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= -12.3! USER MOD Set 1.2: B 85 MET CE :methyl -161:sc= 0 (180deg=-0.022) USER MOD Set 2.1: B 64 SER OG : rot 180:sc= 0.0296 USER MOD Set 2.2: C1920 LYS NZ :NH3+ -143:sc= 0.0306 (180deg=0) USER MOD Set 3.1: B 35 LYS NZ :NH3+ -177:sc= 0.18 (180deg=0.134) USER MOD Set 3.2: B 50 THR OG1 : rot 50:sc= 0.0664 USER MOD Set 4.1: B 18 LYS NZ :NH3+ -177:sc= 1.22 (180deg=1.18) USER MOD Set 4.2: B 19 TYR OH : rot -174:sc= -0.451 USER MOD Set 5.1: A 80 SER OG : rot -117:sc= -0.286 USER MOD Set 5.2: B 12 MET CE :methyl -123:sc= -2.45! (180deg=-6.14!) USER MOD Set 5.3: B 80 SER OG : rot -157:sc= -1.7! USER MOD Set 6.1: A 81 CYS SG : rot 95:sc= -4.36! USER MOD Set 6.2: A 84 MET CE :methyl -164:sc= -5.4! (180deg=-5.84!) USER MOD Set 6.3: C1910 MET CE :methyl 169:sc= -4.34! (180deg=-4.23!) USER MOD Set 7.1: A 76 CYS SG : rot -71:sc= -4.09! USER MOD Set 7.2: B 84 MET CE :methyl 152:sc= -6.84! (180deg=-12.4!) USER MOD Set 8.1: A 64 SER OG : rot -18:sc= 2.29 USER MOD Set 8.2: C1911 ASN : amide:sc= -0.686 K(o=1.6,f=-2!) USER MOD Set 9.1: A 18 LYS NZ :NH3+ 165:sc= 1.29 (180deg=1.23) USER MOD Set 9.2: A 19 TYR OH : rot 179:sc= -0.484 USER MOD Single : A 3 CYS SG : rot 180:sc= 0.0427 USER MOD Single : A 7 LYS NZ :NH3+ -115:sc= 1.06 (180deg=0.193) USER MOD Single : A 12 MET CE :methyl -163:sc= -0.0508 (180deg=-0.843) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot 87:sc= 0.721 USER MOD Single : A 17 HIS :FLIP no HE2:sc= 0.111 F(o=-0.47,f=0.11) USER MOD Single : A 20 SER OG : rot -41:sc= 0.946 USER MOD Single : A 28 LYS NZ :NH3+ -128:sc= 0.388 (180deg=-0.0105) USER MOD Single : A 30 ASN : amide:sc= -1.65! C(o=-1.7!,f=-5.5!) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ 143:sc= 1.22 (180deg=1.06) USER MOD Single : A 39 THR OG1 : rot -88:sc= -2.17! USER MOD Single : A 44 SER OG : rot 140:sc= 1.22 USER MOD Single : A 48 LYS NZ :NH3+ 169:sc= -0.005 (180deg=-0.117) USER MOD Single : A 50 THR OG1 : rot 96:sc= -2.61! USER MOD Single : A 56 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 MET CE :methyl 158:sc= -2.23 (180deg=-3.84!) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 61 ASN : amide:sc= -0.885 K(o=-0.88,f=-2.1!) USER MOD Single : A 65 ASN : amide:sc= -2.71! C(o=-2.7!,f=-7.1!) USER MOD Single : A 68 ASN :FLIP amide:sc= -0.112 F(o=-1.7!,f=-0.11) USER MOD Single : A 73 GLN :FLIP amide:sc= -0.565 F(o=-2.5!,f=-0.56) USER MOD Single : A 75 TYR OH : rot 120:sc= -0.984 USER MOD Single : A 85 MET CE :methyl -170:sc= -5.89! (180deg=-6.38!) USER MOD Single : A 86 CYS SG : rot -25:sc= -0.421 USER MOD Single : A 87 ASN : amide:sc= 0.793 K(o=0.79,f=-0.44) USER MOD Single : B 3 CYS SG : rot 180:sc= 0.0406 USER MOD Single : B 7 LYS NZ :NH3+ -115:sc= 1.06 (180deg=0.265) USER MOD Single : B 14 SER OG : rot 180:sc= 0 USER MOD Single : B 15 THR OG1 : rot 86:sc= 1.2 USER MOD Single : B 17 HIS : no HD1:sc= -0.328 X(o=-0.33,f=0.052) USER MOD Single : B 20 SER OG : rot -35:sc= 0.841 USER MOD Single : B 28 LYS NZ :NH3+ 173:sc= 1.22 (180deg=1.1) USER MOD Single : B 30 ASN : amide:sc= -1.73! C(o=-1.7!,f=-6.1!) USER MOD Single : B 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 32 SER OG : rot 180:sc= 0 USER MOD Single : B 39 THR OG1 : rot -86:sc= -2.32! USER MOD Single : B 44 SER OG : rot 114:sc= 1.3 USER MOD Single : B 48 LYS NZ :NH3+ -170:sc= 1.18 (180deg=0.807) USER MOD Single : B 56 GLN : amide:sc= 0 K(o=0,f=-0.82) USER MOD Single : B 57 LYS NZ :NH3+ -159:sc= -0.119 (180deg=-0.527) USER MOD Single : B 59 MET CE :methyl 145:sc= -2.59 (180deg=-3.19) USER MOD Single : B 60 SER OG : rot 22:sc= 0.0822 USER MOD Single : B 61 ASN :FLIP amide:sc= -0.617 F(o=-4.7!,f=-0.62) USER MOD Single : B 65 ASN : amide:sc= -0.339 X(o=-0.34,f=-0.65) USER MOD Single : B 68 ASN :FLIP amide:sc= -1.04 F(o=-2.1!,f=-1) USER MOD Single : B 73 GLN : amide:sc= -2.38! C(o=-2.4!,f=-2.2!) USER MOD Single : B 75 TYR OH : rot -28:sc= -0.987 USER MOD Single : B 76 CYS SG : rot 66:sc= 1.11 USER MOD Single : B 86 CYS SG : rot 54:sc= -2.76! USER MOD Single : B 87 ASN : amide:sc= -0.494 X(o=-0.49,f=0) USER MOD Single : C1904 THR OG1 : rot 4:sc= 1.24 USER MOD Single : C1906 THR OG1 : rot 180:sc= 0.00803 USER MOD Single : C1915 SER OG : rot -90:sc= 0.565 USER MOD Single : C1916 SER OG : rot 180:sc= 0 USER MOD Single : C1918 LYS NZ :NH3+ -171:sc= 0.0245 (180deg=0.0171) USER MOD Single : C1919 ASN : amide:sc= 0 X(o=0,f=-0.086) USER MOD ----------------------------------------------------------------- ATOM 44 N GLU C1899 -14.700 -8.622 1.924 1.00 0.40 N ATOM 45 CA GLU C1899 -13.319 -9.014 2.138 1.00 0.29 C ATOM 46 C GLU C1899 -12.611 -7.992 2.990 1.00 0.24 C ATOM 47 O GLU C1899 -11.688 -8.311 3.727 1.00 0.27 O ATOM 48 CB GLU C1899 -12.630 -9.073 0.788 1.00 0.30 C ATOM 49 CG GLU C1899 -13.155 -7.992 -0.142 1.00 0.35 C ATOM 50 CD GLU C1899 -14.209 -8.526 -1.091 1.00 0.62 C ATOM 51 OE1 GLU C1899 -13.850 -9.038 -2.168 1.00 0.76 O ATOM 52 OE2 GLU C1899 -15.412 -8.468 -0.734 1.00 0.97 O ATOM 0 HA GLU C1899 -13.290 -9.981 2.640 1.00 0.29 H new ATOM 0 HB2 GLU C1899 -11.555 -8.953 0.920 1.00 0.30 H new ATOM 0 HB3 GLU C1899 -12.789 -10.053 0.338 1.00 0.30 H new ATOM 0 HG2 GLU C1899 -13.577 -7.179 0.448 1.00 0.35 H new ATOM 0 HG3 GLU C1899 -12.328 -7.574 -0.716 1.00 0.35 H new ATOM 59 N LEU C1900 -13.071 -6.754 2.881 1.00 0.24 N ATOM 60 CA LEU C1900 -12.467 -5.640 3.578 1.00 0.25 C ATOM 61 C LEU C1900 -12.493 -5.878 5.094 1.00 0.28 C ATOM 62 O LEU C1900 -11.688 -5.320 5.835 1.00 0.44 O ATOM 63 CB LEU C1900 -13.180 -4.323 3.231 1.00 0.33 C ATOM 64 CG LEU C1900 -13.020 -3.785 1.802 1.00 0.20 C ATOM 65 CD1 LEU C1900 -11.565 -3.749 1.386 1.00 0.22 C ATOM 66 CD2 LEU C1900 -13.857 -4.550 0.806 1.00 0.31 C ATOM 0 H LEU C1900 -13.874 -6.499 2.306 1.00 0.24 H new ATOM 0 HA LEU C1900 -11.429 -5.561 3.254 1.00 0.25 H new ATOM 0 HB2 LEU C1900 -14.245 -4.456 3.423 1.00 0.33 H new ATOM 0 HB3 LEU C1900 -12.825 -3.557 3.920 1.00 0.33 H new ATOM 0 HG LEU C1900 -13.392 -2.760 1.807 1.00 0.20 H new ATOM 0 HD11 LEU C1900 -11.487 -3.363 0.370 1.00 0.22 H new ATOM 0 HD12 LEU C1900 -11.009 -3.101 2.064 1.00 0.22 H new ATOM 0 HD13 LEU C1900 -11.150 -4.756 1.425 1.00 0.22 H new ATOM 0 HD21 LEU C1900 -13.710 -4.132 -0.190 1.00 0.31 H new ATOM 0 HD22 LEU C1900 -13.557 -5.598 0.808 1.00 0.31 H new ATOM 0 HD23 LEU C1900 -14.909 -4.473 1.080 1.00 0.31 H new ATOM 78 N GLU C1901 -13.410 -6.727 5.545 1.00 0.27 N ATOM 79 CA GLU C1901 -13.472 -7.118 6.949 1.00 0.34 C ATOM 80 C GLU C1901 -12.221 -7.899 7.336 1.00 0.37 C ATOM 81 O GLU C1901 -11.565 -7.587 8.320 1.00 0.52 O ATOM 82 CB GLU C1901 -14.712 -7.976 7.199 1.00 0.48 C ATOM 83 CG GLU C1901 -14.791 -8.548 8.603 1.00 1.00 C ATOM 84 CD GLU C1901 -15.980 -9.463 8.786 1.00 1.11 C ATOM 85 OE1 GLU C1901 -16.089 -10.456 8.041 1.00 1.48 O ATOM 86 OE2 GLU C1901 -16.816 -9.190 9.676 1.00 1.44 O ATOM 0 H GLU C1901 -14.123 -7.159 4.957 1.00 0.27 H new ATOM 0 HA GLU C1901 -13.530 -6.217 7.559 1.00 0.34 H new ATOM 0 HB2 GLU C1901 -15.602 -7.375 7.012 1.00 0.48 H new ATOM 0 HB3 GLU C1901 -14.725 -8.797 6.482 1.00 0.48 H new ATOM 0 HG2 GLU C1901 -13.876 -9.098 8.820 1.00 1.00 H new ATOM 0 HG3 GLU C1901 -14.850 -7.731 9.322 1.00 1.00 H new ATOM 93 N ASP C1902 -11.898 -8.902 6.532 1.00 0.37 N ATOM 94 CA ASP C1902 -10.758 -9.779 6.789 1.00 0.46 C ATOM 95 C ASP C1902 -9.463 -9.132 6.308 1.00 0.44 C ATOM 96 O ASP C1902 -8.377 -9.409 6.817 1.00 0.58 O ATOM 97 CB ASP C1902 -10.981 -11.115 6.072 1.00 0.60 C ATOM 98 CG ASP C1902 -9.901 -12.137 6.357 1.00 1.18 C ATOM 99 OD1 ASP C1902 -9.883 -12.689 7.478 1.00 1.42 O ATOM 100 OD2 ASP C1902 -9.083 -12.415 5.457 1.00 2.01 O ATOM 0 H ASP C1902 -12.416 -9.133 5.684 1.00 0.37 H new ATOM 0 HA ASP C1902 -10.672 -9.950 7.862 1.00 0.46 H new ATOM 0 HB2 ASP C1902 -11.946 -11.524 6.372 1.00 0.60 H new ATOM 0 HB3 ASP C1902 -11.030 -10.939 4.997 1.00 0.60 H new ATOM 105 N ALA C1903 -9.599 -8.260 5.324 1.00 0.36 N ATOM 106 CA ALA C1903 -8.461 -7.610 4.701 1.00 0.46 C ATOM 107 C ALA C1903 -8.028 -6.363 5.461 1.00 0.37 C ATOM 108 O ALA C1903 -6.969 -6.340 6.086 1.00 0.37 O ATOM 109 CB ALA C1903 -8.806 -7.244 3.270 1.00 0.66 C ATOM 0 H ALA C1903 -10.501 -7.983 4.935 1.00 0.36 H new ATOM 0 HA ALA C1903 -7.627 -8.312 4.718 1.00 0.46 H new ATOM 0 HB1 ALA C1903 -7.951 -6.756 2.803 1.00 0.66 H new ATOM 0 HB2 ALA C1903 -9.057 -8.147 2.714 1.00 0.66 H new ATOM 0 HB3 ALA C1903 -9.659 -6.566 3.264 1.00 0.66 H new ATOM 115 N THR C1904 -8.860 -5.330 5.423 1.00 0.37 N ATOM 116 CA THR C1904 -8.464 -4.027 5.932 1.00 0.36 C ATOM 117 C THR C1904 -8.667 -3.904 7.438 1.00 0.34 C ATOM 118 O THR C1904 -8.539 -2.818 7.992 1.00 0.36 O ATOM 119 CB THR C1904 -9.198 -2.882 5.203 1.00 0.40 C ATOM 120 OG1 THR C1904 -10.616 -3.071 5.260 1.00 0.42 O ATOM 121 CG2 THR C1904 -8.758 -2.801 3.749 1.00 0.40 C ATOM 0 H THR C1904 -9.807 -5.370 5.047 1.00 0.37 H new ATOM 0 HA THR C1904 -7.396 -3.938 5.732 1.00 0.36 H new ATOM 0 HB THR C1904 -8.942 -1.950 5.707 1.00 0.40 H new ATOM 0 HG1 THR C1904 -10.819 -3.862 5.801 1.00 0.42 H new ATOM 0 HG21 THR C1904 -9.288 -1.987 3.253 1.00 0.40 H new ATOM 0 HG22 THR C1904 -7.685 -2.616 3.703 1.00 0.40 H new ATOM 0 HG23 THR C1904 -8.986 -3.741 3.247 1.00 0.40 H new ATOM 129 N GLU C1905 -8.964 -5.008 8.112 1.00 0.32 N ATOM 130 CA GLU C1905 -8.982 -4.995 9.567 1.00 0.32 C ATOM 131 C GLU C1905 -7.574 -4.731 10.067 1.00 0.28 C ATOM 132 O GLU C1905 -7.356 -4.043 11.066 1.00 0.32 O ATOM 133 CB GLU C1905 -9.483 -6.312 10.148 1.00 0.36 C ATOM 134 CG GLU C1905 -8.686 -7.537 9.725 1.00 0.62 C ATOM 135 CD GLU C1905 -9.101 -8.786 10.485 1.00 1.25 C ATOM 136 OE1 GLU C1905 -8.637 -8.964 11.629 1.00 2.06 O ATOM 137 OE2 GLU C1905 -9.897 -9.590 9.953 1.00 1.76 O ATOM 0 H GLU C1905 -9.191 -5.906 7.685 1.00 0.32 H new ATOM 0 HA GLU C1905 -9.667 -4.212 9.891 1.00 0.32 H new ATOM 0 HB2 GLU C1905 -9.467 -6.243 11.236 1.00 0.36 H new ATOM 0 HB3 GLU C1905 -10.523 -6.452 9.852 1.00 0.36 H new ATOM 0 HG2 GLU C1905 -8.820 -7.704 8.656 1.00 0.62 H new ATOM 0 HG3 GLU C1905 -7.624 -7.351 9.888 1.00 0.62 H new ATOM 144 N THR C1906 -6.621 -5.275 9.328 1.00 0.25 N ATOM 145 CA THR C1906 -5.224 -5.143 9.653 1.00 0.24 C ATOM 146 C THR C1906 -4.690 -3.794 9.175 1.00 0.21 C ATOM 147 O THR C1906 -3.531 -3.456 9.405 1.00 0.19 O ATOM 148 CB THR C1906 -4.424 -6.288 9.012 1.00 0.29 C ATOM 149 OG1 THR C1906 -5.255 -7.458 8.923 1.00 0.48 O ATOM 150 CG2 THR C1906 -3.200 -6.616 9.844 1.00 0.47 C ATOM 0 H THR C1906 -6.802 -5.820 8.485 1.00 0.25 H new ATOM 0 HA THR C1906 -5.111 -5.196 10.736 1.00 0.24 H new ATOM 0 HB THR C1906 -4.104 -5.975 8.018 1.00 0.29 H new ATOM 0 HG1 THR C1906 -4.748 -8.189 8.513 1.00 0.48 H new ATOM 0 HG21 THR C1906 -2.647 -7.429 9.373 1.00 0.47 H new ATOM 0 HG22 THR C1906 -2.561 -5.736 9.914 1.00 0.47 H new ATOM 0 HG23 THR C1906 -3.510 -6.919 10.844 1.00 0.47 H new ATOM 158 N ALA C1907 -5.553 -3.020 8.514 1.00 0.23 N ATOM 159 CA ALA C1907 -5.175 -1.687 8.067 1.00 0.21 C ATOM 160 C ALA C1907 -4.867 -0.805 9.263 1.00 0.21 C ATOM 161 O ALA C1907 -3.874 -0.079 9.275 1.00 0.21 O ATOM 162 CB ALA C1907 -6.260 -1.061 7.198 1.00 0.22 C ATOM 0 H ALA C1907 -6.508 -3.293 8.280 1.00 0.23 H new ATOM 0 HA ALA C1907 -4.278 -1.776 7.454 1.00 0.21 H new ATOM 0 HB1 ALA C1907 -5.945 -0.067 6.882 1.00 0.22 H new ATOM 0 HB2 ALA C1907 -6.428 -1.685 6.320 1.00 0.22 H new ATOM 0 HB3 ALA C1907 -7.185 -0.984 7.770 1.00 0.22 H new ATOM 168 N ASP C1908 -5.725 -0.886 10.271 1.00 0.24 N ATOM 169 CA ASP C1908 -5.499 -0.209 11.545 1.00 0.26 C ATOM 170 C ASP C1908 -4.118 -0.567 12.107 1.00 0.27 C ATOM 171 O ASP C1908 -3.424 0.290 12.657 1.00 0.34 O ATOM 172 CB ASP C1908 -6.596 -0.610 12.539 1.00 0.33 C ATOM 173 CG ASP C1908 -6.534 0.154 13.848 1.00 0.44 C ATOM 174 OD1 ASP C1908 -5.784 -0.268 14.749 1.00 0.68 O ATOM 175 OD2 ASP C1908 -7.208 1.198 13.973 1.00 0.58 O ATOM 0 H ASP C1908 -6.594 -1.419 10.231 1.00 0.24 H new ATOM 0 HA ASP C1908 -5.533 0.869 11.385 1.00 0.26 H new ATOM 0 HB2 ASP C1908 -7.570 -0.447 12.078 1.00 0.33 H new ATOM 0 HB3 ASP C1908 -6.516 -1.677 12.746 1.00 0.33 H new ATOM 180 N ALA C1909 -3.718 -1.830 11.948 1.00 0.23 N ATOM 181 CA ALA C1909 -2.410 -2.286 12.421 1.00 0.24 C ATOM 182 C ALA C1909 -1.276 -1.643 11.618 1.00 0.22 C ATOM 183 O ALA C1909 -0.479 -0.877 12.168 1.00 0.24 O ATOM 184 CB ALA C1909 -2.319 -3.804 12.355 1.00 0.27 C ATOM 0 H ALA C1909 -4.279 -2.553 11.497 1.00 0.23 H new ATOM 0 HA ALA C1909 -2.301 -1.976 13.460 1.00 0.24 H new ATOM 0 HB1 ALA C1909 -1.340 -4.126 12.710 1.00 0.27 H new ATOM 0 HB2 ALA C1909 -3.095 -4.243 12.982 1.00 0.27 H new ATOM 0 HB3 ALA C1909 -2.457 -4.132 11.325 1.00 0.27 H new ATOM 190 N MET C1910 -1.214 -1.955 10.319 1.00 0.19 N ATOM 191 CA MET C1910 -0.237 -1.348 9.409 1.00 0.19 C ATOM 192 C MET C1910 -0.164 0.167 9.553 1.00 0.19 C ATOM 193 O MET C1910 0.897 0.742 9.419 1.00 0.22 O ATOM 194 CB MET C1910 -0.574 -1.702 7.954 1.00 0.18 C ATOM 195 CG MET C1910 0.130 -0.831 6.907 1.00 0.20 C ATOM 196 SD MET C1910 -0.255 -1.353 5.232 1.00 0.20 S ATOM 197 CE MET C1910 0.160 -3.093 5.321 1.00 0.14 C ATOM 0 H MET C1910 -1.834 -2.630 9.872 1.00 0.19 H new ATOM 0 HA MET C1910 0.737 -1.755 9.680 1.00 0.19 H new ATOM 0 HB2 MET C1910 -0.310 -2.745 7.777 1.00 0.18 H new ATOM 0 HB3 MET C1910 -1.652 -1.617 7.813 1.00 0.18 H new ATOM 0 HG2 MET C1910 -0.168 0.209 7.041 1.00 0.20 H new ATOM 0 HG3 MET C1910 1.208 -0.876 7.063 1.00 0.20 H new ATOM 0 HE1 MET C1910 -0.204 -3.600 4.427 1.00 0.14 H new ATOM 0 HE2 MET C1910 1.242 -3.206 5.387 1.00 0.14 H new ATOM 0 HE3 MET C1910 -0.305 -3.533 6.203 1.00 0.14 H new ATOM 207 N ASN C1911 -1.278 0.810 9.831 1.00 0.21 N ATOM 208 CA ASN C1911 -1.316 2.268 9.877 1.00 0.22 C ATOM 209 C ASN C1911 -0.452 2.830 10.998 1.00 0.23 C ATOM 210 O ASN C1911 0.167 3.886 10.854 1.00 0.27 O ATOM 211 CB ASN C1911 -2.740 2.748 10.063 1.00 0.24 C ATOM 212 CG ASN C1911 -2.850 4.241 9.914 1.00 0.25 C ATOM 213 OD1 ASN C1911 -2.741 4.993 10.880 1.00 0.42 O ATOM 214 ND2 ASN C1911 -3.049 4.675 8.692 1.00 0.25 N ATOM 0 H ASN C1911 -2.169 0.355 10.029 1.00 0.21 H new ATOM 0 HA ASN C1911 -0.918 2.627 8.928 1.00 0.22 H new ATOM 0 HB2 ASN C1911 -3.386 2.261 9.332 1.00 0.24 H new ATOM 0 HB3 ASN C1911 -3.097 2.454 11.050 1.00 0.24 H new ATOM 0 HD21 ASN C1911 -3.120 5.676 8.512 1.00 0.25 H new ATOM 0 HD22 ASN C1911 -3.133 4.011 7.922 1.00 0.25 H new ATOM 221 N ARG C1912 -0.409 2.136 12.115 1.00 0.23 N ATOM 222 CA ARG C1912 0.328 2.606 13.254 1.00 0.26 C ATOM 223 C ARG C1912 1.819 2.535 13.005 1.00 0.28 C ATOM 224 O ARG C1912 2.572 3.436 13.380 1.00 0.38 O ATOM 225 CB ARG C1912 -0.052 1.784 14.465 1.00 0.30 C ATOM 226 CG ARG C1912 -1.442 2.107 14.987 1.00 0.75 C ATOM 227 CD ARG C1912 -1.760 3.587 14.830 1.00 1.46 C ATOM 228 NE ARG C1912 -3.060 3.935 15.398 1.00 2.17 N ATOM 229 CZ ARG C1912 -4.047 4.511 14.710 1.00 2.91 C ATOM 230 NH1 ARG C1912 -3.893 4.795 13.425 1.00 3.13 N ATOM 231 NH2 ARG C1912 -5.190 4.812 15.313 1.00 3.76 N ATOM 0 H ARG C1912 -0.880 1.242 12.253 1.00 0.23 H new ATOM 0 HA ARG C1912 0.077 3.651 13.433 1.00 0.26 H new ATOM 0 HB2 ARG C1912 -0.002 0.726 14.209 1.00 0.30 H new ATOM 0 HB3 ARG C1912 0.677 1.955 15.257 1.00 0.30 H new ATOM 0 HG2 ARG C1912 -2.182 1.515 14.449 1.00 0.75 H new ATOM 0 HG3 ARG C1912 -1.513 1.827 16.038 1.00 0.75 H new ATOM 0 HD2 ARG C1912 -0.983 4.177 15.316 1.00 1.46 H new ATOM 0 HD3 ARG C1912 -1.745 3.850 13.772 1.00 1.46 H new ATOM 0 HE ARG C1912 -3.223 3.724 16.383 1.00 2.17 H new ATOM 0 HH11 ARG C1912 -3.015 4.573 12.955 1.00 3.13 H new ATOM 0 HH12 ARG C1912 -4.652 5.235 12.905 1.00 3.13 H new ATOM 0 HH21 ARG C1912 -5.315 4.603 16.304 1.00 3.76 H new ATOM 0 HH22 ARG C1912 -5.944 5.252 14.786 1.00 3.76 H new ATOM 245 N GLU C1913 2.239 1.460 12.384 1.00 0.23 N ATOM 246 CA GLU C1913 3.621 1.312 11.985 1.00 0.25 C ATOM 247 C GLU C1913 3.919 2.126 10.738 1.00 0.22 C ATOM 248 O GLU C1913 4.944 2.756 10.675 1.00 0.27 O ATOM 249 CB GLU C1913 3.952 -0.153 11.742 1.00 0.29 C ATOM 250 CG GLU C1913 3.053 -0.812 10.718 1.00 0.29 C ATOM 251 CD GLU C1913 3.331 -2.288 10.581 1.00 0.39 C ATOM 252 OE1 GLU C1913 2.971 -3.047 11.505 1.00 0.79 O ATOM 253 OE2 GLU C1913 3.926 -2.693 9.568 1.00 0.57 O ATOM 0 H GLU C1913 1.641 0.670 12.142 1.00 0.23 H new ATOM 0 HA GLU C1913 4.245 1.686 12.797 1.00 0.25 H new ATOM 0 HB2 GLU C1913 4.987 -0.233 11.411 1.00 0.29 H new ATOM 0 HB3 GLU C1913 3.876 -0.696 12.684 1.00 0.29 H new ATOM 0 HG2 GLU C1913 2.011 -0.665 11.004 1.00 0.29 H new ATOM 0 HG3 GLU C1913 3.190 -0.327 9.751 1.00 0.29 H new ATOM 260 N VAL C1914 2.999 2.139 9.774 1.00 0.19 N ATOM 261 CA VAL C1914 3.225 2.769 8.466 1.00 0.20 C ATOM 262 C VAL C1914 3.593 4.232 8.610 1.00 0.18 C ATOM 263 O VAL C1914 4.382 4.765 7.835 1.00 0.20 O ATOM 264 CB VAL C1914 1.964 2.672 7.562 1.00 0.24 C ATOM 265 CG1 VAL C1914 0.935 3.727 7.919 1.00 0.26 C ATOM 266 CG2 VAL C1914 2.313 2.796 6.097 1.00 0.29 C ATOM 0 H VAL C1914 2.077 1.715 9.874 1.00 0.19 H new ATOM 0 HA VAL C1914 4.050 2.227 8.005 1.00 0.20 H new ATOM 0 HB VAL C1914 1.537 1.685 7.741 1.00 0.24 H new ATOM 0 HG11 VAL C1914 0.069 3.626 7.265 1.00 0.26 H new ATOM 0 HG12 VAL C1914 0.624 3.596 8.956 1.00 0.26 H new ATOM 0 HG13 VAL C1914 1.371 4.718 7.793 1.00 0.26 H new ATOM 0 HG21 VAL C1914 1.405 2.723 5.499 1.00 0.29 H new ATOM 0 HG22 VAL C1914 2.790 3.760 5.917 1.00 0.29 H new ATOM 0 HG23 VAL C1914 2.997 1.995 5.817 1.00 0.29 H new ATOM 276 N SER C1915 3.020 4.872 9.602 1.00 0.21 N ATOM 277 CA SER C1915 3.237 6.275 9.808 1.00 0.28 C ATOM 278 C SER C1915 4.641 6.500 10.355 1.00 0.28 C ATOM 279 O SER C1915 5.322 7.457 9.987 1.00 0.36 O ATOM 280 CB SER C1915 2.157 6.796 10.732 1.00 0.36 C ATOM 281 OG SER C1915 2.013 5.959 11.867 1.00 1.31 O ATOM 0 H SER C1915 2.396 4.435 10.281 1.00 0.21 H new ATOM 0 HA SER C1915 3.172 6.827 8.870 1.00 0.28 H new ATOM 0 HB2 SER C1915 2.404 7.809 11.051 1.00 0.36 H new ATOM 0 HB3 SER C1915 1.210 6.853 10.195 1.00 0.36 H new ATOM 0 HG SER C1915 1.348 5.264 11.679 1.00 1.31 H new ATOM 287 N SER C1916 5.075 5.581 11.207 1.00 0.25 N ATOM 288 CA SER C1916 6.448 5.532 11.664 1.00 0.27 C ATOM 289 C SER C1916 7.354 4.997 10.552 1.00 0.27 C ATOM 290 O SER C1916 8.492 5.423 10.396 1.00 0.29 O ATOM 291 CB SER C1916 6.523 4.615 12.883 1.00 0.31 C ATOM 292 OG SER C1916 5.655 5.055 13.916 1.00 1.04 O ATOM 0 H SER C1916 4.481 4.850 11.598 1.00 0.25 H new ATOM 0 HA SER C1916 6.784 6.534 11.931 1.00 0.27 H new ATOM 0 HB2 SER C1916 6.259 3.598 12.592 1.00 0.31 H new ATOM 0 HB3 SER C1916 7.547 4.584 13.255 1.00 0.31 H new ATOM 0 HG SER C1916 5.724 4.448 14.682 1.00 1.04 H new ATOM 298 N LEU C1917 6.808 4.073 9.775 1.00 0.30 N ATOM 299 CA LEU C1917 7.521 3.367 8.729 1.00 0.30 C ATOM 300 C LEU C1917 7.900 4.308 7.605 1.00 0.26 C ATOM 301 O LEU C1917 9.079 4.472 7.291 1.00 0.26 O ATOM 302 CB LEU C1917 6.652 2.217 8.193 1.00 0.42 C ATOM 303 CG LEU C1917 7.367 1.181 7.322 1.00 0.57 C ATOM 304 CD1 LEU C1917 7.175 1.467 5.853 1.00 1.25 C ATOM 305 CD2 LEU C1917 8.829 1.181 7.637 1.00 1.16 C ATOM 0 H LEU C1917 5.832 3.789 9.859 1.00 0.30 H new ATOM 0 HA LEU C1917 8.439 2.956 9.149 1.00 0.30 H new ATOM 0 HB2 LEU C1917 6.204 1.701 9.042 1.00 0.42 H new ATOM 0 HB3 LEU C1917 5.834 2.646 7.614 1.00 0.42 H new ATOM 0 HG LEU C1917 6.935 0.204 7.541 1.00 0.57 H new ATOM 0 HD11 LEU C1917 7.696 0.712 5.264 1.00 1.25 H new ATOM 0 HD12 LEU C1917 6.112 1.444 5.614 1.00 1.25 H new ATOM 0 HD13 LEU C1917 7.578 2.452 5.618 1.00 1.25 H new ATOM 0 HD21 LEU C1917 9.335 0.442 7.015 1.00 1.16 H new ATOM 0 HD22 LEU C1917 9.244 2.169 7.438 1.00 1.16 H new ATOM 0 HD23 LEU C1917 8.975 0.932 8.688 1.00 1.16 H new ATOM 317 N LYS C1918 6.902 4.937 7.012 1.00 0.28 N ATOM 318 CA LYS C1918 7.150 5.885 5.948 1.00 0.29 C ATOM 319 C LYS C1918 7.998 7.055 6.474 1.00 0.32 C ATOM 320 O LYS C1918 8.590 7.805 5.707 1.00 0.38 O ATOM 321 CB LYS C1918 5.819 6.341 5.315 1.00 0.39 C ATOM 322 CG LYS C1918 5.506 7.815 5.432 1.00 0.29 C ATOM 323 CD LYS C1918 4.947 8.162 6.801 1.00 0.40 C ATOM 324 CE LYS C1918 5.678 9.355 7.362 1.00 0.69 C ATOM 325 NZ LYS C1918 4.871 10.126 8.342 1.00 1.36 N ATOM 0 H LYS C1918 5.918 4.808 7.249 1.00 0.28 H new ATOM 0 HA LYS C1918 7.724 5.408 5.154 1.00 0.29 H new ATOM 0 HB2 LYS C1918 5.831 6.074 4.258 1.00 0.39 H new ATOM 0 HB3 LYS C1918 5.007 5.779 5.777 1.00 0.39 H new ATOM 0 HG2 LYS C1918 6.411 8.395 5.250 1.00 0.29 H new ATOM 0 HG3 LYS C1918 4.787 8.097 4.663 1.00 0.29 H new ATOM 0 HD2 LYS C1918 3.882 8.379 6.725 1.00 0.40 H new ATOM 0 HD3 LYS C1918 5.051 7.310 7.473 1.00 0.40 H new ATOM 0 HE2 LYS C1918 6.596 9.018 7.842 1.00 0.69 H new ATOM 0 HE3 LYS C1918 5.970 10.013 6.543 1.00 0.69 H new ATOM 0 HZ1 LYS C1918 5.363 11.012 8.576 1.00 1.36 H new ATOM 0 HZ2 LYS C1918 3.941 10.345 7.931 1.00 1.36 H new ATOM 0 HZ3 LYS C1918 4.743 9.562 9.206 1.00 1.36 H new ATOM 339 N ASN C1919 8.066 7.166 7.805 1.00 0.31 N ATOM 340 CA ASN C1919 8.863 8.180 8.488 1.00 0.33 C ATOM 341 C ASN C1919 10.319 7.740 8.638 1.00 0.32 C ATOM 342 O ASN C1919 11.224 8.562 8.534 1.00 0.41 O ATOM 343 CB ASN C1919 8.253 8.481 9.866 1.00 0.37 C ATOM 344 CG ASN C1919 9.205 9.197 10.809 1.00 0.43 C ATOM 345 OD1 ASN C1919 9.938 8.559 11.568 1.00 1.05 O ATOM 346 ND2 ASN C1919 9.193 10.518 10.784 1.00 1.15 N ATOM 0 H ASN C1919 7.563 6.547 8.441 1.00 0.31 H new ATOM 0 HA ASN C1919 8.852 9.086 7.882 1.00 0.33 H new ATOM 0 HB2 ASN C1919 7.359 9.091 9.733 1.00 0.37 H new ATOM 0 HB3 ASN C1919 7.935 7.545 10.326 1.00 0.37 H new ATOM 0 HD21 ASN C1919 9.805 11.045 11.407 1.00 1.15 H new ATOM 0 HD22 ASN C1919 8.572 11.010 10.142 1.00 1.15 H new ATOM 353 N LYS C1920 10.559 6.445 8.853 1.00 0.28 N ATOM 354 CA LYS C1920 11.921 5.960 8.998 1.00 0.37 C ATOM 355 C LYS C1920 12.541 5.805 7.632 1.00 0.41 C ATOM 356 O LYS C1920 13.752 5.943 7.459 1.00 0.53 O ATOM 357 CB LYS C1920 12.017 4.649 9.810 1.00 0.48 C ATOM 358 CG LYS C1920 10.845 3.674 9.681 1.00 0.33 C ATOM 359 CD LYS C1920 11.029 2.498 10.635 1.00 0.44 C ATOM 360 CE LYS C1920 9.776 1.643 10.736 1.00 1.36 C ATOM 361 NZ LYS C1920 9.956 0.468 11.632 1.00 1.64 N ATOM 0 H LYS C1920 9.837 5.728 8.929 1.00 0.28 H new ATOM 0 HA LYS C1920 12.477 6.700 9.573 1.00 0.37 H new ATOM 0 HB2 LYS C1920 12.927 4.129 9.510 1.00 0.48 H new ATOM 0 HB3 LYS C1920 12.130 4.908 10.863 1.00 0.48 H new ATOM 0 HG2 LYS C1920 9.909 4.188 9.902 1.00 0.33 H new ATOM 0 HG3 LYS C1920 10.775 3.312 8.655 1.00 0.33 H new ATOM 0 HD2 LYS C1920 11.861 1.882 10.294 1.00 0.44 H new ATOM 0 HD3 LYS C1920 11.293 2.872 11.624 1.00 0.44 H new ATOM 0 HE2 LYS C1920 8.952 2.254 11.105 1.00 1.36 H new ATOM 0 HE3 LYS C1920 9.495 1.297 9.741 1.00 1.36 H new ATOM 0 HZ1 LYS C1920 9.443 -0.348 11.242 1.00 1.64 H new ATOM 0 HZ2 LYS C1920 10.968 0.238 11.704 1.00 1.64 H new ATOM 0 HZ3 LYS C1920 9.584 0.692 12.577 1.00 1.64 H new ATOM 375 N LEU C1921 11.695 5.558 6.648 1.00 0.38 N ATOM 376 CA LEU C1921 12.134 5.525 5.271 1.00 0.46 C ATOM 377 C LEU C1921 12.383 6.949 4.784 1.00 0.59 C ATOM 378 O LEU C1921 13.093 7.184 3.810 1.00 0.92 O ATOM 379 CB LEU C1921 11.098 4.818 4.394 1.00 0.44 C ATOM 380 CG LEU C1921 10.715 3.401 4.836 1.00 0.38 C ATOM 381 CD1 LEU C1921 10.120 2.634 3.676 1.00 0.40 C ATOM 382 CD2 LEU C1921 11.907 2.651 5.406 1.00 0.48 C ATOM 0 H LEU C1921 10.700 5.378 6.781 1.00 0.38 H new ATOM 0 HA LEU C1921 13.065 4.962 5.202 1.00 0.46 H new ATOM 0 HB2 LEU C1921 10.195 5.428 4.366 1.00 0.44 H new ATOM 0 HB3 LEU C1921 11.482 4.770 3.375 1.00 0.44 H new ATOM 0 HG LEU C1921 9.970 3.490 5.627 1.00 0.38 H new ATOM 0 HD11 LEU C1921 9.852 1.629 4.003 1.00 0.40 H new ATOM 0 HD12 LEU C1921 9.228 3.149 3.319 1.00 0.40 H new ATOM 0 HD13 LEU C1921 10.850 2.570 2.869 1.00 0.40 H new ATOM 0 HD21 LEU C1921 11.597 1.651 5.708 1.00 0.48 H new ATOM 0 HD22 LEU C1921 12.686 2.575 4.647 1.00 0.48 H new ATOM 0 HD23 LEU C1921 12.295 3.188 6.272 1.00 0.48 H new ATOM 394 N ARG C1922 11.786 7.892 5.493 1.00 0.49 N ATOM 395 CA ARG C1922 11.987 9.311 5.253 1.00 0.66 C ATOM 396 C ARG C1922 13.061 9.888 6.173 1.00 0.65 C ATOM 397 O ARG C1922 13.343 11.084 6.134 1.00 0.78 O ATOM 398 CB ARG C1922 10.671 10.056 5.470 1.00 0.87 C ATOM 399 CG ARG C1922 9.823 10.187 4.219 1.00 1.15 C ATOM 400 CD ARG C1922 10.533 10.987 3.139 1.00 1.07 C ATOM 401 NE ARG C1922 10.967 12.296 3.633 1.00 1.64 N ATOM 402 CZ ARG C1922 10.189 13.379 3.660 1.00 2.45 C ATOM 403 NH1 ARG C1922 8.957 13.332 3.172 1.00 2.92 N ATOM 404 NH2 ARG C1922 10.651 14.509 4.178 1.00 3.23 N ATOM 0 H ARG C1922 11.142 7.692 6.259 1.00 0.49 H new ATOM 0 HA ARG C1922 12.323 9.437 4.224 1.00 0.66 H new ATOM 0 HB2 ARG C1922 10.094 9.537 6.235 1.00 0.87 H new ATOM 0 HB3 ARG C1922 10.888 11.052 5.855 1.00 0.87 H new ATOM 0 HG2 ARG C1922 9.582 9.195 3.837 1.00 1.15 H new ATOM 0 HG3 ARG C1922 8.879 10.671 4.469 1.00 1.15 H new ATOM 0 HD2 ARG C1922 11.398 10.428 2.781 1.00 1.07 H new ATOM 0 HD3 ARG C1922 9.866 11.122 2.288 1.00 1.07 H new ATOM 0 HE ARG C1922 11.923 12.385 3.978 1.00 1.64 H new ATOM 0 HH11 ARG C1922 8.599 12.464 2.773 1.00 2.92 H new ATOM 0 HH12 ARG C1922 8.367 14.164 3.196 1.00 2.92 H new ATOM 0 HH21 ARG C1922 11.598 14.548 4.554 1.00 3.23 H new ATOM 0 HH22 ARG C1922 10.059 15.339 4.200 1.00 3.23 H new ATOM 461 N LEU C1926 17.709 5.866 4.423 1.00 0.64 N ATOM 462 CA LEU C1926 17.226 5.150 3.256 1.00 0.60 C ATOM 463 C LEU C1926 17.969 5.524 1.980 1.00 0.54 C ATOM 464 O LEU C1926 18.304 6.689 1.751 1.00 0.72 O ATOM 465 CB LEU C1926 15.733 5.405 3.058 1.00 0.93 C ATOM 466 CG LEU C1926 14.785 4.439 3.771 1.00 0.48 C ATOM 467 CD1 LEU C1926 13.752 3.945 2.777 1.00 0.56 C ATOM 468 CD2 LEU C1926 15.541 3.268 4.380 1.00 0.57 C ATOM 0 HA LEU C1926 17.409 4.093 3.447 1.00 0.60 H new ATOM 0 HB2 LEU C1926 15.510 6.417 3.396 1.00 0.93 H new ATOM 0 HB3 LEU C1926 15.518 5.371 1.990 1.00 0.93 H new ATOM 0 HG LEU C1926 14.292 4.965 4.588 1.00 0.48 H new ATOM 0 HD11 LEU C1926 13.070 3.255 3.274 1.00 0.56 H new ATOM 0 HD12 LEU C1926 13.189 4.793 2.385 1.00 0.56 H new ATOM 0 HD13 LEU C1926 14.253 3.432 1.956 1.00 0.56 H new ATOM 0 HD21 LEU C1926 14.838 2.601 4.879 1.00 0.57 H new ATOM 0 HD22 LEU C1926 16.063 2.723 3.593 1.00 0.57 H new ATOM 0 HD23 LEU C1926 16.265 3.640 5.105 1.00 0.57 H new ATOM 480 N PRO C1927 18.234 4.517 1.137 1.00 0.46 N ATOM 481 CA PRO C1927 18.778 4.718 -0.203 1.00 0.55 C ATOM 482 C PRO C1927 17.678 5.009 -1.215 1.00 0.63 C ATOM 483 O PRO C1927 17.933 5.505 -2.313 1.00 1.12 O ATOM 484 CB PRO C1927 19.418 3.368 -0.506 1.00 0.54 C ATOM 485 CG PRO C1927 18.572 2.379 0.219 1.00 0.44 C ATOM 486 CD PRO C1927 18.049 3.082 1.444 1.00 0.41 C ATOM 0 HA PRO C1927 19.464 5.563 -0.258 1.00 0.55 H new ATOM 0 HB2 PRO C1927 19.432 3.168 -1.577 1.00 0.54 H new ATOM 0 HB3 PRO C1927 20.452 3.333 -0.162 1.00 0.54 H new ATOM 0 HG2 PRO C1927 17.752 2.034 -0.411 1.00 0.44 H new ATOM 0 HG3 PRO C1927 19.153 1.499 0.495 1.00 0.44 H new ATOM 0 HD2 PRO C1927 17.001 2.844 1.624 1.00 0.41 H new ATOM 0 HD3 PRO C1927 18.600 2.790 2.338 1.00 0.41 H new ATOM 494 N PHE C1928 16.453 4.696 -0.822 1.00 0.30 N ATOM 495 CA PHE C1928 15.309 4.802 -1.701 1.00 0.27 C ATOM 496 C PHE C1928 14.314 5.781 -1.133 1.00 0.27 C ATOM 497 O PHE C1928 14.211 5.937 0.086 1.00 0.31 O ATOM 498 CB PHE C1928 14.682 3.418 -1.909 1.00 0.24 C ATOM 499 CG PHE C1928 13.357 3.198 -1.261 1.00 0.23 C ATOM 500 CD1 PHE C1928 12.266 3.882 -1.711 1.00 0.30 C ATOM 501 CD2 PHE C1928 13.210 2.335 -0.197 1.00 0.26 C ATOM 502 CE1 PHE C1928 11.037 3.711 -1.124 1.00 0.33 C ATOM 503 CE2 PHE C1928 11.997 2.156 0.394 1.00 0.29 C ATOM 504 CZ PHE C1928 10.928 2.739 -0.065 1.00 0.27 C ATOM 0 H PHE C1928 16.229 4.362 0.115 1.00 0.30 H new ATOM 0 HA PHE C1928 15.628 5.176 -2.674 1.00 0.27 H new ATOM 0 HB2 PHE C1928 14.574 3.247 -2.980 1.00 0.24 H new ATOM 0 HB3 PHE C1928 15.377 2.666 -1.535 1.00 0.24 H new ATOM 0 HD1 PHE C1928 12.370 4.567 -2.540 1.00 0.30 H new ATOM 0 HD2 PHE C1928 14.068 1.794 0.173 1.00 0.26 H new ATOM 0 HE1 PHE C1928 10.180 4.285 -1.445 1.00 0.33 H new ATOM 0 HE2 PHE C1928 11.920 1.517 1.261 1.00 0.29 H new ATOM 0 HZ PHE C1928 9.960 2.495 0.347 1.00 0.27 H new ATOM 514 N VAL C1929 13.599 6.451 -2.018 1.00 0.25 N ATOM 515 CA VAL C1929 12.630 7.426 -1.608 1.00 0.25 C ATOM 516 C VAL C1929 11.822 7.946 -2.781 1.00 0.25 C ATOM 517 O VAL C1929 12.275 7.960 -3.924 1.00 0.27 O ATOM 518 CB VAL C1929 13.327 8.579 -0.922 1.00 0.29 C ATOM 519 CG1 VAL C1929 14.352 9.151 -1.865 1.00 0.62 C ATOM 520 CG2 VAL C1929 12.356 9.625 -0.460 1.00 0.62 C ATOM 0 H VAL C1929 13.679 6.330 -3.028 1.00 0.25 H new ATOM 0 HA VAL C1929 11.941 6.940 -0.917 1.00 0.25 H new ATOM 0 HB VAL C1929 13.824 8.213 -0.024 1.00 0.29 H new ATOM 0 HG11 VAL C1929 14.864 9.985 -1.384 1.00 0.62 H new ATOM 0 HG12 VAL C1929 15.078 8.380 -2.124 1.00 0.62 H new ATOM 0 HG13 VAL C1929 13.857 9.503 -2.770 1.00 0.62 H new ATOM 0 HG21 VAL C1929 12.898 10.435 0.027 1.00 0.62 H new ATOM 0 HG22 VAL C1929 11.810 10.018 -1.317 1.00 0.62 H new ATOM 0 HG23 VAL C1929 11.653 9.183 0.246 1.00 0.62 H new ATOM 530 N VAL C1930 10.649 8.415 -2.458 1.00 0.26 N ATOM 531 CA VAL C1930 9.728 8.953 -3.447 1.00 0.26 C ATOM 532 C VAL C1930 10.243 10.258 -4.061 1.00 0.29 C ATOM 533 O VAL C1930 10.683 11.162 -3.350 1.00 0.32 O ATOM 534 CB VAL C1930 8.346 9.217 -2.840 1.00 0.28 C ATOM 535 CG1 VAL C1930 7.410 9.797 -3.882 1.00 0.34 C ATOM 536 CG2 VAL C1930 7.775 7.944 -2.261 1.00 0.32 C ATOM 0 H VAL C1930 10.294 8.439 -1.502 1.00 0.26 H new ATOM 0 HA VAL C1930 9.650 8.196 -4.228 1.00 0.26 H new ATOM 0 HB VAL C1930 8.454 9.944 -2.035 1.00 0.28 H new ATOM 0 HG11 VAL C1930 6.433 9.978 -3.433 1.00 0.34 H new ATOM 0 HG12 VAL C1930 7.818 10.737 -4.255 1.00 0.34 H new ATOM 0 HG13 VAL C1930 7.305 9.094 -4.708 1.00 0.34 H new ATOM 0 HG21 VAL C1930 6.793 8.147 -1.833 1.00 0.32 H new ATOM 0 HG22 VAL C1930 7.680 7.197 -3.049 1.00 0.32 H new ATOM 0 HG23 VAL C1930 8.439 7.568 -1.482 1.00 0.32 H new ATOM 546 N PRO C1931 10.195 10.348 -5.398 1.00 0.34 N ATOM 547 CA PRO C1931 10.496 11.577 -6.140 1.00 0.42 C ATOM 548 C PRO C1931 9.342 12.582 -6.071 1.00 0.45 C ATOM 549 O PRO C1931 8.257 12.251 -5.598 1.00 0.45 O ATOM 550 CB PRO C1931 10.686 11.076 -7.568 1.00 0.56 C ATOM 551 CG PRO C1931 9.818 9.869 -7.656 1.00 0.48 C ATOM 552 CD PRO C1931 9.848 9.235 -6.297 1.00 0.36 C ATOM 0 HA PRO C1931 11.361 12.106 -5.740 1.00 0.42 H new ATOM 0 HB2 PRO C1931 10.391 11.831 -8.297 1.00 0.56 H new ATOM 0 HB3 PRO C1931 11.729 10.831 -7.767 1.00 0.56 H new ATOM 0 HG2 PRO C1931 8.800 10.140 -7.937 1.00 0.48 H new ATOM 0 HG3 PRO C1931 10.185 9.179 -8.416 1.00 0.48 H new ATOM 0 HD2 PRO C1931 8.884 8.797 -6.038 1.00 0.36 H new ATOM 0 HD3 PRO C1931 10.586 8.434 -6.245 1.00 0.36 H new ATOM 560 N ARG C1932 9.569 13.802 -6.550 1.00 0.54 N ATOM 561 CA ARG C1932 8.550 14.849 -6.469 1.00 0.70 C ATOM 562 C ARG C1932 7.369 14.540 -7.376 1.00 0.89 C ATOM 563 O ARG C1932 6.225 14.881 -7.075 1.00 1.79 O ATOM 564 CB ARG C1932 9.127 16.232 -6.796 1.00 0.83 C ATOM 565 CG ARG C1932 9.920 16.865 -5.659 1.00 1.53 C ATOM 566 CD ARG C1932 11.228 16.135 -5.396 1.00 2.00 C ATOM 567 NE ARG C1932 12.128 16.189 -6.547 1.00 2.79 N ATOM 568 CZ ARG C1932 13.164 15.371 -6.721 1.00 3.62 C ATOM 569 NH1 ARG C1932 13.413 14.410 -5.843 1.00 3.88 N ATOM 570 NH2 ARG C1932 13.952 15.511 -7.776 1.00 4.56 N ATOM 0 H ARG C1932 10.440 14.090 -6.995 1.00 0.54 H new ATOM 0 HA ARG C1932 8.197 14.869 -5.438 1.00 0.70 H new ATOM 0 HB2 ARG C1932 9.773 16.146 -7.670 1.00 0.83 H new ATOM 0 HB3 ARG C1932 8.309 16.899 -7.068 1.00 0.83 H new ATOM 0 HG2 ARG C1932 10.129 17.907 -5.900 1.00 1.53 H new ATOM 0 HG3 ARG C1932 9.316 16.863 -4.752 1.00 1.53 H new ATOM 0 HD2 ARG C1932 11.721 16.576 -4.530 1.00 2.00 H new ATOM 0 HD3 ARG C1932 11.019 15.094 -5.148 1.00 2.00 H new ATOM 0 HE ARG C1932 11.951 16.897 -7.260 1.00 2.79 H new ATOM 0 HH11 ARG C1932 12.810 14.294 -5.029 1.00 3.88 H new ATOM 0 HH12 ARG C1932 14.208 13.786 -5.981 1.00 3.88 H new ATOM 0 HH21 ARG C1932 13.766 16.247 -8.457 1.00 4.56 H new ATOM 0 HH22 ARG C1932 14.745 14.883 -7.907 1.00 4.56 H new ATOM 584 N ARG C1933 7.656 13.908 -8.491 1.00 0.74 N ATOM 585 CA ARG C1933 6.622 13.370 -9.350 1.00 0.76 C ATOM 586 C ARG C1933 6.915 11.902 -9.564 1.00 0.65 C ATOM 587 O ARG C1933 8.005 11.452 -9.245 1.00 0.69 O ATOM 588 CB ARG C1933 6.575 14.111 -10.691 1.00 0.95 C ATOM 589 CG ARG C1933 7.886 14.077 -11.461 1.00 1.66 C ATOM 590 CD ARG C1933 7.751 14.725 -12.829 1.00 1.80 C ATOM 591 NE ARG C1933 6.802 14.011 -13.689 1.00 2.56 N ATOM 592 CZ ARG C1933 6.142 14.576 -14.700 1.00 2.86 C ATOM 593 NH1 ARG C1933 6.296 15.867 -14.962 1.00 2.53 N ATOM 594 NH2 ARG C1933 5.322 13.850 -15.451 1.00 3.92 N ATOM 0 H ARG C1933 8.606 13.752 -8.828 1.00 0.74 H new ATOM 0 HA ARG C1933 5.647 13.499 -8.880 1.00 0.76 H new ATOM 0 HB2 ARG C1933 5.791 13.674 -11.309 1.00 0.95 H new ATOM 0 HB3 ARG C1933 6.297 15.150 -10.511 1.00 0.95 H new ATOM 0 HG2 ARG C1933 8.658 14.592 -10.889 1.00 1.66 H new ATOM 0 HG3 ARG C1933 8.213 13.044 -11.578 1.00 1.66 H new ATOM 0 HD2 ARG C1933 7.424 15.758 -12.709 1.00 1.80 H new ATOM 0 HD3 ARG C1933 8.727 14.754 -13.313 1.00 1.80 H new ATOM 0 HE ARG C1933 6.637 13.022 -13.502 1.00 2.56 H new ATOM 0 HH11 ARG C1933 6.922 16.433 -14.389 1.00 2.53 H new ATOM 0 HH12 ARG C1933 5.789 16.294 -15.737 1.00 2.53 H new ATOM 0 HH21 ARG C1933 5.196 12.857 -15.255 1.00 3.92 H new ATOM 0 HH22 ARG C1933 4.818 14.285 -16.224 1.00 3.92 H new ATOM 654 N ALA A 2 1.880 -2.192 -17.666 1.00 0.37 N ATOM 655 CA ALA A 2 2.410 -1.080 -16.897 1.00 0.33 C ATOM 656 C ALA A 2 3.290 -1.623 -15.788 1.00 0.30 C ATOM 657 O ALA A 2 3.009 -2.705 -15.282 1.00 0.39 O ATOM 658 CB ALA A 2 1.277 -0.249 -16.316 1.00 0.33 C ATOM 0 HA ALA A 2 3.001 -0.436 -17.548 1.00 0.33 H new ATOM 0 HB1 ALA A 2 1.691 0.580 -15.743 1.00 0.33 H new ATOM 0 HB2 ALA A 2 0.660 0.142 -17.125 1.00 0.33 H new ATOM 0 HB3 ALA A 2 0.666 -0.872 -15.663 1.00 0.33 H new ATOM 664 N CYS A 3 4.367 -0.902 -15.442 1.00 0.29 N ATOM 665 CA CYS A 3 5.230 -1.271 -14.329 1.00 0.27 C ATOM 666 C CYS A 3 4.385 -1.567 -13.103 1.00 0.22 C ATOM 667 O CYS A 3 3.886 -0.654 -12.445 1.00 0.21 O ATOM 668 CB CYS A 3 6.224 -0.147 -14.036 1.00 0.32 C ATOM 669 SG CYS A 3 7.211 0.353 -15.466 1.00 0.43 S ATOM 0 H CYS A 3 4.656 -0.053 -15.928 1.00 0.29 H new ATOM 0 HA CYS A 3 5.793 -2.166 -14.594 1.00 0.27 H new ATOM 0 HB2 CYS A 3 5.678 0.720 -13.664 1.00 0.32 H new ATOM 0 HB3 CYS A 3 6.895 -0.468 -13.239 1.00 0.32 H new ATOM 0 HG CYS A 3 8.021 1.310 -15.121 1.00 0.43 H new ATOM 675 N PRO A 4 4.206 -2.859 -12.808 1.00 0.20 N ATOM 676 CA PRO A 4 3.246 -3.333 -11.807 1.00 0.18 C ATOM 677 C PRO A 4 3.425 -2.667 -10.458 1.00 0.16 C ATOM 678 O PRO A 4 2.540 -1.952 -9.986 1.00 0.16 O ATOM 679 CB PRO A 4 3.583 -4.819 -11.709 1.00 0.21 C ATOM 680 CG PRO A 4 4.116 -5.160 -13.051 1.00 0.24 C ATOM 681 CD PRO A 4 4.941 -3.975 -13.437 1.00 0.24 C ATOM 0 HA PRO A 4 2.216 -3.115 -12.089 1.00 0.18 H new ATOM 0 HB2 PRO A 4 4.319 -5.010 -10.928 1.00 0.21 H new ATOM 0 HB3 PRO A 4 2.701 -5.412 -11.468 1.00 0.21 H new ATOM 0 HG2 PRO A 4 4.717 -6.069 -13.020 1.00 0.24 H new ATOM 0 HG3 PRO A 4 3.311 -5.333 -13.766 1.00 0.24 H new ATOM 0 HD2 PRO A 4 5.962 -4.051 -13.063 1.00 0.24 H new ATOM 0 HD3 PRO A 4 5.006 -3.860 -14.519 1.00 0.24 H new ATOM 689 N LEU A 5 4.587 -2.867 -9.862 1.00 0.16 N ATOM 690 CA LEU A 5 4.847 -2.359 -8.532 1.00 0.17 C ATOM 691 C LEU A 5 4.872 -0.836 -8.551 1.00 0.19 C ATOM 692 O LEU A 5 4.419 -0.197 -7.611 1.00 0.24 O ATOM 693 CB LEU A 5 6.168 -2.924 -7.997 1.00 0.17 C ATOM 694 CG LEU A 5 6.165 -3.338 -6.517 1.00 0.18 C ATOM 695 CD1 LEU A 5 5.975 -2.137 -5.608 1.00 0.20 C ATOM 696 CD2 LEU A 5 5.081 -4.368 -6.250 1.00 0.20 C ATOM 0 H LEU A 5 5.364 -3.378 -10.280 1.00 0.16 H new ATOM 0 HA LEU A 5 4.047 -2.680 -7.865 1.00 0.17 H new ATOM 0 HB2 LEU A 5 6.440 -3.792 -8.597 1.00 0.17 H new ATOM 0 HB3 LEU A 5 6.948 -2.177 -8.145 1.00 0.17 H new ATOM 0 HG LEU A 5 7.136 -3.782 -6.298 1.00 0.18 H new ATOM 0 HD11 LEU A 5 5.977 -2.464 -4.568 1.00 0.20 H new ATOM 0 HD12 LEU A 5 6.787 -1.428 -5.768 1.00 0.20 H new ATOM 0 HD13 LEU A 5 5.024 -1.656 -5.835 1.00 0.20 H new ATOM 0 HD21 LEU A 5 5.096 -4.647 -5.197 1.00 0.20 H new ATOM 0 HD22 LEU A 5 4.108 -3.945 -6.499 1.00 0.20 H new ATOM 0 HD23 LEU A 5 5.260 -5.252 -6.862 1.00 0.20 H new ATOM 708 N GLU A 6 5.361 -0.258 -9.646 1.00 0.19 N ATOM 709 CA GLU A 6 5.442 1.191 -9.760 1.00 0.23 C ATOM 710 C GLU A 6 4.056 1.817 -9.738 1.00 0.21 C ATOM 711 O GLU A 6 3.800 2.761 -8.987 1.00 0.25 O ATOM 712 CB GLU A 6 6.170 1.611 -11.036 1.00 0.32 C ATOM 713 CG GLU A 6 6.289 3.118 -11.194 1.00 0.47 C ATOM 714 CD GLU A 6 7.109 3.518 -12.399 1.00 0.90 C ATOM 715 OE1 GLU A 6 6.698 3.204 -13.535 1.00 1.39 O ATOM 716 OE2 GLU A 6 8.160 4.167 -12.220 1.00 1.78 O ATOM 0 H GLU A 6 5.704 -0.769 -10.460 1.00 0.19 H new ATOM 0 HA GLU A 6 6.010 1.549 -8.901 1.00 0.23 H new ATOM 0 HB2 GLU A 6 7.168 1.173 -11.037 1.00 0.32 H new ATOM 0 HB3 GLU A 6 5.642 1.203 -11.898 1.00 0.32 H new ATOM 0 HG2 GLU A 6 5.292 3.550 -11.279 1.00 0.47 H new ATOM 0 HG3 GLU A 6 6.742 3.538 -10.296 1.00 0.47 H new ATOM 723 N LYS A 7 3.163 1.288 -10.569 1.00 0.18 N ATOM 724 CA LYS A 7 1.807 1.794 -10.639 1.00 0.20 C ATOM 725 C LYS A 7 1.122 1.703 -9.287 1.00 0.17 C ATOM 726 O LYS A 7 0.373 2.594 -8.926 1.00 0.19 O ATOM 727 CB LYS A 7 1.001 1.051 -11.713 1.00 0.26 C ATOM 728 CG LYS A 7 1.159 1.596 -13.140 1.00 0.41 C ATOM 729 CD LYS A 7 2.445 2.395 -13.362 1.00 0.90 C ATOM 730 CE LYS A 7 2.331 3.829 -12.849 1.00 0.83 C ATOM 731 NZ LYS A 7 1.331 4.628 -13.607 1.00 1.16 N ATOM 0 H LYS A 7 3.359 0.511 -11.200 1.00 0.18 H new ATOM 0 HA LYS A 7 1.855 2.846 -10.920 1.00 0.20 H new ATOM 0 HB2 LYS A 7 1.297 0.002 -11.707 1.00 0.26 H new ATOM 0 HB3 LYS A 7 -0.054 1.086 -11.442 1.00 0.26 H new ATOM 0 HG2 LYS A 7 1.136 0.762 -13.841 1.00 0.41 H new ATOM 0 HG3 LYS A 7 0.304 2.231 -13.372 1.00 0.41 H new ATOM 0 HD2 LYS A 7 3.272 1.896 -12.858 1.00 0.90 H new ATOM 0 HD3 LYS A 7 2.682 2.410 -14.426 1.00 0.90 H new ATOM 0 HE2 LYS A 7 2.055 3.813 -11.795 1.00 0.83 H new ATOM 0 HE3 LYS A 7 3.305 4.314 -12.916 1.00 0.83 H new ATOM 0 HZ1 LYS A 7 1.814 5.397 -14.114 1.00 1.16 H new ATOM 0 HZ2 LYS A 7 0.843 4.015 -14.291 1.00 1.16 H new ATOM 0 HZ3 LYS A 7 0.636 5.031 -12.947 1.00 1.16 H new ATOM 745 N ALA A 8 1.418 0.653 -8.528 1.00 0.18 N ATOM 746 CA ALA A 8 0.824 0.466 -7.204 1.00 0.19 C ATOM 747 C ALA A 8 0.902 1.735 -6.359 1.00 0.17 C ATOM 748 O ALA A 8 -0.083 2.129 -5.738 1.00 0.21 O ATOM 749 CB ALA A 8 1.499 -0.681 -6.476 1.00 0.20 C ATOM 0 H ALA A 8 2.066 -0.084 -8.805 1.00 0.18 H new ATOM 0 HA ALA A 8 -0.229 0.229 -7.354 1.00 0.19 H new ATOM 0 HB1 ALA A 8 1.045 -0.806 -5.493 1.00 0.20 H new ATOM 0 HB2 ALA A 8 1.377 -1.599 -7.051 1.00 0.20 H new ATOM 0 HB3 ALA A 8 2.561 -0.464 -6.360 1.00 0.20 H new ATOM 755 N LEU A 9 2.063 2.377 -6.342 1.00 0.14 N ATOM 756 CA LEU A 9 2.232 3.607 -5.574 1.00 0.14 C ATOM 757 C LEU A 9 1.617 4.797 -6.299 1.00 0.13 C ATOM 758 O LEU A 9 0.875 5.582 -5.704 1.00 0.16 O ATOM 759 CB LEU A 9 3.712 3.889 -5.291 1.00 0.15 C ATOM 760 CG LEU A 9 4.458 2.794 -4.528 1.00 0.16 C ATOM 761 CD1 LEU A 9 3.572 2.204 -3.449 1.00 0.19 C ATOM 762 CD2 LEU A 9 4.951 1.709 -5.461 1.00 0.15 C ATOM 0 H LEU A 9 2.896 2.071 -6.846 1.00 0.14 H new ATOM 0 HA LEU A 9 1.715 3.465 -4.625 1.00 0.14 H new ATOM 0 HB2 LEU A 9 4.220 4.056 -6.241 1.00 0.15 H new ATOM 0 HB3 LEU A 9 3.785 4.817 -4.723 1.00 0.15 H new ATOM 0 HG LEU A 9 5.329 3.249 -4.057 1.00 0.16 H new ATOM 0 HD11 LEU A 9 4.118 1.426 -2.915 1.00 0.19 H new ATOM 0 HD12 LEU A 9 3.280 2.987 -2.750 1.00 0.19 H new ATOM 0 HD13 LEU A 9 2.680 1.774 -3.905 1.00 0.19 H new ATOM 0 HD21 LEU A 9 5.477 0.946 -4.887 1.00 0.15 H new ATOM 0 HD22 LEU A 9 4.102 1.256 -5.973 1.00 0.15 H new ATOM 0 HD23 LEU A 9 5.630 2.142 -6.196 1.00 0.15 H new ATOM 774 N ASP A 10 1.927 4.913 -7.584 1.00 0.14 N ATOM 775 CA ASP A 10 1.437 6.018 -8.406 1.00 0.15 C ATOM 776 C ASP A 10 -0.081 6.108 -8.375 1.00 0.15 C ATOM 777 O ASP A 10 -0.647 7.175 -8.147 1.00 0.18 O ATOM 778 CB ASP A 10 1.919 5.852 -9.850 1.00 0.19 C ATOM 779 CG ASP A 10 1.186 6.752 -10.833 1.00 0.48 C ATOM 780 OD1 ASP A 10 1.333 7.986 -10.754 1.00 1.19 O ATOM 781 OD2 ASP A 10 0.456 6.215 -11.694 1.00 1.18 O ATOM 0 H ASP A 10 2.520 4.251 -8.085 1.00 0.14 H new ATOM 0 HA ASP A 10 1.837 6.943 -7.992 1.00 0.15 H new ATOM 0 HB2 ASP A 10 2.987 6.067 -9.897 1.00 0.19 H new ATOM 0 HB3 ASP A 10 1.789 4.813 -10.152 1.00 0.19 H new ATOM 786 N VAL A 11 -0.738 4.975 -8.562 1.00 0.16 N ATOM 787 CA VAL A 11 -2.183 4.950 -8.693 1.00 0.18 C ATOM 788 C VAL A 11 -2.878 5.254 -7.374 1.00 0.18 C ATOM 789 O VAL A 11 -4.026 5.674 -7.376 1.00 0.23 O ATOM 790 CB VAL A 11 -2.698 3.609 -9.238 1.00 0.20 C ATOM 791 CG1 VAL A 11 -1.992 3.265 -10.539 1.00 0.23 C ATOM 792 CG2 VAL A 11 -2.540 2.504 -8.206 1.00 0.18 C ATOM 0 H VAL A 11 -0.292 4.060 -8.626 1.00 0.16 H new ATOM 0 HA VAL A 11 -2.426 5.732 -9.412 1.00 0.18 H new ATOM 0 HB VAL A 11 -3.764 3.704 -9.447 1.00 0.20 H new ATOM 0 HG11 VAL A 11 -2.366 2.313 -10.915 1.00 0.23 H new ATOM 0 HG12 VAL A 11 -2.184 4.046 -11.275 1.00 0.23 H new ATOM 0 HG13 VAL A 11 -0.919 3.189 -10.362 1.00 0.23 H new ATOM 0 HG21 VAL A 11 -2.912 1.566 -8.618 1.00 0.18 H new ATOM 0 HG22 VAL A 11 -1.487 2.395 -7.948 1.00 0.18 H new ATOM 0 HG23 VAL A 11 -3.108 2.758 -7.311 1.00 0.18 H new ATOM 802 N MET A 12 -2.199 5.037 -6.248 1.00 0.16 N ATOM 803 CA MET A 12 -2.791 5.371 -4.957 1.00 0.20 C ATOM 804 C MET A 12 -3.131 6.851 -4.912 1.00 0.24 C ATOM 805 O MET A 12 -4.281 7.225 -4.715 1.00 0.40 O ATOM 806 CB MET A 12 -1.869 5.025 -3.785 1.00 0.25 C ATOM 807 CG MET A 12 -1.624 3.540 -3.603 1.00 0.17 C ATOM 808 SD MET A 12 -1.069 3.131 -1.937 1.00 0.72 S ATOM 809 CE MET A 12 -0.701 1.396 -2.128 1.00 0.19 C ATOM 0 H MET A 12 -1.260 4.641 -6.204 1.00 0.16 H new ATOM 0 HA MET A 12 -3.696 4.772 -4.854 1.00 0.20 H new ATOM 0 HB2 MET A 12 -0.911 5.524 -3.931 1.00 0.25 H new ATOM 0 HB3 MET A 12 -2.300 5.426 -2.868 1.00 0.25 H new ATOM 0 HG2 MET A 12 -2.542 2.994 -3.821 1.00 0.17 H new ATOM 0 HG3 MET A 12 -0.877 3.207 -4.323 1.00 0.17 H new ATOM 0 HE1 MET A 12 -0.639 0.927 -1.146 1.00 0.19 H new ATOM 0 HE2 MET A 12 -1.490 0.918 -2.709 1.00 0.19 H new ATOM 0 HE3 MET A 12 0.251 1.281 -2.646 1.00 0.19 H new ATOM 819 N VAL A 13 -2.128 7.692 -5.144 1.00 0.17 N ATOM 820 CA VAL A 13 -2.321 9.134 -5.090 1.00 0.19 C ATOM 821 C VAL A 13 -2.957 9.662 -6.381 1.00 0.20 C ATOM 822 O VAL A 13 -3.525 10.753 -6.403 1.00 0.28 O ATOM 823 CB VAL A 13 -0.996 9.880 -4.816 1.00 0.18 C ATOM 824 CG1 VAL A 13 -0.378 9.418 -3.507 1.00 0.21 C ATOM 825 CG2 VAL A 13 -0.016 9.691 -5.957 1.00 0.19 C ATOM 0 H VAL A 13 -1.177 7.400 -5.370 1.00 0.17 H new ATOM 0 HA VAL A 13 -3.001 9.327 -4.260 1.00 0.19 H new ATOM 0 HB VAL A 13 -1.224 10.943 -4.736 1.00 0.18 H new ATOM 0 HG11 VAL A 13 0.554 9.957 -3.335 1.00 0.21 H new ATOM 0 HG12 VAL A 13 -1.069 9.617 -2.688 1.00 0.21 H new ATOM 0 HG13 VAL A 13 -0.175 8.348 -3.558 1.00 0.21 H new ATOM 0 HG21 VAL A 13 0.907 10.227 -5.736 1.00 0.19 H new ATOM 0 HG22 VAL A 13 0.201 8.630 -6.078 1.00 0.19 H new ATOM 0 HG23 VAL A 13 -0.450 10.080 -6.878 1.00 0.19 H new ATOM 835 N SER A 14 -2.866 8.883 -7.453 1.00 0.19 N ATOM 836 CA SER A 14 -3.469 9.260 -8.725 1.00 0.22 C ATOM 837 C SER A 14 -4.982 9.037 -8.680 1.00 0.24 C ATOM 838 O SER A 14 -5.768 9.959 -8.919 1.00 0.28 O ATOM 839 CB SER A 14 -2.840 8.454 -9.865 1.00 0.24 C ATOM 840 OG SER A 14 -3.212 8.969 -11.132 1.00 1.12 O ATOM 0 H SER A 14 -2.380 7.986 -7.466 1.00 0.19 H new ATOM 0 HA SER A 14 -3.282 10.319 -8.904 1.00 0.22 H new ATOM 0 HB2 SER A 14 -1.754 8.471 -9.768 1.00 0.24 H new ATOM 0 HB3 SER A 14 -3.150 7.412 -9.789 1.00 0.24 H new ATOM 0 HG SER A 14 -2.793 8.434 -11.838 1.00 1.12 H new ATOM 846 N THR A 15 -5.383 7.813 -8.343 1.00 0.25 N ATOM 847 CA THR A 15 -6.791 7.468 -8.201 1.00 0.28 C ATOM 848 C THR A 15 -7.398 8.261 -7.044 1.00 0.30 C ATOM 849 O THR A 15 -8.599 8.538 -7.020 1.00 0.33 O ATOM 850 CB THR A 15 -6.970 5.954 -7.970 1.00 0.28 C ATOM 851 OG1 THR A 15 -6.164 5.229 -8.907 1.00 0.34 O ATOM 852 CG2 THR A 15 -8.421 5.529 -8.133 1.00 0.26 C ATOM 0 H THR A 15 -4.744 7.039 -8.162 1.00 0.25 H new ATOM 0 HA THR A 15 -7.309 7.726 -9.125 1.00 0.28 H new ATOM 0 HB THR A 15 -6.661 5.734 -6.948 1.00 0.28 H new ATOM 0 HG1 THR A 15 -5.260 5.119 -8.544 1.00 0.34 H new ATOM 0 HG21 THR A 15 -8.507 4.456 -7.963 1.00 0.26 H new ATOM 0 HG22 THR A 15 -9.040 6.062 -7.411 1.00 0.26 H new ATOM 0 HG23 THR A 15 -8.758 5.764 -9.143 1.00 0.26 H new ATOM 860 N PHE A 16 -6.541 8.608 -6.083 1.00 0.31 N ATOM 861 CA PHE A 16 -6.897 9.513 -4.998 1.00 0.37 C ATOM 862 C PHE A 16 -7.607 10.742 -5.551 1.00 0.42 C ATOM 863 O PHE A 16 -8.783 10.975 -5.270 1.00 0.54 O ATOM 864 CB PHE A 16 -5.629 9.978 -4.280 1.00 0.45 C ATOM 865 CG PHE A 16 -5.601 9.728 -2.806 1.00 0.36 C ATOM 866 CD1 PHE A 16 -6.591 10.226 -1.985 1.00 1.26 C ATOM 867 CD2 PHE A 16 -4.571 8.997 -2.241 1.00 1.24 C ATOM 868 CE1 PHE A 16 -6.554 9.998 -0.625 1.00 1.43 C ATOM 869 CE2 PHE A 16 -4.530 8.769 -0.883 1.00 1.39 C ATOM 870 CZ PHE A 16 -5.523 9.271 -0.074 1.00 0.99 C ATOM 0 H PHE A 16 -5.581 8.267 -6.038 1.00 0.31 H new ATOM 0 HA PHE A 16 -7.554 8.983 -4.308 1.00 0.37 H new ATOM 0 HB2 PHE A 16 -4.772 9.480 -4.733 1.00 0.45 H new ATOM 0 HB3 PHE A 16 -5.505 11.047 -4.453 1.00 0.45 H new ATOM 0 HD1 PHE A 16 -7.402 10.799 -2.410 1.00 1.26 H new ATOM 0 HD2 PHE A 16 -3.790 8.600 -2.872 1.00 1.24 H new ATOM 0 HE1 PHE A 16 -7.335 10.391 0.009 1.00 1.43 H new ATOM 0 HE2 PHE A 16 -3.720 8.197 -0.454 1.00 1.39 H new ATOM 0 HZ PHE A 16 -5.494 9.095 0.991 1.00 0.99 H new ATOM 880 N HIS A 17 -6.874 11.506 -6.362 1.00 0.44 N ATOM 881 CA HIS A 17 -7.379 12.747 -6.954 1.00 0.54 C ATOM 882 C HIS A 17 -8.666 12.511 -7.733 1.00 0.47 C ATOM 883 O HIS A 17 -9.542 13.375 -7.780 1.00 0.52 O ATOM 884 CB HIS A 17 -6.337 13.351 -7.901 1.00 0.72 C ATOM 885 CG HIS A 17 -5.226 14.086 -7.224 1.00 1.09 C ATOM 886 ND1 HIS A 17 -4.332 13.688 -6.291 1.00 2.16 N flip ATOM 887 CD2 HIS A 17 -4.928 15.398 -7.500 1.00 1.23 C flip ATOM 888 CE1 HIS A 17 -3.518 14.759 -6.023 1.00 2.80 C flip ATOM 889 NE2 HIS A 17 -3.901 15.777 -6.769 1.00 2.27 N flip ATOM 0 H HIS A 17 -5.915 11.283 -6.627 1.00 0.44 H new ATOM 0 HA HIS A 17 -7.582 13.435 -6.133 1.00 0.54 H new ATOM 0 HB2 HIS A 17 -5.909 12.551 -8.506 1.00 0.72 H new ATOM 0 HB3 HIS A 17 -6.841 14.033 -8.586 1.00 0.72 H new ATOM 0 HD1 HIS A 17 -4.274 12.763 -5.865 1.00 2.16 H new ATOM 0 HD2 HIS A 17 -5.455 16.022 -8.207 1.00 1.23 H new ATOM 0 HE1 HIS A 17 -2.700 14.767 -5.318 1.00 2.80 H new ATOM 898 N LYS A 18 -8.763 11.337 -8.338 1.00 0.43 N ATOM 899 CA LYS A 18 -9.901 10.975 -9.173 1.00 0.46 C ATOM 900 C LYS A 18 -11.217 11.039 -8.389 1.00 0.44 C ATOM 901 O LYS A 18 -12.265 11.367 -8.951 1.00 0.62 O ATOM 902 CB LYS A 18 -9.678 9.568 -9.744 1.00 0.55 C ATOM 903 CG LYS A 18 -10.755 9.092 -10.703 1.00 0.77 C ATOM 904 CD LYS A 18 -10.456 7.685 -11.201 1.00 0.73 C ATOM 905 CE LYS A 18 -11.561 7.154 -12.097 1.00 1.41 C ATOM 906 NZ LYS A 18 -11.321 5.742 -12.494 1.00 1.69 N ATOM 0 H LYS A 18 -8.055 10.607 -8.265 1.00 0.43 H new ATOM 0 HA LYS A 18 -9.979 11.693 -9.989 1.00 0.46 H new ATOM 0 HB2 LYS A 18 -8.718 9.548 -10.259 1.00 0.55 H new ATOM 0 HB3 LYS A 18 -9.610 8.862 -8.916 1.00 0.55 H new ATOM 0 HG2 LYS A 18 -11.724 9.107 -10.204 1.00 0.77 H new ATOM 0 HG3 LYS A 18 -10.821 9.775 -11.550 1.00 0.77 H new ATOM 0 HD2 LYS A 18 -9.514 7.687 -11.749 1.00 0.73 H new ATOM 0 HD3 LYS A 18 -10.328 7.018 -10.349 1.00 0.73 H new ATOM 0 HE2 LYS A 18 -12.517 7.228 -11.578 1.00 1.41 H new ATOM 0 HE3 LYS A 18 -11.634 7.775 -12.990 1.00 1.41 H new ATOM 0 HZ1 LYS A 18 -12.196 5.337 -12.883 1.00 1.69 H new ATOM 0 HZ2 LYS A 18 -10.573 5.707 -13.216 1.00 1.69 H new ATOM 0 HZ3 LYS A 18 -11.025 5.193 -11.662 1.00 1.69 H new ATOM 920 N TYR A 19 -11.158 10.749 -7.090 1.00 0.37 N ATOM 921 CA TYR A 19 -12.369 10.713 -6.274 1.00 0.41 C ATOM 922 C TYR A 19 -12.318 11.698 -5.111 1.00 0.48 C ATOM 923 O TYR A 19 -13.224 12.492 -4.956 1.00 0.73 O ATOM 924 CB TYR A 19 -12.622 9.300 -5.749 1.00 0.43 C ATOM 925 CG TYR A 19 -12.770 8.281 -6.849 1.00 0.38 C ATOM 926 CD1 TYR A 19 -13.961 8.155 -7.556 1.00 1.18 C ATOM 927 CD2 TYR A 19 -11.713 7.452 -7.190 1.00 1.14 C ATOM 928 CE1 TYR A 19 -14.087 7.227 -8.577 1.00 1.21 C ATOM 929 CE2 TYR A 19 -11.831 6.526 -8.201 1.00 1.14 C ATOM 930 CZ TYR A 19 -13.015 6.417 -8.893 1.00 0.48 C ATOM 931 OH TYR A 19 -13.118 5.506 -9.914 1.00 0.59 O ATOM 0 H TYR A 19 -10.297 10.538 -6.586 1.00 0.37 H new ATOM 0 HA TYR A 19 -13.193 11.013 -6.921 1.00 0.41 H new ATOM 0 HB2 TYR A 19 -11.798 9.007 -5.098 1.00 0.43 H new ATOM 0 HB3 TYR A 19 -13.525 9.301 -5.139 1.00 0.43 H new ATOM 0 HD1 TYR A 19 -14.799 8.789 -7.306 1.00 1.18 H new ATOM 0 HD2 TYR A 19 -10.780 7.534 -6.653 1.00 1.14 H new ATOM 0 HE1 TYR A 19 -15.016 7.138 -9.121 1.00 1.21 H new ATOM 0 HE2 TYR A 19 -10.997 5.887 -8.450 1.00 1.14 H new ATOM 0 HH TYR A 19 -12.267 5.030 -10.015 1.00 0.59 H new ATOM 941 N SER A 20 -11.262 11.658 -4.306 1.00 0.38 N ATOM 942 CA SER A 20 -11.206 12.482 -3.096 1.00 0.45 C ATOM 943 C SER A 20 -11.366 13.968 -3.422 1.00 0.54 C ATOM 944 O SER A 20 -12.074 14.693 -2.720 1.00 0.68 O ATOM 945 CB SER A 20 -9.899 12.239 -2.341 1.00 0.47 C ATOM 946 OG SER A 20 -8.781 12.518 -3.161 1.00 0.52 O ATOM 0 H SER A 20 -10.441 11.073 -4.463 1.00 0.38 H new ATOM 0 HA SER A 20 -12.040 12.189 -2.458 1.00 0.45 H new ATOM 0 HB2 SER A 20 -9.867 12.867 -1.450 1.00 0.47 H new ATOM 0 HB3 SER A 20 -9.857 11.204 -2.003 1.00 0.47 H new ATOM 0 HG SER A 20 -8.942 12.171 -4.063 1.00 0.52 H new ATOM 952 N GLY A 21 -10.738 14.410 -4.512 1.00 0.54 N ATOM 953 CA GLY A 21 -10.838 15.802 -4.924 1.00 0.65 C ATOM 954 C GLY A 21 -12.138 16.096 -5.651 1.00 0.68 C ATOM 955 O GLY A 21 -12.158 16.823 -6.647 1.00 0.82 O ATOM 0 H GLY A 21 -10.161 13.827 -5.118 1.00 0.54 H new ATOM 0 HA2 GLY A 21 -10.762 16.445 -4.047 1.00 0.65 H new ATOM 0 HA3 GLY A 21 -9.998 16.048 -5.573 1.00 0.65 H new ATOM 1057 N LYS A 28 -8.134 12.859 0.755 1.00 0.67 N ATOM 1058 CA LYS A 28 -9.018 12.194 1.707 1.00 0.64 C ATOM 1059 C LYS A 28 -10.394 11.939 1.096 1.00 0.48 C ATOM 1060 O LYS A 28 -11.001 12.823 0.494 1.00 0.54 O ATOM 1061 CB LYS A 28 -9.128 13.010 3.001 1.00 0.87 C ATOM 1062 CG LYS A 28 -9.739 14.387 2.821 1.00 1.00 C ATOM 1063 CD LYS A 28 -11.131 14.444 3.418 1.00 1.04 C ATOM 1064 CE LYS A 28 -11.777 15.804 3.207 1.00 1.55 C ATOM 1065 NZ LYS A 28 -13.102 15.903 3.873 1.00 2.03 N ATOM 0 HA LYS A 28 -8.584 11.225 1.954 1.00 0.64 H new ATOM 0 HB2 LYS A 28 -9.727 12.451 3.720 1.00 0.87 H new ATOM 0 HB3 LYS A 28 -8.133 13.120 3.433 1.00 0.87 H new ATOM 0 HG2 LYS A 28 -9.105 15.135 3.296 1.00 1.00 H new ATOM 0 HG3 LYS A 28 -9.784 14.633 1.760 1.00 1.00 H new ATOM 0 HD2 LYS A 28 -11.753 13.671 2.966 1.00 1.04 H new ATOM 0 HD3 LYS A 28 -11.079 14.227 4.485 1.00 1.04 H new ATOM 0 HE2 LYS A 28 -11.118 16.582 3.594 1.00 1.55 H new ATOM 0 HE3 LYS A 28 -11.894 15.988 2.139 1.00 1.55 H new ATOM 0 HZ1 LYS A 28 -13.812 16.231 3.187 1.00 2.03 H new ATOM 0 HZ2 LYS A 28 -13.378 14.969 4.237 1.00 2.03 H new ATOM 0 HZ3 LYS A 28 -13.045 16.579 4.661 1.00 2.03 H new ATOM 1079 N LEU A 29 -10.877 10.719 1.260 1.00 0.36 N ATOM 1080 CA LEU A 29 -12.133 10.295 0.638 1.00 0.32 C ATOM 1081 C LEU A 29 -13.218 10.061 1.681 1.00 0.34 C ATOM 1082 O LEU A 29 -12.944 9.577 2.776 1.00 0.40 O ATOM 1083 CB LEU A 29 -11.958 8.996 -0.166 1.00 0.30 C ATOM 1084 CG LEU A 29 -11.014 9.056 -1.371 1.00 0.30 C ATOM 1085 CD1 LEU A 29 -9.568 8.976 -0.926 1.00 0.32 C ATOM 1086 CD2 LEU A 29 -11.328 7.935 -2.349 1.00 0.33 C ATOM 0 H LEU A 29 -10.421 9.998 1.819 1.00 0.36 H new ATOM 0 HA LEU A 29 -12.429 11.103 -0.031 1.00 0.32 H new ATOM 0 HB2 LEU A 29 -11.597 8.222 0.511 1.00 0.30 H new ATOM 0 HB3 LEU A 29 -12.940 8.678 -0.518 1.00 0.30 H new ATOM 0 HG LEU A 29 -11.166 10.011 -1.874 1.00 0.30 H new ATOM 0 HD11 LEU A 29 -8.916 9.020 -1.798 1.00 0.32 H new ATOM 0 HD12 LEU A 29 -9.345 9.812 -0.263 1.00 0.32 H new ATOM 0 HD13 LEU A 29 -9.402 8.038 -0.396 1.00 0.32 H new ATOM 0 HD21 LEU A 29 -10.648 7.993 -3.199 1.00 0.33 H new ATOM 0 HD22 LEU A 29 -11.206 6.973 -1.851 1.00 0.33 H new ATOM 0 HD23 LEU A 29 -12.355 8.035 -2.699 1.00 0.33 H new ATOM 1098 N ASN A 30 -14.452 10.396 1.334 1.00 0.35 N ATOM 1099 CA ASN A 30 -15.589 10.055 2.178 1.00 0.35 C ATOM 1100 C ASN A 30 -16.204 8.751 1.671 1.00 0.31 C ATOM 1101 O ASN A 30 -15.667 8.140 0.743 1.00 0.29 O ATOM 1102 CB ASN A 30 -16.635 11.185 2.204 1.00 0.41 C ATOM 1103 CG ASN A 30 -17.516 11.239 0.965 1.00 0.62 C ATOM 1104 OD1 ASN A 30 -18.545 10.567 0.896 1.00 1.20 O ATOM 1105 ND2 ASN A 30 -17.142 12.056 -0.004 1.00 0.63 N ATOM 0 H ASN A 30 -14.691 10.900 0.480 1.00 0.35 H new ATOM 0 HA ASN A 30 -15.244 9.924 3.204 1.00 0.35 H new ATOM 0 HB2 ASN A 30 -17.268 11.061 3.083 1.00 0.41 H new ATOM 0 HB3 ASN A 30 -16.121 12.140 2.314 1.00 0.41 H new ATOM 0 HD21 ASN A 30 -17.713 12.145 -0.845 1.00 0.63 H new ATOM 0 HD22 ASN A 30 -16.282 12.597 0.089 1.00 0.63 H new ATOM 1112 N LYS A 31 -17.311 8.328 2.282 1.00 0.32 N ATOM 1113 CA LYS A 31 -17.997 7.087 1.897 1.00 0.31 C ATOM 1114 C LYS A 31 -18.170 6.970 0.382 1.00 0.30 C ATOM 1115 O LYS A 31 -17.730 5.999 -0.232 1.00 0.31 O ATOM 1116 CB LYS A 31 -19.379 7.017 2.544 1.00 0.35 C ATOM 1117 CG LYS A 31 -19.369 7.065 4.060 1.00 0.45 C ATOM 1118 CD LYS A 31 -20.785 7.028 4.608 1.00 0.56 C ATOM 1119 CE LYS A 31 -20.811 7.223 6.114 1.00 1.22 C ATOM 1120 NZ LYS A 31 -22.201 7.314 6.639 1.00 1.70 N ATOM 0 H LYS A 31 -17.757 8.828 3.051 1.00 0.32 H new ATOM 0 HA LYS A 31 -17.370 6.265 2.244 1.00 0.31 H new ATOM 0 HB2 LYS A 31 -19.983 7.844 2.171 1.00 0.35 H new ATOM 0 HB3 LYS A 31 -19.869 6.097 2.226 1.00 0.35 H new ATOM 0 HG2 LYS A 31 -18.800 6.222 4.452 1.00 0.45 H new ATOM 0 HG3 LYS A 31 -18.867 7.972 4.397 1.00 0.45 H new ATOM 0 HD2 LYS A 31 -21.380 7.806 4.130 1.00 0.56 H new ATOM 0 HD3 LYS A 31 -21.247 6.073 4.357 1.00 0.56 H new ATOM 0 HE2 LYS A 31 -20.295 6.393 6.596 1.00 1.22 H new ATOM 0 HE3 LYS A 31 -20.266 8.131 6.372 1.00 1.22 H new ATOM 0 HZ1 LYS A 31 -22.175 7.447 7.670 1.00 1.70 H new ATOM 0 HZ2 LYS A 31 -22.686 8.121 6.198 1.00 1.70 H new ATOM 0 HZ3 LYS A 31 -22.714 6.438 6.416 1.00 1.70 H new ATOM 1134 N SER A 32 -18.794 7.980 -0.210 1.00 0.32 N ATOM 1135 CA SER A 32 -19.160 7.955 -1.623 1.00 0.34 C ATOM 1136 C SER A 32 -17.928 7.925 -2.531 1.00 0.31 C ATOM 1137 O SER A 32 -17.996 7.447 -3.666 1.00 0.34 O ATOM 1138 CB SER A 32 -20.023 9.177 -1.943 1.00 0.43 C ATOM 1139 OG SER A 32 -20.436 9.189 -3.299 1.00 1.29 O ATOM 0 H SER A 32 -19.061 8.838 0.273 1.00 0.32 H new ATOM 0 HA SER A 32 -19.724 7.042 -1.813 1.00 0.34 H new ATOM 0 HB2 SER A 32 -20.900 9.182 -1.296 1.00 0.43 H new ATOM 0 HB3 SER A 32 -19.461 10.086 -1.726 1.00 0.43 H new ATOM 0 HG SER A 32 -20.986 9.983 -3.466 1.00 1.29 H new ATOM 1145 N GLU A 33 -16.801 8.414 -2.035 1.00 0.30 N ATOM 1146 CA GLU A 33 -15.588 8.454 -2.836 1.00 0.31 C ATOM 1147 C GLU A 33 -14.948 7.079 -2.874 1.00 0.26 C ATOM 1148 O GLU A 33 -14.525 6.608 -3.929 1.00 0.27 O ATOM 1149 CB GLU A 33 -14.612 9.486 -2.283 1.00 0.37 C ATOM 1150 CG GLU A 33 -15.211 10.878 -2.142 1.00 0.51 C ATOM 1151 CD GLU A 33 -15.648 11.499 -3.461 1.00 0.88 C ATOM 1152 OE1 GLU A 33 -15.991 10.754 -4.414 1.00 1.68 O ATOM 1153 OE2 GLU A 33 -15.655 12.743 -3.543 1.00 1.46 O ATOM 0 H GLU A 33 -16.702 8.785 -1.090 1.00 0.30 H new ATOM 0 HA GLU A 33 -15.849 8.748 -3.853 1.00 0.31 H new ATOM 0 HB2 GLU A 33 -14.257 9.152 -1.308 1.00 0.37 H new ATOM 0 HB3 GLU A 33 -13.742 9.539 -2.938 1.00 0.37 H new ATOM 0 HG2 GLU A 33 -16.071 10.827 -1.474 1.00 0.51 H new ATOM 0 HG3 GLU A 33 -14.478 11.532 -1.669 1.00 0.51 H new ATOM 1160 N LEU A 34 -14.893 6.431 -1.716 1.00 0.23 N ATOM 1161 CA LEU A 34 -14.429 5.056 -1.635 1.00 0.20 C ATOM 1162 C LEU A 34 -15.390 4.143 -2.375 1.00 0.20 C ATOM 1163 O LEU A 34 -14.976 3.173 -3.009 1.00 0.23 O ATOM 1164 CB LEU A 34 -14.296 4.620 -0.180 1.00 0.18 C ATOM 1165 CG LEU A 34 -13.032 5.111 0.521 1.00 0.18 C ATOM 1166 CD1 LEU A 34 -13.138 4.876 2.013 1.00 0.21 C ATOM 1167 CD2 LEU A 34 -11.812 4.406 -0.042 1.00 0.18 C ATOM 0 H LEU A 34 -15.165 6.838 -0.821 1.00 0.23 H new ATOM 0 HA LEU A 34 -13.446 4.989 -2.102 1.00 0.20 H new ATOM 0 HB2 LEU A 34 -15.164 4.978 0.373 1.00 0.18 H new ATOM 0 HB3 LEU A 34 -14.319 3.531 -0.138 1.00 0.18 H new ATOM 0 HG LEU A 34 -12.925 6.181 0.345 1.00 0.18 H new ATOM 0 HD11 LEU A 34 -12.231 5.230 2.502 1.00 0.21 H new ATOM 0 HD12 LEU A 34 -13.998 5.418 2.407 1.00 0.21 H new ATOM 0 HD13 LEU A 34 -13.262 3.810 2.206 1.00 0.21 H new ATOM 0 HD21 LEU A 34 -10.917 4.765 0.466 1.00 0.18 H new ATOM 0 HD22 LEU A 34 -11.910 3.331 0.111 1.00 0.18 H new ATOM 0 HD23 LEU A 34 -11.731 4.614 -1.109 1.00 0.18 H new ATOM 1179 N LYS A 35 -16.676 4.471 -2.291 1.00 0.23 N ATOM 1180 CA LYS A 35 -17.707 3.795 -3.034 1.00 0.29 C ATOM 1181 C LYS A 35 -17.303 3.672 -4.497 1.00 0.25 C ATOM 1182 O LYS A 35 -17.169 2.570 -5.015 1.00 0.27 O ATOM 1183 CB LYS A 35 -19.000 4.599 -2.896 1.00 0.42 C ATOM 1184 CG LYS A 35 -20.178 4.036 -3.649 1.00 0.60 C ATOM 1185 CD LYS A 35 -20.821 2.882 -2.909 1.00 0.71 C ATOM 1186 CE LYS A 35 -22.022 2.401 -3.675 1.00 0.53 C ATOM 1187 NZ LYS A 35 -22.700 1.254 -3.013 1.00 0.89 N ATOM 0 H LYS A 35 -17.024 5.223 -1.696 1.00 0.23 H new ATOM 0 HA LYS A 35 -17.856 2.788 -2.644 1.00 0.29 H new ATOM 0 HB2 LYS A 35 -19.260 4.664 -1.839 1.00 0.42 H new ATOM 0 HB3 LYS A 35 -18.818 5.616 -3.243 1.00 0.42 H new ATOM 0 HG2 LYS A 35 -20.916 4.822 -3.808 1.00 0.60 H new ATOM 0 HG3 LYS A 35 -19.853 3.700 -4.634 1.00 0.60 H new ATOM 0 HD2 LYS A 35 -20.105 2.070 -2.788 1.00 0.71 H new ATOM 0 HD3 LYS A 35 -21.117 3.198 -1.909 1.00 0.71 H new ATOM 0 HE2 LYS A 35 -22.730 3.222 -3.786 1.00 0.53 H new ATOM 0 HE3 LYS A 35 -21.715 2.107 -4.679 1.00 0.53 H new ATOM 0 HZ1 LYS A 35 -23.729 1.342 -3.135 1.00 0.89 H new ATOM 0 HZ2 LYS A 35 -22.375 0.364 -3.442 1.00 0.89 H new ATOM 0 HZ3 LYS A 35 -22.471 1.254 -1.999 1.00 0.89 H new ATOM 1201 N GLU A 36 -17.073 4.803 -5.148 1.00 0.25 N ATOM 1202 CA GLU A 36 -16.683 4.796 -6.549 1.00 0.28 C ATOM 1203 C GLU A 36 -15.276 4.246 -6.744 1.00 0.28 C ATOM 1204 O GLU A 36 -15.010 3.568 -7.731 1.00 0.34 O ATOM 1205 CB GLU A 36 -16.795 6.191 -7.149 1.00 0.32 C ATOM 1206 CG GLU A 36 -18.210 6.567 -7.521 1.00 0.66 C ATOM 1207 CD GLU A 36 -18.329 7.979 -8.043 1.00 0.77 C ATOM 1208 OE1 GLU A 36 -18.516 8.907 -7.233 1.00 1.28 O ATOM 1209 OE2 GLU A 36 -18.248 8.172 -9.272 1.00 1.49 O ATOM 0 H GLU A 36 -17.149 5.731 -4.731 1.00 0.25 H new ATOM 0 HA GLU A 36 -17.372 4.133 -7.072 1.00 0.28 H new ATOM 0 HB2 GLU A 36 -16.408 6.919 -6.435 1.00 0.32 H new ATOM 0 HB3 GLU A 36 -16.165 6.249 -8.037 1.00 0.32 H new ATOM 0 HG2 GLU A 36 -18.577 5.874 -8.278 1.00 0.66 H new ATOM 0 HG3 GLU A 36 -18.852 6.454 -6.647 1.00 0.66 H new ATOM 1216 N LEU A 37 -14.382 4.531 -5.802 1.00 0.25 N ATOM 1217 CA LEU A 37 -13.018 4.012 -5.859 1.00 0.27 C ATOM 1218 C LEU A 37 -13.038 2.505 -6.068 1.00 0.23 C ATOM 1219 O LEU A 37 -12.504 1.991 -7.054 1.00 0.24 O ATOM 1220 CB LEU A 37 -12.273 4.338 -4.562 1.00 0.32 C ATOM 1221 CG LEU A 37 -10.759 4.130 -4.605 1.00 0.40 C ATOM 1222 CD1 LEU A 37 -10.046 5.418 -4.998 1.00 0.33 C ATOM 1223 CD2 LEU A 37 -10.261 3.623 -3.266 1.00 0.74 C ATOM 0 H LEU A 37 -14.576 5.118 -4.991 1.00 0.25 H new ATOM 0 HA LEU A 37 -12.503 4.484 -6.696 1.00 0.27 H new ATOM 0 HB2 LEU A 37 -12.473 5.377 -4.300 1.00 0.32 H new ATOM 0 HB3 LEU A 37 -12.685 3.723 -3.762 1.00 0.32 H new ATOM 0 HG LEU A 37 -10.534 3.380 -5.363 1.00 0.40 H new ATOM 0 HD11 LEU A 37 -8.970 5.246 -5.022 1.00 0.33 H new ATOM 0 HD12 LEU A 37 -10.385 5.735 -5.984 1.00 0.33 H new ATOM 0 HD13 LEU A 37 -10.273 6.196 -4.269 1.00 0.33 H new ATOM 0 HD21 LEU A 37 -9.181 3.479 -3.310 1.00 0.74 H new ATOM 0 HD22 LEU A 37 -10.499 4.351 -2.490 1.00 0.74 H new ATOM 0 HD23 LEU A 37 -10.744 2.674 -3.034 1.00 0.74 H new ATOM 1235 N LEU A 38 -13.697 1.810 -5.153 1.00 0.20 N ATOM 1236 CA LEU A 38 -13.755 0.362 -5.195 1.00 0.20 C ATOM 1237 C LEU A 38 -14.655 -0.144 -6.320 1.00 0.22 C ATOM 1238 O LEU A 38 -14.325 -1.115 -6.981 1.00 0.24 O ATOM 1239 CB LEU A 38 -14.215 -0.194 -3.846 1.00 0.19 C ATOM 1240 CG LEU A 38 -13.155 -0.170 -2.742 1.00 0.18 C ATOM 1241 CD1 LEU A 38 -13.489 0.869 -1.689 1.00 0.19 C ATOM 1242 CD2 LEU A 38 -13.029 -1.538 -2.106 1.00 0.21 C ATOM 0 H LEU A 38 -14.200 2.230 -4.371 1.00 0.20 H new ATOM 0 HA LEU A 38 -12.747 0.002 -5.401 1.00 0.20 H new ATOM 0 HB2 LEU A 38 -15.081 0.377 -3.511 1.00 0.19 H new ATOM 0 HB3 LEU A 38 -14.547 -1.222 -3.988 1.00 0.19 H new ATOM 0 HG LEU A 38 -12.201 0.099 -3.194 1.00 0.18 H new ATOM 0 HD11 LEU A 38 -12.720 0.865 -0.917 1.00 0.19 H new ATOM 0 HD12 LEU A 38 -13.533 1.855 -2.152 1.00 0.19 H new ATOM 0 HD13 LEU A 38 -14.455 0.635 -1.241 1.00 0.19 H new ATOM 0 HD21 LEU A 38 -12.272 -1.507 -1.323 1.00 0.21 H new ATOM 0 HD22 LEU A 38 -13.987 -1.828 -1.674 1.00 0.21 H new ATOM 0 HD23 LEU A 38 -12.738 -2.266 -2.863 1.00 0.21 H new ATOM 1254 N THR A 39 -15.772 0.520 -6.560 1.00 0.23 N ATOM 1255 CA THR A 39 -16.719 0.047 -7.575 1.00 0.26 C ATOM 1256 C THR A 39 -16.115 0.107 -8.975 1.00 0.27 C ATOM 1257 O THR A 39 -16.429 -0.718 -9.834 1.00 0.30 O ATOM 1258 CB THR A 39 -18.041 0.843 -7.569 1.00 0.29 C ATOM 1259 OG1 THR A 39 -17.772 2.245 -7.606 1.00 0.33 O ATOM 1260 CG2 THR A 39 -18.877 0.514 -6.342 1.00 0.30 C ATOM 0 H THR A 39 -16.050 1.375 -6.079 1.00 0.23 H new ATOM 0 HA THR A 39 -16.937 -0.988 -7.314 1.00 0.26 H new ATOM 0 HB THR A 39 -18.607 0.558 -8.456 1.00 0.29 H new ATOM 0 HG1 THR A 39 -17.667 2.582 -6.692 1.00 0.33 H new ATOM 0 HG21 THR A 39 -19.802 1.090 -6.367 1.00 0.30 H new ATOM 0 HG22 THR A 39 -19.113 -0.550 -6.337 1.00 0.30 H new ATOM 0 HG23 THR A 39 -18.316 0.766 -5.442 1.00 0.30 H new ATOM 1268 N ARG A 40 -15.243 1.080 -9.197 1.00 0.27 N ATOM 1269 CA ARG A 40 -14.637 1.273 -10.501 1.00 0.30 C ATOM 1270 C ARG A 40 -13.403 0.396 -10.686 1.00 0.29 C ATOM 1271 O ARG A 40 -13.374 -0.463 -11.567 1.00 0.33 O ATOM 1272 CB ARG A 40 -14.262 2.739 -10.703 1.00 0.34 C ATOM 1273 CG ARG A 40 -15.451 3.685 -10.730 1.00 0.36 C ATOM 1274 CD ARG A 40 -16.402 3.367 -11.867 1.00 0.47 C ATOM 1275 NE ARG A 40 -15.731 3.381 -13.166 1.00 0.67 N ATOM 1276 CZ ARG A 40 -16.358 3.224 -14.328 1.00 0.90 C ATOM 1277 NH1 ARG A 40 -17.680 3.089 -14.360 1.00 1.24 N ATOM 1278 NH2 ARG A 40 -15.660 3.206 -15.456 1.00 1.09 N ATOM 0 H ARG A 40 -14.941 1.748 -8.488 1.00 0.27 H new ATOM 0 HA ARG A 40 -15.375 0.981 -11.248 1.00 0.30 H new ATOM 0 HB2 ARG A 40 -13.587 3.044 -9.903 1.00 0.34 H new ATOM 0 HB3 ARG A 40 -13.712 2.837 -11.639 1.00 0.34 H new ATOM 0 HG2 ARG A 40 -15.985 3.623 -9.782 1.00 0.36 H new ATOM 0 HG3 ARG A 40 -15.096 4.711 -10.830 1.00 0.36 H new ATOM 0 HD2 ARG A 40 -16.850 2.387 -11.701 1.00 0.47 H new ATOM 0 HD3 ARG A 40 -17.216 4.092 -11.872 1.00 0.47 H new ATOM 0 HE ARG A 40 -14.721 3.520 -13.182 1.00 0.67 H new ATOM 0 HH11 ARG A 40 -18.216 3.106 -13.492 1.00 1.24 H new ATOM 0 HH12 ARG A 40 -18.159 2.969 -15.253 1.00 1.24 H new ATOM 0 HH21 ARG A 40 -14.646 3.312 -15.430 1.00 1.09 H new ATOM 0 HH22 ARG A 40 -16.137 3.086 -16.349 1.00 1.09 H new ATOM 1292 N GLU A 41 -12.383 0.614 -9.863 1.00 0.29 N ATOM 1293 CA GLU A 41 -11.106 -0.061 -10.058 1.00 0.32 C ATOM 1294 C GLU A 41 -10.894 -1.250 -9.122 1.00 0.35 C ATOM 1295 O GLU A 41 -9.946 -2.004 -9.302 1.00 0.46 O ATOM 1296 CB GLU A 41 -9.943 0.915 -9.917 1.00 0.38 C ATOM 1297 CG GLU A 41 -9.596 1.655 -11.199 1.00 0.47 C ATOM 1298 CD GLU A 41 -10.637 2.680 -11.604 1.00 0.83 C ATOM 1299 OE1 GLU A 41 -10.848 3.658 -10.855 1.00 1.54 O ATOM 1300 OE2 GLU A 41 -11.233 2.523 -12.692 1.00 1.60 O ATOM 0 H GLU A 41 -12.414 1.246 -9.063 1.00 0.29 H new ATOM 0 HA GLU A 41 -11.137 -0.455 -11.074 1.00 0.32 H new ATOM 0 HB2 GLU A 41 -10.186 1.644 -9.144 1.00 0.38 H new ATOM 0 HB3 GLU A 41 -9.064 0.369 -9.576 1.00 0.38 H new ATOM 0 HG2 GLU A 41 -8.635 2.154 -11.073 1.00 0.47 H new ATOM 0 HG3 GLU A 41 -9.476 0.932 -12.006 1.00 0.47 H new ATOM 1307 N LEU A 42 -11.753 -1.435 -8.129 1.00 0.28 N ATOM 1308 CA LEU A 42 -11.603 -2.586 -7.233 1.00 0.29 C ATOM 1309 C LEU A 42 -12.854 -3.487 -7.210 1.00 0.28 C ATOM 1310 O LEU A 42 -13.207 -3.995 -6.148 1.00 0.26 O ATOM 1311 CB LEU A 42 -11.300 -2.136 -5.791 1.00 0.27 C ATOM 1312 CG LEU A 42 -10.031 -1.306 -5.585 1.00 0.27 C ATOM 1313 CD1 LEU A 42 -10.303 0.180 -5.783 1.00 0.27 C ATOM 1314 CD2 LEU A 42 -9.459 -1.564 -4.202 1.00 0.31 C ATOM 0 H LEU A 42 -12.543 -0.824 -7.922 1.00 0.28 H new ATOM 0 HA LEU A 42 -10.766 -3.161 -7.630 1.00 0.29 H new ATOM 0 HB2 LEU A 42 -12.149 -1.556 -5.430 1.00 0.27 H new ATOM 0 HB3 LEU A 42 -11.231 -3.025 -5.164 1.00 0.27 H new ATOM 0 HG LEU A 42 -9.300 -1.611 -6.334 1.00 0.27 H new ATOM 0 HD11 LEU A 42 -9.382 0.742 -5.630 1.00 0.27 H new ATOM 0 HD12 LEU A 42 -10.668 0.351 -6.796 1.00 0.27 H new ATOM 0 HD13 LEU A 42 -11.054 0.511 -5.066 1.00 0.27 H new ATOM 0 HD21 LEU A 42 -8.556 -0.969 -4.065 1.00 0.31 H new ATOM 0 HD22 LEU A 42 -10.194 -1.287 -3.447 1.00 0.31 H new ATOM 0 HD23 LEU A 42 -9.215 -2.622 -4.101 1.00 0.31 H new ATOM 1326 N PRO A 43 -13.528 -3.753 -8.359 1.00 0.32 N ATOM 1327 CA PRO A 43 -14.776 -4.524 -8.358 1.00 0.34 C ATOM 1328 C PRO A 43 -14.522 -5.980 -8.001 1.00 0.35 C ATOM 1329 O PRO A 43 -15.395 -6.675 -7.480 1.00 0.38 O ATOM 1330 CB PRO A 43 -15.298 -4.408 -9.797 1.00 0.43 C ATOM 1331 CG PRO A 43 -14.447 -3.373 -10.454 1.00 0.52 C ATOM 1332 CD PRO A 43 -13.136 -3.388 -9.726 1.00 0.36 C ATOM 0 HA PRO A 43 -15.487 -4.150 -7.621 1.00 0.34 H new ATOM 0 HB2 PRO A 43 -15.225 -5.363 -10.318 1.00 0.43 H new ATOM 0 HB3 PRO A 43 -16.348 -4.117 -9.810 1.00 0.43 H new ATOM 0 HG2 PRO A 43 -14.308 -3.597 -11.512 1.00 0.52 H new ATOM 0 HG3 PRO A 43 -14.914 -2.390 -10.395 1.00 0.52 H new ATOM 0 HD2 PRO A 43 -12.443 -4.112 -10.155 1.00 0.36 H new ATOM 0 HD3 PRO A 43 -12.643 -2.416 -9.760 1.00 0.36 H new ATOM 1340 N SER A 44 -13.306 -6.421 -8.282 1.00 0.37 N ATOM 1341 CA SER A 44 -12.872 -7.761 -7.944 1.00 0.41 C ATOM 1342 C SER A 44 -12.752 -7.896 -6.430 1.00 0.37 C ATOM 1343 O SER A 44 -12.976 -8.964 -5.868 1.00 0.42 O ATOM 1344 CB SER A 44 -11.526 -8.033 -8.614 1.00 0.48 C ATOM 1345 OG SER A 44 -11.559 -7.652 -9.983 1.00 1.09 O ATOM 0 H SER A 44 -12.595 -5.859 -8.750 1.00 0.37 H new ATOM 0 HA SER A 44 -13.602 -8.489 -8.299 1.00 0.41 H new ATOM 0 HB2 SER A 44 -10.739 -7.483 -8.097 1.00 0.48 H new ATOM 0 HB3 SER A 44 -11.281 -9.092 -8.532 1.00 0.48 H new ATOM 0 HG SER A 44 -10.709 -7.229 -10.225 1.00 1.09 H new ATOM 1351 N PHE A 45 -12.446 -6.777 -5.788 1.00 0.33 N ATOM 1352 CA PHE A 45 -12.214 -6.725 -4.351 1.00 0.34 C ATOM 1353 C PHE A 45 -13.493 -6.348 -3.614 1.00 0.36 C ATOM 1354 O PHE A 45 -13.460 -5.948 -2.452 1.00 0.40 O ATOM 1355 CB PHE A 45 -11.099 -5.725 -4.039 1.00 0.33 C ATOM 1356 CG PHE A 45 -9.795 -6.085 -4.696 1.00 0.35 C ATOM 1357 CD1 PHE A 45 -8.967 -7.038 -4.131 1.00 1.17 C ATOM 1358 CD2 PHE A 45 -9.409 -5.484 -5.884 1.00 1.31 C ATOM 1359 CE1 PHE A 45 -7.774 -7.386 -4.736 1.00 1.15 C ATOM 1360 CE2 PHE A 45 -8.220 -5.830 -6.495 1.00 1.36 C ATOM 1361 CZ PHE A 45 -7.401 -6.782 -5.921 1.00 0.46 C ATOM 0 H PHE A 45 -12.351 -5.874 -6.253 1.00 0.33 H new ATOM 0 HA PHE A 45 -11.906 -7.713 -4.010 1.00 0.34 H new ATOM 0 HB2 PHE A 45 -11.405 -4.732 -4.368 1.00 0.33 H new ATOM 0 HB3 PHE A 45 -10.955 -5.673 -2.960 1.00 0.33 H new ATOM 0 HD1 PHE A 45 -9.256 -7.516 -3.206 1.00 1.17 H new ATOM 0 HD2 PHE A 45 -10.045 -4.737 -6.336 1.00 1.31 H new ATOM 0 HE1 PHE A 45 -7.134 -8.129 -4.283 1.00 1.15 H new ATOM 0 HE2 PHE A 45 -7.931 -5.356 -7.421 1.00 1.36 H new ATOM 0 HZ PHE A 45 -6.471 -7.054 -6.398 1.00 0.46 H new ATOM 1371 N LEU A 46 -14.612 -6.427 -4.318 1.00 0.36 N ATOM 1372 CA LEU A 46 -15.902 -6.103 -3.729 1.00 0.40 C ATOM 1373 C LEU A 46 -16.830 -7.303 -3.693 1.00 0.55 C ATOM 1374 O LEU A 46 -17.915 -7.236 -3.118 1.00 0.70 O ATOM 1375 CB LEU A 46 -16.569 -4.980 -4.509 1.00 0.35 C ATOM 1376 CG LEU A 46 -15.844 -3.647 -4.445 1.00 0.32 C ATOM 1377 CD1 LEU A 46 -16.624 -2.586 -5.201 1.00 0.34 C ATOM 1378 CD2 LEU A 46 -15.640 -3.240 -2.999 1.00 0.30 C ATOM 0 H LEU A 46 -14.653 -6.712 -5.296 1.00 0.36 H new ATOM 0 HA LEU A 46 -15.715 -5.787 -2.703 1.00 0.40 H new ATOM 0 HB2 LEU A 46 -16.655 -5.282 -5.553 1.00 0.35 H new ATOM 0 HB3 LEU A 46 -17.583 -4.846 -4.131 1.00 0.35 H new ATOM 0 HG LEU A 46 -14.867 -3.749 -4.917 1.00 0.32 H new ATOM 0 HD11 LEU A 46 -16.093 -1.636 -5.147 1.00 0.34 H new ATOM 0 HD12 LEU A 46 -16.728 -2.885 -6.244 1.00 0.34 H new ATOM 0 HD13 LEU A 46 -17.613 -2.475 -4.756 1.00 0.34 H new ATOM 0 HD21 LEU A 46 -15.119 -2.283 -2.960 1.00 0.30 H new ATOM 0 HD22 LEU A 46 -16.608 -3.146 -2.507 1.00 0.30 H new ATOM 0 HD23 LEU A 46 -15.045 -3.997 -2.488 1.00 0.30 H new ATOM 1390 N GLY A 47 -16.418 -8.396 -4.319 1.00 0.64 N ATOM 1391 CA GLY A 47 -17.293 -9.548 -4.437 1.00 0.82 C ATOM 1392 C GLY A 47 -18.534 -9.242 -5.259 1.00 0.87 C ATOM 1393 O GLY A 47 -19.540 -9.948 -5.160 1.00 1.23 O ATOM 0 H GLY A 47 -15.498 -8.507 -4.746 1.00 0.64 H new ATOM 0 HA2 GLY A 47 -16.747 -10.371 -4.898 1.00 0.82 H new ATOM 0 HA3 GLY A 47 -17.590 -9.880 -3.442 1.00 0.82 H new ATOM 1397 N LYS A 48 -18.458 -8.162 -6.042 1.00 0.79 N ATOM 1398 CA LYS A 48 -19.519 -7.743 -6.969 1.00 0.95 C ATOM 1399 C LYS A 48 -20.740 -7.143 -6.255 1.00 0.73 C ATOM 1400 O LYS A 48 -21.339 -6.189 -6.756 1.00 0.97 O ATOM 1401 CB LYS A 48 -19.945 -8.897 -7.884 1.00 1.43 C ATOM 1402 CG LYS A 48 -18.802 -9.474 -8.709 1.00 2.17 C ATOM 1403 CD LYS A 48 -18.061 -8.388 -9.475 1.00 2.32 C ATOM 1404 CE LYS A 48 -16.930 -8.961 -10.315 1.00 2.88 C ATOM 1405 NZ LYS A 48 -17.434 -9.842 -11.402 1.00 3.51 N ATOM 0 H LYS A 48 -17.647 -7.544 -6.052 1.00 0.79 H new ATOM 0 HA LYS A 48 -19.089 -6.949 -7.580 1.00 0.95 H new ATOM 0 HB2 LYS A 48 -20.380 -9.690 -7.276 1.00 1.43 H new ATOM 0 HB3 LYS A 48 -20.727 -8.546 -8.557 1.00 1.43 H new ATOM 0 HG2 LYS A 48 -18.106 -9.996 -8.053 1.00 2.17 H new ATOM 0 HG3 LYS A 48 -19.194 -10.211 -9.410 1.00 2.17 H new ATOM 0 HD2 LYS A 48 -18.760 -7.857 -10.121 1.00 2.32 H new ATOM 0 HD3 LYS A 48 -17.658 -7.658 -8.773 1.00 2.32 H new ATOM 0 HE2 LYS A 48 -16.351 -8.145 -10.749 1.00 2.88 H new ATOM 0 HE3 LYS A 48 -16.253 -9.527 -9.674 1.00 2.88 H new ATOM 0 HZ1 LYS A 48 -16.658 -10.061 -12.059 1.00 3.51 H new ATOM 0 HZ2 LYS A 48 -17.800 -10.725 -10.992 1.00 3.51 H new ATOM 0 HZ3 LYS A 48 -18.197 -9.357 -11.916 1.00 3.51 H new ATOM 1419 N ARG A 49 -21.108 -7.682 -5.099 1.00 0.73 N ATOM 1420 CA ARG A 49 -22.265 -7.179 -4.359 1.00 0.70 C ATOM 1421 C ARG A 49 -21.843 -6.222 -3.251 1.00 0.61 C ATOM 1422 O ARG A 49 -21.815 -6.577 -2.073 1.00 0.75 O ATOM 1423 CB ARG A 49 -23.101 -8.332 -3.784 1.00 0.97 C ATOM 1424 CG ARG A 49 -22.318 -9.289 -2.895 1.00 1.10 C ATOM 1425 CD ARG A 49 -23.238 -10.229 -2.134 1.00 1.54 C ATOM 1426 NE ARG A 49 -24.017 -11.090 -3.022 1.00 2.02 N ATOM 1427 CZ ARG A 49 -25.101 -11.765 -2.638 1.00 2.68 C ATOM 1428 NH1 ARG A 49 -25.574 -11.624 -1.404 1.00 3.06 N ATOM 1429 NH2 ARG A 49 -25.721 -12.573 -3.490 1.00 3.24 N ATOM 0 H ARG A 49 -20.627 -8.463 -4.653 1.00 0.73 H new ATOM 0 HA ARG A 49 -22.885 -6.626 -5.065 1.00 0.70 H new ATOM 0 HB2 ARG A 49 -23.928 -7.915 -3.209 1.00 0.97 H new ATOM 0 HB3 ARG A 49 -23.538 -8.895 -4.609 1.00 0.97 H new ATOM 0 HG2 ARG A 49 -21.628 -9.871 -3.506 1.00 1.10 H new ATOM 0 HG3 ARG A 49 -21.715 -8.719 -2.188 1.00 1.10 H new ATOM 0 HD2 ARG A 49 -22.644 -10.848 -1.462 1.00 1.54 H new ATOM 0 HD3 ARG A 49 -23.916 -9.644 -1.513 1.00 1.54 H new ATOM 0 HE ARG A 49 -23.714 -11.180 -3.992 1.00 2.02 H new ATOM 0 HH11 ARG A 49 -25.108 -10.998 -0.747 1.00 3.06 H new ATOM 0 HH12 ARG A 49 -26.403 -12.142 -1.113 1.00 3.06 H new ATOM 0 HH21 ARG A 49 -25.368 -12.679 -4.441 1.00 3.24 H new ATOM 0 HH22 ARG A 49 -26.550 -13.088 -3.193 1.00 3.24 H new ATOM 1443 N THR A 50 -21.513 -5.001 -3.625 1.00 0.55 N ATOM 1444 CA THR A 50 -21.049 -4.039 -2.652 1.00 0.50 C ATOM 1445 C THR A 50 -22.037 -2.924 -2.405 1.00 0.50 C ATOM 1446 O THR A 50 -22.162 -1.976 -3.186 1.00 0.56 O ATOM 1447 CB THR A 50 -19.702 -3.446 -3.038 1.00 0.54 C ATOM 1448 OG1 THR A 50 -19.398 -3.770 -4.402 1.00 0.91 O ATOM 1449 CG2 THR A 50 -18.637 -3.976 -2.101 1.00 0.51 C ATOM 0 H THR A 50 -21.557 -4.657 -4.584 1.00 0.55 H new ATOM 0 HA THR A 50 -20.940 -4.601 -1.724 1.00 0.50 H new ATOM 0 HB THR A 50 -19.736 -2.360 -2.950 1.00 0.54 H new ATOM 0 HG1 THR A 50 -19.665 -3.027 -4.982 1.00 0.91 H new ATOM 0 HG21 THR A 50 -17.670 -3.554 -2.374 1.00 0.51 H new ATOM 0 HG22 THR A 50 -18.880 -3.694 -1.077 1.00 0.51 H new ATOM 0 HG23 THR A 50 -18.593 -5.062 -2.177 1.00 0.51 H new ATOM 1457 N ASP A 51 -22.734 -3.058 -1.305 1.00 0.49 N ATOM 1458 CA ASP A 51 -23.597 -2.011 -0.808 1.00 0.51 C ATOM 1459 C ASP A 51 -22.918 -1.344 0.368 1.00 0.44 C ATOM 1460 O ASP A 51 -21.756 -1.640 0.670 1.00 0.43 O ATOM 1461 CB ASP A 51 -24.959 -2.569 -0.394 1.00 0.60 C ATOM 1462 CG ASP A 51 -25.828 -2.916 -1.582 1.00 1.15 C ATOM 1463 OD1 ASP A 51 -26.579 -2.034 -2.049 1.00 1.94 O ATOM 1464 OD2 ASP A 51 -25.775 -4.070 -2.052 1.00 1.72 O ATOM 0 H ASP A 51 -22.720 -3.898 -0.726 1.00 0.49 H new ATOM 0 HA ASP A 51 -23.771 -1.282 -1.599 1.00 0.51 H new ATOM 0 HB2 ASP A 51 -24.813 -3.459 0.217 1.00 0.60 H new ATOM 0 HB3 ASP A 51 -25.474 -1.837 0.228 1.00 0.60 H new ATOM 1469 N GLU A 52 -23.632 -0.476 1.054 1.00 0.47 N ATOM 1470 CA GLU A 52 -23.045 0.277 2.151 1.00 0.46 C ATOM 1471 C GLU A 52 -22.864 -0.622 3.372 1.00 0.46 C ATOM 1472 O GLU A 52 -22.276 -0.221 4.370 1.00 0.46 O ATOM 1473 CB GLU A 52 -23.910 1.493 2.480 1.00 0.49 C ATOM 1474 CG GLU A 52 -24.290 2.313 1.252 1.00 0.52 C ATOM 1475 CD GLU A 52 -23.100 2.708 0.403 1.00 0.71 C ATOM 1476 OE1 GLU A 52 -22.725 1.929 -0.499 1.00 1.44 O ATOM 1477 OE2 GLU A 52 -22.552 3.806 0.617 1.00 1.27 O ATOM 0 H GLU A 52 -24.615 -0.272 0.875 1.00 0.47 H new ATOM 0 HA GLU A 52 -22.061 0.636 1.850 1.00 0.46 H new ATOM 0 HB2 GLU A 52 -24.819 1.159 2.981 1.00 0.49 H new ATOM 0 HB3 GLU A 52 -23.375 2.131 3.183 1.00 0.49 H new ATOM 0 HG2 GLU A 52 -24.988 1.739 0.642 1.00 0.52 H new ATOM 0 HG3 GLU A 52 -24.813 3.214 1.573 1.00 0.52 H new ATOM 1484 N ALA A 53 -23.359 -1.851 3.271 1.00 0.52 N ATOM 1485 CA ALA A 53 -23.167 -2.847 4.314 1.00 0.58 C ATOM 1486 C ALA A 53 -21.719 -3.335 4.325 1.00 0.57 C ATOM 1487 O ALA A 53 -21.074 -3.378 5.374 1.00 0.68 O ATOM 1488 CB ALA A 53 -24.124 -4.013 4.115 1.00 0.65 C ATOM 0 H ALA A 53 -23.899 -2.181 2.471 1.00 0.52 H new ATOM 0 HA ALA A 53 -23.381 -2.387 5.279 1.00 0.58 H new ATOM 0 HB1 ALA A 53 -23.968 -4.750 4.903 1.00 0.65 H new ATOM 0 HB2 ALA A 53 -25.151 -3.651 4.154 1.00 0.65 H new ATOM 0 HB3 ALA A 53 -23.939 -4.474 3.145 1.00 0.65 H new ATOM 1494 N ALA A 54 -21.205 -3.688 3.148 1.00 0.49 N ATOM 1495 CA ALA A 54 -19.817 -4.113 3.023 1.00 0.50 C ATOM 1496 C ALA A 54 -18.880 -2.934 3.260 1.00 0.45 C ATOM 1497 O ALA A 54 -17.825 -3.073 3.883 1.00 0.52 O ATOM 1498 CB ALA A 54 -19.555 -4.727 1.658 1.00 0.49 C ATOM 0 H ALA A 54 -21.728 -3.687 2.272 1.00 0.49 H new ATOM 0 HA ALA A 54 -19.626 -4.874 3.780 1.00 0.50 H new ATOM 0 HB1 ALA A 54 -18.512 -5.035 1.592 1.00 0.49 H new ATOM 0 HB2 ALA A 54 -20.199 -5.595 1.520 1.00 0.49 H new ATOM 0 HB3 ALA A 54 -19.766 -3.991 0.882 1.00 0.49 H new ATOM 1504 N PHE A 55 -19.289 -1.767 2.771 1.00 0.36 N ATOM 1505 CA PHE A 55 -18.491 -0.551 2.896 1.00 0.32 C ATOM 1506 C PHE A 55 -18.440 -0.052 4.335 1.00 0.34 C ATOM 1507 O PHE A 55 -17.461 0.572 4.740 1.00 0.34 O ATOM 1508 CB PHE A 55 -19.037 0.546 1.978 1.00 0.31 C ATOM 1509 CG PHE A 55 -18.500 0.469 0.580 1.00 0.28 C ATOM 1510 CD1 PHE A 55 -19.027 -0.423 -0.339 1.00 1.20 C ATOM 1511 CD2 PHE A 55 -17.454 1.286 0.189 1.00 1.20 C ATOM 1512 CE1 PHE A 55 -18.520 -0.498 -1.622 1.00 1.21 C ATOM 1513 CE2 PHE A 55 -16.942 1.213 -1.090 1.00 1.20 C ATOM 1514 CZ PHE A 55 -17.476 0.321 -1.997 1.00 0.31 C ATOM 0 H PHE A 55 -20.174 -1.637 2.281 1.00 0.36 H new ATOM 0 HA PHE A 55 -17.473 -0.798 2.593 1.00 0.32 H new ATOM 0 HB2 PHE A 55 -20.124 0.477 1.947 1.00 0.31 H new ATOM 0 HB3 PHE A 55 -18.792 1.520 2.401 1.00 0.31 H new ATOM 0 HD1 PHE A 55 -19.844 -1.067 -0.049 1.00 1.20 H new ATOM 0 HD2 PHE A 55 -17.034 1.989 0.893 1.00 1.20 H new ATOM 0 HE1 PHE A 55 -18.941 -1.197 -2.330 1.00 1.21 H new ATOM 0 HE2 PHE A 55 -16.123 1.854 -1.381 1.00 1.20 H new ATOM 0 HZ PHE A 55 -17.077 0.264 -2.999 1.00 0.31 H new ATOM 1524 N GLN A 56 -19.487 -0.334 5.101 1.00 0.37 N ATOM 1525 CA GLN A 56 -19.558 0.075 6.501 1.00 0.40 C ATOM 1526 C GLN A 56 -18.384 -0.487 7.299 1.00 0.37 C ATOM 1527 O GLN A 56 -17.784 0.209 8.124 1.00 0.42 O ATOM 1528 CB GLN A 56 -20.879 -0.389 7.112 1.00 0.46 C ATOM 1529 CG GLN A 56 -21.035 -0.048 8.582 1.00 0.58 C ATOM 1530 CD GLN A 56 -22.365 -0.502 9.135 1.00 0.68 C ATOM 1531 OE1 GLN A 56 -23.341 0.247 9.133 1.00 1.42 O ATOM 1532 NE2 GLN A 56 -22.421 -1.743 9.586 1.00 1.00 N ATOM 0 H GLN A 56 -20.305 -0.848 4.774 1.00 0.37 H new ATOM 0 HA GLN A 56 -19.504 1.163 6.542 1.00 0.40 H new ATOM 0 HB2 GLN A 56 -21.702 0.061 6.556 1.00 0.46 H new ATOM 0 HB3 GLN A 56 -20.964 -1.469 6.989 1.00 0.46 H new ATOM 0 HG2 GLN A 56 -20.229 -0.515 9.149 1.00 0.58 H new ATOM 0 HG3 GLN A 56 -20.936 1.029 8.716 1.00 0.58 H new ATOM 0 HE21 GLN A 56 -21.587 -2.330 9.569 1.00 1.00 H new ATOM 0 HE22 GLN A 56 -23.298 -2.114 9.951 1.00 1.00 H new ATOM 1541 N LYS A 57 -18.044 -1.743 7.035 1.00 0.34 N ATOM 1542 CA LYS A 57 -16.944 -2.389 7.731 1.00 0.35 C ATOM 1543 C LYS A 57 -15.621 -1.874 7.193 1.00 0.29 C ATOM 1544 O LYS A 57 -14.681 -1.638 7.951 1.00 0.34 O ATOM 1545 CB LYS A 57 -17.020 -3.914 7.581 1.00 0.47 C ATOM 1546 CG LYS A 57 -15.788 -4.657 8.093 1.00 0.85 C ATOM 1547 CD LYS A 57 -15.865 -5.016 9.577 1.00 0.57 C ATOM 1548 CE LYS A 57 -15.996 -3.797 10.476 1.00 0.63 C ATOM 1549 NZ LYS A 57 -16.010 -4.166 11.916 1.00 0.92 N ATOM 0 H LYS A 57 -18.514 -2.330 6.346 1.00 0.34 H new ATOM 0 HA LYS A 57 -17.018 -2.149 8.792 1.00 0.35 H new ATOM 0 HB2 LYS A 57 -17.897 -4.277 8.116 1.00 0.47 H new ATOM 0 HB3 LYS A 57 -17.165 -4.157 6.528 1.00 0.47 H new ATOM 0 HG2 LYS A 57 -15.657 -5.570 7.513 1.00 0.85 H new ATOM 0 HG3 LYS A 57 -14.905 -4.041 7.922 1.00 0.85 H new ATOM 0 HD2 LYS A 57 -16.717 -5.676 9.742 1.00 0.57 H new ATOM 0 HD3 LYS A 57 -14.971 -5.573 9.857 1.00 0.57 H new ATOM 0 HE2 LYS A 57 -15.168 -3.115 10.285 1.00 0.63 H new ATOM 0 HE3 LYS A 57 -16.913 -3.262 10.230 1.00 0.63 H new ATOM 0 HZ1 LYS A 57 -16.101 -3.306 12.494 1.00 0.92 H new ATOM 0 HZ2 LYS A 57 -16.815 -4.797 12.105 1.00 0.92 H new ATOM 0 HZ3 LYS A 57 -15.124 -4.654 12.158 1.00 0.92 H new ATOM 1563 N LEU A 58 -15.568 -1.695 5.878 1.00 0.24 N ATOM 1564 CA LEU A 58 -14.390 -1.150 5.222 1.00 0.20 C ATOM 1565 C LEU A 58 -14.036 0.206 5.819 1.00 0.20 C ATOM 1566 O LEU A 58 -12.989 0.361 6.434 1.00 0.22 O ATOM 1567 CB LEU A 58 -14.641 -1.016 3.718 1.00 0.20 C ATOM 1568 CG LEU A 58 -13.537 -0.307 2.940 1.00 0.19 C ATOM 1569 CD1 LEU A 58 -12.195 -0.958 3.220 1.00 0.20 C ATOM 1570 CD2 LEU A 58 -13.848 -0.317 1.450 1.00 0.23 C ATOM 0 H LEU A 58 -16.334 -1.922 5.243 1.00 0.24 H new ATOM 0 HA LEU A 58 -13.553 -1.830 5.380 1.00 0.20 H new ATOM 0 HB2 LEU A 58 -14.778 -2.012 3.298 1.00 0.20 H new ATOM 0 HB3 LEU A 58 -15.575 -0.475 3.568 1.00 0.20 H new ATOM 0 HG LEU A 58 -13.486 0.731 3.268 1.00 0.19 H new ATOM 0 HD11 LEU A 58 -11.416 -0.442 2.658 1.00 0.20 H new ATOM 0 HD12 LEU A 58 -11.976 -0.896 4.286 1.00 0.20 H new ATOM 0 HD13 LEU A 58 -12.228 -2.005 2.917 1.00 0.20 H new ATOM 0 HD21 LEU A 58 -13.051 0.193 0.909 1.00 0.23 H new ATOM 0 HD22 LEU A 58 -13.923 -1.347 1.101 1.00 0.23 H new ATOM 0 HD23 LEU A 58 -14.793 0.196 1.272 1.00 0.23 H new ATOM 1582 N MET A 59 -14.930 1.165 5.619 1.00 0.21 N ATOM 1583 CA MET A 59 -14.827 2.504 6.192 1.00 0.26 C ATOM 1584 C MET A 59 -14.317 2.486 7.635 1.00 0.27 C ATOM 1585 O MET A 59 -13.477 3.297 8.015 1.00 0.33 O ATOM 1586 CB MET A 59 -16.206 3.163 6.166 1.00 0.36 C ATOM 1587 CG MET A 59 -16.146 4.655 5.952 1.00 0.34 C ATOM 1588 SD MET A 59 -15.621 5.061 4.283 1.00 0.72 S ATOM 1589 CE MET A 59 -14.914 6.669 4.564 1.00 0.32 C ATOM 0 H MET A 59 -15.762 1.034 5.044 1.00 0.21 H new ATOM 0 HA MET A 59 -14.108 3.063 5.593 1.00 0.26 H new ATOM 0 HB2 MET A 59 -16.802 2.712 5.373 1.00 0.36 H new ATOM 0 HB3 MET A 59 -16.718 2.957 7.106 1.00 0.36 H new ATOM 0 HG2 MET A 59 -17.127 5.090 6.142 1.00 0.34 H new ATOM 0 HG3 MET A 59 -15.456 5.099 6.670 1.00 0.34 H new ATOM 0 HE1 MET A 59 -14.211 6.902 3.764 1.00 0.32 H new ATOM 0 HE2 MET A 59 -15.707 7.417 4.580 1.00 0.32 H new ATOM 0 HE3 MET A 59 -14.390 6.674 5.520 1.00 0.32 H new ATOM 1599 N SER A 60 -14.828 1.554 8.427 1.00 0.28 N ATOM 1600 CA SER A 60 -14.505 1.484 9.847 1.00 0.35 C ATOM 1601 C SER A 60 -13.093 0.952 10.081 1.00 0.32 C ATOM 1602 O SER A 60 -12.344 1.499 10.890 1.00 0.36 O ATOM 1603 CB SER A 60 -15.504 0.577 10.554 1.00 0.41 C ATOM 1604 OG SER A 60 -15.352 0.632 11.965 1.00 0.64 O ATOM 0 H SER A 60 -15.473 0.831 8.108 1.00 0.28 H new ATOM 0 HA SER A 60 -14.558 2.495 10.250 1.00 0.35 H new ATOM 0 HB2 SER A 60 -16.518 0.872 10.285 1.00 0.41 H new ATOM 0 HB3 SER A 60 -15.370 -0.449 10.213 1.00 0.41 H new ATOM 0 HG SER A 60 -16.009 0.040 12.388 1.00 0.64 H new ATOM 1610 N ASN A 61 -12.745 -0.129 9.394 1.00 0.30 N ATOM 1611 CA ASN A 61 -11.424 -0.732 9.539 1.00 0.31 C ATOM 1612 C ASN A 61 -10.373 0.161 8.912 1.00 0.31 C ATOM 1613 O ASN A 61 -9.207 0.153 9.307 1.00 0.39 O ATOM 1614 CB ASN A 61 -11.376 -2.111 8.881 1.00 0.34 C ATOM 1615 CG ASN A 61 -12.048 -3.188 9.705 1.00 0.43 C ATOM 1616 OD1 ASN A 61 -12.113 -3.104 10.929 1.00 0.95 O ATOM 1617 ND2 ASN A 61 -12.533 -4.222 9.038 1.00 0.57 N ATOM 0 H ASN A 61 -13.357 -0.606 8.732 1.00 0.30 H new ATOM 0 HA ASN A 61 -11.221 -0.845 10.604 1.00 0.31 H new ATOM 0 HB2 ASN A 61 -11.856 -2.057 7.904 1.00 0.34 H new ATOM 0 HB3 ASN A 61 -10.336 -2.389 8.710 1.00 0.34 H new ATOM 0 HD21 ASN A 61 -12.981 -4.988 9.540 1.00 0.57 H new ATOM 0 HD22 ASN A 61 -12.459 -4.253 8.021 1.00 0.57 H new ATOM 1624 N LEU A 62 -10.816 0.932 7.937 1.00 0.30 N ATOM 1625 CA LEU A 62 -9.945 1.822 7.193 1.00 0.33 C ATOM 1626 C LEU A 62 -9.610 3.052 8.012 1.00 0.33 C ATOM 1627 O LEU A 62 -8.444 3.346 8.269 1.00 0.38 O ATOM 1628 CB LEU A 62 -10.630 2.240 5.895 1.00 0.37 C ATOM 1629 CG LEU A 62 -9.727 2.233 4.676 1.00 0.24 C ATOM 1630 CD1 LEU A 62 -9.088 0.870 4.531 1.00 0.52 C ATOM 1631 CD2 LEU A 62 -10.509 2.589 3.425 1.00 0.28 C ATOM 0 H LEU A 62 -11.791 0.959 7.638 1.00 0.30 H new ATOM 0 HA LEU A 62 -9.019 1.294 6.966 1.00 0.33 H new ATOM 0 HB2 LEU A 62 -11.472 1.572 5.712 1.00 0.37 H new ATOM 0 HB3 LEU A 62 -11.040 3.242 6.022 1.00 0.37 H new ATOM 0 HG LEU A 62 -8.947 2.983 4.808 1.00 0.24 H new ATOM 0 HD11 LEU A 62 -8.439 0.864 3.655 1.00 0.52 H new ATOM 0 HD12 LEU A 62 -8.499 0.648 5.421 1.00 0.52 H new ATOM 0 HD13 LEU A 62 -9.865 0.115 4.412 1.00 0.52 H new ATOM 0 HD21 LEU A 62 -9.842 2.578 2.563 1.00 0.28 H new ATOM 0 HD22 LEU A 62 -11.307 1.862 3.275 1.00 0.28 H new ATOM 0 HD23 LEU A 62 -10.941 3.584 3.537 1.00 0.28 H new ATOM 1643 N ASP A 63 -10.650 3.768 8.409 1.00 0.37 N ATOM 1644 CA ASP A 63 -10.493 4.970 9.208 1.00 0.43 C ATOM 1645 C ASP A 63 -10.024 4.585 10.601 1.00 0.38 C ATOM 1646 O ASP A 63 -10.826 4.177 11.439 1.00 0.43 O ATOM 1647 CB ASP A 63 -11.820 5.719 9.293 1.00 0.56 C ATOM 1648 CG ASP A 63 -11.644 7.162 9.701 1.00 0.85 C ATOM 1649 OD1 ASP A 63 -11.019 7.417 10.746 1.00 1.35 O ATOM 1650 OD2 ASP A 63 -12.148 8.047 8.988 1.00 1.56 O ATOM 0 H ASP A 63 -11.618 3.534 8.188 1.00 0.37 H new ATOM 0 HA ASP A 63 -9.754 5.622 8.742 1.00 0.43 H new ATOM 0 HB2 ASP A 63 -12.320 5.677 8.325 1.00 0.56 H new ATOM 0 HB3 ASP A 63 -12.471 5.219 10.010 1.00 0.56 H new ATOM 1655 N SER A 64 -8.733 4.724 10.849 1.00 0.37 N ATOM 1656 CA SER A 64 -8.125 4.182 12.051 1.00 0.41 C ATOM 1657 C SER A 64 -8.379 5.075 13.264 1.00 0.52 C ATOM 1658 O SER A 64 -8.038 4.714 14.393 1.00 0.64 O ATOM 1659 CB SER A 64 -6.624 3.970 11.833 1.00 0.45 C ATOM 1660 OG SER A 64 -5.941 5.203 11.674 1.00 0.58 O ATOM 0 H SER A 64 -8.083 5.210 10.231 1.00 0.37 H new ATOM 0 HA SER A 64 -8.590 3.218 12.258 1.00 0.41 H new ATOM 0 HB2 SER A 64 -6.205 3.428 12.681 1.00 0.45 H new ATOM 0 HB3 SER A 64 -6.468 3.350 10.950 1.00 0.45 H new ATOM 0 HG SER A 64 -6.584 5.906 11.443 1.00 0.58 H new ATOM 1666 N ASN A 65 -8.954 6.248 13.034 1.00 0.60 N ATOM 1667 CA ASN A 65 -9.338 7.123 14.134 1.00 0.83 C ATOM 1668 C ASN A 65 -10.860 7.192 14.238 1.00 0.89 C ATOM 1669 O ASN A 65 -11.407 7.787 15.168 1.00 1.10 O ATOM 1670 CB ASN A 65 -8.738 8.524 13.964 1.00 0.95 C ATOM 1671 CG ASN A 65 -9.403 9.329 12.867 1.00 0.99 C ATOM 1672 OD1 ASN A 65 -10.361 10.060 13.119 1.00 1.52 O ATOM 1673 ND2 ASN A 65 -8.899 9.211 11.649 1.00 1.44 N ATOM 0 H ASN A 65 -9.163 6.613 12.105 1.00 0.60 H new ATOM 0 HA ASN A 65 -8.941 6.707 15.060 1.00 0.83 H new ATOM 0 HB2 ASN A 65 -8.824 9.066 14.906 1.00 0.95 H new ATOM 0 HB3 ASN A 65 -7.674 8.432 13.745 1.00 0.95 H new ATOM 0 HD21 ASN A 65 -9.306 9.737 10.876 1.00 1.44 H new ATOM 0 HD22 ASN A 65 -8.104 8.594 11.484 1.00 1.44 H new ATOM 1680 N ARG A 66 -11.528 6.563 13.269 1.00 0.79 N ATOM 1681 CA ARG A 66 -12.987 6.463 13.229 1.00 0.98 C ATOM 1682 C ARG A 66 -13.645 7.829 13.020 1.00 1.05 C ATOM 1683 O ARG A 66 -14.597 8.191 13.718 1.00 1.34 O ATOM 1684 CB ARG A 66 -13.539 5.771 14.489 1.00 1.26 C ATOM 1685 CG ARG A 66 -13.417 4.250 14.460 1.00 1.46 C ATOM 1686 CD ARG A 66 -11.973 3.784 14.587 1.00 1.25 C ATOM 1687 NE ARG A 66 -11.670 2.682 13.674 1.00 1.91 N ATOM 1688 CZ ARG A 66 -10.531 1.990 13.680 1.00 2.60 C ATOM 1689 NH1 ARG A 66 -9.623 2.191 14.624 1.00 2.85 N ATOM 1690 NH2 ARG A 66 -10.304 1.089 12.736 1.00 3.45 N ATOM 0 H ARG A 66 -11.067 6.105 12.483 1.00 0.79 H new ATOM 0 HA ARG A 66 -13.240 5.843 12.369 1.00 0.98 H new ATOM 0 HB2 ARG A 66 -13.010 6.152 15.363 1.00 1.26 H new ATOM 0 HB3 ARG A 66 -14.588 6.040 14.610 1.00 1.26 H new ATOM 0 HG2 ARG A 66 -14.007 3.825 15.272 1.00 1.46 H new ATOM 0 HG3 ARG A 66 -13.838 3.872 13.529 1.00 1.46 H new ATOM 0 HD2 ARG A 66 -11.303 4.619 14.382 1.00 1.25 H new ATOM 0 HD3 ARG A 66 -11.783 3.468 15.613 1.00 1.25 H new ATOM 0 HE ARG A 66 -12.378 2.426 12.986 1.00 1.91 H new ATOM 0 HH11 ARG A 66 -9.792 2.881 15.356 1.00 2.85 H new ATOM 0 HH12 ARG A 66 -8.755 1.656 14.619 1.00 2.85 H new ATOM 0 HH21 ARG A 66 -11.000 0.927 12.008 1.00 3.45 H new ATOM 0 HH22 ARG A 66 -9.433 0.557 12.737 1.00 3.45 H new ATOM 1704 N ASP A 67 -13.147 8.566 12.034 1.00 0.86 N ATOM 1705 CA ASP A 67 -13.713 9.866 11.671 1.00 1.00 C ATOM 1706 C ASP A 67 -14.749 9.696 10.562 1.00 0.88 C ATOM 1707 O ASP A 67 -15.501 10.618 10.249 1.00 0.94 O ATOM 1708 CB ASP A 67 -12.595 10.813 11.214 1.00 1.13 C ATOM 1709 CG ASP A 67 -13.060 12.243 11.008 1.00 1.57 C ATOM 1710 OD1 ASP A 67 -13.553 12.859 11.978 1.00 2.02 O ATOM 1711 OD2 ASP A 67 -12.890 12.776 9.889 1.00 2.08 O ATOM 0 H ASP A 67 -12.347 8.286 11.467 1.00 0.86 H new ATOM 0 HA ASP A 67 -14.204 10.296 12.544 1.00 1.00 H new ATOM 0 HB2 ASP A 67 -11.795 10.802 11.955 1.00 1.13 H new ATOM 0 HB3 ASP A 67 -12.171 10.439 10.282 1.00 1.13 H new ATOM 1716 N ASN A 68 -14.770 8.496 9.975 1.00 0.77 N ATOM 1717 CA ASN A 68 -15.711 8.133 8.905 1.00 0.74 C ATOM 1718 C ASN A 68 -15.375 8.851 7.605 1.00 0.65 C ATOM 1719 O ASN A 68 -16.195 8.919 6.687 1.00 0.66 O ATOM 1720 CB ASN A 68 -17.167 8.404 9.312 1.00 0.92 C ATOM 1721 CG ASN A 68 -17.692 7.391 10.314 1.00 1.13 C ATOM 1722 OD1 ASN A 68 -17.215 6.157 10.221 1.00 1.54 O flip ATOM 1723 ND2 ASN A 68 -18.526 7.710 11.158 1.00 1.75 N flip ATOM 0 H ASN A 68 -14.131 7.742 10.229 1.00 0.77 H new ATOM 0 HA ASN A 68 -15.606 7.061 8.739 1.00 0.74 H new ATOM 0 HB2 ASN A 68 -17.241 9.404 9.740 1.00 0.92 H new ATOM 0 HB3 ASN A 68 -17.797 8.390 8.423 1.00 0.92 H new ATOM 0 HD21 ASN A 68 -18.869 8.670 11.198 1.00 1.75 H new ATOM 0 HD22 ASN A 68 -18.875 7.015 11.818 1.00 1.75 H new ATOM 1730 N GLU A 69 -14.151 9.346 7.528 1.00 0.64 N ATOM 1731 CA GLU A 69 -13.634 9.986 6.331 1.00 0.63 C ATOM 1732 C GLU A 69 -12.159 9.660 6.197 1.00 0.54 C ATOM 1733 O GLU A 69 -11.320 10.195 6.925 1.00 0.65 O ATOM 1734 CB GLU A 69 -13.855 11.498 6.366 1.00 0.82 C ATOM 1735 CG GLU A 69 -15.286 11.905 6.062 1.00 0.95 C ATOM 1736 CD GLU A 69 -15.491 13.399 6.126 1.00 1.13 C ATOM 1737 OE1 GLU A 69 -14.953 14.116 5.254 1.00 1.59 O ATOM 1738 OE2 GLU A 69 -16.178 13.866 7.056 1.00 1.65 O ATOM 0 H GLU A 69 -13.484 9.315 8.299 1.00 0.64 H new ATOM 0 HA GLU A 69 -14.174 9.605 5.464 1.00 0.63 H new ATOM 0 HB2 GLU A 69 -13.579 11.875 7.351 1.00 0.82 H new ATOM 0 HB3 GLU A 69 -13.189 11.972 5.645 1.00 0.82 H new ATOM 0 HG2 GLU A 69 -15.558 11.547 5.069 1.00 0.95 H new ATOM 0 HG3 GLU A 69 -15.956 11.419 6.771 1.00 0.95 H new ATOM 1745 N VAL A 70 -11.857 8.773 5.266 1.00 0.40 N ATOM 1746 CA VAL A 70 -10.526 8.209 5.145 1.00 0.31 C ATOM 1747 C VAL A 70 -9.527 9.232 4.634 1.00 0.33 C ATOM 1748 O VAL A 70 -9.496 9.565 3.446 1.00 0.39 O ATOM 1749 CB VAL A 70 -10.526 6.969 4.231 1.00 0.28 C ATOM 1750 CG1 VAL A 70 -9.124 6.427 4.025 1.00 0.32 C ATOM 1751 CG2 VAL A 70 -11.428 5.896 4.816 1.00 0.29 C ATOM 0 H VAL A 70 -12.524 8.425 4.577 1.00 0.40 H new ATOM 0 HA VAL A 70 -10.219 7.905 6.146 1.00 0.31 H new ATOM 0 HB VAL A 70 -10.908 7.269 3.255 1.00 0.28 H new ATOM 0 HG11 VAL A 70 -9.164 5.553 3.375 1.00 0.32 H new ATOM 0 HG12 VAL A 70 -8.502 7.194 3.564 1.00 0.32 H new ATOM 0 HG13 VAL A 70 -8.698 6.144 4.988 1.00 0.32 H new ATOM 0 HG21 VAL A 70 -11.423 5.022 4.165 1.00 0.29 H new ATOM 0 HG22 VAL A 70 -11.064 5.614 5.804 1.00 0.29 H new ATOM 0 HG23 VAL A 70 -12.444 6.281 4.900 1.00 0.29 H new ATOM 1761 N ASP A 71 -8.739 9.744 5.563 1.00 0.36 N ATOM 1762 CA ASP A 71 -7.604 10.587 5.243 1.00 0.40 C ATOM 1763 C ASP A 71 -6.544 9.750 4.529 1.00 0.32 C ATOM 1764 O ASP A 71 -6.601 8.520 4.576 1.00 0.29 O ATOM 1765 CB ASP A 71 -7.045 11.196 6.538 1.00 0.49 C ATOM 1766 CG ASP A 71 -5.745 11.946 6.338 1.00 0.61 C ATOM 1767 OD1 ASP A 71 -5.787 13.137 5.969 1.00 1.22 O ATOM 1768 OD2 ASP A 71 -4.672 11.339 6.549 1.00 1.32 O ATOM 0 H ASP A 71 -8.870 9.586 6.562 1.00 0.36 H new ATOM 0 HA ASP A 71 -7.908 11.399 4.583 1.00 0.40 H new ATOM 0 HB2 ASP A 71 -7.786 11.875 6.961 1.00 0.49 H new ATOM 0 HB3 ASP A 71 -6.889 10.401 7.267 1.00 0.49 H new ATOM 1773 N PHE A 72 -5.600 10.410 3.867 1.00 0.36 N ATOM 1774 CA PHE A 72 -4.521 9.732 3.146 1.00 0.36 C ATOM 1775 C PHE A 72 -3.924 8.597 3.982 1.00 0.30 C ATOM 1776 O PHE A 72 -3.754 7.476 3.499 1.00 0.39 O ATOM 1777 CB PHE A 72 -3.422 10.737 2.790 1.00 0.51 C ATOM 1778 CG PHE A 72 -2.480 10.220 1.748 1.00 0.58 C ATOM 1779 CD1 PHE A 72 -1.805 9.032 1.944 1.00 1.38 C ATOM 1780 CD2 PHE A 72 -2.287 10.907 0.565 1.00 1.26 C ATOM 1781 CE1 PHE A 72 -0.959 8.535 0.992 1.00 1.46 C ATOM 1782 CE2 PHE A 72 -1.434 10.414 -0.399 1.00 1.29 C ATOM 1783 CZ PHE A 72 -0.767 9.221 -0.179 1.00 0.78 C ATOM 0 H PHE A 72 -5.558 11.428 3.813 1.00 0.36 H new ATOM 0 HA PHE A 72 -4.940 9.305 2.235 1.00 0.36 H new ATOM 0 HB2 PHE A 72 -3.881 11.659 2.433 1.00 0.51 H new ATOM 0 HB3 PHE A 72 -2.860 10.988 3.690 1.00 0.51 H new ATOM 0 HD1 PHE A 72 -1.948 8.486 2.865 1.00 1.38 H new ATOM 0 HD2 PHE A 72 -2.808 11.837 0.394 1.00 1.26 H new ATOM 0 HE1 PHE A 72 -0.442 7.602 1.163 1.00 1.46 H new ATOM 0 HE2 PHE A 72 -1.287 10.956 -1.322 1.00 1.29 H new ATOM 0 HZ PHE A 72 -0.096 8.831 -0.930 1.00 0.78 H new ATOM 1793 N GLN A 73 -3.617 8.903 5.230 1.00 0.30 N ATOM 1794 CA GLN A 73 -3.029 7.942 6.155 1.00 0.41 C ATOM 1795 C GLN A 73 -3.860 6.670 6.221 1.00 0.38 C ATOM 1796 O GLN A 73 -3.323 5.568 6.158 1.00 0.44 O ATOM 1797 CB GLN A 73 -2.925 8.549 7.558 1.00 0.61 C ATOM 1798 CG GLN A 73 -2.029 9.776 7.645 1.00 0.85 C ATOM 1799 CD GLN A 73 -0.562 9.445 7.467 1.00 0.83 C ATOM 1800 OE1 GLN A 73 -0.164 8.265 7.913 1.00 1.20 O flip ATOM 1801 NE2 GLN A 73 0.212 10.254 6.958 1.00 1.48 N flip ATOM 0 H GLN A 73 -3.768 9.827 5.635 1.00 0.30 H new ATOM 0 HA GLN A 73 -2.033 7.695 5.788 1.00 0.41 H new ATOM 0 HB2 GLN A 73 -3.924 8.819 7.899 1.00 0.61 H new ATOM 0 HB3 GLN A 73 -2.548 7.789 8.243 1.00 0.61 H new ATOM 0 HG2 GLN A 73 -2.330 10.495 6.883 1.00 0.85 H new ATOM 0 HG3 GLN A 73 -2.173 10.258 8.612 1.00 0.85 H new ATOM 0 HE21 GLN A 73 -0.136 11.154 6.627 1.00 1.48 H new ATOM 0 HE22 GLN A 73 1.202 10.025 6.867 1.00 1.48 H new ATOM 1810 N GLU A 74 -5.174 6.823 6.308 1.00 0.34 N ATOM 1811 CA GLU A 74 -6.056 5.682 6.484 1.00 0.37 C ATOM 1812 C GLU A 74 -6.224 4.962 5.148 1.00 0.32 C ATOM 1813 O GLU A 74 -6.741 3.850 5.079 1.00 0.36 O ATOM 1814 CB GLU A 74 -7.425 6.133 7.012 1.00 0.44 C ATOM 1815 CG GLU A 74 -7.401 7.400 7.867 1.00 0.52 C ATOM 1816 CD GLU A 74 -6.605 7.267 9.152 1.00 0.58 C ATOM 1817 OE1 GLU A 74 -7.186 6.876 10.182 1.00 1.29 O ATOM 1818 OE2 GLU A 74 -5.402 7.587 9.143 1.00 1.16 O ATOM 0 H GLU A 74 -5.650 7.724 6.260 1.00 0.34 H new ATOM 0 HA GLU A 74 -5.615 5.003 7.213 1.00 0.37 H new ATOM 0 HB2 GLU A 74 -8.089 6.298 6.163 1.00 0.44 H new ATOM 0 HB3 GLU A 74 -7.855 5.323 7.601 1.00 0.44 H new ATOM 0 HG2 GLU A 74 -6.983 8.216 7.277 1.00 0.52 H new ATOM 0 HG3 GLU A 74 -8.426 7.678 8.114 1.00 0.52 H new ATOM 1825 N TYR A 75 -5.776 5.615 4.084 1.00 0.26 N ATOM 1826 CA TYR A 75 -5.928 5.084 2.740 1.00 0.25 C ATOM 1827 C TYR A 75 -4.732 4.222 2.327 1.00 0.24 C ATOM 1828 O TYR A 75 -4.884 3.287 1.541 1.00 0.28 O ATOM 1829 CB TYR A 75 -6.135 6.224 1.741 1.00 0.25 C ATOM 1830 CG TYR A 75 -6.367 5.747 0.329 1.00 0.26 C ATOM 1831 CD1 TYR A 75 -7.645 5.435 -0.116 1.00 1.17 C ATOM 1832 CD2 TYR A 75 -5.306 5.595 -0.553 1.00 1.27 C ATOM 1833 CE1 TYR A 75 -7.854 4.987 -1.406 1.00 1.17 C ATOM 1834 CE2 TYR A 75 -5.510 5.146 -1.843 1.00 1.30 C ATOM 1835 CZ TYR A 75 -6.785 4.845 -2.263 1.00 0.38 C ATOM 1836 OH TYR A 75 -6.992 4.399 -3.548 1.00 0.47 O ATOM 0 H TYR A 75 -5.302 6.517 4.128 1.00 0.26 H new ATOM 0 HA TYR A 75 -6.809 4.442 2.737 1.00 0.25 H new ATOM 0 HB2 TYR A 75 -6.987 6.825 2.058 1.00 0.25 H new ATOM 0 HB3 TYR A 75 -5.261 6.875 1.758 1.00 0.25 H new ATOM 0 HD1 TYR A 75 -8.485 5.544 0.554 1.00 1.17 H new ATOM 0 HD2 TYR A 75 -4.305 5.832 -0.225 1.00 1.27 H new ATOM 0 HE1 TYR A 75 -8.853 4.749 -1.742 1.00 1.17 H new ATOM 0 HE2 TYR A 75 -4.674 5.032 -2.518 1.00 1.30 H new ATOM 0 HH TYR A 75 -6.686 5.079 -4.184 1.00 0.47 H new ATOM 1846 N CYS A 76 -3.545 4.527 2.842 1.00 0.22 N ATOM 1847 CA CYS A 76 -2.358 3.742 2.501 1.00 0.21 C ATOM 1848 C CYS A 76 -2.549 2.306 2.957 1.00 0.15 C ATOM 1849 O CYS A 76 -2.204 1.353 2.253 1.00 0.17 O ATOM 1850 CB CYS A 76 -1.096 4.331 3.151 1.00 0.27 C ATOM 1851 SG CYS A 76 -0.967 4.087 4.937 1.00 1.65 S ATOM 0 H CYS A 76 -3.378 5.299 3.487 1.00 0.22 H new ATOM 0 HA CYS A 76 -2.227 3.771 1.419 1.00 0.21 H new ATOM 0 HB2 CYS A 76 -0.221 3.888 2.675 1.00 0.27 H new ATOM 0 HB3 CYS A 76 -1.065 5.401 2.943 1.00 0.27 H new ATOM 0 HG CYS A 76 -1.843 4.833 5.541 1.00 1.65 H new ATOM 1857 N VAL A 77 -3.141 2.167 4.127 1.00 0.16 N ATOM 1858 CA VAL A 77 -3.356 0.875 4.730 1.00 0.17 C ATOM 1859 C VAL A 77 -4.517 0.150 4.079 1.00 0.17 C ATOM 1860 O VAL A 77 -4.664 -1.052 4.246 1.00 0.19 O ATOM 1861 CB VAL A 77 -3.577 1.011 6.239 1.00 0.20 C ATOM 1862 CG1 VAL A 77 -2.310 1.526 6.883 1.00 0.23 C ATOM 1863 CG2 VAL A 77 -4.743 1.941 6.544 1.00 0.19 C ATOM 0 H VAL A 77 -3.485 2.950 4.683 1.00 0.16 H new ATOM 0 HA VAL A 77 -2.459 0.278 4.568 1.00 0.17 H new ATOM 0 HB VAL A 77 -3.823 0.031 6.647 1.00 0.20 H new ATOM 0 HG11 VAL A 77 -2.462 1.625 7.958 1.00 0.23 H new ATOM 0 HG12 VAL A 77 -1.496 0.826 6.695 1.00 0.23 H new ATOM 0 HG13 VAL A 77 -2.057 2.499 6.462 1.00 0.23 H new ATOM 0 HG21 VAL A 77 -4.875 2.017 7.623 1.00 0.19 H new ATOM 0 HG22 VAL A 77 -4.537 2.929 6.133 1.00 0.19 H new ATOM 0 HG23 VAL A 77 -5.653 1.543 6.094 1.00 0.19 H new ATOM 1873 N PHE A 78 -5.339 0.887 3.339 1.00 0.20 N ATOM 1874 CA PHE A 78 -6.373 0.285 2.526 1.00 0.22 C ATOM 1875 C PHE A 78 -5.730 -0.713 1.592 1.00 0.19 C ATOM 1876 O PHE A 78 -5.856 -1.916 1.770 1.00 0.18 O ATOM 1877 CB PHE A 78 -7.111 1.382 1.733 1.00 0.30 C ATOM 1878 CG PHE A 78 -8.215 0.912 0.834 1.00 0.22 C ATOM 1879 CD1 PHE A 78 -9.227 0.089 1.290 1.00 1.21 C ATOM 1880 CD2 PHE A 78 -8.232 1.325 -0.483 1.00 1.19 C ATOM 1881 CE1 PHE A 78 -10.238 -0.314 0.441 1.00 1.20 C ATOM 1882 CE2 PHE A 78 -9.234 0.932 -1.334 1.00 1.21 C ATOM 1883 CZ PHE A 78 -10.241 0.109 -0.875 1.00 0.22 C ATOM 0 H PHE A 78 -5.303 1.905 3.290 1.00 0.20 H new ATOM 0 HA PHE A 78 -7.101 -0.229 3.154 1.00 0.22 H new ATOM 0 HB2 PHE A 78 -7.526 2.098 2.442 1.00 0.30 H new ATOM 0 HB3 PHE A 78 -6.381 1.919 1.128 1.00 0.30 H new ATOM 0 HD1 PHE A 78 -9.227 -0.241 2.318 1.00 1.21 H new ATOM 0 HD2 PHE A 78 -7.445 1.967 -0.849 1.00 1.19 H new ATOM 0 HE1 PHE A 78 -11.025 -0.958 0.804 1.00 1.20 H new ATOM 0 HE2 PHE A 78 -9.234 1.266 -2.361 1.00 1.21 H new ATOM 0 HZ PHE A 78 -11.030 -0.204 -1.542 1.00 0.22 H new ATOM 1893 N LEU A 79 -4.956 -0.193 0.667 1.00 0.20 N ATOM 1894 CA LEU A 79 -4.434 -0.981 -0.428 1.00 0.19 C ATOM 1895 C LEU A 79 -3.387 -1.983 0.006 1.00 0.16 C ATOM 1896 O LEU A 79 -3.410 -3.130 -0.421 1.00 0.18 O ATOM 1897 CB LEU A 79 -3.894 -0.050 -1.489 1.00 0.22 C ATOM 1898 CG LEU A 79 -4.990 0.762 -2.147 1.00 0.15 C ATOM 1899 CD1 LEU A 79 -4.434 1.608 -3.271 1.00 0.16 C ATOM 1900 CD2 LEU A 79 -6.080 -0.182 -2.624 1.00 0.16 C ATOM 0 H LEU A 79 -4.670 0.786 0.652 1.00 0.20 H new ATOM 0 HA LEU A 79 -5.253 -1.574 -0.835 1.00 0.19 H new ATOM 0 HB2 LEU A 79 -3.163 0.624 -1.041 1.00 0.22 H new ATOM 0 HB3 LEU A 79 -3.369 -0.631 -2.247 1.00 0.22 H new ATOM 0 HG LEU A 79 -5.423 1.455 -1.426 1.00 0.15 H new ATOM 0 HD11 LEU A 79 -5.240 2.182 -3.728 1.00 0.16 H new ATOM 0 HD12 LEU A 79 -3.682 2.291 -2.875 1.00 0.16 H new ATOM 0 HD13 LEU A 79 -3.978 0.962 -4.021 1.00 0.16 H new ATOM 0 HD21 LEU A 79 -6.875 0.392 -3.100 1.00 0.16 H new ATOM 0 HD22 LEU A 79 -5.662 -0.887 -3.342 1.00 0.16 H new ATOM 0 HD23 LEU A 79 -6.486 -0.729 -1.773 1.00 0.16 H new ATOM 1912 N SER A 80 -2.484 -1.580 0.858 1.00 0.15 N ATOM 1913 CA SER A 80 -1.453 -2.491 1.292 1.00 0.15 C ATOM 1914 C SER A 80 -2.064 -3.681 2.031 1.00 0.15 C ATOM 1915 O SER A 80 -1.538 -4.793 1.994 1.00 0.18 O ATOM 1916 CB SER A 80 -0.462 -1.743 2.153 1.00 0.17 C ATOM 1917 OG SER A 80 0.131 -0.699 1.410 1.00 0.23 O ATOM 0 H SER A 80 -2.438 -0.644 1.261 1.00 0.15 H new ATOM 0 HA SER A 80 -0.925 -2.891 0.426 1.00 0.15 H new ATOM 0 HB2 SER A 80 -0.964 -1.336 3.031 1.00 0.17 H new ATOM 0 HB3 SER A 80 0.307 -2.426 2.514 1.00 0.17 H new ATOM 0 HG SER A 80 1.093 -0.864 1.324 1.00 0.23 H new ATOM 1923 N CYS A 81 -3.194 -3.453 2.675 1.00 0.14 N ATOM 1924 CA CYS A 81 -3.925 -4.529 3.310 1.00 0.15 C ATOM 1925 C CYS A 81 -4.774 -5.293 2.302 1.00 0.14 C ATOM 1926 O CYS A 81 -5.200 -6.415 2.568 1.00 0.16 O ATOM 1927 CB CYS A 81 -4.769 -3.994 4.455 1.00 0.17 C ATOM 1928 SG CYS A 81 -3.779 -3.437 5.856 1.00 0.22 S ATOM 0 H CYS A 81 -3.623 -2.533 2.771 1.00 0.14 H new ATOM 0 HA CYS A 81 -3.203 -5.234 3.722 1.00 0.15 H new ATOM 0 HB2 CYS A 81 -5.378 -3.165 4.094 1.00 0.17 H new ATOM 0 HB3 CYS A 81 -5.455 -4.772 4.788 1.00 0.17 H new ATOM 0 HG CYS A 81 -3.577 -2.156 5.763 1.00 0.22 H new ATOM 1934 N ILE A 82 -5.014 -4.700 1.138 1.00 0.13 N ATOM 1935 CA ILE A 82 -5.755 -5.398 0.104 1.00 0.14 C ATOM 1936 C ILE A 82 -4.793 -6.245 -0.725 1.00 0.17 C ATOM 1937 O ILE A 82 -5.214 -7.154 -1.426 1.00 0.21 O ATOM 1938 CB ILE A 82 -6.579 -4.468 -0.817 1.00 0.15 C ATOM 1939 CG1 ILE A 82 -7.353 -3.446 -0.007 1.00 0.15 C ATOM 1940 CG2 ILE A 82 -7.575 -5.278 -1.626 1.00 0.16 C ATOM 1941 CD1 ILE A 82 -8.208 -2.546 -0.861 1.00 0.18 C ATOM 0 H ILE A 82 -4.712 -3.757 0.893 1.00 0.13 H new ATOM 0 HA ILE A 82 -6.483 -6.029 0.614 1.00 0.14 H new ATOM 0 HB ILE A 82 -5.877 -3.958 -1.477 1.00 0.15 H new ATOM 0 HG12 ILE A 82 -7.986 -3.965 0.713 1.00 0.15 H new ATOM 0 HG13 ILE A 82 -6.653 -2.838 0.565 1.00 0.15 H new ATOM 0 HG21 ILE A 82 -8.148 -4.611 -2.270 1.00 0.16 H new ATOM 0 HG22 ILE A 82 -7.041 -6.004 -2.239 1.00 0.16 H new ATOM 0 HG23 ILE A 82 -8.252 -5.801 -0.951 1.00 0.16 H new ATOM 0 HD11 ILE A 82 -8.737 -1.836 -0.225 1.00 0.18 H new ATOM 0 HD12 ILE A 82 -7.576 -2.003 -1.563 1.00 0.18 H new ATOM 0 HD13 ILE A 82 -8.930 -3.147 -1.413 1.00 0.18 H new ATOM 1953 N ALA A 83 -3.496 -5.936 -0.668 1.00 0.18 N ATOM 1954 CA ALA A 83 -2.492 -6.901 -1.096 1.00 0.23 C ATOM 1955 C ALA A 83 -2.623 -8.162 -0.270 1.00 0.20 C ATOM 1956 O ALA A 83 -2.743 -9.267 -0.800 1.00 0.21 O ATOM 1957 CB ALA A 83 -1.105 -6.352 -0.918 1.00 0.30 C ATOM 0 H ALA A 83 -3.126 -5.045 -0.337 1.00 0.18 H new ATOM 0 HA ALA A 83 -2.655 -7.115 -2.152 1.00 0.23 H new ATOM 0 HB1 ALA A 83 -0.376 -7.093 -1.245 1.00 0.30 H new ATOM 0 HB2 ALA A 83 -0.993 -5.446 -1.513 1.00 0.30 H new ATOM 0 HB3 ALA A 83 -0.938 -6.119 0.134 1.00 0.30 H new ATOM 1963 N MET A 84 -2.599 -7.980 1.043 1.00 0.22 N ATOM 1964 CA MET A 84 -2.808 -9.087 1.966 1.00 0.25 C ATOM 1965 C MET A 84 -4.151 -9.758 1.688 1.00 0.24 C ATOM 1966 O MET A 84 -4.280 -10.980 1.800 1.00 0.28 O ATOM 1967 CB MET A 84 -2.707 -8.618 3.417 1.00 0.30 C ATOM 1968 CG MET A 84 -1.269 -8.411 3.869 1.00 0.34 C ATOM 1969 SD MET A 84 -1.140 -7.731 5.532 1.00 0.36 S ATOM 1970 CE MET A 84 -1.823 -6.101 5.264 1.00 0.20 C ATOM 0 H MET A 84 -2.437 -7.079 1.492 1.00 0.22 H new ATOM 0 HA MET A 84 -2.021 -9.824 1.809 1.00 0.25 H new ATOM 0 HB2 MET A 84 -3.257 -7.684 3.532 1.00 0.30 H new ATOM 0 HB3 MET A 84 -3.185 -9.352 4.066 1.00 0.30 H new ATOM 0 HG2 MET A 84 -0.742 -9.364 3.831 1.00 0.34 H new ATOM 0 HG3 MET A 84 -0.768 -7.742 3.170 1.00 0.34 H new ATOM 0 HE1 MET A 84 -1.563 -5.455 6.103 1.00 0.20 H new ATOM 0 HE2 MET A 84 -1.415 -5.683 4.344 1.00 0.20 H new ATOM 0 HE3 MET A 84 -2.908 -6.170 5.182 1.00 0.20 H new ATOM 1980 N MET A 85 -5.143 -8.953 1.300 1.00 0.25 N ATOM 1981 CA MET A 85 -6.417 -9.480 0.815 1.00 0.36 C ATOM 1982 C MET A 85 -6.189 -10.325 -0.427 1.00 0.33 C ATOM 1983 O MET A 85 -6.630 -11.466 -0.504 1.00 0.43 O ATOM 1984 CB MET A 85 -7.383 -8.361 0.422 1.00 0.62 C ATOM 1985 CG MET A 85 -8.768 -8.888 0.055 1.00 0.77 C ATOM 1986 SD MET A 85 -9.715 -7.736 -0.943 1.00 0.67 S ATOM 1987 CE MET A 85 -10.214 -6.570 0.310 1.00 0.30 C ATOM 0 H MET A 85 -5.087 -7.935 1.313 1.00 0.25 H new ATOM 0 HA MET A 85 -6.844 -10.067 1.628 1.00 0.36 H new ATOM 0 HB2 MET A 85 -7.473 -7.656 1.248 1.00 0.62 H new ATOM 0 HB3 MET A 85 -6.971 -7.810 -0.424 1.00 0.62 H new ATOM 0 HG2 MET A 85 -8.661 -9.827 -0.487 1.00 0.77 H new ATOM 0 HG3 MET A 85 -9.321 -9.108 0.968 1.00 0.77 H new ATOM 0 HE1 MET A 85 -10.955 -5.886 -0.104 1.00 0.30 H new ATOM 0 HE2 MET A 85 -10.646 -7.106 1.155 1.00 0.30 H new ATOM 0 HE3 MET A 85 -9.346 -6.003 0.646 1.00 0.30 H new ATOM 1997 N CYS A 86 -5.494 -9.735 -1.393 1.00 0.32 N ATOM 1998 CA CYS A 86 -5.303 -10.334 -2.707 1.00 0.43 C ATOM 1999 C CYS A 86 -4.615 -11.690 -2.619 1.00 0.43 C ATOM 2000 O CYS A 86 -4.754 -12.502 -3.519 1.00 0.58 O ATOM 2001 CB CYS A 86 -4.501 -9.390 -3.611 1.00 0.49 C ATOM 2002 SG CYS A 86 -4.349 -9.958 -5.320 1.00 0.57 S ATOM 0 H CYS A 86 -5.046 -8.825 -1.286 1.00 0.32 H new ATOM 0 HA CYS A 86 -6.290 -10.494 -3.140 1.00 0.43 H new ATOM 0 HB2 CYS A 86 -4.976 -8.409 -3.606 1.00 0.49 H new ATOM 0 HB3 CYS A 86 -3.503 -9.263 -3.191 1.00 0.49 H new ATOM 0 HG CYS A 86 -4.465 -11.252 -5.359 1.00 0.57 H new ATOM 2008 N ASN A 87 -3.871 -11.934 -1.550 1.00 0.36 N ATOM 2009 CA ASN A 87 -3.263 -13.247 -1.343 1.00 0.44 C ATOM 2010 C ASN A 87 -4.342 -14.273 -1.018 1.00 0.47 C ATOM 2011 O ASN A 87 -4.397 -15.349 -1.617 1.00 0.54 O ATOM 2012 CB ASN A 87 -2.234 -13.198 -0.211 1.00 0.54 C ATOM 2013 CG ASN A 87 -1.482 -14.511 -0.043 1.00 0.72 C ATOM 2014 OD1 ASN A 87 -0.462 -14.741 -0.697 1.00 1.43 O ATOM 2015 ND2 ASN A 87 -1.959 -15.371 0.844 1.00 1.23 N ATOM 0 H ASN A 87 -3.673 -11.251 -0.818 1.00 0.36 H new ATOM 0 HA ASN A 87 -2.752 -13.538 -2.261 1.00 0.44 H new ATOM 0 HB2 ASN A 87 -1.520 -12.398 -0.409 1.00 0.54 H new ATOM 0 HB3 ASN A 87 -2.739 -12.951 0.723 1.00 0.54 H new ATOM 0 HD21 ASN A 87 -1.480 -16.257 1.004 1.00 1.23 H new ATOM 0 HD22 ASN A 87 -2.806 -15.147 1.367 1.00 1.23 H new ATOM 2022 N GLU A 88 -5.217 -13.910 -0.089 1.00 0.56 N ATOM 2023 CA GLU A 88 -6.313 -14.775 0.326 1.00 0.70 C ATOM 2024 C GLU A 88 -7.340 -14.891 -0.790 1.00 0.73 C ATOM 2025 O GLU A 88 -7.813 -15.981 -1.120 1.00 0.82 O ATOM 2026 CB GLU A 88 -6.991 -14.206 1.578 1.00 0.96 C ATOM 2027 CG GLU A 88 -6.027 -13.902 2.713 1.00 1.81 C ATOM 2028 CD GLU A 88 -5.177 -15.094 3.083 1.00 2.18 C ATOM 2029 OE1 GLU A 88 -5.668 -15.974 3.820 1.00 2.60 O ATOM 2030 OE2 GLU A 88 -4.018 -15.165 2.625 1.00 2.78 O ATOM 0 H GLU A 88 -5.187 -13.013 0.395 1.00 0.56 H new ATOM 0 HA GLU A 88 -5.908 -15.762 0.550 1.00 0.70 H new ATOM 0 HB2 GLU A 88 -7.521 -13.292 1.309 1.00 0.96 H new ATOM 0 HB3 GLU A 88 -7.739 -14.917 1.930 1.00 0.96 H new ATOM 0 HG2 GLU A 88 -5.380 -13.074 2.424 1.00 1.81 H new ATOM 0 HG3 GLU A 88 -6.591 -13.576 3.587 1.00 1.81 H new ATOM 2285 N ALA B 2 -3.787 -0.470 -17.706 1.00 0.34 N ATOM 2286 CA ALA B 2 -4.248 -1.496 -16.801 1.00 0.30 C ATOM 2287 C ALA B 2 -5.052 -0.835 -15.700 1.00 0.27 C ATOM 2288 O ALA B 2 -4.747 0.300 -15.342 1.00 0.36 O ATOM 2289 CB ALA B 2 -3.062 -2.253 -16.220 1.00 0.30 C ATOM 0 HA ALA B 2 -4.874 -2.213 -17.332 1.00 0.30 H new ATOM 0 HB1 ALA B 2 -3.421 -3.024 -15.539 1.00 0.30 H new ATOM 0 HB2 ALA B 2 -2.496 -2.717 -17.027 1.00 0.30 H new ATOM 0 HB3 ALA B 2 -2.419 -1.560 -15.677 1.00 0.30 H new ATOM 2295 N CYS B 3 -6.090 -1.514 -15.202 1.00 0.25 N ATOM 2296 CA CYS B 3 -6.880 -1.012 -14.083 1.00 0.23 C ATOM 2297 C CYS B 3 -5.953 -0.564 -12.963 1.00 0.17 C ATOM 2298 O CYS B 3 -5.396 -1.387 -12.235 1.00 0.17 O ATOM 2299 CB CYS B 3 -7.837 -2.093 -13.581 1.00 0.28 C ATOM 2300 SG CYS B 3 -8.933 -2.752 -14.860 1.00 0.39 S ATOM 0 H CYS B 3 -6.401 -2.417 -15.561 1.00 0.25 H new ATOM 0 HA CYS B 3 -7.471 -0.160 -14.418 1.00 0.23 H new ATOM 0 HB2 CYS B 3 -7.255 -2.912 -13.158 1.00 0.28 H new ATOM 0 HB3 CYS B 3 -8.443 -1.682 -12.774 1.00 0.28 H new ATOM 0 HG CYS B 3 -9.705 -3.662 -14.344 1.00 0.39 H new ATOM 2306 N PRO B 4 -5.772 0.759 -12.839 1.00 0.16 N ATOM 2307 CA PRO B 4 -4.744 1.355 -11.981 1.00 0.13 C ATOM 2308 C PRO B 4 -4.804 0.859 -10.547 1.00 0.12 C ATOM 2309 O PRO B 4 -3.865 0.234 -10.056 1.00 0.12 O ATOM 2310 CB PRO B 4 -5.078 2.843 -12.044 1.00 0.17 C ATOM 2311 CG PRO B 4 -5.721 3.016 -13.368 1.00 0.20 C ATOM 2312 CD PRO B 4 -6.563 1.791 -13.539 1.00 0.20 C ATOM 0 HA PRO B 4 -3.738 1.102 -12.314 1.00 0.13 H new ATOM 0 HB2 PRO B 4 -5.747 3.135 -11.235 1.00 0.17 H new ATOM 0 HB3 PRO B 4 -4.182 3.456 -11.953 1.00 0.17 H new ATOM 0 HG2 PRO B 4 -6.327 3.922 -13.400 1.00 0.20 H new ATOM 0 HG3 PRO B 4 -4.979 3.101 -14.162 1.00 0.20 H new ATOM 0 HD2 PRO B 4 -7.552 1.913 -13.097 1.00 0.20 H new ATOM 0 HD3 PRO B 4 -6.712 1.544 -14.590 1.00 0.20 H new ATOM 2320 N LEU B 5 -5.925 1.114 -9.895 1.00 0.13 N ATOM 2321 CA LEU B 5 -6.078 0.764 -8.497 1.00 0.14 C ATOM 2322 C LEU B 5 -6.087 -0.754 -8.333 1.00 0.16 C ATOM 2323 O LEU B 5 -5.556 -1.274 -7.361 1.00 0.22 O ATOM 2324 CB LEU B 5 -7.362 1.386 -7.939 1.00 0.15 C ATOM 2325 CG LEU B 5 -7.265 1.975 -6.528 1.00 0.16 C ATOM 2326 CD1 LEU B 5 -7.009 0.900 -5.506 1.00 0.18 C ATOM 2327 CD2 LEU B 5 -6.177 3.022 -6.448 1.00 0.17 C ATOM 0 H LEU B 5 -6.741 1.562 -10.312 1.00 0.13 H new ATOM 0 HA LEU B 5 -5.234 1.160 -7.933 1.00 0.14 H new ATOM 0 HB2 LEU B 5 -7.685 2.174 -8.619 1.00 0.15 H new ATOM 0 HB3 LEU B 5 -8.142 0.624 -7.940 1.00 0.15 H new ATOM 0 HG LEU B 5 -8.223 2.446 -6.309 1.00 0.16 H new ATOM 0 HD11 LEU B 5 -6.945 1.348 -4.515 1.00 0.18 H new ATOM 0 HD12 LEU B 5 -7.825 0.178 -5.526 1.00 0.18 H new ATOM 0 HD13 LEU B 5 -6.071 0.395 -5.737 1.00 0.18 H new ATOM 0 HD21 LEU B 5 -6.131 3.422 -5.435 1.00 0.17 H new ATOM 0 HD22 LEU B 5 -5.218 2.571 -6.703 1.00 0.17 H new ATOM 0 HD23 LEU B 5 -6.396 3.829 -7.148 1.00 0.17 H new ATOM 2339 N GLU B 6 -6.656 -1.458 -9.309 1.00 0.16 N ATOM 2340 CA GLU B 6 -6.730 -2.915 -9.247 1.00 0.20 C ATOM 2341 C GLU B 6 -5.337 -3.531 -9.267 1.00 0.18 C ATOM 2342 O GLU B 6 -5.014 -4.381 -8.434 1.00 0.23 O ATOM 2343 CB GLU B 6 -7.557 -3.480 -10.404 1.00 0.29 C ATOM 2344 CG GLU B 6 -7.671 -4.998 -10.373 1.00 0.43 C ATOM 2345 CD GLU B 6 -8.565 -5.548 -11.462 1.00 0.90 C ATOM 2346 OE1 GLU B 6 -8.213 -5.409 -12.650 1.00 1.39 O ATOM 2347 OE2 GLU B 6 -9.608 -6.158 -11.131 1.00 1.79 O ATOM 0 H GLU B 6 -7.069 -1.047 -10.146 1.00 0.16 H new ATOM 0 HA GLU B 6 -7.221 -3.174 -8.309 1.00 0.20 H new ATOM 0 HB2 GLU B 6 -8.556 -3.046 -10.374 1.00 0.29 H new ATOM 0 HB3 GLU B 6 -7.105 -3.175 -11.348 1.00 0.29 H new ATOM 0 HG2 GLU B 6 -6.677 -5.433 -10.473 1.00 0.43 H new ATOM 0 HG3 GLU B 6 -8.058 -5.308 -9.402 1.00 0.43 H new ATOM 2354 N LYS B 7 -4.512 -3.101 -10.221 1.00 0.16 N ATOM 2355 CA LYS B 7 -3.159 -3.604 -10.332 1.00 0.18 C ATOM 2356 C LYS B 7 -2.378 -3.357 -9.053 1.00 0.17 C ATOM 2357 O LYS B 7 -1.604 -4.204 -8.645 1.00 0.19 O ATOM 2358 CB LYS B 7 -2.447 -2.988 -11.545 1.00 0.25 C ATOM 2359 CG LYS B 7 -2.711 -3.698 -12.877 1.00 0.41 C ATOM 2360 CD LYS B 7 -4.000 -4.521 -12.904 1.00 0.90 C ATOM 2361 CE LYS B 7 -3.832 -5.884 -12.240 1.00 0.84 C ATOM 2362 NZ LYS B 7 -2.881 -6.764 -12.972 1.00 1.18 N ATOM 0 H LYS B 7 -4.764 -2.406 -10.924 1.00 0.16 H new ATOM 0 HA LYS B 7 -3.210 -4.682 -10.484 1.00 0.18 H new ATOM 0 HB2 LYS B 7 -2.754 -1.946 -11.638 1.00 0.25 H new ATOM 0 HB3 LYS B 7 -1.373 -2.988 -11.356 1.00 0.25 H new ATOM 0 HG2 LYS B 7 -2.752 -2.953 -13.671 1.00 0.41 H new ATOM 0 HG3 LYS B 7 -1.869 -4.354 -13.099 1.00 0.41 H new ATOM 0 HD2 LYS B 7 -4.792 -3.968 -12.398 1.00 0.90 H new ATOM 0 HD3 LYS B 7 -4.318 -4.660 -13.937 1.00 0.90 H new ATOM 0 HE2 LYS B 7 -3.480 -5.745 -11.218 1.00 0.84 H new ATOM 0 HE3 LYS B 7 -4.803 -6.376 -12.178 1.00 0.84 H new ATOM 0 HZ1 LYS B 7 -3.391 -7.588 -13.349 1.00 1.18 H new ATOM 0 HZ2 LYS B 7 -2.451 -6.234 -13.757 1.00 1.18 H new ATOM 0 HZ3 LYS B 7 -2.136 -7.086 -12.322 1.00 1.18 H new ATOM 2376 N ALA B 8 -2.623 -2.223 -8.406 1.00 0.17 N ATOM 2377 CA ALA B 8 -1.941 -1.882 -7.158 1.00 0.17 C ATOM 2378 C ALA B 8 -1.942 -3.045 -6.164 1.00 0.17 C ATOM 2379 O ALA B 8 -0.915 -3.353 -5.568 1.00 0.22 O ATOM 2380 CB ALA B 8 -2.573 -0.660 -6.519 1.00 0.18 C ATOM 0 H ALA B 8 -3.291 -1.521 -8.725 1.00 0.17 H new ATOM 0 HA ALA B 8 -0.904 -1.662 -7.413 1.00 0.17 H new ATOM 0 HB1 ALA B 8 -2.051 -0.423 -5.592 1.00 0.18 H new ATOM 0 HB2 ALA B 8 -2.501 0.186 -7.202 1.00 0.18 H new ATOM 0 HB3 ALA B 8 -3.622 -0.864 -6.303 1.00 0.18 H new ATOM 2386 N LEU B 9 -3.090 -3.695 -5.997 1.00 0.13 N ATOM 2387 CA LEU B 9 -3.190 -4.818 -5.065 1.00 0.12 C ATOM 2388 C LEU B 9 -2.618 -6.082 -5.687 1.00 0.14 C ATOM 2389 O LEU B 9 -1.828 -6.793 -5.062 1.00 0.18 O ATOM 2390 CB LEU B 9 -4.641 -5.077 -4.639 1.00 0.13 C ATOM 2391 CG LEU B 9 -5.361 -3.901 -3.978 1.00 0.13 C ATOM 2392 CD1 LEU B 9 -4.417 -3.160 -3.068 1.00 0.15 C ATOM 2393 CD2 LEU B 9 -5.950 -2.957 -5.005 1.00 0.13 C ATOM 0 H LEU B 9 -3.955 -3.469 -6.487 1.00 0.13 H new ATOM 0 HA LEU B 9 -2.613 -4.550 -4.180 1.00 0.12 H new ATOM 0 HB2 LEU B 9 -5.210 -5.379 -5.519 1.00 0.13 H new ATOM 0 HB3 LEU B 9 -4.652 -5.920 -3.948 1.00 0.13 H new ATOM 0 HG LEU B 9 -6.185 -4.304 -3.389 1.00 0.13 H new ATOM 0 HD11 LEU B 9 -4.941 -2.325 -2.603 1.00 0.15 H new ATOM 0 HD12 LEU B 9 -4.052 -3.836 -2.294 1.00 0.15 H new ATOM 0 HD13 LEU B 9 -3.574 -2.783 -3.647 1.00 0.15 H new ATOM 0 HD21 LEU B 9 -6.453 -2.134 -4.497 1.00 0.13 H new ATOM 0 HD22 LEU B 9 -5.153 -2.561 -5.635 1.00 0.13 H new ATOM 0 HD23 LEU B 9 -6.668 -3.495 -5.624 1.00 0.13 H new ATOM 2405 N ASP B 10 -3.020 -6.345 -6.925 1.00 0.14 N ATOM 2406 CA ASP B 10 -2.585 -7.537 -7.646 1.00 0.16 C ATOM 2407 C ASP B 10 -1.066 -7.622 -7.720 1.00 0.15 C ATOM 2408 O ASP B 10 -0.477 -8.660 -7.426 1.00 0.19 O ATOM 2409 CB ASP B 10 -3.176 -7.537 -9.059 1.00 0.20 C ATOM 2410 CG ASP B 10 -2.528 -8.563 -9.973 1.00 0.51 C ATOM 2411 OD1 ASP B 10 -2.705 -9.774 -9.741 1.00 1.22 O ATOM 2412 OD2 ASP B 10 -1.845 -8.157 -10.939 1.00 1.19 O ATOM 0 H ASP B 10 -3.652 -5.744 -7.454 1.00 0.14 H new ATOM 0 HA ASP B 10 -2.944 -8.409 -7.099 1.00 0.16 H new ATOM 0 HB2 ASP B 10 -4.246 -7.736 -8.999 1.00 0.20 H new ATOM 0 HB3 ASP B 10 -3.060 -6.545 -9.495 1.00 0.20 H new ATOM 2417 N VAL B 11 -0.436 -6.517 -8.082 1.00 0.15 N ATOM 2418 CA VAL B 11 0.994 -6.503 -8.323 1.00 0.16 C ATOM 2419 C VAL B 11 1.794 -6.646 -7.036 1.00 0.16 C ATOM 2420 O VAL B 11 2.942 -7.068 -7.082 1.00 0.20 O ATOM 2421 CB VAL B 11 1.445 -5.231 -9.057 1.00 0.18 C ATOM 2422 CG1 VAL B 11 0.634 -5.041 -10.331 1.00 0.21 C ATOM 2423 CG2 VAL B 11 1.344 -4.013 -8.150 1.00 0.17 C ATOM 0 H VAL B 11 -0.895 -5.616 -8.215 1.00 0.15 H new ATOM 0 HA VAL B 11 1.193 -7.366 -8.959 1.00 0.16 H new ATOM 0 HB VAL B 11 2.493 -5.345 -9.335 1.00 0.18 H new ATOM 0 HG11 VAL B 11 0.964 -4.136 -10.841 1.00 0.21 H new ATOM 0 HG12 VAL B 11 0.779 -5.900 -10.986 1.00 0.21 H new ATOM 0 HG13 VAL B 11 -0.423 -4.951 -10.080 1.00 0.21 H new ATOM 0 HG21 VAL B 11 1.669 -3.126 -8.694 1.00 0.17 H new ATOM 0 HG22 VAL B 11 0.310 -3.883 -7.829 1.00 0.17 H new ATOM 0 HG23 VAL B 11 1.980 -4.156 -7.276 1.00 0.17 H new ATOM 2433 N MET B 12 1.207 -6.292 -5.894 1.00 0.16 N ATOM 2434 CA MET B 12 1.898 -6.474 -4.620 1.00 0.20 C ATOM 2435 C MET B 12 2.250 -7.943 -4.432 1.00 0.23 C ATOM 2436 O MET B 12 3.417 -8.297 -4.289 1.00 0.39 O ATOM 2437 CB MET B 12 1.060 -5.990 -3.439 1.00 0.27 C ATOM 2438 CG MET B 12 0.822 -4.490 -3.410 1.00 0.16 C ATOM 2439 SD MET B 12 0.395 -3.904 -1.764 1.00 0.78 S ATOM 2440 CE MET B 12 0.008 -2.205 -2.096 1.00 0.19 C ATOM 0 H MET B 12 0.274 -5.886 -5.824 1.00 0.16 H new ATOM 0 HA MET B 12 2.807 -5.873 -4.649 1.00 0.20 H new ATOM 0 HB2 MET B 12 0.096 -6.498 -3.461 1.00 0.27 H new ATOM 0 HB3 MET B 12 1.554 -6.285 -2.513 1.00 0.27 H new ATOM 0 HG2 MET B 12 1.718 -3.975 -3.757 1.00 0.16 H new ATOM 0 HG3 MET B 12 0.020 -4.237 -4.104 1.00 0.16 H new ATOM 0 HE1 MET B 12 0.641 -1.562 -1.484 1.00 0.19 H new ATOM 0 HE2 MET B 12 0.184 -1.991 -3.150 1.00 0.19 H new ATOM 0 HE3 MET B 12 -1.039 -2.017 -1.858 1.00 0.19 H new ATOM 2450 N VAL B 13 1.237 -8.803 -4.489 1.00 0.18 N ATOM 2451 CA VAL B 13 1.442 -10.233 -4.284 1.00 0.19 C ATOM 2452 C VAL B 13 1.997 -10.905 -5.547 1.00 0.19 C ATOM 2453 O VAL B 13 2.587 -11.984 -5.482 1.00 0.25 O ATOM 2454 CB VAL B 13 0.143 -10.945 -3.846 1.00 0.20 C ATOM 2455 CG1 VAL B 13 -0.380 -10.335 -2.560 1.00 0.21 C ATOM 2456 CG2 VAL B 13 -0.916 -10.889 -4.933 1.00 0.22 C ATOM 0 H VAL B 13 0.270 -8.536 -4.675 1.00 0.18 H new ATOM 0 HA VAL B 13 2.173 -10.329 -3.482 1.00 0.19 H new ATOM 0 HB VAL B 13 0.378 -11.995 -3.670 1.00 0.20 H new ATOM 0 HG11 VAL B 13 -1.296 -10.845 -2.261 1.00 0.21 H new ATOM 0 HG12 VAL B 13 0.368 -10.444 -1.775 1.00 0.21 H new ATOM 0 HG13 VAL B 13 -0.589 -9.277 -2.718 1.00 0.21 H new ATOM 0 HG21 VAL B 13 -1.816 -11.400 -4.591 1.00 0.22 H new ATOM 0 HG22 VAL B 13 -1.152 -9.849 -5.158 1.00 0.22 H new ATOM 0 HG23 VAL B 13 -0.541 -11.378 -5.832 1.00 0.22 H new ATOM 2466 N SER B 14 1.814 -10.258 -6.693 1.00 0.18 N ATOM 2467 CA SER B 14 2.322 -10.777 -7.957 1.00 0.21 C ATOM 2468 C SER B 14 3.831 -10.549 -8.054 1.00 0.23 C ATOM 2469 O SER B 14 4.602 -11.492 -8.260 1.00 0.26 O ATOM 2470 CB SER B 14 1.604 -10.106 -9.131 1.00 0.23 C ATOM 2471 OG SER B 14 1.907 -10.737 -10.365 1.00 1.12 O ATOM 0 H SER B 14 1.316 -9.371 -6.772 1.00 0.18 H new ATOM 0 HA SER B 14 2.130 -11.849 -7.999 1.00 0.21 H new ATOM 0 HB2 SER B 14 0.527 -10.135 -8.963 1.00 0.23 H new ATOM 0 HB3 SER B 14 1.891 -9.056 -9.180 1.00 0.23 H new ATOM 0 HG SER B 14 1.430 -10.283 -11.091 1.00 1.12 H new ATOM 2477 N THR B 15 4.247 -9.297 -7.882 1.00 0.24 N ATOM 2478 CA THR B 15 5.660 -8.943 -7.897 1.00 0.26 C ATOM 2479 C THR B 15 6.359 -9.574 -6.696 1.00 0.28 C ATOM 2480 O THR B 15 7.563 -9.830 -6.720 1.00 0.31 O ATOM 2481 CB THR B 15 5.839 -7.412 -7.871 1.00 0.27 C ATOM 2482 OG1 THR B 15 4.951 -6.810 -8.824 1.00 0.33 O ATOM 2483 CG2 THR B 15 7.269 -7.010 -8.196 1.00 0.25 C ATOM 0 H THR B 15 3.619 -8.507 -7.730 1.00 0.24 H new ATOM 0 HA THR B 15 6.107 -9.323 -8.816 1.00 0.26 H new ATOM 0 HB THR B 15 5.608 -7.064 -6.864 1.00 0.27 H new ATOM 0 HG1 THR B 15 4.073 -6.673 -8.411 1.00 0.33 H new ATOM 0 HG21 THR B 15 7.357 -5.924 -8.168 1.00 0.25 H new ATOM 0 HG22 THR B 15 7.946 -7.448 -7.462 1.00 0.25 H new ATOM 0 HG23 THR B 15 7.531 -7.370 -9.191 1.00 0.25 H new ATOM 2491 N PHE B 16 5.573 -9.824 -5.650 1.00 0.30 N ATOM 2492 CA PHE B 16 6.020 -10.592 -4.497 1.00 0.36 C ATOM 2493 C PHE B 16 6.700 -11.874 -4.957 1.00 0.40 C ATOM 2494 O PHE B 16 7.897 -12.070 -4.747 1.00 0.51 O ATOM 2495 CB PHE B 16 4.817 -10.974 -3.635 1.00 0.44 C ATOM 2496 CG PHE B 16 4.900 -10.556 -2.204 1.00 0.34 C ATOM 2497 CD1 PHE B 16 5.954 -10.953 -1.408 1.00 1.21 C ATOM 2498 CD2 PHE B 16 3.906 -9.774 -1.650 1.00 1.27 C ATOM 2499 CE1 PHE B 16 6.015 -10.573 -0.085 1.00 1.38 C ATOM 2500 CE2 PHE B 16 3.962 -9.396 -0.330 1.00 1.42 C ATOM 2501 CZ PHE B 16 5.018 -9.795 0.456 1.00 0.97 C ATOM 0 H PHE B 16 4.609 -9.498 -5.581 1.00 0.30 H new ATOM 0 HA PHE B 16 6.719 -9.982 -3.924 1.00 0.36 H new ATOM 0 HB2 PHE B 16 3.922 -10.534 -4.074 1.00 0.44 H new ATOM 0 HB3 PHE B 16 4.692 -12.056 -3.674 1.00 0.44 H new ATOM 0 HD1 PHE B 16 6.738 -11.567 -1.825 1.00 1.21 H new ATOM 0 HD2 PHE B 16 3.075 -9.456 -2.261 1.00 1.27 H new ATOM 0 HE1 PHE B 16 6.847 -10.886 0.528 1.00 1.38 H new ATOM 0 HE2 PHE B 16 3.177 -8.785 0.090 1.00 1.42 H new ATOM 0 HZ PHE B 16 5.064 -9.499 1.494 1.00 0.97 H new ATOM 2511 N HIS B 17 5.914 -12.729 -5.615 1.00 0.41 N ATOM 2512 CA HIS B 17 6.384 -14.029 -6.099 1.00 0.51 C ATOM 2513 C HIS B 17 7.608 -13.883 -6.991 1.00 0.45 C ATOM 2514 O HIS B 17 8.490 -14.740 -6.992 1.00 0.51 O ATOM 2515 CB HIS B 17 5.276 -14.744 -6.882 1.00 0.68 C ATOM 2516 CG HIS B 17 4.239 -15.403 -6.026 1.00 1.09 C ATOM 2517 ND1 HIS B 17 3.924 -16.739 -6.132 1.00 2.16 N ATOM 2518 CD2 HIS B 17 3.433 -14.904 -5.061 1.00 1.26 C ATOM 2519 CE1 HIS B 17 2.974 -17.035 -5.269 1.00 2.82 C ATOM 2520 NE2 HIS B 17 2.658 -15.940 -4.606 1.00 2.30 N ATOM 0 H HIS B 17 4.934 -12.540 -5.827 1.00 0.41 H new ATOM 0 HA HIS B 17 6.657 -14.619 -5.224 1.00 0.51 H new ATOM 0 HB2 HIS B 17 4.785 -14.022 -7.535 1.00 0.68 H new ATOM 0 HB3 HIS B 17 5.731 -15.497 -7.525 1.00 0.68 H new ATOM 0 HD2 HIS B 17 3.405 -13.882 -4.714 1.00 1.26 H new ATOM 0 HE1 HIS B 17 2.529 -18.009 -5.128 1.00 2.82 H new ATOM 0 HE2 HIS B 17 1.951 -15.874 -3.873 1.00 2.30 H new ATOM 2529 N LYS B 18 7.654 -12.786 -7.731 1.00 0.42 N ATOM 2530 CA LYS B 18 8.726 -12.526 -8.685 1.00 0.46 C ATOM 2531 C LYS B 18 10.098 -12.502 -8.001 1.00 0.45 C ATOM 2532 O LYS B 18 11.101 -12.899 -8.598 1.00 0.62 O ATOM 2533 CB LYS B 18 8.448 -11.195 -9.396 1.00 0.55 C ATOM 2534 CG LYS B 18 9.444 -10.833 -10.485 1.00 0.76 C ATOM 2535 CD LYS B 18 9.092 -9.494 -11.118 1.00 0.71 C ATOM 2536 CE LYS B 18 10.117 -9.067 -12.157 1.00 1.40 C ATOM 2537 NZ LYS B 18 9.821 -7.711 -12.697 1.00 1.67 N ATOM 0 H LYS B 18 6.950 -12.049 -7.689 1.00 0.42 H new ATOM 0 HA LYS B 18 8.751 -13.335 -9.416 1.00 0.46 H new ATOM 0 HB2 LYS B 18 7.451 -11.235 -9.834 1.00 0.55 H new ATOM 0 HB3 LYS B 18 8.438 -10.398 -8.653 1.00 0.55 H new ATOM 0 HG2 LYS B 18 10.449 -10.788 -10.065 1.00 0.76 H new ATOM 0 HG3 LYS B 18 9.452 -11.610 -11.249 1.00 0.76 H new ATOM 0 HD2 LYS B 18 8.109 -9.561 -11.585 1.00 0.71 H new ATOM 0 HD3 LYS B 18 9.025 -8.732 -10.341 1.00 0.71 H new ATOM 0 HE2 LYS B 18 11.111 -9.072 -11.711 1.00 1.40 H new ATOM 0 HE3 LYS B 18 10.130 -9.789 -12.973 1.00 1.40 H new ATOM 0 HZ1 LYS B 18 10.511 -7.475 -13.439 1.00 1.67 H new ATOM 0 HZ2 LYS B 18 8.862 -7.699 -13.099 1.00 1.67 H new ATOM 0 HZ3 LYS B 18 9.883 -7.011 -11.930 1.00 1.67 H new ATOM 2551 N TYR B 19 10.139 -12.057 -6.745 1.00 0.39 N ATOM 2552 CA TYR B 19 11.409 -11.923 -6.027 1.00 0.43 C ATOM 2553 C TYR B 19 11.449 -12.763 -4.758 1.00 0.50 C ATOM 2554 O TYR B 19 12.372 -13.530 -4.572 1.00 0.74 O ATOM 2555 CB TYR B 19 11.677 -10.459 -5.691 1.00 0.46 C ATOM 2556 CG TYR B 19 11.724 -9.575 -6.912 1.00 0.41 C ATOM 2557 CD1 TYR B 19 12.849 -9.540 -7.725 1.00 1.17 C ATOM 2558 CD2 TYR B 19 10.636 -8.791 -7.260 1.00 1.17 C ATOM 2559 CE1 TYR B 19 12.882 -8.742 -8.856 1.00 1.21 C ATOM 2560 CE2 TYR B 19 10.663 -7.991 -8.382 1.00 1.17 C ATOM 2561 CZ TYR B 19 11.784 -7.970 -9.175 1.00 0.50 C ATOM 2562 OH TYR B 19 11.801 -7.185 -10.300 1.00 0.61 O ATOM 0 H TYR B 19 9.316 -11.785 -6.207 1.00 0.39 H new ATOM 0 HA TYR B 19 12.191 -12.295 -6.690 1.00 0.43 H new ATOM 0 HB2 TYR B 19 10.900 -10.098 -5.017 1.00 0.46 H new ATOM 0 HB3 TYR B 19 12.624 -10.382 -5.156 1.00 0.46 H new ATOM 0 HD1 TYR B 19 13.709 -10.143 -7.472 1.00 1.17 H new ATOM 0 HD2 TYR B 19 9.751 -8.807 -6.641 1.00 1.17 H new ATOM 0 HE1 TYR B 19 13.761 -8.724 -9.484 1.00 1.21 H new ATOM 0 HE2 TYR B 19 9.807 -7.384 -8.636 1.00 1.17 H new ATOM 0 HH TYR B 19 10.990 -6.635 -10.328 1.00 0.61 H new ATOM 2572 N SER B 20 10.450 -12.631 -3.893 1.00 0.41 N ATOM 2573 CA SER B 20 10.485 -13.308 -2.595 1.00 0.48 C ATOM 2574 C SER B 20 10.641 -14.822 -2.755 1.00 0.57 C ATOM 2575 O SER B 20 11.408 -15.453 -2.028 1.00 0.70 O ATOM 2576 CB SER B 20 9.230 -12.981 -1.788 1.00 0.49 C ATOM 2577 OG SER B 20 8.058 -13.342 -2.491 1.00 0.53 O ATOM 0 H SER B 20 9.615 -12.070 -4.060 1.00 0.41 H new ATOM 0 HA SER B 20 11.357 -12.941 -2.053 1.00 0.48 H new ATOM 0 HB2 SER B 20 9.261 -13.508 -0.834 1.00 0.49 H new ATOM 0 HB3 SER B 20 9.208 -11.915 -1.563 1.00 0.49 H new ATOM 0 HG SER B 20 8.192 -13.191 -3.450 1.00 0.53 H new ATOM 2583 N GLY B 21 9.940 -15.391 -3.735 1.00 0.57 N ATOM 2584 CA GLY B 21 10.024 -16.822 -3.987 1.00 0.68 C ATOM 2585 C GLY B 21 11.271 -17.195 -4.770 1.00 0.71 C ATOM 2586 O GLY B 21 11.229 -18.032 -5.675 1.00 0.86 O ATOM 0 H GLY B 21 9.314 -14.885 -4.361 1.00 0.57 H new ATOM 0 HA2 GLY B 21 10.020 -17.357 -3.037 1.00 0.68 H new ATOM 0 HA3 GLY B 21 9.141 -17.144 -4.539 1.00 0.68 H new ATOM 2688 N LYS B 28 7.725 -13.233 1.518 1.00 0.69 N ATOM 2689 CA LYS B 28 8.670 -12.454 2.306 1.00 0.68 C ATOM 2690 C LYS B 28 9.996 -12.272 1.563 1.00 0.50 C ATOM 2691 O LYS B 28 10.560 -13.224 1.028 1.00 0.54 O ATOM 2692 CB LYS B 28 8.882 -13.105 3.679 1.00 0.92 C ATOM 2693 CG LYS B 28 9.488 -14.495 3.626 1.00 0.93 C ATOM 2694 CD LYS B 28 10.911 -14.483 4.147 1.00 0.98 C ATOM 2695 CE LYS B 28 11.568 -15.849 3.994 1.00 1.51 C ATOM 2696 NZ LYS B 28 12.947 -15.879 4.548 1.00 1.98 N ATOM 0 HA LYS B 28 8.250 -11.460 2.462 1.00 0.68 H new ATOM 0 HB2 LYS B 28 9.529 -12.462 4.276 1.00 0.92 H new ATOM 0 HB3 LYS B 28 7.923 -13.159 4.194 1.00 0.92 H new ATOM 0 HG2 LYS B 28 8.885 -15.182 4.219 1.00 0.93 H new ATOM 0 HG3 LYS B 28 9.475 -14.863 2.600 1.00 0.93 H new ATOM 0 HD2 LYS B 28 11.492 -13.735 3.607 1.00 0.98 H new ATOM 0 HD3 LYS B 28 10.914 -14.191 5.197 1.00 0.98 H new ATOM 0 HE2 LYS B 28 10.960 -16.600 4.498 1.00 1.51 H new ATOM 0 HE3 LYS B 28 11.597 -16.119 2.938 1.00 1.51 H new ATOM 0 HZ1 LYS B 28 13.308 -16.854 4.529 1.00 1.98 H new ATOM 0 HZ2 LYS B 28 13.565 -15.270 3.975 1.00 1.98 H new ATOM 0 HZ3 LYS B 28 12.935 -15.534 5.529 1.00 1.98 H new ATOM 2710 N LEU B 29 10.484 -11.037 1.534 1.00 0.38 N ATOM 2711 CA LEU B 29 11.685 -10.699 0.770 1.00 0.32 C ATOM 2712 C LEU B 29 12.841 -10.343 1.689 1.00 0.33 C ATOM 2713 O LEU B 29 12.647 -9.723 2.727 1.00 0.42 O ATOM 2714 CB LEU B 29 11.436 -9.504 -0.164 1.00 0.29 C ATOM 2715 CG LEU B 29 10.407 -9.710 -1.276 1.00 0.29 C ATOM 2716 CD1 LEU B 29 9.002 -9.592 -0.731 1.00 0.34 C ATOM 2717 CD2 LEU B 29 10.625 -8.707 -2.396 1.00 0.31 C ATOM 0 H LEU B 29 10.067 -10.250 2.031 1.00 0.38 H new ATOM 0 HA LEU B 29 11.936 -11.582 0.182 1.00 0.32 H new ATOM 0 HB2 LEU B 29 11.117 -8.657 0.443 1.00 0.29 H new ATOM 0 HB3 LEU B 29 12.385 -9.227 -0.624 1.00 0.29 H new ATOM 0 HG LEU B 29 10.537 -10.714 -1.679 1.00 0.29 H new ATOM 0 HD11 LEU B 29 8.285 -9.742 -1.538 1.00 0.34 H new ATOM 0 HD12 LEU B 29 8.846 -10.348 0.038 1.00 0.34 H new ATOM 0 HD13 LEU B 29 8.861 -8.601 -0.300 1.00 0.34 H new ATOM 0 HD21 LEU B 29 9.884 -8.869 -3.179 1.00 0.31 H new ATOM 0 HD22 LEU B 29 10.523 -7.695 -2.003 1.00 0.31 H new ATOM 0 HD23 LEU B 29 11.625 -8.836 -2.811 1.00 0.31 H new ATOM 2729 N ASN B 30 14.048 -10.719 1.300 1.00 0.31 N ATOM 2730 CA ASN B 30 15.235 -10.278 2.017 1.00 0.31 C ATOM 2731 C ASN B 30 15.798 -9.041 1.321 1.00 0.27 C ATOM 2732 O ASN B 30 15.177 -8.531 0.382 1.00 0.26 O ATOM 2733 CB ASN B 30 16.291 -11.391 2.099 1.00 0.35 C ATOM 2734 CG ASN B 30 17.074 -11.573 0.814 1.00 0.58 C ATOM 2735 OD1 ASN B 30 18.088 -10.912 0.589 1.00 1.17 O ATOM 2736 ND2 ASN B 30 16.634 -12.486 -0.024 1.00 0.60 N ATOM 0 H ASN B 30 14.232 -11.323 0.499 1.00 0.31 H new ATOM 0 HA ASN B 30 14.960 -10.029 3.042 1.00 0.31 H new ATOM 0 HB2 ASN B 30 16.984 -11.165 2.909 1.00 0.35 H new ATOM 0 HB3 ASN B 30 15.799 -12.330 2.352 1.00 0.35 H new ATOM 0 HD21 ASN B 30 17.137 -12.665 -0.893 1.00 0.60 H new ATOM 0 HD22 ASN B 30 15.790 -13.015 0.195 1.00 0.60 H new ATOM 2743 N LYS B 31 16.953 -8.561 1.780 1.00 0.27 N ATOM 2744 CA LYS B 31 17.581 -7.367 1.212 1.00 0.26 C ATOM 2745 C LYS B 31 17.634 -7.430 -0.315 1.00 0.25 C ATOM 2746 O LYS B 31 17.131 -6.549 -1.006 1.00 0.28 O ATOM 2747 CB LYS B 31 19.010 -7.204 1.737 1.00 0.29 C ATOM 2748 CG LYS B 31 19.120 -7.074 3.243 1.00 0.40 C ATOM 2749 CD LYS B 31 20.573 -6.976 3.676 1.00 0.49 C ATOM 2750 CE LYS B 31 20.711 -6.987 5.188 1.00 1.20 C ATOM 2751 NZ LYS B 31 22.137 -7.020 5.608 1.00 1.72 N ATOM 0 H LYS B 31 17.476 -8.983 2.548 1.00 0.27 H new ATOM 0 HA LYS B 31 16.970 -6.517 1.515 1.00 0.26 H new ATOM 0 HB2 LYS B 31 19.601 -8.062 1.416 1.00 0.29 H new ATOM 0 HB3 LYS B 31 19.453 -6.321 1.276 1.00 0.29 H new ATOM 0 HG2 LYS B 31 18.577 -6.189 3.576 1.00 0.40 H new ATOM 0 HG3 LYS B 31 18.651 -7.934 3.721 1.00 0.40 H new ATOM 0 HD2 LYS B 31 21.135 -7.808 3.253 1.00 0.49 H new ATOM 0 HD3 LYS B 31 21.010 -6.061 3.277 1.00 0.49 H new ATOM 0 HE2 LYS B 31 20.229 -6.102 5.604 1.00 1.20 H new ATOM 0 HE3 LYS B 31 20.191 -7.854 5.595 1.00 1.20 H new ATOM 0 HZ1 LYS B 31 22.193 -7.027 6.646 1.00 1.72 H new ATOM 0 HZ2 LYS B 31 22.590 -7.877 5.231 1.00 1.72 H new ATOM 0 HZ3 LYS B 31 22.627 -6.179 5.240 1.00 1.72 H new ATOM 2765 N SER B 32 18.225 -8.499 -0.827 1.00 0.25 N ATOM 2766 CA SER B 32 18.487 -8.642 -2.254 1.00 0.27 C ATOM 2767 C SER B 32 17.193 -8.718 -3.068 1.00 0.24 C ATOM 2768 O SER B 32 17.176 -8.378 -4.254 1.00 0.27 O ATOM 2769 CB SER B 32 19.342 -9.887 -2.490 1.00 0.35 C ATOM 2770 OG SER B 32 19.653 -10.058 -3.863 1.00 1.27 O ATOM 0 H SER B 32 18.537 -9.292 -0.267 1.00 0.25 H new ATOM 0 HA SER B 32 19.025 -7.757 -2.592 1.00 0.27 H new ATOM 0 HB2 SER B 32 20.265 -9.809 -1.915 1.00 0.35 H new ATOM 0 HB3 SER B 32 18.812 -10.767 -2.125 1.00 0.35 H new ATOM 0 HG SER B 32 20.202 -10.862 -3.976 1.00 1.27 H new ATOM 2776 N GLU B 33 16.111 -9.144 -2.436 1.00 0.25 N ATOM 2777 CA GLU B 33 14.840 -9.272 -3.133 1.00 0.27 C ATOM 2778 C GLU B 33 14.183 -7.909 -3.277 1.00 0.24 C ATOM 2779 O GLU B 33 13.680 -7.562 -4.345 1.00 0.26 O ATOM 2780 CB GLU B 33 13.916 -10.238 -2.399 1.00 0.34 C ATOM 2781 CG GLU B 33 14.539 -11.600 -2.138 1.00 0.47 C ATOM 2782 CD GLU B 33 14.885 -12.370 -3.402 1.00 0.83 C ATOM 2783 OE1 GLU B 33 15.138 -11.739 -4.459 1.00 1.65 O ATOM 2784 OE2 GLU B 33 14.909 -13.613 -3.339 1.00 1.43 O ATOM 0 H GLU B 33 16.086 -9.405 -1.450 1.00 0.25 H new ATOM 0 HA GLU B 33 15.029 -9.676 -4.128 1.00 0.27 H new ATOM 0 HB2 GLU B 33 13.623 -9.794 -1.448 1.00 0.34 H new ATOM 0 HB3 GLU B 33 13.005 -10.371 -2.983 1.00 0.34 H new ATOM 0 HG2 GLU B 33 15.444 -11.467 -1.546 1.00 0.47 H new ATOM 0 HG3 GLU B 33 13.850 -12.195 -1.539 1.00 0.47 H new ATOM 2791 N LEU B 34 14.203 -7.131 -2.198 1.00 0.21 N ATOM 2792 CA LEU B 34 13.729 -5.757 -2.246 1.00 0.21 C ATOM 2793 C LEU B 34 14.622 -4.939 -3.161 1.00 0.20 C ATOM 2794 O LEU B 34 14.158 -4.049 -3.873 1.00 0.24 O ATOM 2795 CB LEU B 34 13.704 -5.150 -0.845 1.00 0.21 C ATOM 2796 CG LEU B 34 12.500 -5.543 0.004 1.00 0.21 C ATOM 2797 CD1 LEU B 34 12.714 -5.129 1.449 1.00 0.24 C ATOM 2798 CD2 LEU B 34 11.241 -4.900 -0.552 1.00 0.21 C ATOM 0 H LEU B 34 14.542 -7.430 -1.284 1.00 0.21 H new ATOM 0 HA LEU B 34 12.713 -5.748 -2.640 1.00 0.21 H new ATOM 0 HB2 LEU B 34 14.612 -5.446 -0.320 1.00 0.21 H new ATOM 0 HB3 LEU B 34 13.728 -4.064 -0.935 1.00 0.21 H new ATOM 0 HG LEU B 34 12.384 -6.626 -0.029 1.00 0.21 H new ATOM 0 HD11 LEU B 34 11.846 -5.416 2.042 1.00 0.24 H new ATOM 0 HD12 LEU B 34 13.602 -5.624 1.842 1.00 0.24 H new ATOM 0 HD13 LEU B 34 12.848 -4.049 1.502 1.00 0.24 H new ATOM 0 HD21 LEU B 34 10.386 -5.186 0.060 1.00 0.21 H new ATOM 0 HD22 LEU B 34 11.350 -3.816 -0.539 1.00 0.21 H new ATOM 0 HD23 LEU B 34 11.083 -5.237 -1.577 1.00 0.21 H new ATOM 2810 N LYS B 35 15.907 -5.265 -3.132 1.00 0.21 N ATOM 2811 CA LYS B 35 16.888 -4.679 -4.028 1.00 0.26 C ATOM 2812 C LYS B 35 16.377 -4.713 -5.460 1.00 0.22 C ATOM 2813 O LYS B 35 16.194 -3.676 -6.087 1.00 0.24 O ATOM 2814 CB LYS B 35 18.202 -5.456 -3.911 1.00 0.37 C ATOM 2815 CG LYS B 35 19.309 -4.977 -4.828 1.00 0.54 C ATOM 2816 CD LYS B 35 19.992 -3.730 -4.299 1.00 0.68 C ATOM 2817 CE LYS B 35 21.155 -3.338 -5.189 1.00 0.61 C ATOM 2818 NZ LYS B 35 21.868 -2.137 -4.689 1.00 0.95 N ATOM 0 H LYS B 35 16.298 -5.947 -2.482 1.00 0.21 H new ATOM 0 HA LYS B 35 17.059 -3.639 -3.751 1.00 0.26 H new ATOM 0 HB2 LYS B 35 18.552 -5.396 -2.880 1.00 0.37 H new ATOM 0 HB3 LYS B 35 18.006 -6.507 -4.121 1.00 0.37 H new ATOM 0 HG2 LYS B 35 20.047 -5.770 -4.949 1.00 0.54 H new ATOM 0 HG3 LYS B 35 18.897 -4.772 -5.816 1.00 0.54 H new ATOM 0 HD2 LYS B 35 19.275 -2.911 -4.247 1.00 0.68 H new ATOM 0 HD3 LYS B 35 20.348 -3.907 -3.284 1.00 0.68 H new ATOM 0 HE2 LYS B 35 21.855 -4.171 -5.256 1.00 0.61 H new ATOM 0 HE3 LYS B 35 20.789 -3.147 -6.198 1.00 0.61 H new ATOM 0 HZ1 LYS B 35 22.622 -1.878 -5.357 1.00 0.95 H new ATOM 0 HZ2 LYS B 35 21.197 -1.347 -4.601 1.00 0.95 H new ATOM 0 HZ3 LYS B 35 22.285 -2.343 -3.759 1.00 0.95 H new ATOM 2832 N GLU B 36 16.109 -5.907 -5.962 1.00 0.22 N ATOM 2833 CA GLU B 36 15.622 -6.053 -7.321 1.00 0.24 C ATOM 2834 C GLU B 36 14.196 -5.540 -7.472 1.00 0.25 C ATOM 2835 O GLU B 36 13.849 -4.987 -8.510 1.00 0.32 O ATOM 2836 CB GLU B 36 15.710 -7.497 -7.777 1.00 0.28 C ATOM 2837 CG GLU B 36 17.107 -7.921 -8.174 1.00 0.65 C ATOM 2838 CD GLU B 36 17.187 -9.383 -8.540 1.00 0.77 C ATOM 2839 OE1 GLU B 36 16.989 -9.715 -9.725 1.00 1.48 O ATOM 2840 OE2 GLU B 36 17.452 -10.211 -7.645 1.00 1.30 O ATOM 0 H GLU B 36 16.220 -6.783 -5.452 1.00 0.22 H new ATOM 0 HA GLU B 36 16.265 -5.444 -7.957 1.00 0.24 H new ATOM 0 HB2 GLU B 36 15.356 -8.145 -6.975 1.00 0.28 H new ATOM 0 HB3 GLU B 36 15.040 -7.644 -8.624 1.00 0.28 H new ATOM 0 HG2 GLU B 36 17.439 -7.320 -9.020 1.00 0.65 H new ATOM 0 HG3 GLU B 36 17.792 -7.718 -7.351 1.00 0.65 H new ATOM 2847 N LEU B 37 13.377 -5.718 -6.440 1.00 0.23 N ATOM 2848 CA LEU B 37 12.004 -5.217 -6.457 1.00 0.26 C ATOM 2849 C LEU B 37 11.992 -3.740 -6.840 1.00 0.22 C ATOM 2850 O LEU B 37 11.377 -3.343 -7.832 1.00 0.22 O ATOM 2851 CB LEU B 37 11.361 -5.378 -5.078 1.00 0.32 C ATOM 2852 CG LEU B 37 9.841 -5.189 -5.029 1.00 0.41 C ATOM 2853 CD1 LEU B 37 9.123 -6.519 -5.214 1.00 0.34 C ATOM 2854 CD2 LEU B 37 9.432 -4.530 -3.723 1.00 0.74 C ATOM 0 H LEU B 37 13.638 -6.204 -5.582 1.00 0.23 H new ATOM 0 HA LEU B 37 11.438 -5.793 -7.190 1.00 0.26 H new ATOM 0 HB2 LEU B 37 11.598 -6.373 -4.701 1.00 0.32 H new ATOM 0 HB3 LEU B 37 11.820 -4.661 -4.397 1.00 0.32 H new ATOM 0 HG LEU B 37 9.549 -4.534 -5.850 1.00 0.41 H new ATOM 0 HD11 LEU B 37 8.045 -6.359 -5.175 1.00 0.34 H new ATOM 0 HD12 LEU B 37 9.392 -6.947 -6.180 1.00 0.34 H new ATOM 0 HD13 LEU B 37 9.417 -7.205 -4.419 1.00 0.34 H new ATOM 0 HD21 LEU B 37 8.350 -4.402 -3.703 1.00 0.74 H new ATOM 0 HD22 LEU B 37 9.739 -5.158 -2.887 1.00 0.74 H new ATOM 0 HD23 LEU B 37 9.914 -3.556 -3.641 1.00 0.74 H new ATOM 2866 N LEU B 38 12.714 -2.941 -6.061 1.00 0.19 N ATOM 2867 CA LEU B 38 12.760 -1.503 -6.269 1.00 0.19 C ATOM 2868 C LEU B 38 13.574 -1.129 -7.509 1.00 0.19 C ATOM 2869 O LEU B 38 13.191 -0.237 -8.246 1.00 0.21 O ATOM 2870 CB LEU B 38 13.313 -0.796 -5.028 1.00 0.19 C ATOM 2871 CG LEU B 38 12.335 -0.674 -3.853 1.00 0.19 C ATOM 2872 CD1 LEU B 38 12.756 -1.573 -2.703 1.00 0.20 C ATOM 2873 CD2 LEU B 38 12.233 0.773 -3.391 1.00 0.20 C ATOM 0 H LEU B 38 13.277 -3.270 -5.277 1.00 0.19 H new ATOM 0 HA LEU B 38 11.737 -1.167 -6.438 1.00 0.19 H new ATOM 0 HB2 LEU B 38 14.198 -1.333 -4.688 1.00 0.19 H new ATOM 0 HB3 LEU B 38 13.638 0.204 -5.314 1.00 0.19 H new ATOM 0 HG LEU B 38 11.352 -0.998 -4.194 1.00 0.19 H new ATOM 0 HD11 LEU B 38 12.047 -1.469 -1.882 1.00 0.20 H new ATOM 0 HD12 LEU B 38 12.773 -2.610 -3.039 1.00 0.20 H new ATOM 0 HD13 LEU B 38 13.751 -1.286 -2.362 1.00 0.20 H new ATOM 0 HD21 LEU B 38 11.535 0.840 -2.557 1.00 0.20 H new ATOM 0 HD22 LEU B 38 13.215 1.123 -3.072 1.00 0.20 H new ATOM 0 HD23 LEU B 38 11.877 1.393 -4.213 1.00 0.20 H new ATOM 2885 N THR B 39 14.681 -1.817 -7.762 1.00 0.20 N ATOM 2886 CA THR B 39 15.530 -1.469 -8.901 1.00 0.22 C ATOM 2887 C THR B 39 14.819 -1.691 -10.232 1.00 0.23 C ATOM 2888 O THR B 39 15.064 -0.973 -11.206 1.00 0.27 O ATOM 2889 CB THR B 39 16.847 -2.267 -8.911 1.00 0.25 C ATOM 2890 OG1 THR B 39 16.581 -3.664 -8.776 1.00 0.30 O ATOM 2891 CG2 THR B 39 17.754 -1.824 -7.788 1.00 0.27 C ATOM 0 H THR B 39 15.010 -2.606 -7.206 1.00 0.20 H new ATOM 0 HA THR B 39 15.755 -0.409 -8.783 1.00 0.22 H new ATOM 0 HB THR B 39 17.344 -2.080 -9.863 1.00 0.25 H new ATOM 0 HG1 THR B 39 16.505 -3.892 -7.826 1.00 0.30 H new ATOM 0 HG21 THR B 39 18.677 -2.402 -7.816 1.00 0.27 H new ATOM 0 HG22 THR B 39 17.985 -0.765 -7.903 1.00 0.27 H new ATOM 0 HG23 THR B 39 17.255 -1.984 -6.832 1.00 0.27 H new ATOM 2899 N ARG B 40 13.945 -2.682 -10.270 1.00 0.24 N ATOM 2900 CA ARG B 40 13.245 -3.034 -11.493 1.00 0.27 C ATOM 2901 C ARG B 40 11.988 -2.192 -11.682 1.00 0.27 C ATOM 2902 O ARG B 40 11.880 -1.437 -12.649 1.00 0.30 O ATOM 2903 CB ARG B 40 12.876 -4.515 -11.482 1.00 0.31 C ATOM 2904 CG ARG B 40 14.068 -5.459 -11.499 1.00 0.34 C ATOM 2905 CD ARG B 40 14.923 -5.277 -12.737 1.00 0.44 C ATOM 2906 NE ARG B 40 14.154 -5.444 -13.969 1.00 0.64 N ATOM 2907 CZ ARG B 40 14.687 -5.417 -15.189 1.00 0.87 C ATOM 2908 NH1 ARG B 40 15.999 -5.277 -15.346 1.00 1.22 N ATOM 2909 NH2 ARG B 40 13.904 -5.533 -16.252 1.00 1.06 N ATOM 0 H ARG B 40 13.703 -3.259 -9.465 1.00 0.24 H new ATOM 0 HA ARG B 40 13.917 -2.832 -12.327 1.00 0.27 H new ATOM 0 HB2 ARG B 40 12.277 -4.721 -10.595 1.00 0.31 H new ATOM 0 HB3 ARG B 40 12.248 -4.727 -12.347 1.00 0.31 H new ATOM 0 HG2 ARG B 40 14.677 -5.289 -10.611 1.00 0.34 H new ATOM 0 HG3 ARG B 40 13.715 -6.489 -11.451 1.00 0.34 H new ATOM 0 HD2 ARG B 40 15.373 -4.284 -12.723 1.00 0.44 H new ATOM 0 HD3 ARG B 40 15.741 -5.997 -12.721 1.00 0.44 H new ATOM 0 HE ARG B 40 13.148 -5.590 -13.889 1.00 0.64 H new ATOM 0 HH11 ARG B 40 16.604 -5.190 -14.529 1.00 1.22 H new ATOM 0 HH12 ARG B 40 16.401 -5.257 -16.283 1.00 1.22 H new ATOM 0 HH21 ARG B 40 12.897 -5.642 -16.134 1.00 1.06 H new ATOM 0 HH22 ARG B 40 14.309 -5.513 -17.188 1.00 1.06 H new ATOM 2923 N GLU B 41 11.033 -2.320 -10.765 1.00 0.27 N ATOM 2924 CA GLU B 41 9.740 -1.670 -10.939 1.00 0.30 C ATOM 2925 C GLU B 41 9.593 -0.386 -10.131 1.00 0.34 C ATOM 2926 O GLU B 41 8.632 0.344 -10.324 1.00 0.46 O ATOM 2927 CB GLU B 41 8.587 -2.623 -10.616 1.00 0.36 C ATOM 2928 CG GLU B 41 8.164 -3.481 -11.800 1.00 0.45 C ATOM 2929 CD GLU B 41 9.163 -4.583 -12.121 1.00 0.83 C ATOM 2930 OE1 GLU B 41 9.422 -5.447 -11.253 1.00 1.54 O ATOM 2931 OE2 GLU B 41 9.687 -4.591 -13.255 1.00 1.59 O ATOM 0 H GLU B 41 11.128 -2.861 -9.905 1.00 0.27 H new ATOM 0 HA GLU B 41 9.694 -1.393 -11.992 1.00 0.30 H new ATOM 0 HB2 GLU B 41 8.882 -3.273 -9.792 1.00 0.36 H new ATOM 0 HB3 GLU B 41 7.731 -2.043 -10.273 1.00 0.36 H new ATOM 0 HG2 GLU B 41 7.193 -3.928 -11.589 1.00 0.45 H new ATOM 0 HG3 GLU B 41 8.038 -2.845 -12.676 1.00 0.45 H new ATOM 2938 N LEU B 42 10.519 -0.087 -9.230 1.00 0.27 N ATOM 2939 CA LEU B 42 10.424 1.168 -8.478 1.00 0.28 C ATOM 2940 C LEU B 42 11.657 2.069 -8.652 1.00 0.27 C ATOM 2941 O LEU B 42 12.075 2.708 -7.687 1.00 0.26 O ATOM 2942 CB LEU B 42 10.229 0.896 -6.978 1.00 0.27 C ATOM 2943 CG LEU B 42 8.971 0.118 -6.589 1.00 0.27 C ATOM 2944 CD1 LEU B 42 9.219 -1.375 -6.655 1.00 0.26 C ATOM 2945 CD2 LEU B 42 8.510 0.515 -5.200 1.00 0.32 C ATOM 0 H LEU B 42 11.323 -0.672 -9.002 1.00 0.27 H new ATOM 0 HA LEU B 42 9.559 1.690 -8.887 1.00 0.28 H new ATOM 0 HB2 LEU B 42 11.097 0.347 -6.614 1.00 0.27 H new ATOM 0 HB3 LEU B 42 10.215 1.853 -6.456 1.00 0.27 H new ATOM 0 HG LEU B 42 8.184 0.366 -7.302 1.00 0.27 H new ATOM 0 HD11 LEU B 42 8.310 -1.908 -6.374 1.00 0.26 H new ATOM 0 HD12 LEU B 42 9.503 -1.652 -7.670 1.00 0.26 H new ATOM 0 HD13 LEU B 42 10.022 -1.641 -5.968 1.00 0.26 H new ATOM 0 HD21 LEU B 42 7.614 -0.048 -4.939 1.00 0.32 H new ATOM 0 HD22 LEU B 42 9.298 0.297 -4.479 1.00 0.32 H new ATOM 0 HD23 LEU B 42 8.286 1.582 -5.182 1.00 0.32 H new ATOM 2957 N PRO B 43 12.239 2.198 -9.869 1.00 0.31 N ATOM 2958 CA PRO B 43 13.474 2.967 -10.051 1.00 0.33 C ATOM 2959 C PRO B 43 13.228 4.453 -9.846 1.00 0.33 C ATOM 2960 O PRO B 43 14.132 5.207 -9.486 1.00 0.36 O ATOM 2961 CB PRO B 43 13.887 2.688 -11.501 1.00 0.41 C ATOM 2962 CG PRO B 43 13.002 1.583 -11.971 1.00 0.51 C ATOM 2963 CD PRO B 43 11.750 1.675 -11.152 1.00 0.35 C ATOM 0 HA PRO B 43 14.243 2.683 -9.332 1.00 0.33 H new ATOM 0 HB2 PRO B 43 13.765 3.577 -12.120 1.00 0.41 H new ATOM 0 HB3 PRO B 43 14.937 2.400 -11.560 1.00 0.41 H new ATOM 0 HG2 PRO B 43 12.781 1.686 -13.033 1.00 0.51 H new ATOM 0 HG3 PRO B 43 13.484 0.614 -11.838 1.00 0.51 H new ATOM 0 HD2 PRO B 43 11.017 2.341 -11.607 1.00 0.35 H new ATOM 0 HD3 PRO B 43 11.270 0.703 -11.036 1.00 0.35 H new ATOM 2971 N SER B 44 11.987 4.855 -10.073 1.00 0.36 N ATOM 2972 CA SER B 44 11.567 6.227 -9.870 1.00 0.39 C ATOM 2973 C SER B 44 11.553 6.573 -8.379 1.00 0.35 C ATOM 2974 O SER B 44 11.934 7.673 -7.984 1.00 0.40 O ATOM 2975 CB SER B 44 10.176 6.423 -10.474 1.00 0.46 C ATOM 2976 OG SER B 44 10.116 5.870 -11.779 1.00 1.09 O ATOM 0 H SER B 44 11.245 4.237 -10.403 1.00 0.36 H new ATOM 0 HA SER B 44 12.274 6.893 -10.364 1.00 0.39 H new ATOM 0 HB2 SER B 44 9.428 5.950 -9.838 1.00 0.46 H new ATOM 0 HB3 SER B 44 9.937 7.486 -10.512 1.00 0.46 H new ATOM 0 HG SER B 44 9.500 5.108 -11.783 1.00 1.09 H new ATOM 2982 N PHE B 45 11.149 5.608 -7.556 1.00 0.30 N ATOM 2983 CA PHE B 45 10.980 5.824 -6.121 1.00 0.28 C ATOM 2984 C PHE B 45 12.254 5.529 -5.358 1.00 0.28 C ATOM 2985 O PHE B 45 12.198 5.143 -4.200 1.00 0.27 O ATOM 2986 CB PHE B 45 9.874 4.924 -5.559 1.00 0.31 C ATOM 2987 CG PHE B 45 8.615 4.890 -6.367 1.00 0.28 C ATOM 2988 CD1 PHE B 45 7.649 5.867 -6.221 1.00 1.28 C ATOM 2989 CD2 PHE B 45 8.390 3.856 -7.258 1.00 1.17 C ATOM 2990 CE1 PHE B 45 6.478 5.811 -6.950 1.00 1.34 C ATOM 2991 CE2 PHE B 45 7.228 3.797 -7.991 1.00 1.18 C ATOM 2992 CZ PHE B 45 6.268 4.772 -7.838 1.00 0.47 C ATOM 0 H PHE B 45 10.931 4.660 -7.862 1.00 0.30 H new ATOM 0 HA PHE B 45 10.714 6.874 -5.995 1.00 0.28 H new ATOM 0 HB2 PHE B 45 10.261 3.909 -5.474 1.00 0.31 H new ATOM 0 HB3 PHE B 45 9.632 5.258 -4.550 1.00 0.31 H new ATOM 0 HD1 PHE B 45 7.811 6.682 -5.531 1.00 1.28 H new ATOM 0 HD2 PHE B 45 9.137 3.085 -7.380 1.00 1.17 H new ATOM 0 HE1 PHE B 45 5.727 6.577 -6.827 1.00 1.34 H new ATOM 0 HE2 PHE B 45 7.069 2.986 -8.686 1.00 1.18 H new ATOM 0 HZ PHE B 45 5.353 4.725 -8.410 1.00 0.47 H new ATOM 3002 N LEU B 46 13.403 5.707 -5.974 1.00 0.32 N ATOM 3003 CA LEU B 46 14.638 5.546 -5.233 1.00 0.33 C ATOM 3004 C LEU B 46 15.185 6.908 -4.831 1.00 0.39 C ATOM 3005 O LEU B 46 15.819 7.042 -3.787 1.00 0.47 O ATOM 3006 CB LEU B 46 15.668 4.729 -6.018 1.00 0.35 C ATOM 3007 CG LEU B 46 15.195 3.327 -6.433 1.00 0.32 C ATOM 3008 CD1 LEU B 46 16.378 2.434 -6.778 1.00 0.41 C ATOM 3009 CD2 LEU B 46 14.333 2.695 -5.341 1.00 0.30 C ATOM 0 H LEU B 46 13.510 5.956 -6.957 1.00 0.32 H new ATOM 0 HA LEU B 46 14.423 4.982 -4.326 1.00 0.33 H new ATOM 0 HB2 LEU B 46 15.945 5.284 -6.914 1.00 0.35 H new ATOM 0 HB3 LEU B 46 16.569 4.629 -5.413 1.00 0.35 H new ATOM 0 HG LEU B 46 14.580 3.431 -7.327 1.00 0.32 H new ATOM 0 HD11 LEU B 46 16.017 1.447 -7.068 1.00 0.41 H new ATOM 0 HD12 LEU B 46 16.937 2.873 -7.604 1.00 0.41 H new ATOM 0 HD13 LEU B 46 17.029 2.341 -5.909 1.00 0.41 H new ATOM 0 HD21 LEU B 46 14.011 1.704 -5.660 1.00 0.30 H new ATOM 0 HD22 LEU B 46 14.914 2.610 -4.422 1.00 0.30 H new ATOM 0 HD23 LEU B 46 13.458 3.320 -5.161 1.00 0.30 H new ATOM 3021 N GLY B 47 14.897 7.916 -5.657 1.00 0.41 N ATOM 3022 CA GLY B 47 15.304 9.303 -5.409 1.00 0.49 C ATOM 3023 C GLY B 47 16.811 9.515 -5.415 1.00 0.53 C ATOM 3024 O GLY B 47 17.301 10.556 -5.859 1.00 0.60 O ATOM 0 H GLY B 47 14.372 7.793 -6.523 1.00 0.41 H new ATOM 0 HA2 GLY B 47 14.854 9.944 -6.167 1.00 0.49 H new ATOM 0 HA3 GLY B 47 14.906 9.621 -4.445 1.00 0.49 H new ATOM 3028 N LYS B 48 17.537 8.534 -4.933 1.00 0.54 N ATOM 3029 CA LYS B 48 18.978 8.504 -5.038 1.00 0.67 C ATOM 3030 C LYS B 48 19.398 7.229 -5.759 1.00 0.70 C ATOM 3031 O LYS B 48 19.666 7.247 -6.959 1.00 1.18 O ATOM 3032 CB LYS B 48 19.621 8.575 -3.647 1.00 0.82 C ATOM 3033 CG LYS B 48 21.139 8.542 -3.674 1.00 1.41 C ATOM 3034 CD LYS B 48 21.722 8.441 -2.274 1.00 2.04 C ATOM 3035 CE LYS B 48 23.241 8.439 -2.306 1.00 2.61 C ATOM 3036 NZ LYS B 48 23.780 7.347 -3.160 1.00 3.21 N ATOM 0 H LYS B 48 17.141 7.726 -4.452 1.00 0.54 H new ATOM 0 HA LYS B 48 19.318 9.369 -5.607 1.00 0.67 H new ATOM 0 HB2 LYS B 48 19.295 9.490 -3.152 1.00 0.82 H new ATOM 0 HB3 LYS B 48 19.259 7.741 -3.046 1.00 0.82 H new ATOM 0 HG2 LYS B 48 21.474 7.693 -4.270 1.00 1.41 H new ATOM 0 HG3 LYS B 48 21.514 9.442 -4.161 1.00 1.41 H new ATOM 0 HD2 LYS B 48 21.370 9.278 -1.670 1.00 2.04 H new ATOM 0 HD3 LYS B 48 21.365 7.530 -1.794 1.00 2.04 H new ATOM 0 HE2 LYS B 48 23.597 9.400 -2.679 1.00 2.61 H new ATOM 0 HE3 LYS B 48 23.625 8.329 -1.292 1.00 2.61 H new ATOM 0 HZ1 LYS B 48 24.808 7.274 -3.022 1.00 3.21 H new ATOM 0 HZ2 LYS B 48 23.330 6.447 -2.897 1.00 3.21 H new ATOM 0 HZ3 LYS B 48 23.579 7.556 -4.159 1.00 3.21 H new ATOM 3050 N ARG B 49 19.395 6.127 -5.013 1.00 0.54 N ATOM 3051 CA ARG B 49 19.768 4.810 -5.518 1.00 0.54 C ATOM 3052 C ARG B 49 19.968 3.877 -4.339 1.00 0.51 C ATOM 3053 O ARG B 49 20.470 4.294 -3.297 1.00 0.55 O ATOM 3054 CB ARG B 49 21.055 4.857 -6.351 1.00 0.66 C ATOM 3055 CG ARG B 49 21.424 3.519 -6.974 1.00 0.74 C ATOM 3056 CD ARG B 49 20.310 2.989 -7.866 1.00 0.73 C ATOM 3057 NE ARG B 49 20.008 3.885 -8.981 1.00 1.28 N ATOM 3058 CZ ARG B 49 19.233 3.552 -10.014 1.00 1.46 C ATOM 3059 NH1 ARG B 49 18.745 2.319 -10.115 1.00 1.43 N ATOM 3060 NH2 ARG B 49 18.962 4.446 -10.954 1.00 2.26 N ATOM 0 H ARG B 49 19.130 6.125 -4.028 1.00 0.54 H new ATOM 0 HA ARG B 49 18.968 4.454 -6.167 1.00 0.54 H new ATOM 0 HB2 ARG B 49 20.939 5.598 -7.142 1.00 0.66 H new ATOM 0 HB3 ARG B 49 21.876 5.193 -5.718 1.00 0.66 H new ATOM 0 HG2 ARG B 49 22.337 3.629 -7.558 1.00 0.74 H new ATOM 0 HG3 ARG B 49 21.635 2.796 -6.186 1.00 0.74 H new ATOM 0 HD2 ARG B 49 20.596 2.012 -8.257 1.00 0.73 H new ATOM 0 HD3 ARG B 49 19.410 2.842 -7.269 1.00 0.73 H new ATOM 0 HE ARG B 49 20.414 4.821 -8.968 1.00 1.28 H new ATOM 0 HH11 ARG B 49 18.963 1.624 -9.401 1.00 1.43 H new ATOM 0 HH12 ARG B 49 18.153 2.068 -10.907 1.00 1.43 H new ATOM 0 HH21 ARG B 49 19.346 5.389 -10.887 1.00 2.26 H new ATOM 0 HH22 ARG B 49 18.369 4.192 -11.744 1.00 2.26 H new ATOM 3074 N THR B 50 19.560 2.631 -4.490 1.00 0.51 N ATOM 3075 CA THR B 50 19.742 1.650 -3.444 1.00 0.51 C ATOM 3076 C THR B 50 21.216 1.278 -3.291 1.00 0.61 C ATOM 3077 O THR B 50 21.749 0.481 -4.062 1.00 0.82 O ATOM 3078 CB THR B 50 18.901 0.397 -3.728 1.00 0.57 C ATOM 3079 OG1 THR B 50 18.985 0.056 -5.120 1.00 0.69 O ATOM 3080 CG2 THR B 50 17.445 0.628 -3.346 1.00 0.57 C ATOM 0 H THR B 50 19.100 2.277 -5.329 1.00 0.51 H new ATOM 0 HA THR B 50 19.404 2.092 -2.506 1.00 0.51 H new ATOM 0 HB THR B 50 19.294 -0.424 -3.128 1.00 0.57 H new ATOM 0 HG1 THR B 50 19.925 0.044 -5.398 1.00 0.69 H new ATOM 0 HG21 THR B 50 16.867 -0.272 -3.555 1.00 0.57 H new ATOM 0 HG22 THR B 50 17.380 0.862 -2.283 1.00 0.57 H new ATOM 0 HG23 THR B 50 17.044 1.460 -3.926 1.00 0.57 H new ATOM 3088 N ASP B 51 21.869 1.885 -2.306 1.00 0.58 N ATOM 3089 CA ASP B 51 23.275 1.611 -2.021 1.00 0.72 C ATOM 3090 C ASP B 51 23.412 0.372 -1.151 1.00 0.60 C ATOM 3091 O ASP B 51 22.417 -0.228 -0.753 1.00 0.58 O ATOM 3092 CB ASP B 51 23.930 2.802 -1.313 1.00 0.91 C ATOM 3093 CG ASP B 51 24.132 3.999 -2.219 1.00 1.35 C ATOM 3094 OD1 ASP B 51 25.119 4.012 -2.981 1.00 1.98 O ATOM 3095 OD2 ASP B 51 23.320 4.944 -2.154 1.00 1.91 O ATOM 0 H ASP B 51 21.444 2.575 -1.687 1.00 0.58 H new ATOM 0 HA ASP B 51 23.780 1.441 -2.972 1.00 0.72 H new ATOM 0 HB2 ASP B 51 23.312 3.097 -0.465 1.00 0.91 H new ATOM 0 HB3 ASP B 51 24.895 2.492 -0.912 1.00 0.91 H new ATOM 3100 N GLU B 52 24.644 0.007 -0.837 1.00 0.68 N ATOM 3101 CA GLU B 52 24.912 -1.179 -0.035 1.00 0.66 C ATOM 3102 C GLU B 52 24.821 -0.850 1.451 1.00 0.55 C ATOM 3103 O GLU B 52 24.061 -1.477 2.190 1.00 0.50 O ATOM 3104 CB GLU B 52 26.293 -1.741 -0.366 1.00 0.83 C ATOM 3105 CG GLU B 52 26.442 -2.155 -1.819 1.00 1.57 C ATOM 3106 CD GLU B 52 27.817 -2.697 -2.124 1.00 2.22 C ATOM 3107 OE1 GLU B 52 28.062 -3.891 -1.854 1.00 2.79 O ATOM 3108 OE2 GLU B 52 28.662 -1.935 -2.635 1.00 2.89 O ATOM 0 H GLU B 52 25.479 0.517 -1.126 1.00 0.68 H new ATOM 0 HA GLU B 52 24.160 -1.932 -0.271 1.00 0.66 H new ATOM 0 HB2 GLU B 52 27.048 -0.991 -0.130 1.00 0.83 H new ATOM 0 HB3 GLU B 52 26.489 -2.603 0.272 1.00 0.83 H new ATOM 0 HG2 GLU B 52 25.695 -2.912 -2.057 1.00 1.57 H new ATOM 0 HG3 GLU B 52 26.242 -1.297 -2.461 1.00 1.57 H new ATOM 3115 N ALA B 53 25.576 0.159 1.874 1.00 0.58 N ATOM 3116 CA ALA B 53 25.564 0.598 3.265 1.00 0.58 C ATOM 3117 C ALA B 53 24.215 1.208 3.624 1.00 0.53 C ATOM 3118 O ALA B 53 23.870 1.352 4.793 1.00 0.58 O ATOM 3119 CB ALA B 53 26.682 1.597 3.520 1.00 0.70 C ATOM 0 H ALA B 53 26.205 0.689 1.271 1.00 0.58 H new ATOM 0 HA ALA B 53 25.728 -0.273 3.899 1.00 0.58 H new ATOM 0 HB1 ALA B 53 26.657 1.913 4.563 1.00 0.70 H new ATOM 0 HB2 ALA B 53 27.643 1.130 3.305 1.00 0.70 H new ATOM 0 HB3 ALA B 53 26.548 2.465 2.875 1.00 0.70 H new ATOM 3125 N ALA B 54 23.457 1.567 2.602 1.00 0.52 N ATOM 3126 CA ALA B 54 22.124 2.101 2.800 1.00 0.51 C ATOM 3127 C ALA B 54 21.097 0.984 2.837 1.00 0.39 C ATOM 3128 O ALA B 54 20.088 1.078 3.528 1.00 0.35 O ATOM 3129 CB ALA B 54 21.778 3.067 1.693 1.00 0.63 C ATOM 0 H ALA B 54 23.744 1.497 1.626 1.00 0.52 H new ATOM 0 HA ALA B 54 22.108 2.626 3.755 1.00 0.51 H new ATOM 0 HB1 ALA B 54 20.774 3.461 1.854 1.00 0.63 H new ATOM 0 HB2 ALA B 54 22.494 3.889 1.690 1.00 0.63 H new ATOM 0 HB3 ALA B 54 21.816 2.550 0.734 1.00 0.63 H new ATOM 3135 N PHE B 55 21.348 -0.071 2.078 1.00 0.38 N ATOM 3136 CA PHE B 55 20.407 -1.179 2.006 1.00 0.32 C ATOM 3137 C PHE B 55 20.409 -2.000 3.287 1.00 0.31 C ATOM 3138 O PHE B 55 19.378 -2.557 3.671 1.00 0.31 O ATOM 3139 CB PHE B 55 20.690 -2.081 0.812 1.00 0.41 C ATOM 3140 CG PHE B 55 19.430 -2.567 0.173 1.00 0.36 C ATOM 3141 CD1 PHE B 55 18.609 -3.465 0.830 1.00 1.23 C ATOM 3142 CD2 PHE B 55 19.049 -2.097 -1.070 1.00 1.25 C ATOM 3143 CE1 PHE B 55 17.429 -3.887 0.258 1.00 1.30 C ATOM 3144 CE2 PHE B 55 17.874 -2.522 -1.650 1.00 1.22 C ATOM 3145 CZ PHE B 55 17.062 -3.416 -0.983 1.00 0.46 C ATOM 0 H PHE B 55 22.186 -0.184 1.508 1.00 0.38 H new ATOM 0 HA PHE B 55 19.418 -0.739 1.879 1.00 0.32 H new ATOM 0 HB2 PHE B 55 21.283 -1.536 0.078 1.00 0.41 H new ATOM 0 HB3 PHE B 55 21.287 -2.934 1.134 1.00 0.41 H new ATOM 0 HD1 PHE B 55 18.896 -3.839 1.802 1.00 1.23 H new ATOM 0 HD2 PHE B 55 19.678 -1.390 -1.591 1.00 1.25 H new ATOM 0 HE1 PHE B 55 16.793 -4.586 0.782 1.00 1.30 H new ATOM 0 HE2 PHE B 55 17.589 -2.156 -2.625 1.00 1.22 H new ATOM 0 HZ PHE B 55 16.138 -3.747 -1.434 1.00 0.46 H new ATOM 3155 N GLN B 56 21.556 -2.074 3.955 1.00 0.35 N ATOM 3156 CA GLN B 56 21.623 -2.742 5.251 1.00 0.41 C ATOM 3157 C GLN B 56 20.755 -1.993 6.258 1.00 0.42 C ATOM 3158 O GLN B 56 20.347 -2.541 7.282 1.00 0.52 O ATOM 3159 CB GLN B 56 23.068 -2.857 5.749 1.00 0.51 C ATOM 3160 CG GLN B 56 23.763 -1.528 5.990 1.00 0.53 C ATOM 3161 CD GLN B 56 25.205 -1.707 6.421 1.00 0.69 C ATOM 3162 OE1 GLN B 56 25.862 -2.674 6.035 1.00 1.15 O ATOM 3163 NE2 GLN B 56 25.711 -0.780 7.213 1.00 1.53 N ATOM 0 H GLN B 56 22.440 -1.686 3.627 1.00 0.35 H new ATOM 0 HA GLN B 56 21.242 -3.757 5.138 1.00 0.41 H new ATOM 0 HB2 GLN B 56 23.074 -3.428 6.677 1.00 0.51 H new ATOM 0 HB3 GLN B 56 23.645 -3.427 5.020 1.00 0.51 H new ATOM 0 HG2 GLN B 56 23.729 -0.932 5.078 1.00 0.53 H new ATOM 0 HG3 GLN B 56 23.223 -0.971 6.756 1.00 0.53 H new ATOM 0 HE21 GLN B 56 25.134 0.007 7.511 1.00 1.53 H new ATOM 0 HE22 GLN B 56 26.679 -0.850 7.527 1.00 1.53 H new ATOM 3172 N LYS B 57 20.479 -0.733 5.943 1.00 0.36 N ATOM 3173 CA LYS B 57 19.492 0.043 6.670 1.00 0.39 C ATOM 3174 C LYS B 57 18.104 -0.277 6.135 1.00 0.34 C ATOM 3175 O LYS B 57 17.221 -0.654 6.890 1.00 0.41 O ATOM 3176 CB LYS B 57 19.767 1.544 6.523 1.00 0.44 C ATOM 3177 CG LYS B 57 21.022 2.013 7.233 1.00 0.54 C ATOM 3178 CD LYS B 57 21.321 3.474 6.929 1.00 0.61 C ATOM 3179 CE LYS B 57 22.444 4.005 7.804 1.00 0.79 C ATOM 3180 NZ LYS B 57 22.099 3.940 9.249 1.00 1.27 N ATOM 0 H LYS B 57 20.931 -0.227 5.182 1.00 0.36 H new ATOM 0 HA LYS B 57 19.551 -0.218 7.727 1.00 0.39 H new ATOM 0 HB2 LYS B 57 19.849 1.786 5.463 1.00 0.44 H new ATOM 0 HB3 LYS B 57 18.913 2.099 6.911 1.00 0.44 H new ATOM 0 HG2 LYS B 57 20.904 1.881 8.308 1.00 0.54 H new ATOM 0 HG3 LYS B 57 21.867 1.396 6.927 1.00 0.54 H new ATOM 0 HD2 LYS B 57 21.595 3.580 5.879 1.00 0.61 H new ATOM 0 HD3 LYS B 57 20.423 4.071 7.086 1.00 0.61 H new ATOM 0 HE2 LYS B 57 23.351 3.428 7.621 1.00 0.79 H new ATOM 0 HE3 LYS B 57 22.662 5.037 7.529 1.00 0.79 H new ATOM 0 HZ1 LYS B 57 22.695 4.608 9.779 1.00 1.27 H new ATOM 0 HZ2 LYS B 57 21.098 4.191 9.379 1.00 1.27 H new ATOM 0 HZ3 LYS B 57 22.263 2.976 9.602 1.00 1.27 H new ATOM 3194 N LEU B 58 17.955 -0.169 4.812 1.00 0.27 N ATOM 3195 CA LEU B 58 16.662 -0.290 4.133 1.00 0.25 C ATOM 3196 C LEU B 58 15.886 -1.531 4.558 1.00 0.24 C ATOM 3197 O LEU B 58 14.736 -1.429 4.978 1.00 0.26 O ATOM 3198 CB LEU B 58 16.861 -0.315 2.616 1.00 0.22 C ATOM 3199 CG LEU B 58 15.564 -0.370 1.812 1.00 0.22 C ATOM 3200 CD1 LEU B 58 14.759 0.884 2.046 1.00 0.26 C ATOM 3201 CD2 LEU B 58 15.841 -0.539 0.332 1.00 0.23 C ATOM 0 H LEU B 58 18.734 0.006 4.177 1.00 0.27 H new ATOM 0 HA LEU B 58 16.076 0.582 4.423 1.00 0.25 H new ATOM 0 HB2 LEU B 58 17.421 0.572 2.320 1.00 0.22 H new ATOM 0 HB3 LEU B 58 17.473 -1.179 2.356 1.00 0.22 H new ATOM 0 HG LEU B 58 14.993 -1.235 2.150 1.00 0.22 H new ATOM 0 HD11 LEU B 58 13.836 0.837 1.469 1.00 0.26 H new ATOM 0 HD12 LEU B 58 14.520 0.971 3.106 1.00 0.26 H new ATOM 0 HD13 LEU B 58 15.339 1.752 1.732 1.00 0.26 H new ATOM 0 HD21 LEU B 58 14.898 -0.575 -0.213 1.00 0.23 H new ATOM 0 HD22 LEU B 58 16.435 0.302 -0.025 1.00 0.23 H new ATOM 0 HD23 LEU B 58 16.390 -1.466 0.168 1.00 0.23 H new ATOM 3213 N MET B 59 16.514 -2.689 4.423 1.00 0.24 N ATOM 3214 CA MET B 59 15.900 -3.962 4.800 1.00 0.27 C ATOM 3215 C MET B 59 15.205 -3.881 6.156 1.00 0.34 C ATOM 3216 O MET B 59 13.992 -4.062 6.253 1.00 0.41 O ATOM 3217 CB MET B 59 16.971 -5.061 4.793 1.00 0.28 C ATOM 3218 CG MET B 59 16.736 -6.239 5.745 1.00 0.30 C ATOM 3219 SD MET B 59 15.079 -6.949 5.678 1.00 0.31 S ATOM 3220 CE MET B 59 14.852 -7.155 3.924 1.00 0.25 C ATOM 0 H MET B 59 17.460 -2.778 4.051 1.00 0.24 H new ATOM 0 HA MET B 59 15.128 -4.204 4.070 1.00 0.27 H new ATOM 0 HB2 MET B 59 17.055 -5.451 3.779 1.00 0.28 H new ATOM 0 HB3 MET B 59 17.930 -4.606 5.040 1.00 0.28 H new ATOM 0 HG2 MET B 59 17.460 -7.021 5.518 1.00 0.30 H new ATOM 0 HG3 MET B 59 16.933 -5.908 6.765 1.00 0.30 H new ATOM 0 HE1 MET B 59 14.269 -8.057 3.736 1.00 0.25 H new ATOM 0 HE2 MET B 59 14.324 -6.291 3.522 1.00 0.25 H new ATOM 0 HE3 MET B 59 15.824 -7.244 3.439 1.00 0.25 H new ATOM 3230 N SER B 60 15.964 -3.568 7.185 1.00 0.39 N ATOM 3231 CA SER B 60 15.440 -3.565 8.533 1.00 0.51 C ATOM 3232 C SER B 60 14.806 -2.213 8.866 1.00 0.44 C ATOM 3233 O SER B 60 14.290 -1.999 9.966 1.00 0.51 O ATOM 3234 CB SER B 60 16.550 -3.940 9.506 1.00 0.70 C ATOM 3235 OG SER B 60 16.065 -4.060 10.834 1.00 1.36 O ATOM 0 H SER B 60 16.949 -3.312 7.112 1.00 0.39 H new ATOM 0 HA SER B 60 14.648 -4.309 8.621 1.00 0.51 H new ATOM 0 HB2 SER B 60 17.002 -4.883 9.197 1.00 0.70 H new ATOM 0 HB3 SER B 60 17.335 -3.184 9.472 1.00 0.70 H new ATOM 0 HG SER B 60 15.099 -4.226 10.816 1.00 1.36 H new ATOM 3241 N ASN B 61 14.862 -1.296 7.909 1.00 0.37 N ATOM 3242 CA ASN B 61 14.144 -0.037 8.008 1.00 0.42 C ATOM 3243 C ASN B 61 12.682 -0.329 7.775 1.00 0.44 C ATOM 3244 O ASN B 61 11.798 0.356 8.283 1.00 0.64 O ATOM 3245 CB ASN B 61 14.664 0.967 6.983 1.00 0.46 C ATOM 3246 CG ASN B 61 15.117 2.263 7.620 1.00 0.47 C ATOM 3247 OD1 ASN B 61 14.230 3.238 7.665 1.00 0.96 O flip ATOM 3248 ND2 ASN B 61 16.264 2.395 8.045 1.00 0.92 N flip ATOM 0 H ASN B 61 15.402 -1.404 7.050 1.00 0.37 H new ATOM 0 HA ASN B 61 14.291 0.406 8.993 1.00 0.42 H new ATOM 0 HB2 ASN B 61 15.496 0.525 6.436 1.00 0.46 H new ATOM 0 HB3 ASN B 61 13.880 1.178 6.256 1.00 0.46 H new ATOM 0 HD21 ASN B 61 16.920 1.616 7.992 1.00 0.92 H new ATOM 0 HD22 ASN B 61 16.559 3.283 8.451 1.00 0.92 H new ATOM 3255 N LEU B 62 12.450 -1.378 6.996 1.00 0.33 N ATOM 3256 CA LEU B 62 11.135 -1.957 6.850 1.00 0.39 C ATOM 3257 C LEU B 62 10.939 -2.994 7.942 1.00 0.54 C ATOM 3258 O LEU B 62 10.183 -2.780 8.888 1.00 1.18 O ATOM 3259 CB LEU B 62 10.980 -2.625 5.481 1.00 0.35 C ATOM 3260 CG LEU B 62 10.688 -1.696 4.304 1.00 0.25 C ATOM 3261 CD1 LEU B 62 9.396 -0.936 4.542 1.00 0.24 C ATOM 3262 CD2 LEU B 62 11.839 -0.736 4.049 1.00 0.22 C ATOM 0 H LEU B 62 13.173 -1.846 6.450 1.00 0.33 H new ATOM 0 HA LEU B 62 10.388 -1.168 6.931 1.00 0.39 H new ATOM 0 HB2 LEU B 62 11.895 -3.176 5.263 1.00 0.35 H new ATOM 0 HB3 LEU B 62 10.175 -3.357 5.547 1.00 0.35 H new ATOM 0 HG LEU B 62 10.574 -2.312 3.412 1.00 0.25 H new ATOM 0 HD11 LEU B 62 9.200 -0.278 3.696 1.00 0.24 H new ATOM 0 HD12 LEU B 62 8.573 -1.642 4.651 1.00 0.24 H new ATOM 0 HD13 LEU B 62 9.486 -0.341 5.451 1.00 0.24 H new ATOM 0 HD21 LEU B 62 11.595 -0.091 3.205 1.00 0.22 H new ATOM 0 HD22 LEU B 62 12.006 -0.125 4.936 1.00 0.22 H new ATOM 0 HD23 LEU B 62 12.742 -1.303 3.823 1.00 0.22 H new ATOM 3274 N ASP B 63 11.682 -4.092 7.812 1.00 0.31 N ATOM 3275 CA ASP B 63 11.600 -5.222 8.731 1.00 0.33 C ATOM 3276 C ASP B 63 11.851 -4.789 10.169 1.00 0.37 C ATOM 3277 O ASP B 63 12.990 -4.534 10.575 1.00 0.43 O ATOM 3278 CB ASP B 63 12.597 -6.306 8.310 1.00 0.40 C ATOM 3279 CG ASP B 63 12.779 -7.390 9.354 1.00 0.38 C ATOM 3280 OD1 ASP B 63 11.783 -7.796 9.986 1.00 1.15 O ATOM 3281 OD2 ASP B 63 13.927 -7.844 9.541 1.00 1.08 O ATOM 0 H ASP B 63 12.361 -4.222 7.062 1.00 0.31 H new ATOM 0 HA ASP B 63 10.590 -5.629 8.685 1.00 0.33 H new ATOM 0 HB2 ASP B 63 12.258 -6.761 7.379 1.00 0.40 H new ATOM 0 HB3 ASP B 63 13.562 -5.843 8.105 1.00 0.40 H new ATOM 3286 N SER B 64 10.773 -4.703 10.932 1.00 0.43 N ATOM 3287 CA SER B 64 10.839 -4.264 12.313 1.00 0.52 C ATOM 3288 C SER B 64 11.186 -5.424 13.234 1.00 0.58 C ATOM 3289 O SER B 64 11.470 -5.228 14.414 1.00 0.71 O ATOM 3290 CB SER B 64 9.509 -3.633 12.721 1.00 0.67 C ATOM 3291 OG SER B 64 9.180 -2.552 11.863 1.00 1.14 O ATOM 0 H SER B 64 9.833 -4.935 10.612 1.00 0.43 H new ATOM 0 HA SER B 64 11.627 -3.517 12.404 1.00 0.52 H new ATOM 0 HB2 SER B 64 8.719 -4.384 12.687 1.00 0.67 H new ATOM 0 HB3 SER B 64 9.569 -3.281 13.751 1.00 0.67 H new ATOM 0 HG SER B 64 8.324 -2.163 12.140 1.00 1.14 H new ATOM 3297 N ASN B 65 11.176 -6.633 12.689 1.00 0.60 N ATOM 3298 CA ASN B 65 11.531 -7.816 13.457 1.00 0.75 C ATOM 3299 C ASN B 65 13.050 -7.933 13.540 1.00 0.76 C ATOM 3300 O ASN B 65 13.590 -8.624 14.409 1.00 0.91 O ATOM 3301 CB ASN B 65 10.930 -9.071 12.812 1.00 0.89 C ATOM 3302 CG ASN B 65 11.157 -10.327 13.635 1.00 1.52 C ATOM 3303 OD1 ASN B 65 11.220 -10.280 14.865 1.00 1.87 O ATOM 3304 ND2 ASN B 65 11.278 -11.460 12.961 1.00 2.34 N ATOM 0 H ASN B 65 10.926 -6.819 11.718 1.00 0.60 H new ATOM 0 HA ASN B 65 11.126 -7.724 14.465 1.00 0.75 H new ATOM 0 HB2 ASN B 65 9.859 -8.924 12.672 1.00 0.89 H new ATOM 0 HB3 ASN B 65 11.365 -9.208 11.822 1.00 0.89 H new ATOM 0 HD21 ASN B 65 11.429 -12.337 13.460 1.00 2.34 H new ATOM 0 HD22 ASN B 65 11.220 -11.456 11.943 1.00 2.34 H new ATOM 3311 N ARG B 66 13.724 -7.226 12.628 1.00 0.68 N ATOM 3312 CA ARG B 66 15.181 -7.228 12.544 1.00 0.81 C ATOM 3313 C ARG B 66 15.683 -8.644 12.314 1.00 0.88 C ATOM 3314 O ARG B 66 16.581 -9.128 13.002 1.00 1.11 O ATOM 3315 CB ARG B 66 15.808 -6.621 13.805 1.00 1.04 C ATOM 3316 CG ARG B 66 15.383 -5.183 14.058 1.00 1.10 C ATOM 3317 CD ARG B 66 16.110 -4.578 15.249 1.00 1.39 C ATOM 3318 NE ARG B 66 17.551 -4.466 15.020 1.00 2.08 N ATOM 3319 CZ ARG B 66 18.210 -3.306 14.973 1.00 2.77 C ATOM 3320 NH1 ARG B 66 17.558 -2.157 15.099 1.00 2.86 N ATOM 3321 NH2 ARG B 66 19.525 -3.294 14.790 1.00 3.79 N ATOM 0 H ARG B 66 13.272 -6.637 11.929 1.00 0.68 H new ATOM 0 HA ARG B 66 15.482 -6.608 11.699 1.00 0.81 H new ATOM 0 HB2 ARG B 66 15.535 -7.230 14.667 1.00 1.04 H new ATOM 0 HB3 ARG B 66 16.894 -6.661 13.718 1.00 1.04 H new ATOM 0 HG2 ARG B 66 15.581 -4.584 13.169 1.00 1.10 H new ATOM 0 HG3 ARG B 66 14.308 -5.148 14.233 1.00 1.10 H new ATOM 0 HD2 ARG B 66 15.700 -3.590 15.459 1.00 1.39 H new ATOM 0 HD3 ARG B 66 15.931 -5.192 16.132 1.00 1.39 H new ATOM 0 HE ARG B 66 18.084 -5.326 14.888 1.00 2.08 H new ATOM 0 HH11 ARG B 66 16.547 -2.156 15.233 1.00 2.86 H new ATOM 0 HH12 ARG B 66 18.068 -1.274 15.062 1.00 2.86 H new ATOM 0 HH21 ARG B 66 20.033 -4.172 14.685 1.00 3.79 H new ATOM 0 HH22 ARG B 66 20.027 -2.407 14.754 1.00 3.79 H new ATOM 3335 N ASP B 67 15.098 -9.295 11.322 1.00 0.75 N ATOM 3336 CA ASP B 67 15.397 -10.685 11.030 1.00 0.88 C ATOM 3337 C ASP B 67 15.942 -10.802 9.614 1.00 0.77 C ATOM 3338 O ASP B 67 16.450 -11.850 9.214 1.00 0.96 O ATOM 3339 CB ASP B 67 14.135 -11.534 11.199 1.00 1.00 C ATOM 3340 CG ASP B 67 14.413 -13.020 11.126 1.00 1.39 C ATOM 3341 OD1 ASP B 67 15.175 -13.528 11.973 1.00 1.93 O ATOM 3342 OD2 ASP B 67 13.865 -13.689 10.228 1.00 1.95 O ATOM 0 H ASP B 67 14.406 -8.877 10.700 1.00 0.75 H new ATOM 0 HA ASP B 67 16.152 -11.051 11.725 1.00 0.88 H new ATOM 0 HB2 ASP B 67 13.673 -11.302 12.159 1.00 1.00 H new ATOM 0 HB3 ASP B 67 13.416 -11.265 10.425 1.00 1.00 H new ATOM 3347 N ASN B 68 15.827 -9.695 8.873 1.00 0.62 N ATOM 3348 CA ASN B 68 16.384 -9.566 7.521 1.00 0.55 C ATOM 3349 C ASN B 68 15.500 -10.258 6.493 1.00 0.43 C ATOM 3350 O ASN B 68 15.979 -10.796 5.492 1.00 0.57 O ATOM 3351 CB ASN B 68 17.828 -10.084 7.447 1.00 0.77 C ATOM 3352 CG ASN B 68 18.834 -9.130 8.075 1.00 1.30 C ATOM 3353 OD1 ASN B 68 18.415 -8.389 9.092 1.00 1.41 O flip ATOM 3354 ND2 ASN B 68 19.984 -9.058 7.646 1.00 2.22 N flip ATOM 0 H ASN B 68 15.342 -8.858 9.196 1.00 0.62 H new ATOM 0 HA ASN B 68 16.408 -8.503 7.282 1.00 0.55 H new ATOM 0 HB2 ASN B 68 17.888 -11.049 7.949 1.00 0.77 H new ATOM 0 HB3 ASN B 68 18.096 -10.250 6.404 1.00 0.77 H new ATOM 0 HD21 ASN B 68 20.273 -9.643 6.862 1.00 2.22 H new ATOM 0 HD22 ASN B 68 20.649 -8.414 8.074 1.00 2.22 H new ATOM 3361 N GLU B 69 14.200 -10.196 6.735 1.00 0.42 N ATOM 3362 CA GLU B 69 13.210 -10.692 5.804 1.00 0.42 C ATOM 3363 C GLU B 69 11.905 -9.930 6.000 1.00 0.39 C ATOM 3364 O GLU B 69 11.249 -10.037 7.036 1.00 0.54 O ATOM 3365 CB GLU B 69 12.984 -12.202 5.961 1.00 0.60 C ATOM 3366 CG GLU B 69 12.648 -12.641 7.377 1.00 1.04 C ATOM 3367 CD GLU B 69 12.123 -14.060 7.433 1.00 1.44 C ATOM 3368 OE1 GLU B 69 12.864 -14.993 7.052 1.00 1.84 O ATOM 3369 OE2 GLU B 69 10.964 -14.253 7.861 1.00 2.09 O ATOM 0 H GLU B 69 13.805 -9.798 7.587 1.00 0.42 H new ATOM 0 HA GLU B 69 13.580 -10.529 4.792 1.00 0.42 H new ATOM 0 HB2 GLU B 69 12.175 -12.507 5.297 1.00 0.60 H new ATOM 0 HB3 GLU B 69 13.881 -12.728 5.633 1.00 0.60 H new ATOM 0 HG2 GLU B 69 13.539 -12.561 8.000 1.00 1.04 H new ATOM 0 HG3 GLU B 69 11.904 -11.964 7.797 1.00 1.04 H new ATOM 3376 N VAL B 70 11.559 -9.134 5.011 1.00 0.28 N ATOM 3377 CA VAL B 70 10.337 -8.363 5.039 1.00 0.25 C ATOM 3378 C VAL B 70 9.148 -9.254 4.715 1.00 0.25 C ATOM 3379 O VAL B 70 8.977 -9.710 3.583 1.00 0.33 O ATOM 3380 CB VAL B 70 10.422 -7.166 4.066 1.00 0.26 C ATOM 3381 CG1 VAL B 70 9.047 -6.660 3.676 1.00 0.29 C ATOM 3382 CG2 VAL B 70 11.212 -6.045 4.708 1.00 0.30 C ATOM 0 H VAL B 70 12.117 -9.004 4.167 1.00 0.28 H new ATOM 0 HA VAL B 70 10.199 -7.962 6.043 1.00 0.25 H new ATOM 0 HB VAL B 70 10.923 -7.506 3.160 1.00 0.26 H new ATOM 0 HG11 VAL B 70 9.150 -5.818 2.991 1.00 0.29 H new ATOM 0 HG12 VAL B 70 8.490 -7.460 3.187 1.00 0.29 H new ATOM 0 HG13 VAL B 70 8.511 -6.338 4.569 1.00 0.29 H new ATOM 0 HG21 VAL B 70 11.271 -5.201 4.020 1.00 0.30 H new ATOM 0 HG22 VAL B 70 10.717 -5.730 5.627 1.00 0.30 H new ATOM 0 HG23 VAL B 70 12.218 -6.395 4.940 1.00 0.30 H new ATOM 3392 N ASP B 71 8.357 -9.526 5.740 1.00 0.25 N ATOM 3393 CA ASP B 71 7.200 -10.399 5.618 1.00 0.29 C ATOM 3394 C ASP B 71 6.029 -9.624 5.002 1.00 0.22 C ATOM 3395 O ASP B 71 6.190 -8.464 4.623 1.00 0.21 O ATOM 3396 CB ASP B 71 6.829 -10.959 6.999 1.00 0.42 C ATOM 3397 CG ASP B 71 5.923 -12.173 6.938 1.00 1.18 C ATOM 3398 OD1 ASP B 71 6.436 -13.292 6.746 1.00 1.72 O ATOM 3399 OD2 ASP B 71 4.693 -12.012 7.101 1.00 2.06 O ATOM 0 H ASP B 71 8.498 -9.149 6.677 1.00 0.25 H new ATOM 0 HA ASP B 71 7.437 -11.236 4.961 1.00 0.29 H new ATOM 0 HB2 ASP B 71 7.742 -11.224 7.532 1.00 0.42 H new ATOM 0 HB3 ASP B 71 6.337 -10.178 7.579 1.00 0.42 H new ATOM 3404 N PHE B 72 4.856 -10.248 4.929 1.00 0.21 N ATOM 3405 CA PHE B 72 3.736 -9.718 4.148 1.00 0.19 C ATOM 3406 C PHE B 72 3.353 -8.283 4.532 1.00 0.15 C ATOM 3407 O PHE B 72 3.404 -7.389 3.685 1.00 0.14 O ATOM 3408 CB PHE B 72 2.513 -10.626 4.268 1.00 0.21 C ATOM 3409 CG PHE B 72 1.732 -10.721 2.988 1.00 0.20 C ATOM 3410 CD1 PHE B 72 1.796 -9.707 2.042 1.00 1.19 C ATOM 3411 CD2 PHE B 72 0.957 -11.832 2.718 1.00 1.18 C ATOM 3412 CE1 PHE B 72 1.100 -9.799 0.854 1.00 1.20 C ATOM 3413 CE2 PHE B 72 0.261 -11.932 1.531 1.00 1.20 C ATOM 3414 CZ PHE B 72 0.334 -10.915 0.598 1.00 0.32 C ATOM 0 H PHE B 72 4.654 -11.128 5.404 1.00 0.21 H new ATOM 0 HA PHE B 72 4.078 -9.693 3.114 1.00 0.19 H new ATOM 0 HB2 PHE B 72 2.835 -11.624 4.567 1.00 0.21 H new ATOM 0 HB3 PHE B 72 1.863 -10.250 5.058 1.00 0.21 H new ATOM 0 HD1 PHE B 72 2.399 -8.833 2.239 1.00 1.19 H new ATOM 0 HD2 PHE B 72 0.895 -12.630 3.443 1.00 1.18 H new ATOM 0 HE1 PHE B 72 1.155 -9.001 0.129 1.00 1.20 H new ATOM 0 HE2 PHE B 72 -0.341 -12.806 1.331 1.00 1.20 H new ATOM 0 HZ PHE B 72 -0.210 -10.995 -0.332 1.00 0.32 H new ATOM 3424 N GLN B 73 2.961 -8.049 5.785 1.00 0.15 N ATOM 3425 CA GLN B 73 2.491 -6.719 6.170 1.00 0.14 C ATOM 3426 C GLN B 73 3.630 -5.716 6.073 1.00 0.12 C ATOM 3427 O GLN B 73 3.415 -4.572 5.686 1.00 0.13 O ATOM 3428 CB GLN B 73 1.886 -6.690 7.582 1.00 0.16 C ATOM 3429 CG GLN B 73 0.938 -5.521 7.796 1.00 0.26 C ATOM 3430 CD GLN B 73 0.596 -5.288 9.255 1.00 0.22 C ATOM 3431 OE1 GLN B 73 -0.499 -4.838 9.581 1.00 0.68 O ATOM 3432 NE2 GLN B 73 1.539 -5.570 10.141 1.00 0.60 N ATOM 0 H GLN B 73 2.959 -8.743 6.533 1.00 0.15 H new ATOM 0 HA GLN B 73 1.696 -6.448 5.475 1.00 0.14 H new ATOM 0 HB2 GLN B 73 1.351 -7.623 7.762 1.00 0.16 H new ATOM 0 HB3 GLN B 73 2.691 -6.638 8.315 1.00 0.16 H new ATOM 0 HG2 GLN B 73 1.388 -4.617 7.386 1.00 0.26 H new ATOM 0 HG3 GLN B 73 0.019 -5.700 7.238 1.00 0.26 H new ATOM 0 HE21 GLN B 73 2.436 -5.943 9.830 1.00 0.60 H new ATOM 0 HE22 GLN B 73 1.368 -5.415 11.135 1.00 0.60 H new ATOM 3441 N GLU B 74 4.847 -6.169 6.379 1.00 0.14 N ATOM 3442 CA GLU B 74 6.026 -5.316 6.327 1.00 0.17 C ATOM 3443 C GLU B 74 6.287 -4.889 4.888 1.00 0.14 C ATOM 3444 O GLU B 74 6.753 -3.783 4.617 1.00 0.16 O ATOM 3445 CB GLU B 74 7.240 -6.072 6.870 1.00 0.27 C ATOM 3446 CG GLU B 74 8.278 -5.174 7.516 1.00 0.38 C ATOM 3447 CD GLU B 74 7.861 -4.724 8.900 1.00 0.43 C ATOM 3448 OE1 GLU B 74 7.063 -3.775 9.012 1.00 1.10 O ATOM 3449 OE2 GLU B 74 8.322 -5.332 9.889 1.00 1.21 O ATOM 0 H GLU B 74 5.038 -7.129 6.667 1.00 0.14 H new ATOM 0 HA GLU B 74 5.854 -4.431 6.940 1.00 0.17 H new ATOM 0 HB2 GLU B 74 6.902 -6.807 7.601 1.00 0.27 H new ATOM 0 HB3 GLU B 74 7.707 -6.625 6.055 1.00 0.27 H new ATOM 0 HG2 GLU B 74 9.228 -5.706 7.579 1.00 0.38 H new ATOM 0 HG3 GLU B 74 8.443 -4.300 6.886 1.00 0.38 H new ATOM 3456 N TYR B 75 5.978 -5.786 3.968 1.00 0.14 N ATOM 3457 CA TYR B 75 6.127 -5.525 2.549 1.00 0.14 C ATOM 3458 C TYR B 75 5.094 -4.514 2.086 1.00 0.11 C ATOM 3459 O TYR B 75 5.387 -3.629 1.290 1.00 0.13 O ATOM 3460 CB TYR B 75 5.973 -6.833 1.772 1.00 0.16 C ATOM 3461 CG TYR B 75 6.024 -6.682 0.270 1.00 0.17 C ATOM 3462 CD1 TYR B 75 4.877 -6.402 -0.465 1.00 1.21 C ATOM 3463 CD2 TYR B 75 7.217 -6.835 -0.411 1.00 1.19 C ATOM 3464 CE1 TYR B 75 4.921 -6.277 -1.837 1.00 1.22 C ATOM 3465 CE2 TYR B 75 7.272 -6.710 -1.788 1.00 1.20 C ATOM 3466 CZ TYR B 75 6.120 -6.430 -2.494 1.00 0.22 C ATOM 3467 OH TYR B 75 6.169 -6.310 -3.862 1.00 0.26 O ATOM 0 H TYR B 75 5.617 -6.715 4.185 1.00 0.14 H new ATOM 0 HA TYR B 75 7.118 -5.111 2.364 1.00 0.14 H new ATOM 0 HB2 TYR B 75 6.761 -7.519 2.082 1.00 0.16 H new ATOM 0 HB3 TYR B 75 5.024 -7.293 2.046 1.00 0.16 H new ATOM 0 HD1 TYR B 75 3.935 -6.280 0.049 1.00 1.21 H new ATOM 0 HD2 TYR B 75 8.120 -7.055 0.140 1.00 1.19 H new ATOM 0 HE1 TYR B 75 4.020 -6.060 -2.392 1.00 1.22 H new ATOM 0 HE2 TYR B 75 8.211 -6.831 -2.307 1.00 1.20 H new ATOM 0 HH TYR B 75 5.302 -6.562 -4.244 1.00 0.26 H new ATOM 3477 N CYS B 76 3.887 -4.646 2.592 1.00 0.11 N ATOM 3478 CA CYS B 76 2.806 -3.796 2.164 1.00 0.12 C ATOM 3479 C CYS B 76 2.882 -2.420 2.823 1.00 0.12 C ATOM 3480 O CYS B 76 2.579 -1.417 2.183 1.00 0.13 O ATOM 3481 CB CYS B 76 1.469 -4.471 2.456 1.00 0.14 C ATOM 3482 SG CYS B 76 1.358 -6.169 1.847 1.00 0.22 S ATOM 0 H CYS B 76 3.633 -5.335 3.300 1.00 0.11 H new ATOM 0 HA CYS B 76 2.895 -3.642 1.089 1.00 0.12 H new ATOM 0 HB2 CYS B 76 1.300 -4.470 3.533 1.00 0.14 H new ATOM 0 HB3 CYS B 76 0.670 -3.881 2.007 1.00 0.14 H new ATOM 0 HG CYS B 76 2.199 -6.919 2.496 1.00 0.22 H new ATOM 3488 N VAL B 77 3.288 -2.360 4.091 1.00 0.13 N ATOM 3489 CA VAL B 77 3.489 -1.069 4.751 1.00 0.14 C ATOM 3490 C VAL B 77 4.622 -0.323 4.058 1.00 0.14 C ATOM 3491 O VAL B 77 4.621 0.899 3.989 1.00 0.19 O ATOM 3492 CB VAL B 77 3.780 -1.216 6.268 1.00 0.16 C ATOM 3493 CG1 VAL B 77 4.957 -2.126 6.488 1.00 0.14 C ATOM 3494 CG2 VAL B 77 4.030 0.129 6.934 1.00 0.20 C ATOM 0 H VAL B 77 3.482 -3.174 4.674 1.00 0.13 H new ATOM 0 HA VAL B 77 2.563 -0.501 4.667 1.00 0.14 H new ATOM 0 HB VAL B 77 2.893 -1.652 6.728 1.00 0.16 H new ATOM 0 HG11 VAL B 77 5.150 -2.220 7.557 1.00 0.14 H new ATOM 0 HG12 VAL B 77 4.740 -3.109 6.071 1.00 0.14 H new ATOM 0 HG13 VAL B 77 5.836 -1.709 5.996 1.00 0.14 H new ATOM 0 HG21 VAL B 77 4.229 -0.022 7.995 1.00 0.20 H new ATOM 0 HG22 VAL B 77 4.889 0.611 6.468 1.00 0.20 H new ATOM 0 HG23 VAL B 77 3.151 0.762 6.816 1.00 0.20 H new ATOM 3504 N PHE B 78 5.572 -1.085 3.528 1.00 0.11 N ATOM 3505 CA PHE B 78 6.595 -0.556 2.642 1.00 0.11 C ATOM 3506 C PHE B 78 5.944 0.207 1.494 1.00 0.11 C ATOM 3507 O PHE B 78 6.307 1.343 1.187 1.00 0.11 O ATOM 3508 CB PHE B 78 7.426 -1.720 2.092 1.00 0.12 C ATOM 3509 CG PHE B 78 8.171 -1.424 0.826 1.00 0.12 C ATOM 3510 CD1 PHE B 78 9.447 -0.896 0.872 1.00 1.17 C ATOM 3511 CD2 PHE B 78 7.601 -1.697 -0.414 1.00 1.18 C ATOM 3512 CE1 PHE B 78 10.145 -0.642 -0.289 1.00 1.18 C ATOM 3513 CE2 PHE B 78 8.293 -1.439 -1.578 1.00 1.18 C ATOM 3514 CZ PHE B 78 9.570 -0.913 -1.515 1.00 0.15 C ATOM 0 H PHE B 78 5.652 -2.087 3.702 1.00 0.11 H new ATOM 0 HA PHE B 78 7.241 0.128 3.193 1.00 0.11 H new ATOM 0 HB2 PHE B 78 8.142 -2.027 2.854 1.00 0.12 H new ATOM 0 HB3 PHE B 78 6.764 -2.568 1.916 1.00 0.12 H new ATOM 0 HD1 PHE B 78 9.902 -0.680 1.827 1.00 1.17 H new ATOM 0 HD2 PHE B 78 6.607 -2.115 -0.465 1.00 1.18 H new ATOM 0 HE1 PHE B 78 11.142 -0.231 -0.240 1.00 1.18 H new ATOM 0 HE2 PHE B 78 7.839 -1.647 -2.536 1.00 1.18 H new ATOM 0 HZ PHE B 78 10.118 -0.714 -2.424 1.00 0.15 H new ATOM 3524 N LEU B 79 4.973 -0.444 0.874 1.00 0.14 N ATOM 3525 CA LEU B 79 4.246 0.123 -0.244 1.00 0.16 C ATOM 3526 C LEU B 79 3.469 1.352 0.158 1.00 0.17 C ATOM 3527 O LEU B 79 3.611 2.416 -0.442 1.00 0.20 O ATOM 3528 CB LEU B 79 3.289 -0.908 -0.818 1.00 0.15 C ATOM 3529 CG LEU B 79 3.915 -1.888 -1.789 1.00 0.15 C ATOM 3530 CD1 LEU B 79 3.762 -3.307 -1.291 1.00 0.19 C ATOM 3531 CD2 LEU B 79 3.265 -1.726 -3.133 1.00 0.14 C ATOM 0 H LEU B 79 4.668 -1.382 1.134 1.00 0.14 H new ATOM 0 HA LEU B 79 4.979 0.414 -0.996 1.00 0.16 H new ATOM 0 HB2 LEU B 79 2.845 -1.468 0.005 1.00 0.15 H new ATOM 0 HB3 LEU B 79 2.477 -0.386 -1.324 1.00 0.15 H new ATOM 0 HG LEU B 79 4.982 -1.681 -1.874 1.00 0.15 H new ATOM 0 HD11 LEU B 79 4.219 -3.994 -2.004 1.00 0.19 H new ATOM 0 HD12 LEU B 79 4.254 -3.408 -0.323 1.00 0.19 H new ATOM 0 HD13 LEU B 79 2.703 -3.544 -1.186 1.00 0.19 H new ATOM 0 HD21 LEU B 79 3.709 -2.428 -3.839 1.00 0.14 H new ATOM 0 HD22 LEU B 79 2.197 -1.925 -3.047 1.00 0.14 H new ATOM 0 HD23 LEU B 79 3.416 -0.707 -3.490 1.00 0.14 H new ATOM 3543 N SER B 80 2.650 1.204 1.177 1.00 0.19 N ATOM 3544 CA SER B 80 1.833 2.296 1.641 1.00 0.21 C ATOM 3545 C SER B 80 2.709 3.427 2.117 1.00 0.20 C ATOM 3546 O SER B 80 2.348 4.591 1.999 1.00 0.24 O ATOM 3547 CB SER B 80 0.904 1.817 2.735 1.00 0.22 C ATOM 3548 OG SER B 80 1.570 0.969 3.648 1.00 0.18 O ATOM 0 H SER B 80 2.535 0.335 1.698 1.00 0.19 H new ATOM 0 HA SER B 80 1.221 2.668 0.820 1.00 0.21 H new ATOM 0 HB2 SER B 80 0.494 2.676 3.267 1.00 0.22 H new ATOM 0 HB3 SER B 80 0.062 1.286 2.291 1.00 0.22 H new ATOM 0 HG SER B 80 0.916 0.395 4.099 1.00 0.18 H new ATOM 3554 N CYS B 81 3.874 3.076 2.630 1.00 0.17 N ATOM 3555 CA CYS B 81 4.877 4.058 2.946 1.00 0.18 C ATOM 3556 C CYS B 81 5.243 4.844 1.719 1.00 0.33 C ATOM 3557 O CYS B 81 5.177 6.048 1.743 1.00 0.72 O ATOM 3558 CB CYS B 81 6.131 3.421 3.504 1.00 0.30 C ATOM 3559 SG CYS B 81 7.617 4.406 3.223 1.00 1.83 S ATOM 0 H CYS B 81 4.143 2.114 2.835 1.00 0.17 H new ATOM 0 HA CYS B 81 4.451 4.716 3.703 1.00 0.18 H new ATOM 0 HB2 CYS B 81 6.005 3.264 4.575 1.00 0.30 H new ATOM 0 HB3 CYS B 81 6.264 2.438 3.051 1.00 0.30 H new ATOM 0 HG CYS B 81 8.037 4.220 2.007 1.00 1.83 H new ATOM 3565 N ILE B 82 5.623 4.157 0.650 1.00 0.17 N ATOM 3566 CA ILE B 82 6.030 4.839 -0.565 1.00 0.19 C ATOM 3567 C ILE B 82 4.930 5.768 -1.053 1.00 0.21 C ATOM 3568 O ILE B 82 5.147 6.964 -1.199 1.00 0.28 O ATOM 3569 CB ILE B 82 6.419 3.863 -1.696 1.00 0.19 C ATOM 3570 CG1 ILE B 82 7.613 3.008 -1.266 1.00 0.24 C ATOM 3571 CG2 ILE B 82 6.749 4.635 -2.964 1.00 0.24 C ATOM 3572 CD1 ILE B 82 8.445 2.499 -2.423 1.00 0.41 C ATOM 0 H ILE B 82 5.657 3.139 0.602 1.00 0.17 H new ATOM 0 HA ILE B 82 6.917 5.418 -0.309 1.00 0.19 H new ATOM 0 HB ILE B 82 5.575 3.205 -1.900 1.00 0.19 H new ATOM 0 HG12 ILE B 82 8.249 3.595 -0.603 1.00 0.24 H new ATOM 0 HG13 ILE B 82 7.250 2.157 -0.689 1.00 0.24 H new ATOM 0 HG21 ILE B 82 7.022 3.936 -3.755 1.00 0.24 H new ATOM 0 HG22 ILE B 82 5.879 5.213 -3.275 1.00 0.24 H new ATOM 0 HG23 ILE B 82 7.583 5.310 -2.772 1.00 0.24 H new ATOM 0 HD11 ILE B 82 9.273 1.901 -2.041 1.00 0.41 H new ATOM 0 HD12 ILE B 82 7.824 1.884 -3.075 1.00 0.41 H new ATOM 0 HD13 ILE B 82 8.838 3.344 -2.988 1.00 0.41 H new ATOM 3584 N ALA B 83 3.742 5.227 -1.252 1.00 0.26 N ATOM 3585 CA ALA B 83 2.630 6.008 -1.775 1.00 0.32 C ATOM 3586 C ALA B 83 2.265 7.163 -0.846 1.00 0.32 C ATOM 3587 O ALA B 83 1.942 8.259 -1.295 1.00 0.35 O ATOM 3588 CB ALA B 83 1.434 5.115 -2.006 1.00 0.42 C ATOM 0 H ALA B 83 3.520 4.250 -1.060 1.00 0.26 H new ATOM 0 HA ALA B 83 2.942 6.441 -2.726 1.00 0.32 H new ATOM 0 HB1 ALA B 83 0.607 5.708 -2.397 1.00 0.42 H new ATOM 0 HB2 ALA B 83 1.694 4.337 -2.724 1.00 0.42 H new ATOM 0 HB3 ALA B 83 1.136 4.655 -1.064 1.00 0.42 H new ATOM 3594 N MET B 84 2.329 6.914 0.451 1.00 0.33 N ATOM 3595 CA MET B 84 2.038 7.938 1.447 1.00 0.36 C ATOM 3596 C MET B 84 3.210 8.888 1.604 1.00 0.36 C ATOM 3597 O MET B 84 3.043 10.055 1.940 1.00 0.48 O ATOM 3598 CB MET B 84 1.698 7.277 2.770 1.00 0.38 C ATOM 3599 CG MET B 84 1.490 8.233 3.923 1.00 0.44 C ATOM 3600 SD MET B 84 1.280 7.332 5.462 1.00 0.38 S ATOM 3601 CE MET B 84 2.565 6.108 5.249 1.00 0.22 C ATOM 0 H MET B 84 2.581 6.007 0.843 1.00 0.33 H new ATOM 0 HA MET B 84 1.182 8.524 1.113 1.00 0.36 H new ATOM 0 HB2 MET B 84 0.793 6.683 2.641 1.00 0.38 H new ATOM 0 HB3 MET B 84 2.499 6.585 3.030 1.00 0.38 H new ATOM 0 HG2 MET B 84 2.344 8.906 4.003 1.00 0.44 H new ATOM 0 HG3 MET B 84 0.613 8.852 3.735 1.00 0.44 H new ATOM 0 HE1 MET B 84 2.931 5.791 6.226 1.00 0.22 H new ATOM 0 HE2 MET B 84 2.162 5.247 4.715 1.00 0.22 H new ATOM 0 HE3 MET B 84 3.386 6.539 4.676 1.00 0.22 H new ATOM 3611 N MET B 85 4.397 8.385 1.350 1.00 0.28 N ATOM 3612 CA MET B 85 5.581 9.199 1.325 1.00 0.29 C ATOM 3613 C MET B 85 5.488 10.168 0.145 1.00 0.34 C ATOM 3614 O MET B 85 6.061 11.257 0.164 1.00 0.48 O ATOM 3615 CB MET B 85 6.806 8.310 1.216 1.00 0.28 C ATOM 3616 CG MET B 85 8.068 9.006 1.655 1.00 0.32 C ATOM 3617 SD MET B 85 9.537 8.429 0.780 1.00 0.29 S ATOM 3618 CE MET B 85 9.583 6.729 1.327 1.00 0.25 C ATOM 0 H MET B 85 4.564 7.398 1.155 1.00 0.28 H new ATOM 0 HA MET B 85 5.667 9.777 2.245 1.00 0.29 H new ATOM 0 HB2 MET B 85 6.658 7.417 1.824 1.00 0.28 H new ATOM 0 HB3 MET B 85 6.919 7.978 0.184 1.00 0.28 H new ATOM 0 HG2 MET B 85 7.957 10.079 1.498 1.00 0.32 H new ATOM 0 HG3 MET B 85 8.207 8.853 2.725 1.00 0.32 H new ATOM 0 HE1 MET B 85 10.581 6.322 1.167 1.00 0.25 H new ATOM 0 HE2 MET B 85 9.338 6.681 2.388 1.00 0.25 H new ATOM 0 HE3 MET B 85 8.858 6.145 0.760 1.00 0.25 H new ATOM 3628 N CYS B 86 4.717 9.758 -0.871 1.00 0.31 N ATOM 3629 CA CYS B 86 4.435 10.591 -2.038 1.00 0.34 C ATOM 3630 C CYS B 86 3.519 11.748 -1.667 1.00 0.39 C ATOM 3631 O CYS B 86 3.411 12.719 -2.412 1.00 0.46 O ATOM 3632 CB CYS B 86 3.750 9.782 -3.148 1.00 0.39 C ATOM 3633 SG CYS B 86 4.614 8.282 -3.665 1.00 0.94 S ATOM 0 H CYS B 86 4.274 8.840 -0.903 1.00 0.31 H new ATOM 0 HA CYS B 86 5.393 10.968 -2.396 1.00 0.34 H new ATOM 0 HB2 CYS B 86 2.751 9.506 -2.809 1.00 0.39 H new ATOM 0 HB3 CYS B 86 3.625 10.426 -4.018 1.00 0.39 H new ATOM 0 HG CYS B 86 4.848 7.536 -2.626 1.00 0.94 H new ATOM 3639 N ASN B 87 2.843 11.628 -0.531 1.00 0.45 N ATOM 3640 CA ASN B 87 1.857 12.619 -0.114 1.00 0.58 C ATOM 3641 C ASN B 87 2.463 14.014 -0.057 1.00 0.68 C ATOM 3642 O ASN B 87 1.813 14.984 -0.406 1.00 0.89 O ATOM 3643 CB ASN B 87 1.244 12.242 1.243 1.00 0.72 C ATOM 3644 CG ASN B 87 0.194 13.224 1.752 1.00 1.10 C ATOM 3645 OD1 ASN B 87 0.061 13.425 2.958 1.00 1.72 O ATOM 3646 ND2 ASN B 87 -0.575 13.820 0.851 1.00 1.77 N ATOM 0 H ASN B 87 2.960 10.852 0.120 1.00 0.45 H new ATOM 0 HA ASN B 87 1.063 12.629 -0.861 1.00 0.58 H new ATOM 0 HB2 ASN B 87 0.791 11.254 1.162 1.00 0.72 H new ATOM 0 HB3 ASN B 87 2.043 12.167 1.981 1.00 0.72 H new ATOM 0 HD21 ASN B 87 -1.304 14.468 1.151 1.00 1.77 H new ATOM 0 HD22 ASN B 87 -0.438 13.631 -0.142 1.00 1.77 H new ATOM 3653 N GLU B 88 3.710 14.121 0.354 1.00 0.70 N ATOM 3654 CA GLU B 88 4.364 15.418 0.363 1.00 0.89 C ATOM 3655 C GLU B 88 4.839 15.787 -1.035 1.00 0.86 C ATOM 3656 O GLU B 88 4.581 16.884 -1.521 1.00 1.06 O ATOM 3657 CB GLU B 88 5.546 15.426 1.316 1.00 1.03 C ATOM 3658 CG GLU B 88 5.186 15.064 2.738 1.00 1.51 C ATOM 3659 CD GLU B 88 6.356 15.263 3.676 1.00 1.72 C ATOM 3660 OE1 GLU B 88 7.484 15.482 3.178 1.00 2.33 O ATOM 3661 OE2 GLU B 88 6.157 15.217 4.906 1.00 1.98 O ATOM 0 H GLU B 88 4.284 13.343 0.681 1.00 0.70 H new ATOM 0 HA GLU B 88 3.634 16.153 0.702 1.00 0.89 H new ATOM 0 HB2 GLU B 88 6.299 14.726 0.952 1.00 1.03 H new ATOM 0 HB3 GLU B 88 6.001 16.416 1.307 1.00 1.03 H new ATOM 0 HG2 GLU B 88 4.346 15.675 3.068 1.00 1.51 H new ATOM 0 HG3 GLU B 88 4.859 14.025 2.778 1.00 1.51 H new ATOM 3668 N PHE B 89 5.527 14.852 -1.677 1.00 0.69 N ATOM 3669 CA PHE B 89 6.148 15.096 -2.974 1.00 0.71 C ATOM 3670 C PHE B 89 5.109 15.258 -4.080 1.00 0.73 C ATOM 3671 O PHE B 89 4.890 16.358 -4.590 1.00 0.88 O ATOM 3672 CB PHE B 89 7.087 13.939 -3.322 1.00 0.69 C ATOM 3673 CG PHE B 89 8.236 13.780 -2.367 1.00 0.91 C ATOM 3674 CD1 PHE B 89 9.384 14.538 -2.514 1.00 1.65 C ATOM 3675 CD2 PHE B 89 8.166 12.872 -1.323 1.00 1.53 C ATOM 3676 CE1 PHE B 89 10.444 14.396 -1.638 1.00 1.99 C ATOM 3677 CE2 PHE B 89 9.222 12.725 -0.443 1.00 1.89 C ATOM 3678 CZ PHE B 89 10.361 13.487 -0.601 1.00 1.81 C ATOM 0 H PHE B 89 5.670 13.908 -1.317 1.00 0.69 H new ATOM 0 HA PHE B 89 6.710 16.027 -2.902 1.00 0.71 H new ATOM 0 HB2 PHE B 89 6.514 13.012 -3.343 1.00 0.69 H new ATOM 0 HB3 PHE B 89 7.481 14.093 -4.327 1.00 0.69 H new ATOM 0 HD1 PHE B 89 9.453 15.250 -3.323 1.00 1.65 H new ATOM 0 HD2 PHE B 89 7.277 12.272 -1.195 1.00 1.53 H new ATOM 0 HE1 PHE B 89 11.334 14.994 -1.764 1.00 1.99 H new ATOM 0 HE2 PHE B 89 9.155 12.014 0.367 1.00 1.89 H new ATOM 0 HZ PHE B 89 11.187 13.373 0.085 1.00 1.81 H new ATOM 3688 N PHE B 90 4.461 14.159 -4.423 1.00 0.63 N ATOM 3689 CA PHE B 90 3.504 14.127 -5.518 1.00 0.66 C ATOM 3690 C PHE B 90 2.211 14.821 -5.125 1.00 0.69 C ATOM 3691 O PHE B 90 1.744 15.738 -5.803 1.00 0.83 O ATOM 3692 CB PHE B 90 3.201 12.676 -5.891 1.00 0.69 C ATOM 3693 CG PHE B 90 2.423 12.534 -7.173 1.00 0.95 C ATOM 3694 CD1 PHE B 90 1.039 12.618 -7.179 1.00 1.44 C ATOM 3695 CD2 PHE B 90 3.082 12.323 -8.372 1.00 1.79 C ATOM 3696 CE1 PHE B 90 0.328 12.492 -8.358 1.00 1.68 C ATOM 3697 CE2 PHE B 90 2.377 12.196 -9.554 1.00 2.09 C ATOM 3698 CZ PHE B 90 0.998 12.279 -9.547 1.00 1.67 C ATOM 0 H PHE B 90 4.582 13.263 -3.951 1.00 0.63 H new ATOM 0 HA PHE B 90 3.939 14.649 -6.370 1.00 0.66 H new ATOM 0 HB2 PHE B 90 4.140 12.129 -5.983 1.00 0.69 H new ATOM 0 HB3 PHE B 90 2.639 12.211 -5.081 1.00 0.69 H new ATOM 0 HD1 PHE B 90 0.510 12.784 -6.252 1.00 1.44 H new ATOM 0 HD2 PHE B 90 4.160 12.257 -8.384 1.00 1.79 H new ATOM 0 HE1 PHE B 90 -0.750 12.560 -8.349 1.00 1.68 H new ATOM 0 HE2 PHE B 90 2.904 12.032 -10.482 1.00 2.09 H new ATOM 0 HZ PHE B 90 0.445 12.178 -10.469 1.00 1.67 H new