOM 1894 CA LEU A 79 -4.612 -0.779 -0.371 1.00 0.19 C ATOM 1895 C LEU A 79 -3.590 -1.810 0.063 1.00 0.16 C ATOM 1896 O LEU A 79 -3.682 -2.971 -0.308 1.00 0.18 O ATOM 1897 CB LEU A 79 -4.045 0.101 -1.472 1.00 0.22 C ATOM 1898 CG LEU A 79 -5.086 0.995 -2.121 1.00 0.15 C ATOM 1899 CD1 LEU A 79 -4.511 1.696 -3.335 1.00 0.16 C ATOM 1900 CD2 LEU A 79 -6.303 0.163 -2.481 1.00 0.16 C ATOM 0 H LEU A 79 -4.774 1.019 0.679 1.00 0.20 H new ATOM 0 HA LEU A 79 -5.472 -1.332 -0.749 1.00 0.19 H new ATOM 0 HB2 LEU A 79 -3.250 0.722 -1.059 1.00 0.22 H new ATOM 0 HB3 LEU A 79 -3.592 -0.531 -2.236 1.00 0.22 H new ATOM 0 HG LEU A 79 -5.389 1.771 -1.418 1.00 0.15 H new ATOM 0 HD11 LEU A 79 -5.275 2.331 -3.784 1.00 0.16 H new ATOM 0 HD12 LEU A 79 -3.661 2.308 -3.033 1.00 0.16 H new ATOM 0 HD13 LEU A 79 -4.183 0.954 -4.062 1.00 0.16 H new ATOM 0 HD21 LEU A 79 -7.054 0.800 -2.948 1.00 0.16 H new ATOM 0 HD22 LEU A 79 -6.013 -0.625 -3.176 1.00 0.16 H new ATOM 0 HD23 LEU A 79 -6.718 -0.285 -1.578 1.00 0.16 H new ATOM 1912 N SER A 80 -2.632 -1.408 0.862 1.00 0.15 N ATOM 1913 CA SER A 80 -1.574 -2.315 1.251 1.00 0.15 C ATOM 1914 C SER A 80 -2.127 -3.492 2.046 1.00 0.15 C ATOM 1915 O SER A 80 -1.585 -4.592 2.012 1.00 0.18 O ATOM 1916 CB SER A 80 -0.523 -1.562 2.036 1.00 0.17 C ATOM 1917 OG SER A 80 0.062 -0.559 1.231 1.00 0.23 O ATOM 0 H SER A 80 -2.561 -0.469 1.254 1.00 0.15 H new ATOM 0 HA SER A 80 -1.110 -2.725 0.354 1.00 0.15 H new ATOM 0 HB2 SER A 80 -0.973 -1.112 2.921 1.00 0.17 H new ATOM 0 HB3 SER A 80 0.245 -2.252 2.385 1.00 0.17 H new ATOM 0 HG SER A 80 0.736 -0.962 0.645 1.00 0.23 H new ATOM 1923 N CYS A 81 -3.216 -3.266 2.751 1.00 0.14 N ATOM 1924 CA CYS A 81 -3.879 -4.342 3.452 1.00 0.15 C ATOM 1925 C CYS A 81 -4.785 -5.134 2.514 1.00 0.14 C ATOM 1926 O CYS A 81 -5.146 -6.274 2.806 1.00 0.16 O ATOM 1927 CB CYS A 81 -4.631 -3.796 4.649 1.00 0.17 C ATOM 1928 SG CYS A 81 -3.517 -3.184 5.931 1.00 0.22 S ATOM 0 H CYS A 81 -3.658 -2.352 2.853 1.00 0.14 H new ATOM 0 HA CYS A 81 -3.127 -5.040 3.821 1.00 0.15 H new ATOM 0 HB2 CYS A 81 -5.289 -2.989 4.326 1.00 0.17 H new ATOM 0 HB3 CYS A 81 -5.266 -4.578 5.065 1.00 0.17 H new ATOM 0 HG CYS A 81 -2.497 -2.600 5.376 1.00 0.22 H new ATOM 1934 N ILE A 82 -5.130 -4.550 1.370 1.00 0.13 N ATOM 1935 CA ILE A 82 -5.859 -5.294 0.356 1.00 0.14 C ATOM 1936 C ILE A 82 -4.872 -6.148 -0.431 1.00 0.17 C ATOM 1937 O ILE A 82 -5.269 -7.073 -1.109 1.00 0.21 O ATOM 1938 CB ILE A 82 -6.674 -4.411 -0.623 1.00 0.15 C ATOM 1939 CG1 ILE A 82 -7.399 -3.299 0.113 1.00 0.15 C ATOM 1940 CG2 ILE A 82 -7.708 -5.255 -1.355 1.00 0.16 C ATOM 1941 CD1 ILE A 82 -8.242 -2.433 -0.794 1.00 0.18 C ATOM 0 H ILE A 82 -4.920 -3.582 1.127 1.00 0.13 H new ATOM 0 HA ILE A 82 -6.590 -5.906 0.885 1.00 0.14 H new ATOM 0 HB ILE A 82 -5.970 -3.974 -1.332 1.00 0.15 H new ATOM 0 HG12 ILE A 82 -8.036 -3.737 0.881 1.00 0.15 H new ATOM 0 HG13 ILE A 82 -6.667 -2.673 0.624 1.00 0.15 H new ATOM 0 HG21 ILE A 82 -8.274 -4.624 -2.040 1.00 0.16 H new ATOM 0 HG22 ILE A 82 -7.204 -6.040 -1.918 1.00 0.16 H new ATOM 0 HG23 ILE A 82 -8.387 -5.706 -0.632 1.00 0.16 H new ATOM 0 HD11 ILE A 82 -8.733 -1.658 -0.205 1.00 0.18 H new ATOM 0 HD12 ILE A 82 -7.606 -1.968 -1.547 1.00 0.18 H new ATOM 0 HD13 ILE A 82 -8.996 -3.047 -1.286 1.00 0.18 H new ATOM 1953 N ALA A 83 -3.579 -5.811 -0.368 1.00 0.18 N ATOM 1954 CA ALA A 83 -2.538 -6.726 -0.830 1.00 0.23 C ATOM 1955 C ALA A 83 -2.641 -8.047 -0.090 1.00 0.20 C ATOM 1956 O ALA A 83 -2.812 -9.109 -0.691 1.00 0.21 O ATOM 1957 CB ALA A 83 -1.162 -6.139 -0.596 1.00 0.30 C ATOM 0 H ALA A 83 -3.235 -4.922 -0.006 1.00 0.18 H new ATOM 0 HA ALA A 83 -2.681 -6.886 -1.899 1.00 0.23 H new ATOM 0 HB1 ALA A 83 -0.403 -6.838 -0.948 1.00 0.30 H new ATOM 0 HB2 ALA A 83 -1.070 -5.199 -1.141 1.00 0.30 H new ATOM 0 HB3 ALA A 83 -1.021 -5.956 0.469 1.00 0.30 H new ATOM 1963 N MET A 84 -2.540 -7.958 1.229 1.00 0.22 N ATOM 1964 CA MET A 84 -2.647 -9.127 2.096 1.00 0.25 C ATOM 1965 C MET A 84 -3.985 -9.826 1.902 1.00 0.24 C ATOM 1966 O MET A 84 -4.075 -11.053 1.949 1.00 0.28 O ATOM 1967 CB MET A 84 -2.475 -8.725 3.560 1.00 0.30 C ATOM 1968 CG MET A 84 -1.051 -8.333 3.919 1.00 0.34 C ATOM 1969 SD MET A 84 -0.904 -7.718 5.604 1.00 0.36 S ATOM 1970 CE MET A 84 -1.838 -6.196 5.477 1.00 0.20 C ATOM 0 H MET A 84 -2.383 -7.082 1.727 1.00 0.22 H new ATOM 0 HA MET A 84 -1.852 -9.821 1.825 1.00 0.25 H new ATOM 0 HB2 MET A 84 -3.139 -7.889 3.779 1.00 0.30 H new ATOM 0 HB3 MET A 84 -2.786 -9.555 4.195 1.00 0.30 H new ATOM 0 HG2 MET A 84 -0.398 -9.197 3.794 1.00 0.34 H new ATOM 0 HG3 MET A 84 -0.703 -7.567 3.225 1.00 0.34 H new ATOM 0 HE1 MET A 84 -1.769 -5.648 6.416 1.00 0.20 H new ATOM 0 HE2 MET A 84 -1.432 -5.586 4.670 1.00 0.20 H new ATOM 0 HE3 MET A 84 -2.882 -6.426 5.267 1.00 0.20 H new ATOM 1980 N MET A 85 -5.018 -9.034 1.667 1.00 0.25 N ATOM 1981 CA MET A 85 -6.361 -9.554 1.467 1.00 0.36 C ATOM 1982 C MET A 85 -6.536 -10.115 0.049 1.00 0.33 C ATOM 1983 O MET A 85 -7.270 -11.079 -0.155 1.00 0.43 O ATOM 1984 CB MET A 85 -7.385 -8.454 1.755 1.00 0.62 C ATOM 1985 CG MET A 85 -8.818 -8.926 1.627 1.00 0.77 C ATOM 1986 SD MET A 85 -9.563 -8.415 0.073 1.00 0.67 S ATOM 1987 CE MET A 85 -10.242 -6.839 0.574 1.00 0.30 C ATOM 0 H MET A 85 -4.951 -8.018 1.610 1.00 0.25 H new ATOM 0 HA MET A 85 -6.524 -10.379 2.161 1.00 0.36 H new ATOM 0 HB2 MET A 85 -7.224 -8.071 2.763 1.00 0.62 H new ATOM 0 HB3 MET A 85 -7.220 -7.624 1.068 1.00 0.62 H new ATOM 0 HG2 MET A 85 -8.849 -10.013 1.703 1.00 0.77 H new ATOM 0 HG3 MET A 85 -9.405 -8.531 2.457 1.00 0.77 H new ATOM 0 HE1 MET A 85 -10.700 -6.350 -0.286 1.00 0.30 H new ATOM 0 HE2 MET A 85 -10.995 -6.996 1.346 1.00 0.30 H new ATOM 0 HE3 MET A 85 -9.445 -6.208 0.968 1.00 0.30 H new ATOM 1997 N CYS A 86 -5.856 -9.520 -0.931 1.00 0.32 N ATOM 1998 CA CYS A 86 -5.878 -10.030 -2.297 1.00 0.43 C ATOM 1999 C CYS A 86 -5.326 -11.446 -2.347 1.00 0.43 C ATOM 2000 O CYS A 86 -5.718 -12.238 -3.199 1.00 0.58 O ATOM 2001 CB CYS A 86 -5.066 -9.123 -3.228 1.00 0.49 C ATOM 2002 SG CYS A 86 -5.075 -9.640 -4.960 1.00 0.57 S ATOM 0 H CYS A 86 -5.284 -8.685 -0.802 1.00 0.32 H new ATOM 0 HA CYS A 86 -6.914 -10.042 -2.635 1.00 0.43 H new ATOM 0 HB2 CYS A 86 -5.459 -8.108 -3.161 1.00 0.49 H new ATOM 0 HB3 CYS A 86 -4.035 -9.090 -2.876 1.00 0.49 H new ATOM 0 HG CYS A 86 -5.334 -10.912 -5.032 1.00 0.57 H new ATOM 2008 N ASN A 87 -4.422 -11.763 -1.421 1.00 0.36 N ATOM 2009 CA ASN A 87 -3.863 -13.107 -1.319 1.00 0.44 C ATOM 2010 C ASN A 87 -4.973 -14.137 -1.138 1.00 0.47 C ATOM 2011 O ASN A 87 -4.913 -15.232 -1.697 1.00 0.54 O ATOM 2012 CB ASN A 87 -2.868 -13.194 -0.157 1.00 0.54 C ATOM 2013 CG ASN A 87 -2.384 -14.612 0.102 1.00 0.72 C ATOM 2014 OD1 ASN A 87 -2.946 -15.332 0.926 1.00 1.43 O ATOM 2015 ND2 ASN A 87 -1.346 -15.025 -0.608 1.00 1.23 N ATOM 0 H ASN A 87 -4.062 -11.105 -0.730 1.00 0.36 H new ATOM 0 HA ASN A 87 -3.333 -13.324 -2.246 1.00 0.44 H new ATOM 0 HB2 ASN A 87 -2.010 -12.556 -0.371 1.00 0.54 H new ATOM 0 HB3 ASN A 87 -3.337 -12.805 0.747 1.00 0.54 H new ATOM 0 HD21 ASN A 87 -0.985 -15.971 -0.481 1.00 1.23 H new ATOM 0 HD22 ASN A 87 -0.907 -14.398 -1.282 1.00 1.23 H new ATOM 2022 N GLU A 88 -6.001 -13.754 -0.388 1.00 0.56 N ATOM 2023 CA GLU A 88 -7.142 -14.623 -0.134 1.00 0.70 C ATOM 2024 C GLU A 88 -7.804 -15.045 -1.444 1.00 0.73 C ATOM 2025 O GLU A 88 -8.073 -16.227 -1.666 1.00 0.82 O ATOM 2026 CB GLU A 88 -8.158 -13.911 0.763 1.00 0.96 C ATOM 2027 CG GLU A 88 -7.603 -13.495 2.116 1.00 1.81 C ATOM 2028 CD GLU A 88 -8.685 -12.996 3.050 1.00 2.18 C ATOM 2029 OE1 GLU A 88 -8.985 -11.783 3.035 1.00 2.78 O ATOM 2030 OE2 GLU A 88 -9.253 -13.818 3.797 1.00 2.60 O ATOM 0 H GLU A 88 -6.066 -12.839 0.058 1.00 0.56 H new ATOM 0 HA GLU A 88 -6.784 -15.518 0.375 1.00 0.70 H new ATOM 0 HB2 GLU A 88 -8.527 -13.026 0.245 1.00 0.96 H new ATOM 0 HB3 GLU A 88 -9.013 -14.569 0.919 1.00 0.96 H new ATOM 0 HG2 GLU A 88 -7.093 -14.343 2.574 1.00 1.81 H new ATOM 0 HG3 GLU A 88 -6.857 -12.712 1.976 1.00 1.81 H new ATOM 2285 N ALA B 2 -3.588 -0.283 -17.824 1.00 0.34 N ATOM 2286 CA ALA B 2 -4.143 -1.285 -16.944 1.00 0.30 C ATOM 2287 C ALA B 2 -5.153 -0.626 -16.016 1.00 0.27 C ATOM 2288 O ALA B 2 -5.277 0.599 -16.015 1.00 0.36 O ATOM 2289 CB ALA B 2 -3.036 -1.965 -16.153 1.00 0.30 C ATOM 0 HA ALA B 2 -4.649 -2.052 -17.531 1.00 0.30 H new ATOM 0 HB1 ALA B 2 -3.469 -2.718 -15.494 1.00 0.30 H new ATOM 0 HB2 ALA B 2 -2.338 -2.443 -16.841 1.00 0.30 H new ATOM 0 HB3 ALA B 2 -2.506 -1.222 -15.557 1.00 0.30 H new ATOM 2295 N CYS B 3 -5.892 -1.422 -15.259 1.00 0.25 N ATOM 2296 CA CYS B 3 -6.764 -0.889 -14.232 1.00 0.23 C ATOM 2297 C CYS B 3 -5.901 -0.459 -13.060 1.00 0.17 C ATOM 2298 O CYS B 3 -5.404 -1.294 -12.307 1.00 0.17 O ATOM 2299 CB CYS B 3 -7.796 -1.931 -13.804 1.00 0.28 C ATOM 2300 SG CYS B 3 -8.828 -2.534 -15.160 1.00 0.39 S ATOM 0 H CYS B 3 -5.903 -2.439 -15.339 1.00 0.25 H new ATOM 0 HA CYS B 3 -7.317 -0.032 -14.616 1.00 0.23 H new ATOM 0 HB2 CYS B 3 -7.279 -2.776 -13.350 1.00 0.28 H new ATOM 0 HB3 CYS B 3 -8.437 -1.499 -13.036 1.00 0.28 H new ATOM 0 HG CYS B 3 -9.671 -3.414 -14.706 1.00 0.39 H new ATOM 2306 N PRO B 4 -5.699 0.855 -12.922 1.00 0.16 N ATOM 2307 CA PRO B 4 -4.688 1.430 -12.023 1.00 0.13 C ATOM 2308 C PRO B 4 -4.746 0.889 -10.601 1.00 0.12 C ATOM 2309 O PRO B 4 -3.805 0.247 -10.133 1.00 0.12 O ATOM 2310 CB PRO B 4 -5.052 2.911 -12.035 1.00 0.17 C ATOM 2311 CG PRO B 4 -5.631 3.129 -13.380 1.00 0.20 C ATOM 2312 CD PRO B 4 -6.451 1.906 -13.637 1.00 0.20 C ATOM 0 HA PRO B 4 -3.676 1.194 -12.353 1.00 0.13 H new ATOM 0 HB2 PRO B 4 -5.768 3.152 -11.249 1.00 0.17 H new ATOM 0 HB3 PRO B 4 -4.176 3.538 -11.872 1.00 0.17 H new ATOM 0 HG2 PRO B 4 -6.243 4.030 -13.407 1.00 0.20 H new ATOM 0 HG3 PRO B 4 -4.852 3.250 -14.133 1.00 0.20 H new ATOM 0 HD2 PRO B 4 -7.466 2.011 -13.253 1.00 0.20 H new ATOM 0 HD3 PRO B 4 -6.534 1.691 -14.702 1.00 0.20 H new ATOM 2320 N LEU B 5 -5.864 1.121 -9.932 1.00 0.13 N ATOM 2321 CA LEU B 5 -6.004 0.732 -8.539 1.00 0.14 C ATOM 2322 C LEU B 5 -6.054 -0.788 -8.426 1.00 0.16 C ATOM 2323 O LEU B 5 -5.550 -1.360 -7.466 1.00 0.22 O ATOM 2324 CB LEU B 5 -7.265 1.370 -7.944 1.00 0.15 C ATOM 2325 CG LEU B 5 -7.166 1.841 -6.492 1.00 0.16 C ATOM 2326 CD1 LEU B 5 -6.975 0.674 -5.558 1.00 0.18 C ATOM 2327 CD2 LEU B 5 -6.031 2.830 -6.314 1.00 0.17 C ATOM 0 H LEU B 5 -6.686 1.576 -10.330 1.00 0.13 H new ATOM 0 HA LEU B 5 -5.142 1.088 -7.975 1.00 0.14 H new ATOM 0 HB2 LEU B 5 -7.541 2.224 -8.563 1.00 0.15 H new ATOM 0 HB3 LEU B 5 -8.079 0.649 -8.015 1.00 0.15 H new ATOM 0 HG LEU B 5 -8.104 2.339 -6.247 1.00 0.16 H new ATOM 0 HD11 LEU B 5 -6.908 1.036 -4.532 1.00 0.18 H new ATOM 0 HD12 LEU B 5 -7.822 -0.006 -5.648 1.00 0.18 H new ATOM 0 HD13 LEU B 5 -6.057 0.147 -5.818 1.00 0.18 H new ATOM 0 HD21 LEU B 5 -5.985 3.147 -5.272 1.00 0.17 H new ATOM 0 HD22 LEU B 5 -5.089 2.357 -6.591 1.00 0.17 H new ATOM 0 HD23 LEU B 5 -6.202 3.698 -6.950 1.00 0.17 H new ATOM 2339 N GLU B 6 -6.635 -1.438 -9.429 1.00 0.16 N ATOM 2340 CA GLU B 6 -6.709 -2.895 -9.458 1.00 0.20 C ATOM 2341 C GLU B 6 -5.315 -3.503 -9.432 1.00 0.18 C ATOM 2342 O GLU B 6 -5.011 -4.369 -8.607 1.00 0.23 O ATOM 2343 CB GLU B 6 -7.426 -3.375 -10.715 1.00 0.29 C ATOM 2344 CG GLU B 6 -7.466 -4.888 -10.841 1.00 0.43 C ATOM 2345 CD GLU B 6 -7.757 -5.343 -12.250 1.00 0.90 C ATOM 2346 OE1 GLU B 6 -6.813 -5.376 -13.071 1.00 1.79 O ATOM 2347 OE2 GLU B 6 -8.927 -5.665 -12.549 1.00 1.39 O ATOM 0 H GLU B 6 -7.062 -0.979 -10.233 1.00 0.16 H new ATOM 0 HA GLU B 6 -7.265 -3.213 -8.576 1.00 0.20 H new ATOM 0 HB2 GLU B 6 -8.446 -2.990 -10.713 1.00 0.29 H new ATOM 0 HB3 GLU B 6 -6.929 -2.957 -11.591 1.00 0.29 H new ATOM 0 HG2 GLU B 6 -6.510 -5.302 -10.519 1.00 0.43 H new ATOM 0 HG3 GLU B 6 -8.227 -5.285 -10.170 1.00 0.43 H new ATOM 2354 N LYS B 7 -4.472 -3.035 -10.348 1.00 0.16 N ATOM 2355 CA LYS B 7 -3.125 -3.553 -10.486 1.00 0.18 C ATOM 2356 C LYS B 7 -2.338 -3.383 -9.197 1.00 0.17 C ATOM 2357 O LYS B 7 -1.535 -4.236 -8.857 1.00 0.19 O ATOM 2358 CB LYS B 7 -2.405 -2.879 -11.665 1.00 0.25 C ATOM 2359 CG LYS B 7 -2.873 -3.367 -13.029 1.00 0.41 C ATOM 2360 CD LYS B 7 -2.251 -4.707 -13.407 1.00 0.90 C ATOM 2361 CE LYS B 7 -2.857 -5.873 -12.638 1.00 0.84 C ATOM 2362 NZ LYS B 7 -4.221 -6.224 -13.121 1.00 1.18 N ATOM 0 H LYS B 7 -4.705 -2.293 -11.007 1.00 0.16 H new ATOM 0 HA LYS B 7 -3.192 -4.621 -10.693 1.00 0.18 H new ATOM 0 HB2 LYS B 7 -2.556 -1.801 -11.603 1.00 0.25 H new ATOM 0 HB3 LYS B 7 -1.333 -3.056 -11.574 1.00 0.25 H new ATOM 0 HG2 LYS B 7 -3.959 -3.461 -13.026 1.00 0.41 H new ATOM 0 HG3 LYS B 7 -2.619 -2.624 -13.785 1.00 0.41 H new ATOM 0 HD2 LYS B 7 -2.381 -4.875 -14.476 1.00 0.90 H new ATOM 0 HD3 LYS B 7 -1.178 -4.671 -13.219 1.00 0.90 H new ATOM 0 HE2 LYS B 7 -2.207 -6.743 -12.731 1.00 0.84 H new ATOM 0 HE3 LYS B 7 -2.903 -5.621 -11.579 1.00 0.84 H new ATOM 0 HZ1 LYS B 7 -4.522 -7.121 -12.689 1.00 1.18 H new ATOM 0 HZ2 LYS B 7 -4.888 -5.471 -12.856 1.00 1.18 H new ATOM 0 HZ3 LYS B 7 -4.207 -6.326 -14.156 1.00 1.18 H new ATOM 2376 N ALA B 8 -2.604 -2.304 -8.471 1.00 0.17 N ATOM 2377 CA ALA B 8 -1.923 -2.036 -7.208 1.00 0.17 C ATOM 2378 C ALA B 8 -1.921 -3.259 -6.287 1.00 0.17 C ATOM 2379 O ALA B 8 -0.862 -3.690 -5.840 1.00 0.22 O ATOM 2380 CB ALA B 8 -2.556 -0.845 -6.503 1.00 0.18 C ATOM 0 H ALA B 8 -3.290 -1.597 -8.736 1.00 0.17 H new ATOM 0 HA ALA B 8 -0.885 -1.801 -7.443 1.00 0.17 H new ATOM 0 HB1 ALA B 8 -2.036 -0.660 -5.563 1.00 0.18 H new ATOM 0 HB2 ALA B 8 -2.481 0.037 -7.139 1.00 0.18 H new ATOM 0 HB3 ALA B 8 -3.606 -1.058 -6.301 1.00 0.18 H new ATOM 2386 N LEU B 9 -3.095 -3.836 -6.031 1.00 0.13 N ATOM 2387 CA LEU B 9 -3.186 -4.979 -5.118 1.00 0.12 C ATOM 2388 C LEU B 9 -2.698 -6.253 -5.802 1.00 0.14 C ATOM 2389 O LEU B 9 -2.034 -7.087 -5.185 1.00 0.18 O ATOM 2390 CB LEU B 9 -4.618 -5.199 -4.591 1.00 0.13 C ATOM 2391 CG LEU B 9 -5.314 -3.983 -3.964 1.00 0.13 C ATOM 2392 CD1 LEU B 9 -4.358 -3.207 -3.092 1.00 0.15 C ATOM 2393 CD2 LEU B 9 -5.919 -3.074 -5.015 1.00 0.13 C ATOM 0 H LEU B 9 -3.983 -3.538 -6.434 1.00 0.13 H new ATOM 0 HA LEU B 9 -2.547 -4.748 -4.266 1.00 0.12 H new ATOM 0 HB2 LEU B 9 -5.234 -5.556 -5.417 1.00 0.13 H new ATOM 0 HB3 LEU B 9 -4.589 -5.996 -3.848 1.00 0.13 H new ATOM 0 HG LEU B 9 -6.127 -4.363 -3.345 1.00 0.13 H new ATOM 0 HD11 LEU B 9 -4.874 -2.350 -2.659 1.00 0.15 H new ATOM 0 HD12 LEU B 9 -3.990 -3.851 -2.293 1.00 0.15 H new ATOM 0 HD13 LEU B 9 -3.518 -2.859 -3.693 1.00 0.15 H new ATOM 0 HD21 LEU B 9 -6.402 -2.226 -4.529 1.00 0.13 H new ATOM 0 HD22 LEU B 9 -5.134 -2.713 -5.679 1.00 0.13 H new ATOM 0 HD23 LEU B 9 -6.657 -3.628 -5.594 1.00 0.13 H new ATOM 2405 N ASP B 10 -3.027 -6.388 -7.082 1.00 0.14 N ATOM 2406 CA ASP B 10 -2.630 -7.557 -7.867 1.00 0.16 C ATOM 2407 C ASP B 10 -1.114 -7.712 -7.888 1.00 0.15 C ATOM 2408 O ASP B 10 -0.579 -8.792 -7.631 1.00 0.19 O ATOM 2409 CB ASP B 10 -3.157 -7.429 -9.301 1.00 0.20 C ATOM 2410 CG ASP B 10 -2.618 -8.501 -10.234 1.00 0.51 C ATOM 2411 OD1 ASP B 10 -3.246 -9.573 -10.350 1.00 1.22 O ATOM 2412 OD2 ASP B 10 -1.587 -8.256 -10.893 1.00 1.19 O ATOM 0 H ASP B 10 -3.571 -5.700 -7.603 1.00 0.14 H new ATOM 0 HA ASP B 10 -3.060 -8.442 -7.399 1.00 0.16 H new ATOM 0 HB2 ASP B 10 -4.246 -7.482 -9.287 1.00 0.20 H new ATOM 0 HB3 ASP B 10 -2.891 -6.447 -9.693 1.00 0.20 H new ATOM 2417 N VAL B 11 -0.425 -6.618 -8.167 1.00 0.15 N ATOM 2418 CA VAL B 11 1.021 -6.646 -8.300 1.00 0.16 C ATOM 2419 C VAL B 11 1.701 -6.752 -6.944 1.00 0.16 C ATOM 2420 O VAL B 11 2.853 -7.167 -6.858 1.00 0.20 O ATOM 2421 CB VAL B 11 1.542 -5.402 -9.039 1.00 0.18 C ATOM 2422 CG1 VAL B 11 0.792 -5.224 -10.349 1.00 0.21 C ATOM 2423 CG2 VAL B 11 1.426 -4.158 -8.168 1.00 0.17 C ATOM 0 H VAL B 11 -0.845 -5.699 -8.306 1.00 0.15 H new ATOM 0 HA VAL B 11 1.266 -7.531 -8.887 1.00 0.16 H new ATOM 0 HB VAL B 11 2.599 -5.547 -9.261 1.00 0.18 H new ATOM 0 HG11 VAL B 11 1.167 -4.341 -10.866 1.00 0.21 H new ATOM 0 HG12 VAL B 11 0.942 -6.103 -10.976 1.00 0.21 H new ATOM 0 HG13 VAL B 11 -0.272 -5.101 -10.145 1.00 0.21 H new ATOM 0 HG21 VAL B 11 1.802 -3.294 -8.716 1.00 0.17 H new ATOM 0 HG22 VAL B 11 0.381 -3.994 -7.905 1.00 0.17 H new ATOM 0 HG23 VAL B 11 2.012 -4.294 -7.259 1.00 0.17 H new ATOM 2433 N MET B 12 0.986 -6.381 -5.891 1.00 0.16 N ATOM 2434 CA MET B 12 1.505 -6.489 -4.535 1.00 0.20 C ATOM 2435 C MET B 12 1.866 -7.926 -4.209 1.00 0.23 C ATOM 2436 O MET B 12 2.908 -8.189 -3.626 1.00 0.39 O ATOM 2437 CB MET B 12 0.484 -5.964 -3.539 1.00 0.27 C ATOM 2438 CG MET B 12 0.571 -4.466 -3.335 1.00 0.16 C ATOM 2439 SD MET B 12 -0.911 -3.784 -2.581 1.00 0.78 S ATOM 2440 CE MET B 12 -0.317 -2.183 -2.078 1.00 0.19 C ATOM 0 H MET B 12 0.041 -6.001 -5.951 1.00 0.16 H new ATOM 0 HA MET B 12 2.410 -5.885 -4.465 1.00 0.20 H new ATOM 0 HB2 MET B 12 -0.517 -6.220 -3.885 1.00 0.27 H new ATOM 0 HB3 MET B 12 0.628 -6.464 -2.581 1.00 0.27 H new ATOM 0 HG2 MET B 12 1.432 -4.238 -2.706 1.00 0.16 H new ATOM 0 HG3 MET B 12 0.741 -3.981 -4.296 1.00 0.16 H new ATOM 0 HE1 MET B 12 -1.131 -1.619 -1.623 1.00 0.19 H new ATOM 0 HE2 MET B 12 0.489 -2.305 -1.354 1.00 0.19 H new ATOM 0 HE3 MET B 12 0.056 -1.643 -2.948 1.00 0.19 H new ATOM 2450 N VAL B 13 1.004 -8.856 -4.597 1.00 0.18 N ATOM 2451 CA VAL B 13 1.272 -10.268 -4.371 1.00 0.19 C ATOM 2452 C VAL B 13 2.012 -10.897 -5.552 1.00 0.19 C ATOM 2453 O VAL B 13 2.771 -11.852 -5.381 1.00 0.25 O ATOM 2454 CB VAL B 13 -0.018 -11.061 -4.071 1.00 0.20 C ATOM 2455 CG1 VAL B 13 -0.606 -10.628 -2.739 1.00 0.21 C ATOM 2456 CG2 VAL B 13 -1.045 -10.891 -5.181 1.00 0.22 C ATOM 0 H VAL B 13 0.120 -8.660 -5.066 1.00 0.18 H new ATOM 0 HA VAL B 13 1.914 -10.322 -3.492 1.00 0.19 H new ATOM 0 HB VAL B 13 0.245 -12.117 -4.017 1.00 0.20 H new ATOM 0 HG11 VAL B 13 -1.515 -11.196 -2.541 1.00 0.21 H new ATOM 0 HG12 VAL B 13 0.117 -10.813 -1.945 1.00 0.21 H new ATOM 0 HG13 VAL B 13 -0.843 -9.565 -2.774 1.00 0.21 H new ATOM 0 HG21 VAL B 13 -1.941 -11.462 -4.938 1.00 0.22 H new ATOM 0 HG22 VAL B 13 -1.303 -9.837 -5.280 1.00 0.22 H new ATOM 0 HG23 VAL B 13 -0.628 -11.252 -6.121 1.00 0.22 H new ATOM 2466 N SER B 14 1.805 -10.349 -6.743 1.00 0.18 N ATOM 2467 CA SER B 14 2.445 -10.870 -7.945 1.00 0.21 C ATOM 2468 C SER B 14 3.945 -10.553 -7.941 1.00 0.23 C ATOM 2469 O SER B 14 4.780 -11.456 -8.024 1.00 0.26 O ATOM 2470 CB SER B 14 1.777 -10.286 -9.194 1.00 0.23 C ATOM 2471 OG SER B 14 2.250 -10.917 -10.371 1.00 1.12 O ATOM 0 H SER B 14 1.199 -9.544 -6.903 1.00 0.18 H new ATOM 0 HA SER B 14 2.326 -11.953 -7.959 1.00 0.21 H new ATOM 0 HB2 SER B 14 0.696 -10.408 -9.122 1.00 0.23 H new ATOM 0 HB3 SER B 14 1.974 -9.215 -9.248 1.00 0.23 H new ATOM 0 HG SER B 14 1.806 -10.526 -11.153 1.00 1.12 H new ATOM 2477 N THR B 15 4.279 -9.270 -7.821 1.00 0.24 N ATOM 2478 CA THR B 15 5.670 -8.831 -7.785 1.00 0.26 C ATOM 2479 C THR B 15 6.348 -9.377 -6.532 1.00 0.28 C ATOM 2480 O THR B 15 7.551 -9.640 -6.518 1.00 0.31 O ATOM 2481 CB THR B 15 5.753 -7.288 -7.796 1.00 0.27 C ATOM 2482 OG1 THR B 15 4.824 -6.765 -8.756 1.00 0.33 O ATOM 2483 CG2 THR B 15 7.155 -6.803 -8.140 1.00 0.25 C ATOM 0 H THR B 15 3.600 -8.513 -7.747 1.00 0.24 H new ATOM 0 HA THR B 15 6.180 -9.212 -8.670 1.00 0.26 H new ATOM 0 HB THR B 15 5.506 -6.933 -6.796 1.00 0.27 H new ATOM 0 HG1 THR B 15 3.931 -6.720 -8.356 1.00 0.33 H new ATOM 0 HG21 THR B 15 7.174 -5.713 -8.138 1.00 0.25 H new ATOM 0 HG22 THR B 15 7.862 -7.179 -7.401 1.00 0.25 H new ATOM 0 HG23 THR B 15 7.434 -7.169 -9.128 1.00 0.25 H new ATOM 2491 N PHE B 16 5.538 -9.560 -5.492 1.00 0.30 N ATOM 2492 CA PHE B 16 5.970 -10.150 -4.233 1.00 0.36 C ATOM 2493 C PHE B 16 6.712 -11.458 -4.472 1.00 0.40 C ATOM 2494 O PHE B 16 7.916 -11.548 -4.237 1.00 0.51 O ATOM 2495 CB PHE B 16 4.735 -10.390 -3.360 1.00 0.44 C ATOM 2496 CG PHE B 16 4.999 -10.967 -2.000 1.00 0.34 C ATOM 2497 CD1 PHE B 16 5.530 -10.186 -0.991 1.00 1.21 C ATOM 2498 CD2 PHE B 16 4.688 -12.285 -1.727 1.00 1.27 C ATOM 2499 CE1 PHE B 16 5.753 -10.712 0.265 1.00 1.38 C ATOM 2500 CE2 PHE B 16 4.903 -12.815 -0.474 1.00 1.42 C ATOM 2501 CZ PHE B 16 5.437 -12.026 0.524 1.00 0.97 C ATOM 0 H PHE B 16 4.552 -9.299 -5.503 1.00 0.30 H new ATOM 0 HA PHE B 16 6.657 -9.469 -3.730 1.00 0.36 H new ATOM 0 HB2 PHE B 16 4.211 -9.442 -3.236 1.00 0.44 H new ATOM 0 HB3 PHE B 16 4.061 -11.060 -3.894 1.00 0.44 H new ATOM 0 HD1 PHE B 16 5.773 -9.152 -1.188 1.00 1.21 H new ATOM 0 HD2 PHE B 16 4.271 -12.907 -2.505 1.00 1.27 H new ATOM 0 HE1 PHE B 16 6.175 -10.094 1.043 1.00 1.38 H new ATOM 0 HE2 PHE B 16 4.654 -13.847 -0.273 1.00 1.42 H new ATOM 0 HZ PHE B 16 5.607 -12.439 1.507 1.00 0.97 H new ATOM 2511 N HIS B 17 5.989 -12.456 -4.979 1.00 0.41 N ATOM 2512 CA HIS B 17 6.548 -13.791 -5.195 1.00 0.51 C ATOM 2513 C HIS B 17 7.655 -13.782 -6.249 1.00 0.45 C ATOM 2514 O HIS B 17 8.551 -14.625 -6.216 1.00 0.51 O ATOM 2515 CB HIS B 17 5.456 -14.777 -5.630 1.00 0.68 C ATOM 2516 CG HIS B 17 4.327 -14.939 -4.656 1.00 1.09 C ATOM 2517 ND1 HIS B 17 4.511 -15.157 -3.309 1.00 2.16 N ATOM 2518 CD2 HIS B 17 2.987 -14.923 -4.847 1.00 1.26 C ATOM 2519 CE1 HIS B 17 3.337 -15.278 -2.720 1.00 2.82 C ATOM 2520 NE2 HIS B 17 2.394 -15.140 -3.630 1.00 2.30 N ATOM 0 H HIS B 17 5.010 -12.365 -5.249 1.00 0.41 H new ATOM 0 HA HIS B 17 6.974 -14.109 -4.243 1.00 0.51 H new ATOM 0 HB2 HIS B 17 5.048 -14.446 -6.585 1.00 0.68 H new ATOM 0 HB3 HIS B 17 5.913 -15.752 -5.799 1.00 0.68 H new ATOM 0 HD2 HIS B 17 2.478 -14.768 -5.787 1.00 1.26 H new ATOM 0 HE1 HIS B 17 3.176 -15.460 -1.668 1.00 2.82 H new ATOM 0 HE2 HIS B 17 1.390 -15.187 -3.458 1.00 2.30 H new ATOM 2529 N LYS B 18 7.596 -12.825 -7.174 1.00 0.42 N ATOM 2530 CA LYS B 18 8.523 -12.796 -8.305 1.00 0.46 C ATOM 2531 C LYS B 18 9.974 -12.656 -7.847 1.00 0.45 C ATOM 2532 O LYS B 18 10.854 -13.364 -8.335 1.00 0.62 O ATOM 2533 CB LYS B 18 8.190 -11.647 -9.259 1.00 0.55 C ATOM 2534 CG LYS B 18 8.956 -11.720 -10.578 1.00 0.76 C ATOM 2535 CD LYS B 18 9.143 -10.359 -11.225 1.00 0.71 C ATOM 2536 CE LYS B 18 7.820 -9.701 -11.529 1.00 1.40 C ATOM 2537 NZ LYS B 18 7.990 -8.344 -12.119 1.00 1.67 N ATOM 0 H LYS B 18 6.919 -12.062 -7.163 1.00 0.42 H new ATOM 0 HA LYS B 18 8.409 -13.747 -8.825 1.00 0.46 H new ATOM 0 HB2 LYS B 18 7.120 -11.654 -9.467 1.00 0.55 H new ATOM 0 HB3 LYS B 18 8.413 -10.700 -8.768 1.00 0.55 H new ATOM 0 HG2 LYS B 18 9.933 -12.171 -10.401 1.00 0.76 H new ATOM 0 HG3 LYS B 18 8.423 -12.375 -11.267 1.00 0.76 H new ATOM 0 HD2 LYS B 18 9.725 -9.718 -10.563 1.00 0.71 H new ATOM 0 HD3 LYS B 18 9.715 -10.469 -12.146 1.00 0.71 H new ATOM 0 HE2 LYS B 18 7.255 -10.327 -12.219 1.00 1.40 H new ATOM 0 HE3 LYS B 18 7.234 -9.626 -10.613 1.00 1.40 H new ATOM 0 HZ1 LYS B 18 7.216 -7.727 -11.800 1.00 1.67 H new ATOM 0 HZ2 LYS B 18 8.900 -7.944 -11.813 1.00 1.67 H new ATOM 0 HZ3 LYS B 18 7.973 -8.412 -13.157 1.00 1.67 H new ATOM 2551 N TYR B 19 10.221 -11.748 -6.911 1.00 0.39 N ATOM 2552 CA TYR B 19 11.588 -11.435 -6.506 1.00 0.43 C ATOM 2553 C TYR B 19 11.991 -12.164 -5.239 1.00 0.50 C ATOM 2554 O TYR B 19 13.167 -12.420 -5.029 1.00 0.74 O ATOM 2555 CB TYR B 19 11.760 -9.926 -6.325 1.00 0.46 C ATOM 2556 CG TYR B 19 11.541 -9.144 -7.597 1.00 0.41 C ATOM 2557 CD1 TYR B 19 12.589 -8.889 -8.471 1.00 1.17 C ATOM 2558 CD2 TYR B 19 10.283 -8.669 -7.931 1.00 1.17 C ATOM 2559 CE1 TYR B 19 12.383 -8.186 -9.643 1.00 1.21 C ATOM 2560 CE2 TYR B 19 10.074 -7.964 -9.097 1.00 1.17 C ATOM 2561 CZ TYR B 19 11.122 -7.725 -9.948 1.00 0.50 C ATOM 2562 OH TYR B 19 10.905 -7.035 -11.118 1.00 0.61 O ATOM 0 H TYR B 19 9.500 -11.219 -6.421 1.00 0.39 H new ATOM 0 HA TYR B 19 12.246 -11.779 -7.304 1.00 0.43 H new ATOM 0 HB2 TYR B 19 11.060 -9.576 -5.566 1.00 0.46 H new ATOM 0 HB3 TYR B 19 12.764 -9.724 -5.951 1.00 0.46 H new ATOM 0 HD1 TYR B 19 13.580 -9.245 -8.232 1.00 1.17 H new ATOM 0 HD2 TYR B 19 9.452 -8.854 -7.267 1.00 1.17 H new ATOM 0 HE1 TYR B 19 13.207 -7.999 -10.316 1.00 1.21 H new ATOM 0 HE2 TYR B 19 9.086 -7.601 -9.340 1.00 1.17 H new ATOM 0 HH TYR B 19 10.318 -6.270 -10.943 1.00 0.61 H new ATOM 2572 N SER B 20 11.024 -12.504 -4.403 1.00 0.41 N ATOM 2573 CA SER B 20 11.316 -13.210 -3.163 1.00 0.48 C ATOM 2574 C SER B 20 11.713 -14.654 -3.447 1.00 0.57 C ATOM 2575 O SER B 20 12.527 -15.242 -2.736 1.00 0.70 O ATOM 2576 CB SER B 20 10.106 -13.161 -2.243 1.00 0.49 C ATOM 2577 OG SER B 20 8.930 -13.507 -2.949 1.00 0.53 O ATOM 0 H SER B 20 10.036 -12.305 -4.557 1.00 0.41 H new ATOM 0 HA SER B 20 12.155 -12.719 -2.670 1.00 0.48 H new ATOM 0 HB2 SER B 20 10.250 -13.846 -1.407 1.00 0.49 H new ATOM 0 HB3 SER B 20 10.003 -12.161 -1.822 1.00 0.49 H new ATOM 0 HG SER B 20 8.434 -12.693 -3.177 1.00 0.53 H new ATOM 2583 N GLY B 21 11.144 -15.214 -4.507 1.00 0.57 N ATOM 2584 CA GLY B 21 11.460 -16.573 -4.886 1.00 0.68 C ATOM 2585 C GLY B 21 12.720 -16.660 -5.726 1.00 0.71 C ATOM 2586 O GLY B 21 12.817 -17.492 -6.632 1.00 0.86 O ATOM 0 H GLY B 21 10.467 -14.748 -5.111 1.00 0.57 H new ATOM 0 HA2 GLY B 21 11.582 -17.179 -3.988 1.00 0.68 H new ATOM 0 HA3 GLY B 21 10.624 -16.996 -5.444 1.00 0.68 H new ATOM 2688 N LYS B 28 9.097 -14.297 1.368 1.00 0.69 N ATOM 2689 CA LYS B 28 10.015 -13.479 2.134 1.00 0.68 C ATOM 2690 C LYS B 28 10.977 -12.747 1.224 1.00 0.50 C ATOM 2691 O LYS B 28 11.747 -13.362 0.490 1.00 0.54 O ATOM 2692 CB LYS B 28 10.807 -14.333 3.126 1.00 0.92 C ATOM 2693 CG LYS B 28 9.956 -14.998 4.194 1.00 0.93 C ATOM 2694 CD LYS B 28 9.210 -13.973 5.034 1.00 0.98 C ATOM 2695 CE LYS B 28 8.563 -14.620 6.244 1.00 1.51 C ATOM 2696 NZ LYS B 28 9.573 -15.188 7.175 1.00 1.98 N ATOM 0 HA LYS B 28 9.421 -12.749 2.684 1.00 0.68 H new ATOM 0 HB2 LYS B 28 11.346 -15.104 2.575 1.00 0.92 H new ATOM 0 HB3 LYS B 28 11.555 -13.706 3.612 1.00 0.92 H new ATOM 0 HG2 LYS B 28 9.241 -15.673 3.723 1.00 0.93 H new ATOM 0 HG3 LYS B 28 10.590 -15.606 4.839 1.00 0.93 H new ATOM 0 HD2 LYS B 28 9.900 -13.195 5.360 1.00 0.98 H new ATOM 0 HD3 LYS B 28 8.446 -13.488 4.426 1.00 0.98 H new ATOM 0 HE2 LYS B 28 7.958 -13.882 6.771 1.00 1.51 H new ATOM 0 HE3 LYS B 28 7.887 -15.410 5.916 1.00 1.51 H new ATOM 0 HZ1 LYS B 28 9.458 -16.221 7.224 1.00 1.98 H new ATOM 0 HZ2 LYS B 28 10.528 -14.962 6.831 1.00 1.98 H new ATOM 0 HZ3 LYS B 28 9.440 -14.780 8.122 1.00 1.98 H new ATOM 2710 N LEU B 29 10.937 -11.430 1.274 1.00 0.38 N ATOM 2711 CA LEU B 29 11.897 -10.633 0.538 1.00 0.32 C ATOM 2712 C LEU B 29 12.970 -10.105 1.467 1.00 0.33 C ATOM 2713 O LEU B 29 12.722 -9.197 2.261 1.00 0.42 O ATOM 2714 CB LEU B 29 11.238 -9.460 -0.189 1.00 0.29 C ATOM 2715 CG LEU B 29 10.361 -9.835 -1.379 1.00 0.29 C ATOM 2716 CD1 LEU B 29 8.933 -10.061 -0.935 1.00 0.34 C ATOM 2717 CD2 LEU B 29 10.432 -8.759 -2.448 1.00 0.31 C ATOM 0 H LEU B 29 10.256 -10.893 1.812 1.00 0.38 H new ATOM 0 HA LEU B 29 12.343 -11.288 -0.210 1.00 0.32 H new ATOM 0 HB2 LEU B 29 10.631 -8.906 0.527 1.00 0.29 H new ATOM 0 HB3 LEU B 29 12.020 -8.784 -0.535 1.00 0.29 H new ATOM 0 HG LEU B 29 10.734 -10.766 -1.807 1.00 0.29 H new ATOM 0 HD11 LEU B 29 8.322 -10.328 -1.797 1.00 0.34 H new ATOM 0 HD12 LEU B 29 8.903 -10.870 -0.205 1.00 0.34 H new ATOM 0 HD13 LEU B 29 8.544 -9.149 -0.483 1.00 0.34 H new ATOM 0 HD21 LEU B 29 9.801 -9.041 -3.291 1.00 0.31 H new ATOM 0 HD22 LEU B 29 10.084 -7.812 -2.035 1.00 0.31 H new ATOM 0 HD23 LEU B 29 11.462 -8.650 -2.787 1.00 0.31 H new ATOM 2729 N ASN B 30 14.152 -10.693 1.393 1.00 0.31 N ATOM 2730 CA ASN B 30 15.296 -10.157 2.106 1.00 0.31 C ATOM 2731 C ASN B 30 15.812 -8.934 1.354 1.00 0.27 C ATOM 2732 O ASN B 30 15.189 -8.502 0.380 1.00 0.26 O ATOM 2733 CB ASN B 30 16.407 -11.205 2.261 1.00 0.35 C ATOM 2734 CG ASN B 30 17.156 -11.481 0.975 1.00 0.58 C ATOM 2735 OD1 ASN B 30 18.140 -10.813 0.659 1.00 1.17 O ATOM 2736 ND2 ASN B 30 16.717 -12.475 0.237 1.00 0.60 N ATOM 0 H ASN B 30 14.343 -11.535 0.850 1.00 0.31 H new ATOM 0 HA ASN B 30 14.985 -9.872 3.111 1.00 0.31 H new ATOM 0 HB2 ASN B 30 17.113 -10.866 3.019 1.00 0.35 H new ATOM 0 HB3 ASN B 30 15.971 -12.135 2.626 1.00 0.35 H new ATOM 0 HD21 ASN B 30 17.196 -12.716 -0.631 1.00 0.60 H new ATOM 0 HD22 ASN B 30 15.898 -13.006 0.532 1.00 0.60 H new ATOM 2743 N LYS B 31 16.931 -8.375 1.806 1.00 0.27 N ATOM 2744 CA LYS B 31 17.487 -7.172 1.193 1.00 0.26 C ATOM 2745 C LYS B 31 17.588 -7.315 -0.326 1.00 0.25 C ATOM 2746 O LYS B 31 17.123 -6.462 -1.077 1.00 0.28 O ATOM 2747 CB LYS B 31 18.883 -6.876 1.745 1.00 0.29 C ATOM 2748 CG LYS B 31 18.903 -6.547 3.222 1.00 0.40 C ATOM 2749 CD LYS B 31 20.285 -6.125 3.703 1.00 0.49 C ATOM 2750 CE LYS B 31 21.239 -7.303 3.881 1.00 1.20 C ATOM 2751 NZ LYS B 31 21.652 -7.918 2.592 1.00 1.72 N ATOM 0 H LYS B 31 17.470 -8.735 2.593 1.00 0.27 H new ATOM 0 HA LYS B 31 16.810 -6.352 1.434 1.00 0.26 H new ATOM 0 HB2 LYS B 31 19.524 -7.740 1.567 1.00 0.29 H new ATOM 0 HB3 LYS B 31 19.312 -6.041 1.191 1.00 0.29 H new ATOM 0 HG2 LYS B 31 18.191 -5.747 3.423 1.00 0.40 H new ATOM 0 HG3 LYS B 31 18.573 -7.417 3.790 1.00 0.40 H new ATOM 0 HD2 LYS B 31 20.714 -5.422 2.989 1.00 0.49 H new ATOM 0 HD3 LYS B 31 20.188 -5.596 4.651 1.00 0.49 H new ATOM 0 HE2 LYS B 31 22.126 -6.967 4.417 1.00 1.20 H new ATOM 0 HE3 LYS B 31 20.760 -8.061 4.501 1.00 1.20 H new ATOM 0 HZ1 LYS B 31 22.661 -8.166 2.633 1.00 1.72 H new ATOM 0 HZ2 LYS B 31 21.091 -8.777 2.422 1.00 1.72 H new ATOM 0 HZ3 LYS B 31 21.493 -7.242 1.818 1.00 1.72 H new ATOM 2765 N SER B 32 18.182 -8.410 -0.760 1.00 0.25 N ATOM 2766 CA SER B 32 18.459 -8.630 -2.174 1.00 0.27 C ATOM 2767 C SER B 32 17.169 -8.706 -2.998 1.00 0.24 C ATOM 2768 O SER B 32 17.095 -8.145 -4.095 1.00 0.27 O ATOM 2769 CB SER B 32 19.281 -9.909 -2.346 1.00 0.35 C ATOM 2770 OG SER B 32 19.909 -9.952 -3.617 1.00 1.27 O ATOM 0 H SER B 32 18.486 -9.170 -0.151 1.00 0.25 H new ATOM 0 HA SER B 32 19.031 -7.780 -2.544 1.00 0.27 H new ATOM 0 HB2 SER B 32 20.037 -9.966 -1.563 1.00 0.35 H new ATOM 0 HB3 SER B 32 18.634 -10.778 -2.228 1.00 0.35 H new ATOM 0 HG SER B 32 20.428 -10.779 -3.698 1.00 1.27 H new ATOM 2776 N GLU B 33 16.148 -9.370 -2.457 1.00 0.25 N ATOM 2777 CA GLU B 33 14.900 -9.568 -3.189 1.00 0.27 C ATOM 2778 C GLU B 33 14.198 -8.233 -3.372 1.00 0.24 C ATOM 2779 O GLU B 33 13.757 -7.889 -4.473 1.00 0.26 O ATOM 2780 CB GLU B 33 13.962 -10.525 -2.448 1.00 0.34 C ATOM 2781 CG GLU B 33 14.642 -11.732 -1.821 1.00 0.47 C ATOM 2782 CD GLU B 33 15.443 -12.564 -2.801 1.00 0.83 C ATOM 2783 OE1 GLU B 33 16.589 -12.180 -3.105 1.00 1.65 O ATOM 2784 OE2 GLU B 33 14.944 -13.615 -3.242 1.00 1.43 O ATOM 0 H GLU B 33 16.161 -9.777 -1.522 1.00 0.25 H new ATOM 0 HA GLU B 33 15.146 -10.004 -4.157 1.00 0.27 H new ATOM 0 HB2 GLU B 33 13.445 -9.970 -1.665 1.00 0.34 H new ATOM 0 HB3 GLU B 33 13.201 -10.876 -3.145 1.00 0.34 H new ATOM 0 HG2 GLU B 33 15.303 -11.391 -1.024 1.00 0.47 H new ATOM 0 HG3 GLU B 33 13.884 -12.364 -1.358 1.00 0.47 H new ATOM 2791 N LEU B 34 14.101 -7.483 -2.279 1.00 0.21 N ATOM 2792 CA LEU B 34 13.491 -6.167 -2.310 1.00 0.21 C ATOM 2793 C LEU B 34 14.245 -5.243 -3.247 1.00 0.20 C ATOM 2794 O LEU B 34 13.636 -4.513 -4.022 1.00 0.24 O ATOM 2795 CB LEU B 34 13.454 -5.563 -0.909 1.00 0.21 C ATOM 2796 CG LEU B 34 12.235 -5.930 -0.073 1.00 0.21 C ATOM 2797 CD1 LEU B 34 12.428 -5.476 1.362 1.00 0.24 C ATOM 2798 CD2 LEU B 34 10.992 -5.291 -0.667 1.00 0.21 C ATOM 0 H LEU B 34 14.439 -7.769 -1.360 1.00 0.21 H new ATOM 0 HA LEU B 34 12.471 -6.279 -2.677 1.00 0.21 H new ATOM 0 HB2 LEU B 34 14.350 -5.877 -0.372 1.00 0.21 H new ATOM 0 HB3 LEU B 34 13.499 -4.478 -0.998 1.00 0.21 H new ATOM 0 HG LEU B 34 12.112 -7.013 -0.079 1.00 0.21 H new ATOM 0 HD11 LEU B 34 11.550 -5.744 1.950 1.00 0.24 H new ATOM 0 HD12 LEU B 34 13.308 -5.962 1.782 1.00 0.24 H new ATOM 0 HD13 LEU B 34 12.565 -4.395 1.386 1.00 0.24 H new ATOM 0 HD21 LEU B 34 10.123 -5.557 -0.065 1.00 0.21 H new ATOM 0 HD22 LEU B 34 11.109 -4.207 -0.676 1.00 0.21 H new ATOM 0 HD23 LEU B 34 10.850 -5.649 -1.687 1.00 0.21 H new ATOM 2810 N LYS B 35 15.571 -5.292 -3.180 1.00 0.21 N ATOM 2811 CA LYS B 35 16.397 -4.423 -4.000 1.00 0.26 C ATOM 2812 C LYS B 35 16.052 -4.571 -5.462 1.00 0.22 C ATOM 2813 O LYS B 35 15.728 -3.591 -6.119 1.00 0.24 O ATOM 2814 CB LYS B 35 17.886 -4.695 -3.790 1.00 0.37 C ATOM 2815 CG LYS B 35 18.769 -3.723 -4.557 1.00 0.54 C ATOM 2816 CD LYS B 35 20.181 -3.675 -3.990 1.00 0.68 C ATOM 2817 CE LYS B 35 20.959 -4.934 -4.309 1.00 0.61 C ATOM 2818 NZ LYS B 35 22.299 -4.937 -3.665 1.00 0.95 N ATOM 0 H LYS B 35 16.092 -5.921 -2.569 1.00 0.21 H new ATOM 0 HA LYS B 35 16.190 -3.399 -3.688 1.00 0.26 H new ATOM 0 HB2 LYS B 35 18.118 -4.630 -2.727 1.00 0.37 H new ATOM 0 HB3 LYS B 35 18.114 -5.714 -4.104 1.00 0.37 H new ATOM 0 HG2 LYS B 35 18.808 -4.017 -5.606 1.00 0.54 H new ATOM 0 HG3 LYS B 35 18.329 -2.726 -4.522 1.00 0.54 H new ATOM 0 HD2 LYS B 35 20.706 -2.811 -4.396 1.00 0.68 H new ATOM 0 HD3 LYS B 35 20.134 -3.541 -2.909 1.00 0.68 H new ATOM 0 HE2 LYS B 35 20.394 -5.804 -3.975 1.00 0.61 H new ATOM 0 HE3 LYS B 35 21.075 -5.025 -5.389 1.00 0.61 H new ATOM 0 HZ1 LYS B 35 22.799 -5.816 -3.908 1.00 0.95 H new ATOM 0 HZ2 LYS B 35 22.848 -4.121 -4.003 1.00 0.95 H new ATOM 0 HZ3 LYS B 35 22.188 -4.876 -2.633 1.00 0.95 H new ATOM 2832 N GLU B 36 16.089 -5.795 -5.964 1.00 0.22 N ATOM 2833 CA GLU B 36 15.817 -6.020 -7.369 1.00 0.24 C ATOM 2834 C GLU B 36 14.406 -5.569 -7.707 1.00 0.25 C ATOM 2835 O GLU B 36 14.173 -4.948 -8.744 1.00 0.32 O ATOM 2836 CB GLU B 36 15.979 -7.482 -7.736 1.00 0.28 C ATOM 2837 CG GLU B 36 16.188 -7.669 -9.223 1.00 0.65 C ATOM 2838 CD GLU B 36 16.257 -9.120 -9.644 1.00 0.77 C ATOM 2839 OE1 GLU B 36 17.288 -9.769 -9.374 1.00 1.30 O ATOM 2840 OE2 GLU B 36 15.295 -9.611 -10.262 1.00 1.48 O ATOM 0 H GLU B 36 16.302 -6.635 -5.426 1.00 0.22 H new ATOM 0 HA GLU B 36 16.538 -5.438 -7.943 1.00 0.24 H new ATOM 0 HB2 GLU B 36 16.827 -7.901 -7.194 1.00 0.28 H new ATOM 0 HB3 GLU B 36 15.095 -8.036 -7.421 1.00 0.28 H new ATOM 0 HG2 GLU B 36 15.375 -7.181 -9.760 1.00 0.65 H new ATOM 0 HG3 GLU B 36 17.110 -7.169 -9.518 1.00 0.65 H new ATOM 2847 N LEU B 37 13.474 -5.871 -6.815 1.00 0.23 N ATOM 2848 CA LEU B 37 12.087 -5.459 -6.974 1.00 0.26 C ATOM 2849 C LEU B 37 12.008 -3.951 -7.191 1.00 0.22 C ATOM 2850 O LEU B 37 11.398 -3.478 -8.154 1.00 0.22 O ATOM 2851 CB LEU B 37 11.294 -5.861 -5.731 1.00 0.32 C ATOM 2852 CG LEU B 37 9.772 -5.811 -5.860 1.00 0.41 C ATOM 2853 CD1 LEU B 37 9.147 -6.959 -5.088 1.00 0.34 C ATOM 2854 CD2 LEU B 37 9.234 -4.487 -5.344 1.00 0.74 C ATOM 0 H LEU B 37 13.656 -6.405 -5.965 1.00 0.23 H new ATOM 0 HA LEU B 37 11.660 -5.954 -7.846 1.00 0.26 H new ATOM 0 HB2 LEU B 37 11.582 -6.875 -5.453 1.00 0.32 H new ATOM 0 HB3 LEU B 37 11.590 -5.209 -4.909 1.00 0.32 H new ATOM 0 HG LEU B 37 9.512 -5.904 -6.914 1.00 0.41 H new ATOM 0 HD11 LEU B 37 8.062 -6.915 -5.186 1.00 0.34 H new ATOM 0 HD12 LEU B 37 9.509 -7.906 -5.488 1.00 0.34 H new ATOM 0 HD13 LEU B 37 9.420 -6.881 -4.036 1.00 0.34 H new ATOM 0 HD21 LEU B 37 8.149 -4.471 -5.445 1.00 0.74 H new ATOM 0 HD22 LEU B 37 9.503 -4.369 -4.294 1.00 0.74 H new ATOM 0 HD23 LEU B 37 9.664 -3.669 -5.923 1.00 0.74 H new ATOM 2866 N LEU B 38 12.655 -3.207 -6.305 1.00 0.19 N ATOM 2867 CA LEU B 38 12.679 -1.757 -6.396 1.00 0.19 C ATOM 2868 C LEU B 38 13.493 -1.285 -7.601 1.00 0.19 C ATOM 2869 O LEU B 38 13.091 -0.363 -8.290 1.00 0.21 O ATOM 2870 CB LEU B 38 13.215 -1.137 -5.100 1.00 0.19 C ATOM 2871 CG LEU B 38 12.204 -1.029 -3.952 1.00 0.19 C ATOM 2872 CD1 LEU B 38 12.605 -1.930 -2.795 1.00 0.20 C ATOM 2873 CD2 LEU B 38 12.079 0.418 -3.484 1.00 0.20 C ATOM 0 H LEU B 38 13.172 -3.587 -5.512 1.00 0.19 H new ATOM 0 HA LEU B 38 11.652 -1.419 -6.538 1.00 0.19 H new ATOM 0 HB2 LEU B 38 14.064 -1.729 -4.759 1.00 0.19 H new ATOM 0 HB3 LEU B 38 13.592 -0.139 -5.324 1.00 0.19 H new ATOM 0 HG LEU B 38 11.233 -1.358 -4.321 1.00 0.19 H new ATOM 0 HD11 LEU B 38 11.874 -1.838 -1.992 1.00 0.20 H new ATOM 0 HD12 LEU B 38 12.641 -2.965 -3.135 1.00 0.20 H new ATOM 0 HD13 LEU B 38 13.588 -1.634 -2.427 1.00 0.20 H new ATOM 0 HD21 LEU B 38 11.357 0.476 -2.669 1.00 0.20 H new ATOM 0 HD22 LEU B 38 13.049 0.773 -3.136 1.00 0.20 H new ATOM 0 HD23 LEU B 38 11.741 1.040 -4.313 1.00 0.20 H new ATOM 2885 N THR B 39 14.624 -1.926 -7.879 1.00 0.20 N ATOM 2886 CA THR B 39 15.463 -1.514 -9.009 1.00 0.22 C ATOM 2887 C THR B 39 14.724 -1.658 -10.337 1.00 0.23 C ATOM 2888 O THR B 39 15.000 -0.938 -11.299 1.00 0.27 O ATOM 2889 CB THR B 39 16.778 -2.319 -9.094 1.00 0.25 C ATOM 2890 OG1 THR B 39 16.504 -3.713 -9.263 1.00 0.30 O ATOM 2891 CG2 THR B 39 17.625 -2.124 -7.854 1.00 0.27 C ATOM 0 H THR B 39 14.980 -2.721 -7.349 1.00 0.20 H new ATOM 0 HA THR B 39 15.702 -0.466 -8.829 1.00 0.22 H new ATOM 0 HB THR B 39 17.331 -1.949 -9.957 1.00 0.25 H new ATOM 0 HG1 THR B 39 15.543 -3.873 -9.155 1.00 0.30 H new ATOM 0 HG21 THR B 39 18.543 -2.704 -7.946 1.00 0.27 H new ATOM 0 HG22 THR B 39 17.872 -1.068 -7.745 1.00 0.27 H new ATOM 0 HG23 THR B 39 17.070 -2.459 -6.978 1.00 0.27 H new ATOM 2899 N ARG B 40 13.786 -2.592 -10.380 1.00 0.24 N ATOM 2900 CA ARG B 40 13.055 -2.883 -11.600 1.00 0.27 C ATOM 2901 C ARG B 40 11.821 -1.997 -11.738 1.00 0.27 C ATOM 2902 O ARG B 40 11.696 -1.245 -12.706 1.00 0.30 O ATOM 2903 CB ARG B 40 12.649 -4.355 -11.629 1.00 0.31 C ATOM 2904 CG ARG B 40 13.818 -5.320 -11.758 1.00 0.34 C ATOM 2905 CD ARG B 40 14.589 -5.102 -13.047 1.00 0.44 C ATOM 2906 NE ARG B 40 13.742 -5.266 -14.228 1.00 0.64 N ATOM 2907 CZ ARG B 40 14.188 -5.201 -15.480 1.00 0.87 C ATOM 2908 NH1 ARG B 40 15.479 -5.006 -15.717 1.00 1.22 N ATOM 2909 NH2 ARG B 40 13.345 -5.341 -16.493 1.00 1.06 N ATOM 0 H ARG B 40 13.514 -3.163 -9.580 1.00 0.24 H new ATOM 0 HA ARG B 40 13.714 -2.673 -12.443 1.00 0.27 H new ATOM 0 HB2 ARG B 40 12.099 -4.587 -10.717 1.00 0.31 H new ATOM 0 HB3 ARG B 40 11.965 -4.516 -12.463 1.00 0.31 H new ATOM 0 HG2 ARG B 40 14.488 -5.195 -10.908 1.00 0.34 H new ATOM 0 HG3 ARG B 40 13.449 -6.345 -11.724 1.00 0.34 H new ATOM 0 HD2 ARG B 40 15.020 -4.101 -13.046 1.00 0.44 H new ATOM 0 HD3 ARG B 40 15.419 -5.806 -13.096 1.00 0.44 H new ATOM 0 HE ARG B 40 12.748 -5.441 -14.083 1.00 0.64 H new ATOM 0 HH11 ARG B 40 16.131 -4.906 -14.939 1.00 1.22 H new ATOM 0 HH12 ARG B 40 15.819 -4.956 -16.677 1.00 1.22 H new ATOM 0 HH21 ARG B 40 12.353 -5.499 -16.313 1.00 1.06 H new ATOM 0 HH22 ARG B 40 13.688 -5.291 -17.452 1.00 1.06 H new ATOM 2923 N GLU B 41 10.915 -2.079 -10.771 1.00 0.27 N ATOM 2924 CA GLU B 41 9.644 -1.374 -10.875 1.00 0.30 C ATOM 2925 C GLU B 41 9.628 -0.057 -10.103 1.00 0.34 C ATOM 2926 O GLU B 41 8.817 0.813 -10.399 1.00 0.46 O ATOM 2927 CB GLU B 41 8.478 -2.258 -10.423 1.00 0.36 C ATOM 2928 CG GLU B 41 7.919 -3.142 -11.530 1.00 0.45 C ATOM 2929 CD GLU B 41 8.813 -4.325 -11.865 1.00 0.83 C ATOM 2930 OE1 GLU B 41 8.901 -5.270 -11.052 1.00 1.54 O ATOM 2931 OE2 GLU B 41 9.418 -4.323 -12.958 1.00 1.59 O ATOM 0 H GLU B 41 11.035 -2.620 -9.915 1.00 0.27 H new ATOM 0 HA GLU B 41 9.522 -1.134 -11.931 1.00 0.30 H new ATOM 0 HB2 GLU B 41 8.810 -2.889 -9.598 1.00 0.36 H new ATOM 0 HB3 GLU B 41 7.680 -1.623 -10.038 1.00 0.36 H new ATOM 0 HG2 GLU B 41 6.938 -3.510 -11.230 1.00 0.45 H new ATOM 0 HG3 GLU B 41 7.773 -2.540 -12.427 1.00 0.45 H new ATOM 2938 N LEU B 42 10.522 0.120 -9.137 1.00 0.27 N ATOM 2939 CA LEU B 42 10.514 1.356 -8.345 1.00 0.28 C ATOM 2940 C LEU B 42 11.837 2.134 -8.437 1.00 0.27 C ATOM 2941 O LEU B 42 12.342 2.596 -7.415 1.00 0.26 O ATOM 2942 CB LEU B 42 10.226 1.049 -6.865 1.00 0.27 C ATOM 2943 CG LEU B 42 8.954 0.249 -6.577 1.00 0.27 C ATOM 2944 CD1 LEU B 42 9.224 -1.239 -6.690 1.00 0.26 C ATOM 2945 CD2 LEU B 42 8.421 0.587 -5.194 1.00 0.32 C ATOM 0 H LEU B 42 11.245 -0.553 -8.883 1.00 0.27 H new ATOM 0 HA LEU B 42 9.725 1.979 -8.766 1.00 0.28 H new ATOM 0 HB2 LEU B 42 11.075 0.501 -6.457 1.00 0.27 H new ATOM 0 HB3 LEU B 42 10.167 1.994 -6.324 1.00 0.27 H new ATOM 0 HG LEU B 42 8.201 0.519 -7.317 1.00 0.27 H new ATOM 0 HD11 LEU B 42 8.308 -1.792 -6.482 1.00 0.26 H new ATOM 0 HD12 LEU B 42 9.567 -1.471 -7.698 1.00 0.26 H new ATOM 0 HD13 LEU B 42 9.992 -1.525 -5.971 1.00 0.26 H new ATOM 0 HD21 LEU B 42 7.516 0.011 -5.002 1.00 0.32 H new ATOM 0 HD22 LEU B 42 9.173 0.342 -4.444 1.00 0.32 H new ATOM 0 HD23 LEU B 42 8.191 1.651 -5.143 1.00 0.32 H new ATOM 2957 N PRO B 43 12.411 2.343 -9.647 1.00 0.31 N ATOM 2958 CA PRO B 43 13.712 3.004 -9.779 1.00 0.33 C ATOM 2959 C PRO B 43 13.635 4.469 -9.367 1.00 0.33 C ATOM 2960 O PRO B 43 14.618 5.059 -8.912 1.00 0.36 O ATOM 2961 CB PRO B 43 14.047 2.885 -11.271 1.00 0.41 C ATOM 2962 CG PRO B 43 13.074 1.897 -11.822 1.00 0.51 C ATOM 2963 CD PRO B 43 11.853 1.996 -10.959 1.00 0.35 C ATOM 0 HA PRO B 43 14.467 2.550 -9.137 1.00 0.33 H new ATOM 0 HB2 PRO B 43 13.954 3.849 -11.772 1.00 0.41 H new ATOM 0 HB3 PRO B 43 15.073 2.548 -11.417 1.00 0.41 H new ATOM 0 HG2 PRO B 43 12.836 2.121 -12.862 1.00 0.51 H new ATOM 0 HG3 PRO B 43 13.487 0.888 -11.800 1.00 0.51 H new ATOM 0 HD2 PRO B 43 11.163 2.759 -11.320 1.00 0.35 H new ATOM 0 HD3 PRO B 43 11.302 1.056 -10.929 1.00 0.35 H new ATOM 2971 N SER B 44 12.452 5.043 -9.527 1.00 0.36 N ATOM 2972 CA SER B 44 12.195 6.411 -9.116 1.00 0.39 C ATOM 2973 C SER B 44 12.172 6.508 -7.599 1.00 0.35 C ATOM 2974 O SER B 44 12.655 7.477 -7.018 1.00 0.40 O ATOM 2975 CB SER B 44 10.854 6.871 -9.671 1.00 0.46 C ATOM 2976 OG SER B 44 10.789 6.677 -11.074 1.00 1.09 O ATOM 0 H SER B 44 11.648 4.574 -9.944 1.00 0.36 H new ATOM 0 HA SER B 44 12.990 7.049 -9.503 1.00 0.39 H new ATOM 0 HB2 SER B 44 10.048 6.320 -9.187 1.00 0.46 H new ATOM 0 HB3 SER B 44 10.703 7.925 -9.439 1.00 0.46 H new ATOM 0 HG SER B 44 9.918 6.979 -11.406 1.00 1.09 H new ATOM 2982 N PHE B 45 11.642 5.464 -6.969 1.00 0.30 N ATOM 2983 CA PHE B 45 11.432 5.447 -5.529 1.00 0.28 C ATOM 2984 C PHE B 45 12.706 5.107 -4.785 1.00 0.28 C ATOM 2985 O PHE B 45 12.663 4.717 -3.626 1.00 0.27 O ATOM 2986 CB PHE B 45 10.351 4.432 -5.161 1.00 0.31 C ATOM 2987 CG PHE B 45 9.016 4.711 -5.777 1.00 0.28 C ATOM 2988 CD1 PHE B 45 8.254 5.777 -5.344 1.00 1.17 C ATOM 2989 CD2 PHE B 45 8.516 3.896 -6.775 1.00 1.28 C ATOM 2990 CE1 PHE B 45 7.017 6.027 -5.892 1.00 1.18 C ATOM 2991 CE2 PHE B 45 7.278 4.135 -7.328 1.00 1.34 C ATOM 2992 CZ PHE B 45 6.526 5.201 -6.886 1.00 0.47 C ATOM 0 H PHE B 45 11.348 4.610 -7.442 1.00 0.30 H new ATOM 0 HA PHE B 45 11.115 6.448 -5.236 1.00 0.28 H new ATOM 0 HB2 PHE B 45 10.680 3.439 -5.468 1.00 0.31 H new ATOM 0 HB3 PHE B 45 10.242 4.411 -4.077 1.00 0.31 H new ATOM 0 HD1 PHE B 45 8.633 6.423 -4.566 1.00 1.17 H new ATOM 0 HD2 PHE B 45 9.104 3.061 -7.126 1.00 1.28 H new ATOM 0 HE1 PHE B 45 6.431 6.866 -5.547 1.00 1.18 H new ATOM 0 HE2 PHE B 45 6.898 3.489 -8.106 1.00 1.34 H new ATOM 0 HZ PHE B 45 5.554 5.391 -7.316 1.00 0.47 H new ATOM 3002 N LEU B 46 13.839 5.258 -5.439 1.00 0.32 N ATOM 3003 CA LEU B 46 15.106 5.080 -4.762 1.00 0.33 C ATOM 3004 C LEU B 46 15.692 6.446 -4.427 1.00 0.39 C ATOM 3005 O LEU B 46 16.501 6.580 -3.512 1.00 0.47 O ATOM 3006 CB LEU B 46 16.075 4.255 -5.615 1.00 0.35 C ATOM 3007 CG LEU B 46 15.512 2.929 -6.150 1.00 0.32 C ATOM 3008 CD1 LEU B 46 16.632 2.024 -6.634 1.00 0.41 C ATOM 3009 CD2 LEU B 46 14.653 2.228 -5.099 1.00 0.30 C ATOM 0 H LEU B 46 13.909 5.501 -6.427 1.00 0.32 H new ATOM 0 HA LEU B 46 14.943 4.527 -3.837 1.00 0.33 H new ATOM 0 HB2 LEU B 46 16.396 4.862 -6.461 1.00 0.35 H new ATOM 0 HB3 LEU B 46 16.964 4.040 -5.021 1.00 0.35 H new ATOM 0 HG LEU B 46 14.870 3.156 -7.001 1.00 0.32 H new ATOM 0 HD11 LEU B 46 16.210 1.091 -7.008 1.00 0.41 H new ATOM 0 HD12 LEU B 46 17.181 2.521 -7.434 1.00 0.41 H new ATOM 0 HD13 LEU B 46 17.310 1.810 -5.808 1.00 0.41 H new ATOM 0 HD21 LEU B 46 14.269 1.293 -5.507 1.00 0.30 H new ATOM 0 HD22 LEU B 46 15.257 2.018 -4.217 1.00 0.30 H new ATOM 0 HD23 LEU B 46 13.819 2.873 -4.822 1.00 0.30 H new ATOM 3021 N GLY B 47 15.249 7.454 -5.174 1.00 0.41 N ATOM 3022 CA GLY B 47 15.655 8.839 -4.956 1.00 0.49 C ATOM 3023 C GLY B 47 17.123 9.122 -5.246 1.00 0.53 C ATOM 3024 O GLY B 47 17.461 10.199 -5.727 1.00 0.60 O ATOM 0 H GLY B 47 14.597 7.333 -5.949 1.00 0.41 H new ATOM 0 HA2 GLY B 47 15.043 9.486 -5.584 1.00 0.49 H new ATOM 0 HA3 GLY B 47 15.444 9.107 -3.921 1.00 0.49 H new ATOM 3028 N LYS B 48 17.993 8.164 -4.967 1.00 0.54 N ATOM 3029 CA LYS B 48 19.410 8.304 -5.282 1.00 0.67 C ATOM 3030 C LYS B 48 20.075 6.944 -5.494 1.00 0.70 C ATOM 3031 O LYS B 48 21.291 6.817 -5.345 1.00 1.18 O ATOM 3032 CB LYS B 48 20.141 9.098 -4.184 1.00 0.82 C ATOM 3033 CG LYS B 48 19.656 8.831 -2.762 1.00 1.41 C ATOM 3034 CD LYS B 48 19.844 7.382 -2.342 1.00 2.04 C ATOM 3035 CE LYS B 48 19.526 7.187 -0.870 1.00 2.61 C ATOM 3036 NZ LYS B 48 20.601 7.720 0.007 1.00 3.21 N ATOM 0 H LYS B 48 17.745 7.280 -4.523 1.00 0.54 H new ATOM 0 HA LYS B 48 19.483 8.860 -6.217 1.00 0.67 H new ATOM 0 HB2 LYS B 48 21.205 8.868 -4.238 1.00 0.82 H new ATOM 0 HB3 LYS B 48 20.034 10.162 -4.394 1.00 0.82 H new ATOM 0 HG2 LYS B 48 20.195 9.479 -2.071 1.00 1.41 H new ATOM 0 HG3 LYS B 48 18.601 9.093 -2.687 1.00 1.41 H new ATOM 0 HD2 LYS B 48 19.200 6.741 -2.943 1.00 2.04 H new ATOM 0 HD3 LYS B 48 20.871 7.075 -2.538 1.00 2.04 H new ATOM 0 HE2 LYS B 48 18.585 7.684 -0.633 1.00 2.61 H new ATOM 0 HE3 LYS B 48 19.385 6.125 -0.667 1.00 2.61 H new ATOM 0 HZ1 LYS B 48 20.403 7.462 0.995 1.00 3.21 H new ATOM 0 HZ2 LYS B 48 21.515 7.315 -0.279 1.00 3.21 H new ATOM 0 HZ3 LYS B 48 20.638 8.756 -0.080 1.00 3.21 H new ATOM 3050 N ARG B 49 19.261 5.949 -5.860 1.00 0.54 N ATOM 3051 CA ARG B 49 19.735 4.584 -6.120 1.00 0.54 C ATOM 3052 C ARG B 49 20.125 3.873 -4.820 1.00 0.51 C ATOM 3053 O ARG B 49 20.672 4.479 -3.897 1.00 0.55 O ATOM 3054 CB ARG B 49 20.909 4.591 -7.110 1.00 0.66 C ATOM 3055 CG ARG B 49 21.321 3.215 -7.611 1.00 0.74 C ATOM 3056 CD ARG B 49 20.203 2.539 -8.387 1.00 0.73 C ATOM 3057 NE ARG B 49 19.704 3.371 -9.484 1.00 1.28 N ATOM 3058 CZ ARG B 49 18.997 2.902 -10.514 1.00 1.46 C ATOM 3059 NH1 ARG B 49 18.792 1.596 -10.641 1.00 1.43 N ATOM 3060 NH2 ARG B 49 18.515 3.735 -11.424 1.00 2.26 N ATOM 0 H ARG B 49 18.255 6.066 -5.985 1.00 0.54 H new ATOM 0 HA ARG B 49 18.912 4.028 -6.570 1.00 0.54 H new ATOM 0 HB2 ARG B 49 20.642 5.210 -7.966 1.00 0.66 H new ATOM 0 HB3 ARG B 49 21.768 5.062 -6.632 1.00 0.66 H new ATOM 0 HG2 ARG B 49 22.201 3.308 -8.248 1.00 0.74 H new ATOM 0 HG3 ARG B 49 21.605 2.590 -6.764 1.00 0.74 H new ATOM 0 HD2 ARG B 49 20.564 1.592 -8.788 1.00 0.73 H new ATOM 0 HD3 ARG B 49 19.382 2.306 -7.708 1.00 0.73 H new ATOM 0 HE ARG B 49 19.909 4.370 -9.459 1.00 1.28 H new ATOM 0 HH11 ARG B 49 19.175 0.950 -9.951 1.00 1.43 H new ATOM 0 HH12 ARG B 49 18.251 1.239 -11.429 1.00 1.43 H new ATOM 0 HH21 ARG B 49 18.684 4.737 -11.338 1.00 2.26 H new ATOM 0 HH22 ARG B 49 17.975 3.374 -12.210 1.00 2.26 H new ATOM 3074 N THR B 50 19.832 2.584 -4.755 1.00 0.51 N ATOM 3075 CA THR B 50 20.088 1.795 -3.565 1.00 0.51 C ATOM 3076 C THR B 50 21.557 1.394 -3.453 1.00 0.61 C ATOM 3077 O THR B 50 22.112 0.772 -4.360 1.00 0.82 O ATOM 3078 CB THR B 50 19.213 0.532 -3.566 1.00 0.57 C ATOM 3079 OG1 THR B 50 19.298 -0.117 -4.844 1.00 0.69 O ATOM 3080 CG2 THR B 50 17.764 0.875 -3.257 1.00 0.57 C ATOM 0 H THR B 50 19.412 2.059 -5.522 1.00 0.51 H new ATOM 0 HA THR B 50 19.839 2.417 -2.705 1.00 0.51 H new ATOM 0 HB THR B 50 19.579 -0.141 -2.791 1.00 0.57 H new ATOM 0 HG1 THR B 50 20.239 -0.205 -5.104 1.00 0.69 H new ATOM 0 HG21 THR B 50 17.165 -0.036 -3.264 1.00 0.57 H new ATOM 0 HG22 THR B 50 17.702 1.343 -2.274 1.00 0.57 H new ATOM 0 HG23 THR B 50 17.384 1.564 -4.011 1.00 0.57 H new ATOM 3088 N ASP B 51 22.181 1.768 -2.342 1.00 0.58 N ATOM 3089 CA ASP B 51 23.549 1.354 -2.050 1.00 0.72 C ATOM 3090 C ASP B 51 23.529 0.248 -1.007 1.00 0.60 C ATOM 3091 O ASP B 51 22.596 0.169 -0.213 1.00 0.58 O ATOM 3092 CB ASP B 51 24.390 2.530 -1.539 1.00 0.91 C ATOM 3093 CG ASP B 51 24.618 3.595 -2.592 1.00 1.35 C ATOM 3094 OD1 ASP B 51 25.352 3.328 -3.566 1.00 1.98 O ATOM 3095 OD2 ASP B 51 24.061 4.705 -2.454 1.00 1.91 O ATOM 0 H ASP B 51 21.760 2.360 -1.626 1.00 0.58 H new ATOM 0 HA ASP B 51 24.002 0.990 -2.972 1.00 0.72 H new ATOM 0 HB2 ASP B 51 23.893 2.978 -0.678 1.00 0.91 H new ATOM 0 HB3 ASP B 51 25.354 2.157 -1.192 1.00 0.91 H new ATOM 3100 N GLU B 52 24.555 -0.593 -1.003 1.00 0.68 N ATOM 3101 CA GLU B 52 24.618 -1.728 -0.083 1.00 0.66 C ATOM 3102 C GLU B 52 24.672 -1.268 1.371 1.00 0.55 C ATOM 3103 O GLU B 52 23.972 -1.809 2.230 1.00 0.50 O ATOM 3104 CB GLU B 52 25.833 -2.601 -0.386 1.00 0.83 C ATOM 3105 CG GLU B 52 25.824 -3.195 -1.781 1.00 1.57 C ATOM 3106 CD GLU B 52 26.966 -4.159 -2.000 1.00 2.22 C ATOM 3107 OE1 GLU B 52 28.050 -3.721 -2.441 1.00 2.79 O ATOM 3108 OE2 GLU B 52 26.789 -5.365 -1.724 1.00 2.89 O ATOM 0 H GLU B 52 25.358 -0.513 -1.627 1.00 0.68 H new ATOM 0 HA GLU B 52 23.709 -2.311 -0.227 1.00 0.66 H new ATOM 0 HB2 GLU B 52 26.737 -2.006 -0.260 1.00 0.83 H new ATOM 0 HB3 GLU B 52 25.879 -3.410 0.343 1.00 0.83 H new ATOM 0 HG2 GLU B 52 24.879 -3.711 -1.948 1.00 1.57 H new ATOM 0 HG3 GLU B 52 25.883 -2.392 -2.516 1.00 1.57 H new ATOM 3115 N ALA B 53 25.496 -0.262 1.638 1.00 0.58 N ATOM 3116 CA ALA B 53 25.654 0.270 2.988 1.00 0.58 C ATOM 3117 C ALA B 53 24.376 0.953 3.458 1.00 0.53 C ATOM 3118 O ALA B 53 24.149 1.129 4.653 1.00 0.58 O ATOM 3119 CB ALA B 53 26.824 1.239 3.036 1.00 0.70 C ATOM 0 H ALA B 53 26.068 0.204 0.934 1.00 0.58 H new ATOM 0 HA ALA B 53 25.859 -0.562 3.662 1.00 0.58 H new ATOM 0 HB1 ALA B 53 26.932 1.629 4.048 1.00 0.70 H new ATOM 0 HB2 ALA B 53 27.738 0.720 2.748 1.00 0.70 H new ATOM 0 HB3 ALA B 53 26.642 2.064 2.347 1.00 0.70 H new ATOM 3125 N ALA B 54 23.544 1.342 2.506 1.00 0.52 N ATOM 3126 CA ALA B 54 22.256 1.937 2.815 1.00 0.51 C ATOM 3127 C ALA B 54 21.185 0.864 2.916 1.00 0.39 C ATOM 3128 O ALA B 54 20.253 0.964 3.708 1.00 0.35 O ATOM 3129 CB ALA B 54 21.880 2.936 1.742 1.00 0.63 C ATOM 0 H ALA B 54 23.740 1.255 1.509 1.00 0.52 H new ATOM 0 HA ALA B 54 22.330 2.449 3.775 1.00 0.51 H new ATOM 0 HB1 ALA B 54 20.913 3.379 1.980 1.00 0.63 H new ATOM 0 HB2 ALA B 54 22.636 3.720 1.694 1.00 0.63 H new ATOM 0 HB3 ALA B 54 21.820 2.430 0.778 1.00 0.63 H new ATOM 3135 N PHE B 55 21.323 -0.161 2.095 1.00 0.38 N ATOM 3136 CA PHE B 55 20.330 -1.222 2.014 1.00 0.32 C ATOM 3137 C PHE B 55 20.300 -2.066 3.281 1.00 0.31 C ATOM 3138 O PHE B 55 19.253 -2.606 3.648 1.00 0.31 O ATOM 3139 CB PHE B 55 20.582 -2.110 0.803 1.00 0.41 C ATOM 3140 CG PHE B 55 19.307 -2.553 0.165 1.00 0.36 C ATOM 3141 CD1 PHE B 55 18.489 -3.476 0.791 1.00 1.25 C ATOM 3142 CD2 PHE B 55 18.905 -2.014 -1.041 1.00 1.23 C ATOM 3143 CE1 PHE B 55 17.296 -3.859 0.222 1.00 1.22 C ATOM 3144 CE2 PHE B 55 17.712 -2.387 -1.612 1.00 1.30 C ATOM 3145 CZ PHE B 55 16.905 -3.313 -0.981 1.00 0.46 C ATOM 0 H PHE B 55 22.119 -0.283 1.469 1.00 0.38 H new ATOM 0 HA PHE B 55 19.357 -0.742 1.905 1.00 0.32 H new ATOM 0 HB2 PHE B 55 21.184 -1.568 0.074 1.00 0.41 H new ATOM 0 HB3 PHE B 55 21.159 -2.983 1.107 1.00 0.41 H new ATOM 0 HD1 PHE B 55 18.790 -3.901 1.737 1.00 1.25 H new ATOM 0 HD2 PHE B 55 19.534 -1.292 -1.540 1.00 1.23 H new ATOM 0 HE1 PHE B 55 16.668 -4.585 0.717 1.00 1.22 H new ATOM 0 HE2 PHE B 55 17.406 -1.956 -2.554 1.00 1.30 H new ATOM 0 HZ PHE B 55 15.968 -3.609 -1.430 1.00 0.46 H new ATOM 3155 N GLN B 56 21.441 -2.183 3.951 1.00 0.35 N ATOM 3156 CA GLN B 56 21.485 -2.862 5.241 1.00 0.41 C ATOM 3157 C GLN B 56 20.565 -2.137 6.220 1.00 0.42 C ATOM 3158 O GLN B 56 19.927 -2.752 7.076 1.00 0.52 O ATOM 3159 CB GLN B 56 22.915 -2.915 5.785 1.00 0.51 C ATOM 3160 CG GLN B 56 23.538 -1.549 6.008 1.00 0.53 C ATOM 3161 CD GLN B 56 24.898 -1.618 6.669 1.00 0.69 C ATOM 3162 OE1 GLN B 56 25.608 -2.715 6.465 1.00 1.15 O flip ATOM 3163 NE2 GLN B 56 25.303 -0.695 7.378 1.00 1.53 N flip ATOM 0 H GLN B 56 22.338 -1.821 3.627 1.00 0.35 H new ATOM 0 HA GLN B 56 21.143 -3.889 5.114 1.00 0.41 H new ATOM 0 HB2 GLN B 56 22.915 -3.462 6.728 1.00 0.51 H new ATOM 0 HB3 GLN B 56 23.537 -3.478 5.090 1.00 0.51 H new ATOM 0 HG2 GLN B 56 23.632 -1.038 5.050 1.00 0.53 H new ATOM 0 HG3 GLN B 56 22.870 -0.948 6.626 1.00 0.53 H new ATOM 0 HE21 GLN B 56 24.727 0.136 7.512 1.00 1.53 H new ATOM 0 HE22 GLN B 56 26.214 -0.762 7.831 1.00 1.53 H new ATOM 3172 N LYS B 57 20.489 -0.823 6.053 1.00 0.36 N ATOM 3173 CA LYS B 57 19.586 0.006 6.829 1.00 0.39 C ATOM 3174 C LYS B 57 18.158 -0.199 6.348 1.00 0.34 C ATOM 3175 O LYS B 57 17.239 -0.299 7.148 1.00 0.41 O ATOM 3176 CB LYS B 57 19.968 1.480 6.681 1.00 0.44 C ATOM 3177 CG LYS B 57 21.397 1.795 7.086 1.00 0.54 C ATOM 3178 CD LYS B 57 21.859 3.116 6.490 1.00 0.61 C ATOM 3179 CE LYS B 57 23.214 3.541 7.032 1.00 0.79 C ATOM 3180 NZ LYS B 57 23.163 3.866 8.483 1.00 1.27 N ATOM 0 H LYS B 57 21.051 -0.306 5.377 1.00 0.36 H new ATOM 0 HA LYS B 57 19.660 -0.279 7.879 1.00 0.39 H new ATOM 0 HB2 LYS B 57 19.822 1.779 5.643 1.00 0.44 H new ATOM 0 HB3 LYS B 57 19.290 2.082 7.285 1.00 0.44 H new ATOM 0 HG2 LYS B 57 21.469 1.839 8.173 1.00 0.54 H new ATOM 0 HG3 LYS B 57 22.057 0.993 6.755 1.00 0.54 H new ATOM 0 HD2 LYS B 57 21.915 3.025 5.405 1.00 0.61 H new ATOM 0 HD3 LYS B 57 21.122 3.889 6.708 1.00 0.61 H new ATOM 0 HE2 LYS B 57 23.937 2.742 6.866 1.00 0.79 H new ATOM 0 HE3 LYS B 57 23.568 4.411 6.479 1.00 0.79 H new ATOM 0 HZ1 LYS B 57 24.038 4.355 8.760 1.00 1.27 H new ATOM 0 HZ2 LYS B 57 22.347 4.482 8.672 1.00 1.27 H new ATOM 0 HZ3 LYS B 57 23.068 2.988 9.032 1.00 1.27 H new ATOM 3194 N LEU B 58 17.993 -0.271 5.029 1.00 0.27 N ATOM 3195 CA LEU B 58 16.675 -0.404 4.409 1.00 0.25 C ATOM 3196 C LEU B 58 15.903 -1.584 4.975 1.00 0.24 C ATOM 3197 O LEU B 58 14.794 -1.423 5.481 1.00 0.26 O ATOM 3198 CB LEU B 58 16.801 -0.578 2.898 1.00 0.22 C ATOM 3199 CG LEU B 58 15.467 -0.594 2.157 1.00 0.22 C ATOM 3200 CD1 LEU B 58 14.799 0.755 2.264 1.00 0.26 C ATOM 3201 CD2 LEU B 58 15.654 -0.947 0.702 1.00 0.23 C ATOM 0 H LEU B 58 18.764 -0.239 4.362 1.00 0.27 H new ATOM 0 HA LEU B 58 16.130 0.513 4.631 1.00 0.25 H new ATOM 0 HB2 LEU B 58 17.415 0.230 2.500 1.00 0.22 H new ATOM 0 HB3 LEU B 58 17.329 -1.510 2.694 1.00 0.22 H new ATOM 0 HG LEU B 58 14.837 -1.354 2.619 1.00 0.22 H new ATOM 0 HD11 LEU B 58 13.848 0.733 1.732 1.00 0.26 H new ATOM 0 HD12 LEU B 58 14.623 0.991 3.313 1.00 0.26 H new ATOM 0 HD13 LEU B 58 15.443 1.516 1.824 1.00 0.26 H new ATOM 0 HD21 LEU B 58 14.686 -0.950 0.201 1.00 0.23 H new ATOM 0 HD22 LEU B 58 16.305 -0.211 0.230 1.00 0.23 H new ATOM 0 HD23 LEU B 58 16.107 -1.935 0.623 1.00 0.23 H new ATOM 3213 N MET B 59 16.491 -2.765 4.871 1.00 0.24 N ATOM 3214 CA MET B 59 15.876 -3.977 5.399 1.00 0.27 C ATOM 3215 C MET B 59 15.481 -3.797 6.855 1.00 0.34 C ATOM 3216 O MET B 59 14.363 -4.103 7.241 1.00 0.41 O ATOM 3217 CB MET B 59 16.836 -5.156 5.263 1.00 0.28 C ATOM 3218 CG MET B 59 16.405 -6.412 6.012 1.00 0.30 C ATOM 3219 SD MET B 59 14.712 -6.911 5.655 1.00 0.31 S ATOM 3220 CE MET B 59 14.766 -7.047 3.875 1.00 0.25 C ATOM 0 H MET B 59 17.396 -2.913 4.425 1.00 0.24 H new ATOM 0 HA MET B 59 14.974 -4.179 4.821 1.00 0.27 H new ATOM 0 HB2 MET B 59 16.946 -5.398 4.206 1.00 0.28 H new ATOM 0 HB3 MET B 59 17.818 -4.852 5.624 1.00 0.28 H new ATOM 0 HG2 MET B 59 17.079 -7.229 5.754 1.00 0.30 H new ATOM 0 HG3 MET B 59 16.507 -6.240 7.084 1.00 0.30 H new ATOM 0 HE1 MET B 59 13.835 -7.484 3.515 1.00 0.25 H new ATOM 0 HE2 MET B 59 14.895 -6.057 3.438 1.00 0.25 H new ATOM 0 HE3 MET B 59 15.602 -7.683 3.584 1.00 0.25 H new ATOM 3230 N SER B 60 16.391 -3.256 7.642 1.00 0.39 N ATOM 3231 CA SER B 60 16.172 -3.109 9.068 1.00 0.51 C ATOM 3232 C SER B 60 15.249 -1.923 9.368 1.00 0.44 C ATOM 3233 O SER B 60 14.901 -1.668 10.524 1.00 0.51 O ATOM 3234 CB SER B 60 17.521 -2.949 9.762 1.00 0.70 C ATOM 3235 OG SER B 60 17.395 -3.001 11.171 1.00 1.36 O ATOM 0 H SER B 60 17.293 -2.909 7.316 1.00 0.39 H new ATOM 0 HA SER B 60 15.675 -4.001 9.450 1.00 0.51 H new ATOM 0 HB2 SER B 60 18.198 -3.736 9.428 1.00 0.70 H new ATOM 0 HB3 SER B 60 17.969 -1.999 9.472 1.00 0.70 H new ATOM 0 HG SER B 60 16.527 -2.631 11.436 1.00 1.36 H new ATOM 3241 N ASN B 61 14.866 -1.194 8.327 1.00 0.37 N ATOM 3242 CA ASN B 61 13.905 -0.118 8.463 1.00 0.42 C ATOM 3243 C ASN B 61 12.510 -0.651 8.221 1.00 0.44 C ATOM 3244 O ASN B 61 11.569 -0.301 8.932 1.00 0.64 O ATOM 3245 CB ASN B 61 14.221 1.034 7.517 1.00 0.46 C ATOM 3246 CG ASN B 61 15.024 2.127 8.197 1.00 0.47 C ATOM 3247 OD1 ASN B 61 14.465 3.043 8.794 1.00 0.96 O ATOM 3248 ND2 ASN B 61 16.340 2.039 8.123 1.00 0.92 N ATOM 0 H ASN B 61 15.211 -1.333 7.377 1.00 0.37 H new ATOM 0 HA ASN B 61 13.965 0.275 9.478 1.00 0.42 H new ATOM 0 HB2 ASN B 61 14.778 0.656 6.659 1.00 0.46 H new ATOM 0 HB3 ASN B 61 13.291 1.453 7.134 1.00 0.46 H new ATOM 0 HD21 ASN B 61 16.924 2.745 8.570 1.00 0.92 H new ATOM 0 HD22 ASN B 61 16.772 1.265 7.619 1.00 0.92 H new ATOM 3255 N LEU B 62 12.384 -1.527 7.230 1.00 0.33 N ATOM 3256 CA LEU B 62 11.125 -2.201 6.987 1.00 0.39 C ATOM 3257 C LEU B 62 10.908 -3.254 8.053 1.00 0.54 C ATOM 3258 O LEU B 62 9.984 -3.167 8.855 1.00 1.18 O ATOM 3259 CB LEU B 62 11.111 -2.872 5.607 1.00 0.35 C ATOM 3260 CG LEU B 62 10.761 -1.975 4.420 1.00 0.25 C ATOM 3261 CD1 LEU B 62 9.454 -1.236 4.673 1.00 0.24 C ATOM 3262 CD2 LEU B 62 11.887 -1.003 4.106 1.00 0.22 C ATOM 0 H LEU B 62 13.135 -1.782 6.589 1.00 0.33 H new ATOM 0 HA LEU B 62 10.328 -1.458 7.018 1.00 0.39 H new ATOM 0 HB2 LEU B 62 12.094 -3.307 5.428 1.00 0.35 H new ATOM 0 HB3 LEU B 62 10.398 -3.696 5.635 1.00 0.35 H new ATOM 0 HG LEU B 62 10.629 -2.613 3.546 1.00 0.25 H new ATOM 0 HD11 LEU B 62 9.222 -0.603 3.817 1.00 0.24 H new ATOM 0 HD12 LEU B 62 8.650 -1.958 4.819 1.00 0.24 H new ATOM 0 HD13 LEU B 62 9.552 -0.618 5.565 1.00 0.24 H new ATOM 0 HD21 LEU B 62 11.604 -0.381 3.257 1.00 0.22 H new ATOM 0 HD22 LEU B 62 12.074 -0.370 4.973 1.00 0.22 H new ATOM 0 HD23 LEU B 62 12.791 -1.560 3.862 1.00 0.22 H new ATOM 3274 N ASP B 63 11.814 -4.216 8.071 1.00 0.31 N ATOM 3275 CA ASP B 63 11.718 -5.377 8.935 1.00 0.33 C ATOM 3276 C ASP B 63 11.839 -4.995 10.404 1.00 0.37 C ATOM 3277 O ASP B 63 12.931 -4.696 10.898 1.00 0.43 O ATOM 3278 CB ASP B 63 12.812 -6.377 8.563 1.00 0.40 C ATOM 3279 CG ASP B 63 12.792 -7.619 9.417 1.00 0.38 C ATOM 3280 OD1 ASP B 63 11.703 -8.004 9.891 1.00 1.15 O ATOM 3281 OD2 ASP B 63 13.867 -8.217 9.611 1.00 1.08 O ATOM 0 H ASP B 63 12.645 -4.212 7.480 1.00 0.31 H new ATOM 0 HA ASP B 63 10.737 -5.829 8.792 1.00 0.33 H new ATOM 0 HB2 ASP B 63 12.697 -6.661 7.517 1.00 0.40 H new ATOM 0 HB3 ASP B 63 13.785 -5.894 8.657 1.00 0.40 H new ATOM 3286 N SER B 64 10.711 -4.989 11.092 1.00 0.43 N ATOM 3287 CA SER B 64 10.690 -4.722 12.517 1.00 0.52 C ATOM 3288 C SER B 64 10.811 -6.027 13.301 1.00 0.58 C ATOM 3289 O SER B 64 10.769 -6.033 14.531 1.00 0.71 O ATOM 3290 CB SER B 64 9.401 -3.992 12.898 1.00 0.67 C ATOM 3291 OG SER B 64 9.257 -2.781 12.167 1.00 1.14 O ATOM 0 H SER B 64 9.794 -5.167 10.683 1.00 0.43 H new ATOM 0 HA SER B 64 11.539 -4.086 12.767 1.00 0.52 H new ATOM 0 HB2 SER B 64 8.544 -4.639 12.707 1.00 0.67 H new ATOM 0 HB3 SER B 64 9.405 -3.776 13.966 1.00 0.67 H new ATOM 0 HG SER B 64 8.424 -2.337 12.430 1.00 1.14 H new ATOM 3297 N ASN B 65 10.967 -7.132 12.578 1.00 0.60 N ATOM 3298 CA ASN B 65 11.063 -8.447 13.203 1.00 0.75 C ATOM 3299 C ASN B 65 12.520 -8.799 13.448 1.00 0.76 C ATOM 3300 O ASN B 65 12.831 -9.636 14.295 1.00 0.91 O ATOM 3301 CB ASN B 65 10.430 -9.524 12.310 1.00 0.89 C ATOM 3302 CG ASN B 65 9.085 -9.110 11.749 1.00 1.52 C ATOM 3303 OD1 ASN B 65 8.041 -9.339 12.359 1.00 1.87 O ATOM 3304 ND2 ASN B 65 9.103 -8.503 10.572 1.00 2.34 N ATOM 0 H ASN B 65 11.030 -7.143 11.560 1.00 0.60 H new ATOM 0 HA ASN B 65 10.526 -8.411 14.151 1.00 0.75 H new ATOM 0 HB2 ASN B 65 11.107 -9.750 11.486 1.00 0.89 H new ATOM 0 HB3 ASN B 65 10.311 -10.442 12.886 1.00 0.89 H new ATOM 0 HD21 ASN B 65 8.229 -8.206 10.138 1.00 2.34 H new ATOM 0 HD22 ASN B 65 9.991 -8.332 10.100 1.00 2.34 H new ATOM 3311 N ARG B 66 13.403 -8.129 12.707 1.00 0.68 N ATOM 3312 CA ARG B 66 14.840 -8.382 12.773 1.00 0.81 C ATOM 3313 C ARG B 66 15.155 -9.798 12.315 1.00 0.88 C ATOM 3314 O ARG B 66 15.785 -10.579 13.030 1.00 1.11 O ATOM 3315 CB ARG B 66 15.384 -8.129 14.183 1.00 1.04 C ATOM 3316 CG ARG B 66 15.419 -6.660 14.557 1.00 1.10 C ATOM 3317 CD ARG B 66 16.299 -5.879 13.596 1.00 1.39 C ATOM 3318 NE ARG B 66 16.402 -4.471 13.963 1.00 2.08 N ATOM 3319 CZ ARG B 66 17.547 -3.871 14.280 1.00 2.77 C ATOM 3320 NH1 ARG B 66 18.686 -4.556 14.248 1.00 2.86 N ATOM 3321 NH2 ARG B 66 17.560 -2.589 14.613 1.00 3.79 N ATOM 0 H ARG B 66 13.142 -7.397 12.046 1.00 0.68 H new ATOM 0 HA ARG B 66 15.336 -7.685 12.098 1.00 0.81 H new ATOM 0 HB2 ARG B 66 14.768 -8.666 14.904 1.00 1.04 H new ATOM 0 HB3 ARG B 66 16.391 -8.540 14.256 1.00 1.04 H new ATOM 0 HG2 ARG B 66 14.408 -6.253 14.544 1.00 1.10 H new ATOM 0 HG3 ARG B 66 15.795 -6.548 15.574 1.00 1.10 H new ATOM 0 HD2 ARG B 66 17.295 -6.321 13.577 1.00 1.39 H new ATOM 0 HD3 ARG B 66 15.894 -5.961 12.587 1.00 1.39 H new ATOM 0 HE ARG B 66 15.547 -3.914 13.978 1.00 2.08 H new ATOM 0 HH11 ARG B 66 18.682 -5.540 13.981 1.00 2.86 H new ATOM 0 HH12 ARG B 66 19.564 -4.097 14.491 1.00 2.86 H new ATOM 0 HH21 ARG B 66 16.690 -2.057 14.627 1.00 3.79 H new ATOM 0 HH22 ARG B 66 18.440 -2.134 14.855 1.00 3.79 H new ATOM 3335 N ASP B 67 14.715 -10.111 11.106 1.00 0.75 N ATOM 3336 CA ASP B 67 14.924 -11.423 10.526 1.00 0.88 C ATOM 3337 C ASP B 67 15.618 -11.271 9.179 1.00 0.77 C ATOM 3338 O ASP B 67 16.103 -12.244 8.599 1.00 0.96 O ATOM 3339 CB ASP B 67 13.584 -12.150 10.373 1.00 1.00 C ATOM 3340 CG ASP B 67 13.744 -13.603 9.975 1.00 1.39 C ATOM 3341 OD1 ASP B 67 14.748 -14.228 10.373 1.00 1.95 O ATOM 3342 OD2 ASP B 67 12.848 -14.135 9.284 1.00 1.93 O ATOM 0 H ASP B 67 14.206 -9.464 10.504 1.00 0.75 H new ATOM 0 HA ASP B 67 15.557 -12.019 11.183 1.00 0.88 H new ATOM 0 HB2 ASP B 67 13.037 -12.094 11.314 1.00 1.00 H new ATOM 0 HB3 ASP B 67 12.982 -11.637 9.623 1.00 1.00 H new ATOM 3347 N ASN B 68 15.659 -10.028 8.700 1.00 0.62 N ATOM 3348 CA ASN B 68 16.368 -9.667 7.471 1.00 0.55 C ATOM 3349 C ASN B 68 15.674 -10.250 6.251 1.00 0.43 C ATOM 3350 O ASN B 68 16.307 -10.562 5.245 1.00 0.57 O ATOM 3351 CB ASN B 68 17.841 -10.097 7.527 1.00 0.77 C ATOM 3352 CG ASN B 68 18.646 -9.296 8.540 1.00 1.30 C ATOM 3353 OD1 ASN B 68 18.243 -8.051 8.776 1.00 1.41 O flip ATOM 3354 ND2 ASN B 68 19.621 -9.787 9.108 1.00 2.22 N flip ATOM 0 H ASN B 68 15.200 -9.239 9.155 1.00 0.62 H new ATOM 0 HA ASN B 68 16.346 -8.581 7.384 1.00 0.55 H new ATOM 0 HB2 ASN B 68 17.897 -11.156 7.779 1.00 0.77 H new ATOM 0 HB3 ASN B 68 18.288 -9.980 6.540 1.00 0.77 H new ATOM 0 HD21 ASN B 68 19.902 -10.746 8.902 1.00 2.22 H new ATOM 0 HD22 ASN B 68 20.148 -9.235 9.785 1.00 2.22 H new ATOM 3361 N GLU B 69 14.358 -10.342 6.349 1.00 0.42 N ATOM 3362 CA GLU B 69 13.506 -10.795 5.263 1.00 0.42 C ATOM 3363 C GLU B 69 12.076 -10.363 5.556 1.00 0.39 C ATOM 3364 O GLU B 69 11.453 -10.813 6.520 1.00 0.54 O ATOM 3365 CB GLU B 69 13.603 -12.314 5.044 1.00 0.60 C ATOM 3366 CG GLU B 69 13.406 -13.149 6.296 1.00 1.04 C ATOM 3367 CD GLU B 69 13.521 -14.636 6.025 1.00 1.44 C ATOM 3368 OE1 GLU B 69 14.644 -15.109 5.748 1.00 1.84 O ATOM 3369 OE2 GLU B 69 12.494 -15.345 6.104 1.00 2.09 O ATOM 0 H GLU B 69 13.845 -10.101 7.197 1.00 0.42 H new ATOM 0 HA GLU B 69 13.844 -10.338 4.333 1.00 0.42 H new ATOM 0 HB2 GLU B 69 12.857 -12.609 4.306 1.00 0.60 H new ATOM 0 HB3 GLU B 69 14.580 -12.545 4.620 1.00 0.60 H new ATOM 0 HG2 GLU B 69 14.147 -12.860 7.042 1.00 1.04 H new ATOM 0 HG3 GLU B 69 12.425 -12.935 6.721 1.00 1.04 H new ATOM 3376 N VAL B 70 11.586 -9.460 4.728 1.00 0.28 N ATOM 3377 CA VAL B 70 10.320 -8.788 4.959 1.00 0.25 C ATOM 3378 C VAL B 70 9.123 -9.728 4.809 1.00 0.25 C ATOM 3379 O VAL B 70 9.017 -10.477 3.835 1.00 0.33 O ATOM 3380 CB VAL B 70 10.197 -7.572 4.011 1.00 0.26 C ATOM 3381 CG1 VAL B 70 8.755 -7.179 3.783 1.00 0.29 C ATOM 3382 CG2 VAL B 70 10.966 -6.396 4.582 1.00 0.30 C ATOM 0 H VAL B 70 12.057 -9.170 3.871 1.00 0.28 H new ATOM 0 HA VAL B 70 10.308 -8.442 5.993 1.00 0.25 H new ATOM 0 HB VAL B 70 10.619 -7.858 3.048 1.00 0.26 H new ATOM 0 HG11 VAL B 70 8.713 -6.321 3.112 1.00 0.29 H new ATOM 0 HG12 VAL B 70 8.216 -8.015 3.337 1.00 0.29 H new ATOM 0 HG13 VAL B 70 8.294 -6.917 4.735 1.00 0.29 H new ATOM 0 HG21 VAL B 70 10.876 -5.542 3.911 1.00 0.30 H new ATOM 0 HG22 VAL B 70 10.558 -6.134 5.558 1.00 0.30 H new ATOM 0 HG23 VAL B 70 12.017 -6.665 4.688 1.00 0.30 H new ATOM 3392 N ASP B 71 8.236 -9.674 5.804 1.00 0.25 N ATOM 3393 CA ASP B 71 7.020 -10.487 5.831 1.00 0.29 C ATOM 3394 C ASP B 71 5.891 -9.758 5.095 1.00 0.22 C ATOM 3395 O ASP B 71 6.110 -8.689 4.540 1.00 0.21 O ATOM 3396 CB ASP B 71 6.629 -10.782 7.288 1.00 0.42 C ATOM 3397 CG ASP B 71 5.675 -11.954 7.430 1.00 1.18 C ATOM 3398 OD1 ASP B 71 4.445 -11.747 7.326 1.00 1.72 O ATOM 3399 OD2 ASP B 71 6.148 -13.088 7.657 1.00 2.06 O ATOM 0 H ASP B 71 8.341 -9.064 6.615 1.00 0.25 H new ATOM 0 HA ASP B 71 7.201 -11.435 5.324 1.00 0.29 H new ATOM 0 HB2 ASP B 71 7.531 -10.986 7.865 1.00 0.42 H new ATOM 0 HB3 ASP B 71 6.168 -9.894 7.720 1.00 0.42 H new ATOM 3404 N PHE B 72 4.684 -10.313 5.109 1.00 0.21 N ATOM 3405 CA PHE B 72 3.608 -9.815 4.256 1.00 0.19 C ATOM 3406 C PHE B 72 3.154 -8.405 4.654 1.00 0.15 C ATOM 3407 O PHE B 72 3.145 -7.505 3.813 1.00 0.14 O ATOM 3408 CB PHE B 72 2.419 -10.778 4.263 1.00 0.21 C ATOM 3409 CG PHE B 72 1.598 -10.736 2.997 1.00 0.20 C ATOM 3410 CD1 PHE B 72 1.881 -9.818 1.993 1.00 1.19 C ATOM 3411 CD2 PHE B 72 0.556 -11.628 2.806 1.00 1.18 C ATOM 3412 CE1 PHE B 72 1.138 -9.791 0.829 1.00 1.20 C ATOM 3413 CE2 PHE B 72 -0.189 -11.605 1.644 1.00 1.20 C ATOM 3414 CZ PHE B 72 0.103 -10.687 0.654 1.00 0.32 C ATOM 0 H PHE B 72 4.426 -11.104 5.698 1.00 0.21 H new ATOM 0 HA PHE B 72 4.009 -9.754 3.244 1.00 0.19 H new ATOM 0 HB2 PHE B 72 2.786 -11.793 4.414 1.00 0.21 H new ATOM 0 HB3 PHE B 72 1.776 -10.542 5.111 1.00 0.21 H new ATOM 0 HD1 PHE B 72 2.692 -9.117 2.124 1.00 1.19 H new ATOM 0 HD2 PHE B 72 0.324 -12.350 3.575 1.00 1.18 H new ATOM 0 HE1 PHE B 72 1.366 -9.070 0.058 1.00 1.20 H new ATOM 0 HE2 PHE B 72 -1.000 -12.305 1.509 1.00 1.20 H new ATOM 0 HZ PHE B 72 -0.478 -10.670 -0.256 1.00 0.32 H new ATOM 3424 N GLN B 73 2.771 -8.199 5.919 1.00 0.15 N ATOM 3425 CA GLN B 73 2.341 -6.863 6.352 1.00 0.14 C ATOM 3426 C GLN B 73 3.501 -5.894 6.209 1.00 0.12 C ATOM 3427 O GLN B 73 3.310 -4.753 5.807 1.00 0.13 O ATOM 3428 CB GLN B 73 1.823 -6.845 7.799 1.00 0.16 C ATOM 3429 CG GLN B 73 0.782 -5.769 8.061 1.00 0.26 C ATOM 3430 CD GLN B 73 0.490 -5.601 9.540 1.00 0.22 C ATOM 3431 OE1 GLN B 73 -0.358 -6.288 10.099 1.00 0.68 O ATOM 3432 NE2 GLN B 73 1.182 -4.679 10.182 1.00 0.60 N ATOM 0 H GLN B 73 2.749 -8.917 6.643 1.00 0.15 H new ATOM 0 HA GLN B 73 1.510 -6.563 5.714 1.00 0.14 H new ATOM 0 HB2 GLN B 73 1.393 -7.819 8.034 1.00 0.16 H new ATOM 0 HB3 GLN B 73 2.665 -6.696 8.475 1.00 0.16 H new ATOM 0 HG2 GLN B 73 1.131 -4.821 7.652 1.00 0.26 H new ATOM 0 HG3 GLN B 73 -0.140 -6.022 7.537 1.00 0.26 H new ATOM 0 HE21 GLN B 73 1.880 -4.126 9.684 1.00 0.60 H new ATOM 0 HE22 GLN B 73 1.019 -4.519 11.176 1.00 0.60 H new ATOM 3441 N GLU B 74 4.709 -6.379 6.498 1.00 0.14 N ATOM 3442 CA GLU B 74 5.917 -5.574 6.388 1.00 0.17 C ATOM 3443 C GLU B 74 6.145 -5.160 4.938 1.00 0.14 C ATOM 3444 O GLU B 74 6.602 -4.056 4.649 1.00 0.16 O ATOM 3445 CB GLU B 74 7.121 -6.370 6.888 1.00 0.27 C ATOM 3446 CG GLU B 74 8.164 -5.525 7.595 1.00 0.38 C ATOM 3447 CD GLU B 74 7.711 -5.112 8.980 1.00 0.43 C ATOM 3448 OE1 GLU B 74 6.893 -4.177 9.089 1.00 1.21 O ATOM 3449 OE2 GLU B 74 8.154 -5.735 9.966 1.00 1.10 O ATOM 0 H GLU B 74 4.873 -7.335 6.813 1.00 0.14 H new ATOM 0 HA GLU B 74 5.797 -4.679 6.999 1.00 0.17 H new ATOM 0 HB2 GLU B 74 6.774 -7.147 7.569 1.00 0.27 H new ATOM 0 HB3 GLU B 74 7.588 -6.874 6.042 1.00 0.27 H new ATOM 0 HG2 GLU B 74 9.096 -6.086 7.670 1.00 0.38 H new ATOM 0 HG3 GLU B 74 8.374 -4.635 7.001 1.00 0.38 H new ATOM 3456 N TYR B 75 5.817 -6.066 4.030 1.00 0.14 N ATOM 3457 CA TYR B 75 5.954 -5.820 2.604 1.00 0.14 C ATOM 3458 C TYR B 75 4.947 -4.777 2.153 1.00 0.11 C ATOM 3459 O TYR B 75 5.238 -3.941 1.306 1.00 0.13 O ATOM 3460 CB TYR B 75 5.761 -7.133 1.828 1.00 0.16 C ATOM 3461 CG TYR B 75 5.895 -7.002 0.329 1.00 0.17 C ATOM 3462 CD1 TYR B 75 4.831 -6.566 -0.448 1.00 1.21 C ATOM 3463 CD2 TYR B 75 7.089 -7.307 -0.304 1.00 1.19 C ATOM 3464 CE1 TYR B 75 4.950 -6.432 -1.816 1.00 1.22 C ATOM 3465 CE2 TYR B 75 7.218 -7.180 -1.676 1.00 1.20 C ATOM 3466 CZ TYR B 75 6.147 -6.739 -2.427 1.00 0.22 C ATOM 3467 OH TYR B 75 6.272 -6.607 -3.791 1.00 0.26 O ATOM 0 H TYR B 75 5.450 -6.989 4.260 1.00 0.14 H new ATOM 0 HA TYR B 75 6.955 -5.439 2.401 1.00 0.14 H new ATOM 0 HB2 TYR B 75 6.491 -7.860 2.183 1.00 0.16 H new ATOM 0 HB3 TYR B 75 4.774 -7.534 2.058 1.00 0.16 H new ATOM 0 HD1 TYR B 75 3.891 -6.327 0.028 1.00 1.21 H new ATOM 0 HD2 TYR B 75 7.930 -7.648 0.281 1.00 1.19 H new ATOM 0 HE1 TYR B 75 4.111 -6.089 -2.404 1.00 1.22 H new ATOM 0 HE2 TYR B 75 8.153 -7.425 -2.157 1.00 1.20 H new ATOM 0 HH TYR B 75 6.581 -5.702 -4.005 1.00 0.26 H new ATOM 3477 N CYS B 76 3.769 -4.818 2.738 1.00 0.11 N ATOM 3478 CA CYS B 76 2.700 -3.949 2.310 1.00 0.12 C ATOM 3479 C CYS B 76 2.762 -2.592 3.004 1.00 0.12 C ATOM 3480 O CYS B 76 2.439 -1.576 2.394 1.00 0.13 O ATOM 3481 CB CYS B 76 1.357 -4.627 2.553 1.00 0.14 C ATOM 3482 SG CYS B 76 1.246 -6.291 1.864 1.00 0.22 S ATOM 0 H CYS B 76 3.530 -5.442 3.508 1.00 0.11 H new ATOM 0 HA CYS B 76 2.817 -3.764 1.242 1.00 0.12 H new ATOM 0 HB2 CYS B 76 1.174 -4.675 3.626 1.00 0.14 H new ATOM 0 HB3 CYS B 76 0.567 -4.012 2.122 1.00 0.14 H new ATOM 0 HG CYS B 76 1.995 -7.098 2.555 1.00 0.22 H new ATOM 3488 N VAL B 77 3.169 -2.565 4.267 1.00 0.13 N ATOM 3489 CA VAL B 77 3.379 -1.297 4.959 1.00 0.14 C ATOM 3490 C VAL B 77 4.508 -0.553 4.264 1.00 0.14 C ATOM 3491 O VAL B 77 4.502 0.668 4.171 1.00 0.19 O ATOM 3492 CB VAL B 77 3.712 -1.501 6.456 1.00 0.16 C ATOM 3493 CG1 VAL B 77 4.954 -2.344 6.590 1.00 0.14 C ATOM 3494 CG2 VAL B 77 3.887 -0.176 7.188 1.00 0.20 C ATOM 0 H VAL B 77 3.359 -3.395 4.829 1.00 0.13 H new ATOM 0 HA VAL B 77 2.457 -0.718 4.918 1.00 0.14 H new ATOM 0 HB VAL B 77 2.870 -2.015 6.919 1.00 0.16 H new ATOM 0 HG11 VAL B 77 5.186 -2.486 7.646 1.00 0.14 H new ATOM 0 HG12 VAL B 77 4.788 -3.314 6.122 1.00 0.14 H new ATOM 0 HG13 VAL B 77 5.789 -1.843 6.100 1.00 0.14 H new ATOM 0 HG21 VAL B 77 4.120 -0.367 8.236 1.00 0.20 H new ATOM 0 HG22 VAL B 77 4.702 0.387 6.732 1.00 0.20 H new ATOM 0 HG23 VAL B 77 2.965 0.401 7.121 1.00 0.20 H new ATOM 3504 N PHE B 78 5.466 -1.329 3.766 1.00 0.11 N ATOM 3505 CA PHE B 78 6.495 -0.832 2.875 1.00 0.11 C ATOM 3506 C PHE B 78 5.853 -0.056 1.737 1.00 0.11 C ATOM 3507 O PHE B 78 6.268 1.051 1.404 1.00 0.11 O ATOM 3508 CB PHE B 78 7.282 -2.029 2.328 1.00 0.12 C ATOM 3509 CG PHE B 78 8.054 -1.766 1.068 1.00 0.12 C ATOM 3510 CD1 PHE B 78 7.457 -1.938 -0.176 1.00 1.17 C ATOM 3511 CD2 PHE B 78 9.374 -1.369 1.125 1.00 1.18 C ATOM 3512 CE1 PHE B 78 8.165 -1.711 -1.334 1.00 1.18 C ATOM 3513 CE2 PHE B 78 10.091 -1.140 -0.030 1.00 1.18 C ATOM 3514 CZ PHE B 78 9.486 -1.313 -1.263 1.00 0.15 C ATOM 0 H PHE B 78 5.546 -2.324 3.974 1.00 0.11 H new ATOM 0 HA PHE B 78 7.170 -0.164 3.410 1.00 0.11 H new ATOM 0 HB2 PHE B 78 7.977 -2.368 3.096 1.00 0.12 H new ATOM 0 HB3 PHE B 78 6.586 -2.847 2.144 1.00 0.12 H new ATOM 0 HD1 PHE B 78 6.426 -2.253 -0.234 1.00 1.17 H new ATOM 0 HD2 PHE B 78 9.851 -1.236 2.085 1.00 1.18 H new ATOM 0 HE1 PHE B 78 7.690 -1.843 -2.295 1.00 1.18 H new ATOM 0 HE2 PHE B 78 11.123 -0.826 0.027 1.00 1.18 H new ATOM 0 HZ PHE B 78 10.047 -1.137 -2.169 1.00 0.15 H new ATOM 3524 N LEU B 79 4.819 -0.651 1.169 1.00 0.14 N ATOM 3525 CA LEU B 79 4.118 -0.075 0.041 1.00 0.16 C ATOM 3526 C LEU B 79 3.367 1.183 0.422 1.00 0.17 C ATOM 3527 O LEU B 79 3.512 2.225 -0.217 1.00 0.20 O ATOM 3528 CB LEU B 79 3.153 -1.089 -0.551 1.00 0.15 C ATOM 3529 CG LEU B 79 3.755 -2.012 -1.593 1.00 0.15 C ATOM 3530 CD1 LEU B 79 3.602 -3.459 -1.189 1.00 0.19 C ATOM 3531 CD2 LEU B 79 3.089 -1.766 -2.916 1.00 0.14 C ATOM 0 H LEU B 79 4.443 -1.547 1.479 1.00 0.14 H new ATOM 0 HA LEU B 79 4.868 0.196 -0.702 1.00 0.16 H new ATOM 0 HB2 LEU B 79 2.745 -1.695 0.258 1.00 0.15 H new ATOM 0 HB3 LEU B 79 2.317 -0.553 -1.001 1.00 0.15 H new ATOM 0 HG LEU B 79 4.821 -1.802 -1.676 1.00 0.15 H new ATOM 0 HD11 LEU B 79 4.042 -4.099 -1.954 1.00 0.19 H new ATOM 0 HD12 LEU B 79 4.109 -3.627 -0.239 1.00 0.19 H new ATOM 0 HD13 LEU B 79 2.544 -3.697 -1.082 1.00 0.19 H new ATOM 0 HD21 LEU B 79 3.519 -2.427 -3.668 1.00 0.14 H new ATOM 0 HD22 LEU B 79 2.021 -1.963 -2.828 1.00 0.14 H new ATOM 0 HD23 LEU B 79 3.244 -0.729 -3.214 1.00 0.14 H new ATOM 3543 N SER B 80 2.570 1.087 1.462 1.00 0.19 N ATOM 3544 CA SER B 80 1.782 2.213 1.904 1.00 0.21 C ATOM 3545 C SER B 80 2.689 3.329 2.375 1.00 0.20 C ATOM 3546 O SER B 80 2.350 4.508 2.283 1.00 0.24 O ATOM 3547 CB SER B 80 0.831 1.766 2.993 1.00 0.22 C ATOM 3548 OG SER B 80 1.426 0.785 3.823 1.00 0.18 O ATOM 0 H SER B 80 2.451 0.240 2.017 1.00 0.19 H new ATOM 0 HA SER B 80 1.190 2.600 1.074 1.00 0.21 H new ATOM 0 HB2 SER B 80 0.535 2.625 3.596 1.00 0.22 H new ATOM 0 HB3 SER B 80 -0.077 1.364 2.544 1.00 0.22 H new ATOM 0 HG SER B 80 0.726 0.231 4.227 1.00 0.18 H new ATOM 3554 N CYS B 81 3.855 2.939 2.860 1.00 0.17 N ATOM 3555 CA CYS B 81 4.904 3.880 3.142 1.00 0.18 C ATOM 3556 C CYS B 81 5.237 4.658 1.890 1.00 0.33 C ATOM 3557 O CYS B 81 5.182 5.872 1.895 1.00 0.72 O ATOM 3558 CB CYS B 81 6.155 3.172 3.642 1.00 0.30 C ATOM 3559 SG CYS B 81 7.664 4.105 3.330 1.00 1.83 S ATOM 0 H CYS B 81 4.092 1.968 3.065 1.00 0.17 H new ATOM 0 HA CYS B 81 4.554 4.557 3.921 1.00 0.18 H new ATOM 0 HB2 CYS B 81 6.060 2.992 4.713 1.00 0.30 H new ATOM 0 HB3 CYS B 81 6.231 2.197 3.160 1.00 0.30 H new ATOM 0 HG CYS B 81 8.032 3.935 2.095 1.00 1.83 H new ATOM 3565 N ILE B 82 5.548 3.947 0.810 1.00 0.17 N ATOM 3566 CA ILE B 82 5.969 4.587 -0.427 1.00 0.19 C ATOM 3567 C ILE B 82 4.926 5.582 -0.903 1.00 0.21 C ATOM 3568 O ILE B 82 5.252 6.698 -1.275 1.00 0.28 O ATOM 3569 CB ILE B 82 6.220 3.578 -1.569 1.00 0.19 C ATOM 3570 CG1 ILE B 82 7.095 2.419 -1.111 1.00 0.24 C ATOM 3571 CG2 ILE B 82 6.898 4.296 -2.723 1.00 0.24 C ATOM 3572 CD1 ILE B 82 8.514 2.824 -0.827 1.00 0.41 C ATOM 0 H ILE B 82 5.516 2.928 0.769 1.00 0.17 H new ATOM 0 HA ILE B 82 6.907 5.091 -0.193 1.00 0.19 H new ATOM 0 HB ILE B 82 5.259 3.170 -1.883 1.00 0.19 H new ATOM 0 HG12 ILE B 82 6.663 1.979 -0.212 1.00 0.24 H new ATOM 0 HG13 ILE B 82 7.092 1.645 -1.878 1.00 0.24 H new ATOM 0 HG21 ILE B 82 7.079 3.591 -3.534 1.00 0.24 H new ATOM 0 HG22 ILE B 82 6.255 5.101 -3.079 1.00 0.24 H new ATOM 0 HG23 ILE B 82 7.847 4.712 -2.385 1.00 0.24 H new ATOM 0 HD11 ILE B 82 9.084 1.952 -0.505 1.00 0.41 H new ATOM 0 HD12 ILE B 82 8.962 3.237 -1.731 1.00 0.41 H new ATOM 0 HD13 ILE B 82 8.527 3.577 -0.039 1.00 0.41 H new ATOM 3584 N ALA B 83 3.670 5.172 -0.876 1.00 0.26 N ATOM 3585 CA ALA B 83 2.578 6.025 -1.319 1.00 0.32 C ATOM 3586 C ALA B 83 2.470 7.277 -0.460 1.00 0.32 C ATOM 3587 O ALA B 83 2.432 8.392 -0.967 1.00 0.35 O ATOM 3588 CB ALA B 83 1.279 5.257 -1.281 1.00 0.42 C ATOM 0 H ALA B 83 3.379 4.250 -0.551 1.00 0.26 H new ATOM 0 HA ALA B 83 2.785 6.337 -2.343 1.00 0.32 H new ATOM 0 HB1 ALA B 83 0.465 5.901 -1.614 1.00 0.42 H new ATOM 0 HB2 ALA B 83 1.349 4.391 -1.940 1.00 0.42 H new ATOM 0 HB3 ALA B 83 1.084 4.923 -0.262 1.00 0.42 H new ATOM 3594 N MET B 84 2.418 7.074 0.844 1.00 0.33 N ATOM 3595 CA MET B 84 2.328 8.161 1.816 1.00 0.36 C ATOM 3596 C MET B 84 3.565 9.035 1.761 1.00 0.36 C ATOM 3597 O MET B 84 3.483 10.261 1.811 1.00 0.48 O ATOM 3598 CB MET B 84 2.165 7.541 3.185 1.00 0.38 C ATOM 3599 CG MET B 84 1.987 8.510 4.328 1.00 0.44 C ATOM 3600 SD MET B 84 1.635 7.607 5.844 1.00 0.38 S ATOM 3601 CE MET B 84 2.479 6.072 5.457 1.00 0.22 C ATOM 0 H MET B 84 2.437 6.146 1.266 1.00 0.33 H new ATOM 0 HA MET B 84 1.475 8.801 1.590 1.00 0.36 H new ATOM 0 HB2 MET B 84 1.303 6.875 3.161 1.00 0.38 H new ATOM 0 HB3 MET B 84 3.040 6.923 3.390 1.00 0.38 H new ATOM 0 HG2 MET B 84 2.889 9.110 4.452 1.00 0.44 H new ATOM 0 HG3 MET B 84 1.173 9.201 4.108 1.00 0.44 H new ATOM 0 HE1 MET B 84 2.885 5.640 6.371 1.00 0.22 H new ATOM 0 HE2 MET B 84 1.774 5.373 5.007 1.00 0.22 H new ATOM 0 HE3 MET B 84 3.291 6.270 4.757 1.00 0.22 H new ATOM 3611 N MET B 85 4.703 8.381 1.624 1.00 0.28 N ATOM 3612 CA MET B 85 5.976 9.050 1.521 1.00 0.29 C ATOM 3613 C MET B 85 6.087 9.772 0.178 1.00 0.34 C ATOM 3614 O MET B 85 6.899 10.677 0.001 1.00 0.48 O ATOM 3615 CB MET B 85 7.083 8.031 1.671 1.00 0.28 C ATOM 3616 CG MET B 85 8.384 8.655 2.091 1.00 0.32 C ATOM 3617 SD MET B 85 9.755 8.140 1.047 1.00 0.29 S ATOM 3618 CE MET B 85 9.643 6.399 1.372 1.00 0.25 C ATOM 0 H MET B 85 4.765 7.364 1.581 1.00 0.28 H new ATOM 0 HA MET B 85 6.063 9.794 2.312 1.00 0.29 H new ATOM 0 HB2 MET B 85 6.787 7.283 2.407 1.00 0.28 H new ATOM 0 HB3 MET B 85 7.223 7.509 0.725 1.00 0.28 H new ATOM 0 HG2 MET B 85 8.292 9.741 2.057 1.00 0.32 H new ATOM 0 HG3 MET B 85 8.597 8.386 3.126 1.00 0.32 H new ATOM 0 HE1 MET B 85 10.606 5.929 1.173 1.00 0.25 H new ATOM 0 HE2 MET B 85 9.370 6.240 2.415 1.00 0.25 H new ATOM 0 HE3 MET B 85 8.884 5.957 0.727 1.00 0.25 H new ATOM 3628 N CYS B 86 5.278 9.331 -0.775 1.00 0.31 N ATOM 3629 CA CYS B 86 5.171 9.982 -2.070 1.00 0.34 C ATOM 3630 C CYS B 86 4.251 11.176 -1.984 1.00 0.39 C ATOM 3631 O CYS B 86 4.590 12.271 -2.433 1.00 0.46 O ATOM 3632 CB CYS B 86 4.624 9.002 -3.114 1.00 0.39 C ATOM 3633 SG CYS B 86 4.399 9.719 -4.758 1.00 0.94 S ATOM 0 H CYS B 86 4.678 8.512 -0.671 1.00 0.31 H new ATOM 0 HA CYS B 86 6.166 10.312 -2.368 1.00 0.34 H new ATOM 0 HB2 CYS B 86 5.304 8.153 -3.190 1.00 0.39 H new ATOM 0 HB3 CYS B 86 3.667 8.614 -2.765 1.00 0.39 H new ATOM 0 HG CYS B 86 5.394 10.511 -5.026 1.00 0.94 H new ATOM 3639 N ASN B 87 3.088 10.938 -1.387 1.00 0.45 N ATOM 3640 CA ASN B 87 2.016 11.917 -1.315 1.00 0.58 C ATOM 3641 C ASN B 87 2.535 13.278 -0.875 1.00 0.68 C ATOM 3642 O ASN B 87 2.249 14.286 -1.509 1.00 0.89 O ATOM 3643 CB ASN B 87 0.943 11.449 -0.341 1.00 0.72 C ATOM 3644 CG ASN B 87 -0.192 12.442 -0.218 1.00 1.10 C ATOM 3645 OD1 ASN B 87 -1.161 12.397 -0.977 1.00 1.72 O ATOM 3646 ND2 ASN B 87 -0.084 13.335 0.748 1.00 1.77 N ATOM 0 H ASN B 87 2.864 10.051 -0.936 1.00 0.45 H new ATOM 0 HA ASN B 87 1.591 12.015 -2.314 1.00 0.58 H new ATOM 0 HB2 ASN B 87 0.548 10.488 -0.672 1.00 0.72 H new ATOM 0 HB3 ASN B 87 1.391 11.288 0.640 1.00 0.72 H new ATOM 0 HD21 ASN B 87 -0.822 14.025 0.889 1.00 1.77 H new ATOM 0 HD22 ASN B 87 0.737 13.335 1.353 1.00 1.77 H new ATOM 3653 N GLU B 88 3.329 13.275 0.196 1.00 0.70 N ATOM 3654 CA GLU B 88 3.854 14.499 0.802 1.00 0.89 C ATOM 3655 C GLU B 88 4.464 15.446 -0.238 1.00 0.86 C ATOM 3656 O GLU B 88 4.310 16.662 -0.143 1.00 1.06 O ATOM 3657 CB GLU B 88 4.888 14.134 1.873 1.00 1.03 C ATOM 3658 CG GLU B 88 5.942 13.155 1.388 1.00 1.51 C ATOM 3659 CD GLU B 88 6.818 12.619 2.503 1.00 1.72 C ATOM 3660 OE1 GLU B 88 6.328 11.803 3.305 1.00 1.98 O ATOM 3661 OE2 GLU B 88 8.009 12.991 2.562 1.00 2.33 O ATOM 0 H GLU B 88 3.627 12.422 0.669 1.00 0.70 H new ATOM 0 HA GLU B 88 3.022 15.032 1.261 1.00 0.89 H new ATOM 0 HB2 GLU B 88 5.380 15.044 2.217 1.00 1.03 H new ATOM 0 HB3 GLU B 88 4.373 13.705 2.733 1.00 1.03 H new ATOM 0 HG2 GLU B 88 5.451 12.320 0.888 1.00 1.51 H new ATOM 0 HG3 GLU B 88 6.571 13.646 0.645 1.00 1.51 H new ATOM 3668 N PHE B 89 5.173 14.890 -1.208 1.00 0.69 N ATOM 3669 CA PHE B 89 5.732 15.682 -2.296 1.00 0.71 C ATOM 3670 C PHE B 89 4.797 15.730 -3.504 1.00 0.73 C ATOM 3671 O PHE B 89 4.569 16.792 -4.087 1.00 0.88 O ATOM 3672 CB PHE B 89 7.089 15.119 -2.717 1.00 0.69 C ATOM 3673 CG PHE B 89 8.194 15.425 -1.749 1.00 0.91 C ATOM 3674 CD1 PHE B 89 8.324 14.703 -0.577 1.00 1.53 C ATOM 3675 CD2 PHE B 89 9.103 16.437 -2.016 1.00 1.65 C ATOM 3676 CE1 PHE B 89 9.342 14.985 0.315 1.00 1.89 C ATOM 3677 CE2 PHE B 89 10.123 16.721 -1.129 1.00 1.99 C ATOM 3678 CZ PHE B 89 10.242 15.993 0.039 1.00 1.81 C ATOM 0 H PHE B 89 5.376 13.892 -1.265 1.00 0.69 H new ATOM 0 HA PHE B 89 5.856 16.700 -1.927 1.00 0.71 H new ATOM 0 HB2 PHE B 89 7.005 14.038 -2.830 1.00 0.69 H new ATOM 0 HB3 PHE B 89 7.352 15.522 -3.695 1.00 0.69 H new ATOM 0 HD1 PHE B 89 7.624 13.911 -0.356 1.00 1.53 H new ATOM 0 HD2 PHE B 89 9.013 17.009 -2.927 1.00 1.65 H new ATOM 0 HE1 PHE B 89 9.433 14.416 1.228 1.00 1.89 H new ATOM 0 HE2 PHE B 89 10.826 17.511 -1.348 1.00 1.99 H new ATOM 0 HZ PHE B 89 11.038 16.213 0.735 1.00 1.81 H new ATOM 3688 N PHE B 90 4.251 14.574 -3.859 1.00 0.63 N ATOM 3689 CA PHE B 90 3.543 14.403 -5.123 1.00 0.66 C ATOM 3690 C PHE B 90 2.191 15.120 -5.148 1.00 0.69 C ATOM 3691 O PHE B 90 1.735 15.543 -6.214 1.00 0.83 O ATOM 3692 CB PHE B 90 3.367 12.906 -5.418 1.00 0.69 C ATOM 3693 CG PHE B 90 2.618 12.610 -6.691 1.00 0.95 C ATOM 3694 CD1 PHE B 90 1.232 12.606 -6.715 1.00 1.79 C ATOM 3695 CD2 PHE B 90 3.305 12.334 -7.863 1.00 1.44 C ATOM 3696 CE1 PHE B 90 0.545 12.335 -7.884 1.00 2.09 C ATOM 3697 CE2 PHE B 90 2.623 12.061 -9.034 1.00 1.68 C ATOM 3698 CZ PHE B 90 1.242 12.062 -9.045 1.00 1.67 C ATOM 0 H PHE B 90 4.285 13.733 -3.283 1.00 0.63 H new ATOM 0 HA PHE B 90 4.150 14.864 -5.902 1.00 0.66 H new ATOM 0 HB2 PHE B 90 4.351 12.440 -5.472 1.00 0.69 H new ATOM 0 HB3 PHE B 90 2.840 12.443 -4.584 1.00 0.69 H new ATOM 0 HD1 PHE B 90 0.682 12.817 -5.810 1.00 1.79 H new ATOM 0 HD2 PHE B 90 4.385 12.332 -7.861 1.00 1.44 H new ATOM 0 HE1 PHE B 90 -0.535 12.337 -7.889 1.00 2.09 H new ATOM 0 HE2 PHE B 90 3.170 11.847 -9.940 1.00 1.68 H new ATOM 0 HZ PHE B 90 0.708 11.850 -9.959 1.00 1.67 H new