USER MOD reduce.3.24.130724 H: found=0, std=0, add=1668, rem=0, adj=50 USER MOD reduce.3.24.130724 removed 1668 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 84 LYS NZ :NH3+ 165:sc= -4.41! (180deg=0) USER MOD Set 1.2: B 88 ASN : amide:sc= -6.85! C(o=-11!,f=-8.5!) USER MOD Set 2.1: B 45 MET CE :methyl -119:sc= -0.422 (180deg=-0.861) USER MOD Set 2.2: B 52 GLN : amide:sc= -0.0216 X(o=-0.44,f=-0.17) USER MOD Set 3.1: B 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.2: B 19 SER OG : rot 180:sc= -0.664 USER MOD Set 4.1: A 84 LYS NZ :NH3+ 168:sc= -5.37! (180deg=0) USER MOD Set 4.2: A 88 ASN : amide:sc= -6.76! C(o=-12!,f=-7.9!) USER MOD Set 5.1: A 45 MET CE :methyl 163:sc= -0.64 (180deg=-1.34!) USER MOD Set 5.2: A 52 GLN : amide:sc= -0.124 K(o=-0.76,f=-0.036) USER MOD Set 6.1: A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 6.2: A 19 SER OG : rot 180:sc= -0.62 USER MOD Single : A 1 ALA N :NH3+ 178:sc= 0 (180deg=-0.00417) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ -117:sc= -1.34 (180deg=-3.39!) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 SER OG : rot -52:sc= 0.461 USER MOD Single : A 6 LYS NZ :NH3+ 161:sc= 0 (180deg=-0.334) USER MOD Single : A 11 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 CYS SG : rot -42:sc= -0.818 USER MOD Single : A 21 SER OG : rot 100:sc= 0.517 USER MOD Single : A 23 LYS NZ :NH3+ -112:sc= -0.168 (180deg=-2.21!) USER MOD Single : A 24 THR OG1 : rot 180:sc= -0.0563 USER MOD Single : A 27 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 31 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot -150:sc= -1 USER MOD Single : A 40 TYR OH : rot -150:sc= 0.317 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 MET CE :methyl 149:sc= 0 (180deg=-0.00892) USER MOD Single : A 55 LYS NZ :NH3+ -146:sc= -0.192 (180deg=-1.14) USER MOD Single : A 56 GLN : amide:sc= -0.545 K(o=-0.54,f=-1.4) USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 60 THR OG1 : rot 180:sc= -0.567 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 LYS NZ :NH3+ -162:sc=-0.00275 (180deg=-0.493) USER MOD Single : A 72 LYS NZ :NH3+ 141:sc= 0.653 (180deg=-1.13!) USER MOD Single : A 74 ASN : amide:sc= -0.0559 X(o=-0.056,f=0) USER MOD Single : A 76 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 ASN : amide:sc= -0.294 X(o=-0.29,f=-0.016) USER MOD Single : A 80 MET CE :methyl 177:sc= -0.604 (180deg=-0.618) USER MOD Single : A 82 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 95 GLN : amide:sc=-0.000693 K(o=-0.00069,f=-1.3) USER MOD Single : B 1 ALA N :NH3+ 177:sc= 0 (180deg=-0.00727) USER MOD Single : B 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 3 LYS NZ :NH3+ -124:sc= -1.37 (180deg=-3.38!) USER MOD Single : B 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 5 SER OG : rot -53:sc= 0.493 USER MOD Single : B 6 LYS NZ :NH3+ 160:sc= 0 (180deg=-0.296) USER MOD Single : B 11 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 17 CYS SG : rot -29:sc= -2.09 USER MOD Single : B 21 SER OG : rot 107:sc= 0.286 USER MOD Single : B 23 LYS NZ :NH3+ -117:sc= -0.193 (180deg=-2.01!) USER MOD Single : B 24 THR OG1 : rot 180:sc= -0.0827 USER MOD Single : B 27 MET CE :methyl -165:sc= -0.0128 (180deg=-0.419) USER MOD Single : B 28 TYR OH : rot 180:sc= 0 USER MOD Single : B 31 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 33 SER OG : rot 180:sc= 0 USER MOD Single : B 34 TYR OH : rot 180:sc= 0 USER MOD Single : B 37 THR OG1 : rot -170:sc= -2.4! USER MOD Single : B 40 TYR OH : rot -148:sc= 0.345 USER MOD Single : B 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 43 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 55 LYS NZ :NH3+ -147:sc= -0.127 (180deg=-0.822) USER MOD Single : B 56 GLN : amide:sc= -0.024 X(o=-0.024,f=0) USER MOD Single : B 57 TYR OH : rot 180:sc= 0 USER MOD Single : B 58 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 60 THR OG1 : rot 180:sc= -0.517 USER MOD Single : B 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 62 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.208) USER MOD Single : B 72 LYS NZ :NH3+ 145:sc= 0.747 (180deg=-1.45!) USER MOD Single : B 74 ASN : amide:sc= -0.147 X(o=-0.15,f=0) USER MOD Single : B 76 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 79 ASN : amide:sc= -0.264 X(o=-0.26,f=-0.067) USER MOD Single : B 80 MET CE :methyl 162:sc= -0.722 (180deg=-0.8) USER MOD Single : B 82 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 89 SER OG : rot 180:sc= 0 USER MOD Single : B 92 SER OG : rot 180:sc= 0 USER MOD Single : B 95 GLN : amide:sc= 0 K(o=0,f=-1.3) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -14.129 12.732 2.418 1.00 5.35 N ATOM 2 CA ALA A 1 -12.694 13.091 2.597 1.00 4.76 C ATOM 3 C ALA A 1 -11.853 11.815 2.661 1.00 4.12 C ATOM 4 O ALA A 1 -11.006 11.661 3.517 1.00 3.94 O ATOM 5 CB ALA A 1 -12.524 13.879 3.898 1.00 4.81 C ATOM 0 H1 ALA A 1 -14.705 13.598 2.408 1.00 5.35 H new ATOM 0 H2 ALA A 1 -14.250 12.225 1.518 1.00 5.35 H new ATOM 0 H3 ALA A 1 -14.435 12.122 3.203 1.00 5.35 H new ATOM 0 HA ALA A 1 -12.365 13.701 1.756 1.00 4.76 H new ATOM 0 HB1 ALA A 1 -11.474 14.142 4.030 1.00 4.81 H new ATOM 0 HB2 ALA A 1 -13.123 14.788 3.853 1.00 4.81 H new ATOM 0 HB3 ALA A 1 -12.853 13.269 4.739 1.00 4.81 H new ATOM 13 N LYS A 2 -12.079 10.898 1.760 1.00 4.22 N ATOM 14 CA LYS A 2 -11.292 9.633 1.770 1.00 4.07 C ATOM 15 C LYS A 2 -11.442 8.951 3.132 1.00 3.66 C ATOM 16 O LYS A 2 -10.474 8.551 3.747 1.00 4.35 O ATOM 17 CB LYS A 2 -9.816 9.948 1.513 1.00 4.82 C ATOM 18 CG LYS A 2 -9.702 10.954 0.366 1.00 5.66 C ATOM 19 CD LYS A 2 -8.226 11.216 0.059 1.00 6.60 C ATOM 20 CE LYS A 2 -8.114 12.259 -1.053 1.00 7.50 C ATOM 21 NZ LYS A 2 -6.678 12.581 -1.291 1.00 7.90 N ATOM 0 H LYS A 2 -12.775 10.971 1.018 1.00 4.22 H new ATOM 0 HA LYS A 2 -11.661 8.968 0.989 1.00 4.07 H new ATOM 0 HB2 LYS A 2 -9.357 10.354 2.414 1.00 4.82 H new ATOM 0 HB3 LYS A 2 -9.276 9.034 1.265 1.00 4.82 H new ATOM 0 HG2 LYS A 2 -10.206 10.569 -0.521 1.00 5.66 H new ATOM 0 HG3 LYS A 2 -10.199 11.886 0.635 1.00 5.66 H new ATOM 0 HD2 LYS A 2 -7.714 11.568 0.955 1.00 6.60 H new ATOM 0 HD3 LYS A 2 -7.737 10.291 -0.245 1.00 6.60 H new ATOM 0 HE2 LYS A 2 -8.569 11.880 -1.968 1.00 7.50 H new ATOM 0 HE3 LYS A 2 -8.659 13.161 -0.776 1.00 7.50 H new ATOM 0 HZ1 LYS A 2 -6.602 13.291 -2.048 1.00 7.90 H new ATOM 0 HZ2 LYS A 2 -6.258 12.959 -0.418 1.00 7.90 H new ATOM 0 HZ3 LYS A 2 -6.171 11.718 -1.574 1.00 7.90 H new ATOM 35 N LYS A 3 -12.650 8.819 3.605 1.00 2.85 N ATOM 36 CA LYS A 3 -12.866 8.165 4.927 1.00 2.88 C ATOM 37 C LYS A 3 -14.364 7.980 5.147 1.00 2.35 C ATOM 38 O LYS A 3 -14.802 7.043 5.783 1.00 2.83 O ATOM 39 CB LYS A 3 -12.291 9.048 6.037 1.00 3.31 C ATOM 40 CG LYS A 3 -12.880 10.455 5.927 1.00 3.76 C ATOM 41 CD LYS A 3 -12.216 11.374 6.956 1.00 4.46 C ATOM 42 CE LYS A 3 -12.482 10.845 8.369 1.00 5.18 C ATOM 43 NZ LYS A 3 -11.417 9.873 8.743 1.00 5.69 N ATOM 0 H LYS A 3 -13.497 9.136 3.134 1.00 2.85 H new ATOM 0 HA LYS A 3 -12.366 7.196 4.946 1.00 2.88 H new ATOM 0 HB2 LYS A 3 -12.523 8.621 7.013 1.00 3.31 H new ATOM 0 HB3 LYS A 3 -11.205 9.090 5.957 1.00 3.31 H new ATOM 0 HG2 LYS A 3 -12.725 10.847 4.922 1.00 3.76 H new ATOM 0 HG3 LYS A 3 -13.957 10.423 6.095 1.00 3.76 H new ATOM 0 HD2 LYS A 3 -11.143 11.426 6.773 1.00 4.46 H new ATOM 0 HD3 LYS A 3 -12.605 12.387 6.857 1.00 4.46 H new ATOM 0 HE2 LYS A 3 -12.502 11.671 9.080 1.00 5.18 H new ATOM 0 HE3 LYS A 3 -13.459 10.364 8.411 1.00 5.18 H new ATOM 0 HZ1 LYS A 3 -11.840 8.935 8.892 1.00 5.69 H new ATOM 0 HZ2 LYS A 3 -10.713 9.818 7.979 1.00 5.69 H new ATOM 0 HZ3 LYS A 3 -10.953 10.187 9.619 1.00 5.69 H new ATOM 57 N LYS A 4 -15.151 8.871 4.616 1.00 1.83 N ATOM 58 CA LYS A 4 -16.626 8.766 4.775 1.00 1.71 C ATOM 59 C LYS A 4 -17.289 9.218 3.478 1.00 1.52 C ATOM 60 O LYS A 4 -16.628 9.509 2.501 1.00 2.02 O ATOM 61 CB LYS A 4 -17.089 9.677 5.916 1.00 2.12 C ATOM 62 CG LYS A 4 -16.579 9.136 7.254 1.00 2.54 C ATOM 63 CD LYS A 4 -16.994 10.087 8.378 1.00 3.17 C ATOM 64 CE LYS A 4 -16.485 9.551 9.717 1.00 3.65 C ATOM 65 NZ LYS A 4 -16.498 10.646 10.728 1.00 4.24 N ATOM 0 H LYS A 4 -14.833 9.674 4.074 1.00 1.83 H new ATOM 0 HA LYS A 4 -16.899 7.736 5.003 1.00 1.71 H new ATOM 0 HB2 LYS A 4 -16.718 10.690 5.758 1.00 2.12 H new ATOM 0 HB3 LYS A 4 -18.177 9.735 5.928 1.00 2.12 H new ATOM 0 HG2 LYS A 4 -16.986 8.141 7.436 1.00 2.54 H new ATOM 0 HG3 LYS A 4 -15.494 9.037 7.229 1.00 2.54 H new ATOM 0 HD2 LYS A 4 -16.588 11.082 8.195 1.00 3.17 H new ATOM 0 HD3 LYS A 4 -18.079 10.185 8.403 1.00 3.17 H new ATOM 0 HE2 LYS A 4 -17.112 8.725 10.052 1.00 3.65 H new ATOM 0 HE3 LYS A 4 -15.474 9.159 9.603 1.00 3.65 H new ATOM 0 HZ1 LYS A 4 -16.152 10.282 11.639 1.00 4.24 H new ATOM 0 HZ2 LYS A 4 -15.882 11.421 10.408 1.00 4.24 H new ATOM 0 HZ3 LYS A 4 -17.469 11.000 10.843 1.00 4.24 H new ATOM 79 N SER A 5 -18.588 9.293 3.461 1.00 1.49 N ATOM 80 CA SER A 5 -19.291 9.741 2.230 1.00 1.72 C ATOM 81 C SER A 5 -18.723 9.044 0.997 1.00 1.51 C ATOM 82 O SER A 5 -18.659 9.627 -0.064 1.00 1.76 O ATOM 83 CB SER A 5 -19.101 11.237 2.072 1.00 2.08 C ATOM 84 OG SER A 5 -19.990 11.725 1.076 1.00 2.67 O ATOM 0 H SER A 5 -19.195 9.063 4.248 1.00 1.49 H new ATOM 0 HA SER A 5 -20.348 9.492 2.322 1.00 1.72 H new ATOM 0 HB2 SER A 5 -19.289 11.740 3.020 1.00 2.08 H new ATOM 0 HB3 SER A 5 -18.070 11.456 1.793 1.00 2.08 H new ATOM 0 HG SER A 5 -19.891 11.192 0.260 1.00 2.67 H new ATOM 90 N LYS A 6 -18.325 7.806 1.123 1.00 1.38 N ATOM 91 CA LYS A 6 -17.773 7.072 -0.054 1.00 1.30 C ATOM 92 C LYS A 6 -17.021 5.830 0.427 1.00 1.16 C ATOM 93 O LYS A 6 -17.159 4.758 -0.127 1.00 1.17 O ATOM 94 CB LYS A 6 -16.810 7.983 -0.838 1.00 1.59 C ATOM 95 CG LYS A 6 -15.695 7.155 -1.490 1.00 2.31 C ATOM 96 CD LYS A 6 -15.006 7.995 -2.568 1.00 2.60 C ATOM 97 CE LYS A 6 -13.512 7.669 -2.593 1.00 3.41 C ATOM 98 NZ LYS A 6 -13.326 6.203 -2.782 1.00 3.78 N ATOM 0 H LYS A 6 -18.358 7.271 1.991 1.00 1.38 H new ATOM 0 HA LYS A 6 -18.594 6.774 -0.706 1.00 1.30 H new ATOM 0 HB2 LYS A 6 -17.360 8.529 -1.604 1.00 1.59 H new ATOM 0 HB3 LYS A 6 -16.375 8.725 -0.168 1.00 1.59 H new ATOM 0 HG2 LYS A 6 -14.971 6.843 -0.738 1.00 2.31 H new ATOM 0 HG3 LYS A 6 -16.109 6.248 -1.929 1.00 2.31 H new ATOM 0 HD2 LYS A 6 -15.450 7.790 -3.542 1.00 2.60 H new ATOM 0 HD3 LYS A 6 -15.154 9.056 -2.367 1.00 2.60 H new ATOM 0 HE2 LYS A 6 -13.023 8.215 -3.400 1.00 3.41 H new ATOM 0 HE3 LYS A 6 -13.044 7.989 -1.662 1.00 3.41 H new ATOM 0 HZ1 LYS A 6 -12.359 6.016 -3.117 1.00 3.78 H new ATOM 0 HZ2 LYS A 6 -13.479 5.714 -1.877 1.00 3.78 H new ATOM 0 HZ3 LYS A 6 -14.009 5.854 -3.484 1.00 3.78 H new ATOM 112 N LEU A 7 -16.205 5.977 1.432 1.00 1.10 N ATOM 113 CA LEU A 7 -15.415 4.810 1.927 1.00 1.09 C ATOM 114 C LEU A 7 -16.104 4.126 3.114 1.00 1.01 C ATOM 115 O LEU A 7 -16.479 2.970 3.047 1.00 0.97 O ATOM 116 CB LEU A 7 -14.031 5.293 2.365 1.00 1.23 C ATOM 117 CG LEU A 7 -12.955 4.596 1.529 1.00 1.37 C ATOM 118 CD1 LEU A 7 -11.579 5.151 1.902 1.00 2.05 C ATOM 119 CD2 LEU A 7 -12.988 3.091 1.808 1.00 1.67 C ATOM 0 H LEU A 7 -16.049 6.852 1.933 1.00 1.10 H new ATOM 0 HA LEU A 7 -15.333 4.086 1.116 1.00 1.09 H new ATOM 0 HB2 LEU A 7 -13.957 6.374 2.244 1.00 1.23 H new ATOM 0 HB3 LEU A 7 -13.878 5.080 3.423 1.00 1.23 H new ATOM 0 HG LEU A 7 -13.145 4.775 0.471 1.00 1.37 H new ATOM 0 HD11 LEU A 7 -10.813 4.655 1.307 1.00 2.05 H new ATOM 0 HD12 LEU A 7 -11.553 6.223 1.705 1.00 2.05 H new ATOM 0 HD13 LEU A 7 -11.389 4.972 2.960 1.00 2.05 H new ATOM 0 HD21 LEU A 7 -12.222 2.594 1.213 1.00 1.67 H new ATOM 0 HD22 LEU A 7 -12.798 2.913 2.866 1.00 1.67 H new ATOM 0 HD23 LEU A 7 -13.968 2.693 1.544 1.00 1.67 H new ATOM 131 N GLU A 8 -16.242 4.817 4.212 1.00 1.07 N ATOM 132 CA GLU A 8 -16.866 4.179 5.407 1.00 1.16 C ATOM 133 C GLU A 8 -18.384 4.100 5.255 1.00 1.10 C ATOM 134 O GLU A 8 -18.932 3.032 5.141 1.00 1.03 O ATOM 135 CB GLU A 8 -16.525 4.991 6.658 1.00 1.37 C ATOM 136 CG GLU A 8 -17.169 4.333 7.881 1.00 1.46 C ATOM 137 CD GLU A 8 -16.589 4.948 9.155 1.00 1.74 C ATOM 138 OE1 GLU A 8 -15.558 4.473 9.604 1.00 2.33 O ATOM 139 OE2 GLU A 8 -17.185 5.885 9.662 1.00 2.13 O ATOM 0 H GLU A 8 -15.953 5.787 4.334 1.00 1.07 H new ATOM 0 HA GLU A 8 -16.473 3.167 5.500 1.00 1.16 H new ATOM 0 HB2 GLU A 8 -15.444 5.045 6.787 1.00 1.37 H new ATOM 0 HB3 GLU A 8 -16.884 6.014 6.550 1.00 1.37 H new ATOM 0 HG2 GLU A 8 -18.250 4.473 7.856 1.00 1.46 H new ATOM 0 HG3 GLU A 8 -16.987 3.258 7.867 1.00 1.46 H new ATOM 146 N ILE A 9 -19.053 5.222 5.246 1.00 1.18 N ATOM 147 CA ILE A 9 -20.548 5.202 5.118 1.00 1.23 C ATOM 148 C ILE A 9 -20.931 3.987 4.266 1.00 1.11 C ATOM 149 O ILE A 9 -21.818 3.221 4.594 1.00 1.20 O ATOM 150 CB ILE A 9 -21.027 6.495 4.442 1.00 1.31 C ATOM 151 CG1 ILE A 9 -21.353 7.536 5.516 1.00 1.91 C ATOM 152 CG2 ILE A 9 -22.285 6.223 3.611 1.00 1.86 C ATOM 153 CD1 ILE A 9 -20.138 7.736 6.423 1.00 2.19 C ATOM 0 H ILE A 9 -18.636 6.150 5.321 1.00 1.18 H new ATOM 0 HA ILE A 9 -21.016 5.135 6.100 1.00 1.23 H new ATOM 0 HB ILE A 9 -20.238 6.866 3.787 1.00 1.31 H new ATOM 0 HG12 ILE A 9 -21.630 8.481 5.049 1.00 1.91 H new ATOM 0 HG13 ILE A 9 -22.210 7.209 6.106 1.00 1.91 H new ATOM 0 HG21 ILE A 9 -22.615 7.147 3.137 1.00 1.86 H new ATOM 0 HG22 ILE A 9 -22.061 5.482 2.844 1.00 1.86 H new ATOM 0 HG23 ILE A 9 -23.075 5.846 4.260 1.00 1.86 H new ATOM 0 HD11 ILE A 9 -20.372 8.477 7.187 1.00 2.19 H new ATOM 0 HD12 ILE A 9 -19.882 6.791 6.901 1.00 2.19 H new ATOM 0 HD13 ILE A 9 -19.293 8.083 5.828 1.00 2.19 H new ATOM 165 N ILE A 10 -20.233 3.800 3.187 1.00 0.96 N ATOM 166 CA ILE A 10 -20.503 2.634 2.302 1.00 0.91 C ATOM 167 C ILE A 10 -20.271 1.349 3.092 1.00 0.82 C ATOM 168 O ILE A 10 -21.154 0.525 3.229 1.00 0.85 O ATOM 169 CB ILE A 10 -19.587 2.689 1.068 1.00 0.92 C ATOM 170 CG1 ILE A 10 -20.354 3.373 -0.071 1.00 1.11 C ATOM 171 CG2 ILE A 10 -19.180 1.267 0.638 1.00 0.92 C ATOM 172 CD1 ILE A 10 -19.432 3.597 -1.271 1.00 1.39 C ATOM 0 H ILE A 10 -19.478 4.411 2.875 1.00 0.96 H new ATOM 0 HA ILE A 10 -21.537 2.659 1.957 1.00 0.91 H new ATOM 0 HB ILE A 10 -18.682 3.248 1.307 1.00 0.92 H new ATOM 0 HG12 ILE A 10 -21.204 2.758 -0.367 1.00 1.11 H new ATOM 0 HG13 ILE A 10 -20.754 4.327 0.272 1.00 1.11 H new ATOM 0 HG21 ILE A 10 -18.532 1.323 -0.237 1.00 0.92 H new ATOM 0 HG22 ILE A 10 -18.647 0.779 1.454 1.00 0.92 H new ATOM 0 HG23 ILE A 10 -20.073 0.692 0.392 1.00 0.92 H new ATOM 0 HD11 ILE A 10 -19.989 4.083 -2.072 1.00 1.39 H new ATOM 0 HD12 ILE A 10 -18.596 4.230 -0.974 1.00 1.39 H new ATOM 0 HD13 ILE A 10 -19.053 2.637 -1.623 1.00 1.39 H new ATOM 184 N GLN A 11 -19.085 1.168 3.611 1.00 0.77 N ATOM 185 CA GLN A 11 -18.797 -0.066 4.392 1.00 0.74 C ATOM 186 C GLN A 11 -19.943 -0.321 5.371 1.00 0.80 C ATOM 187 O GLN A 11 -20.355 -1.445 5.578 1.00 0.78 O ATOM 188 CB GLN A 11 -17.490 0.113 5.168 1.00 0.77 C ATOM 189 CG GLN A 11 -17.341 -1.020 6.185 1.00 1.36 C ATOM 190 CD GLN A 11 -15.888 -1.097 6.653 1.00 1.62 C ATOM 191 OE1 GLN A 11 -15.124 -1.909 6.173 1.00 2.31 O ATOM 192 NE2 GLN A 11 -15.470 -0.277 7.580 1.00 1.94 N ATOM 0 H GLN A 11 -18.306 1.821 3.527 1.00 0.77 H new ATOM 0 HA GLN A 11 -18.700 -0.914 3.714 1.00 0.74 H new ATOM 0 HB2 GLN A 11 -16.644 0.113 4.481 1.00 0.77 H new ATOM 0 HB3 GLN A 11 -17.486 1.076 5.678 1.00 0.77 H new ATOM 0 HG2 GLN A 11 -18.000 -0.848 7.036 1.00 1.36 H new ATOM 0 HG3 GLN A 11 -17.640 -1.967 5.737 1.00 1.36 H new ATOM 0 HE21 GLN A 11 -16.111 0.406 7.984 1.00 1.94 H new ATOM 0 HE22 GLN A 11 -14.502 -0.319 7.900 1.00 1.94 H new ATOM 201 N ALA A 12 -20.478 0.715 5.960 1.00 0.90 N ATOM 202 CA ALA A 12 -21.614 0.531 6.907 1.00 0.98 C ATOM 203 C ALA A 12 -22.828 -0.009 6.147 1.00 0.94 C ATOM 204 O ALA A 12 -23.609 -0.778 6.672 1.00 0.94 O ATOM 205 CB ALA A 12 -21.966 1.872 7.553 1.00 1.11 C ATOM 0 H ALA A 12 -20.177 1.680 5.826 1.00 0.90 H new ATOM 0 HA ALA A 12 -21.328 -0.178 7.684 1.00 0.98 H new ATOM 0 HB1 ALA A 12 -22.797 1.735 8.245 1.00 1.11 H new ATOM 0 HB2 ALA A 12 -21.101 2.253 8.095 1.00 1.11 H new ATOM 0 HB3 ALA A 12 -22.252 2.585 6.779 1.00 1.11 H new ATOM 211 N ILE A 13 -22.985 0.376 4.906 1.00 0.90 N ATOM 212 CA ILE A 13 -24.144 -0.139 4.121 1.00 0.86 C ATOM 213 C ILE A 13 -23.934 -1.632 3.850 1.00 0.75 C ATOM 214 O ILE A 13 -24.873 -2.402 3.776 1.00 0.72 O ATOM 215 CB ILE A 13 -24.260 0.622 2.795 1.00 0.87 C ATOM 216 CG1 ILE A 13 -24.610 2.085 3.087 1.00 1.03 C ATOM 217 CG2 ILE A 13 -25.365 -0.012 1.940 1.00 0.85 C ATOM 218 CD1 ILE A 13 -24.616 2.895 1.788 1.00 1.06 C ATOM 0 H ILE A 13 -22.368 1.017 4.408 1.00 0.90 H new ATOM 0 HA ILE A 13 -25.064 0.007 4.687 1.00 0.86 H new ATOM 0 HB ILE A 13 -23.314 0.573 2.255 1.00 0.87 H new ATOM 0 HG12 ILE A 13 -25.587 2.144 3.566 1.00 1.03 H new ATOM 0 HG13 ILE A 13 -23.887 2.508 3.785 1.00 1.03 H new ATOM 0 HG21 ILE A 13 -25.450 0.527 0.997 1.00 0.85 H new ATOM 0 HG22 ILE A 13 -25.118 -1.055 1.741 1.00 0.85 H new ATOM 0 HG23 ILE A 13 -26.314 0.041 2.474 1.00 0.85 H new ATOM 0 HD11 ILE A 13 -24.866 3.933 2.008 1.00 1.06 H new ATOM 0 HD12 ILE A 13 -23.630 2.849 1.326 1.00 1.06 H new ATOM 0 HD13 ILE A 13 -25.357 2.480 1.104 1.00 1.06 H new ATOM 230 N LEU A 14 -22.704 -2.041 3.703 1.00 0.74 N ATOM 231 CA LEU A 14 -22.410 -3.478 3.433 1.00 0.65 C ATOM 232 C LEU A 14 -22.637 -4.310 4.699 1.00 0.67 C ATOM 233 O LEU A 14 -23.211 -5.380 4.657 1.00 0.64 O ATOM 234 CB LEU A 14 -20.948 -3.608 3.002 1.00 0.65 C ATOM 235 CG LEU A 14 -20.880 -4.086 1.553 1.00 0.67 C ATOM 236 CD1 LEU A 14 -19.430 -4.036 1.063 1.00 0.61 C ATOM 237 CD2 LEU A 14 -21.397 -5.525 1.474 1.00 1.04 C ATOM 0 H LEU A 14 -21.884 -1.437 3.759 1.00 0.74 H new ATOM 0 HA LEU A 14 -23.071 -3.841 2.647 1.00 0.65 H new ATOM 0 HB2 LEU A 14 -20.442 -2.648 3.103 1.00 0.65 H new ATOM 0 HB3 LEU A 14 -20.428 -4.312 3.652 1.00 0.65 H new ATOM 0 HG LEU A 14 -21.494 -3.440 0.925 1.00 0.67 H new ATOM 0 HD11 LEU A 14 -19.383 -4.377 0.029 1.00 0.61 H new ATOM 0 HD12 LEU A 14 -19.060 -3.012 1.124 1.00 0.61 H new ATOM 0 HD13 LEU A 14 -18.813 -4.683 1.687 1.00 0.61 H new ATOM 0 HD21 LEU A 14 -21.351 -5.872 0.442 1.00 1.04 H new ATOM 0 HD22 LEU A 14 -20.780 -6.168 2.101 1.00 1.04 H new ATOM 0 HD23 LEU A 14 -22.429 -5.561 1.823 1.00 1.04 H new ATOM 249 N GLU A 15 -22.192 -3.825 5.825 1.00 0.75 N ATOM 250 CA GLU A 15 -22.381 -4.581 7.097 1.00 0.80 C ATOM 251 C GLU A 15 -23.864 -4.620 7.459 1.00 0.83 C ATOM 252 O GLU A 15 -24.333 -5.540 8.095 1.00 0.85 O ATOM 253 CB GLU A 15 -21.604 -3.898 8.228 1.00 0.87 C ATOM 254 CG GLU A 15 -20.100 -4.142 8.066 1.00 0.89 C ATOM 255 CD GLU A 15 -19.437 -4.147 9.445 1.00 1.01 C ATOM 256 OE1 GLU A 15 -19.934 -4.842 10.317 1.00 1.53 O ATOM 257 OE2 GLU A 15 -18.445 -3.457 9.607 1.00 1.43 O ATOM 0 H GLU A 15 -21.704 -2.935 5.920 1.00 0.75 H new ATOM 0 HA GLU A 15 -22.011 -5.597 6.963 1.00 0.80 H new ATOM 0 HB2 GLU A 15 -21.808 -2.827 8.223 1.00 0.87 H new ATOM 0 HB3 GLU A 15 -21.939 -4.282 9.192 1.00 0.87 H new ATOM 0 HG2 GLU A 15 -19.926 -5.093 7.563 1.00 0.89 H new ATOM 0 HG3 GLU A 15 -19.659 -3.366 7.441 1.00 0.89 H new ATOM 264 N ALA A 16 -24.607 -3.630 7.069 1.00 0.85 N ATOM 265 CA ALA A 16 -26.051 -3.627 7.396 1.00 0.88 C ATOM 266 C ALA A 16 -26.756 -4.652 6.518 1.00 0.83 C ATOM 267 O ALA A 16 -27.651 -5.349 6.951 1.00 0.86 O ATOM 268 CB ALA A 16 -26.633 -2.241 7.135 1.00 0.91 C ATOM 0 H ALA A 16 -24.277 -2.824 6.539 1.00 0.85 H new ATOM 0 HA ALA A 16 -26.193 -3.880 8.447 1.00 0.88 H new ATOM 0 HB1 ALA A 16 -27.696 -2.241 7.376 1.00 0.91 H new ATOM 0 HB2 ALA A 16 -26.120 -1.508 7.757 1.00 0.91 H new ATOM 0 HB3 ALA A 16 -26.500 -1.982 6.085 1.00 0.91 H new ATOM 274 N CYS A 17 -26.364 -4.740 5.280 1.00 0.76 N ATOM 275 CA CYS A 17 -27.011 -5.701 4.363 1.00 0.72 C ATOM 276 C CYS A 17 -26.466 -7.116 4.612 1.00 0.71 C ATOM 277 O CYS A 17 -27.071 -8.101 4.248 1.00 0.71 O ATOM 278 CB CYS A 17 -26.724 -5.264 2.931 1.00 0.65 C ATOM 279 SG CYS A 17 -25.068 -5.803 2.445 1.00 0.81 S ATOM 0 H CYS A 17 -25.618 -4.182 4.866 1.00 0.76 H new ATOM 0 HA CYS A 17 -28.087 -5.719 4.535 1.00 0.72 H new ATOM 0 HB2 CYS A 17 -27.467 -5.688 2.256 1.00 0.65 H new ATOM 0 HB3 CYS A 17 -26.802 -4.180 2.850 1.00 0.65 H new ATOM 0 HG CYS A 17 -24.239 -5.593 3.424 1.00 0.81 H new ATOM 285 N LYS A 18 -25.318 -7.217 5.214 1.00 0.72 N ATOM 286 CA LYS A 18 -24.698 -8.552 5.488 1.00 0.73 C ATOM 287 C LYS A 18 -25.719 -9.541 6.109 1.00 0.83 C ATOM 288 O LYS A 18 -25.406 -10.691 6.333 1.00 0.87 O ATOM 289 CB LYS A 18 -23.466 -8.316 6.399 1.00 0.78 C ATOM 290 CG LYS A 18 -23.229 -9.457 7.404 1.00 1.34 C ATOM 291 CD LYS A 18 -24.259 -9.395 8.541 1.00 1.96 C ATOM 292 CE LYS A 18 -23.540 -9.189 9.875 1.00 2.36 C ATOM 293 NZ LYS A 18 -24.536 -9.222 10.983 1.00 2.97 N ATOM 0 H LYS A 18 -24.769 -6.420 5.536 1.00 0.72 H new ATOM 0 HA LYS A 18 -24.377 -9.021 4.558 1.00 0.73 H new ATOM 0 HB2 LYS A 18 -22.579 -8.198 5.777 1.00 0.78 H new ATOM 0 HB3 LYS A 18 -23.599 -7.382 6.944 1.00 0.78 H new ATOM 0 HG2 LYS A 18 -23.298 -10.418 6.895 1.00 1.34 H new ATOM 0 HG3 LYS A 18 -22.222 -9.385 7.814 1.00 1.34 H new ATOM 0 HD2 LYS A 18 -24.961 -8.580 8.365 1.00 1.96 H new ATOM 0 HD3 LYS A 18 -24.841 -10.316 8.569 1.00 1.96 H new ATOM 0 HE2 LYS A 18 -22.791 -9.967 10.021 1.00 2.36 H new ATOM 0 HE3 LYS A 18 -23.013 -8.235 9.873 1.00 2.36 H new ATOM 0 HZ1 LYS A 18 -24.049 -9.082 11.891 1.00 2.97 H new ATOM 0 HZ2 LYS A 18 -25.235 -8.464 10.844 1.00 2.97 H new ATOM 0 HZ3 LYS A 18 -25.020 -10.143 10.988 1.00 2.97 H new ATOM 307 N SER A 19 -26.942 -9.139 6.378 1.00 0.88 N ATOM 308 CA SER A 19 -27.904 -10.126 6.975 1.00 0.99 C ATOM 309 C SER A 19 -29.365 -9.758 6.682 1.00 1.05 C ATOM 310 O SER A 19 -30.269 -10.334 7.252 1.00 1.21 O ATOM 311 CB SER A 19 -27.708 -10.181 8.490 1.00 1.07 C ATOM 312 OG SER A 19 -27.179 -8.944 8.944 1.00 1.10 O ATOM 0 H SER A 19 -27.308 -8.201 6.217 1.00 0.88 H new ATOM 0 HA SER A 19 -27.698 -11.095 6.521 1.00 0.99 H new ATOM 0 HB2 SER A 19 -28.658 -10.385 8.983 1.00 1.07 H new ATOM 0 HB3 SER A 19 -27.032 -10.995 8.751 1.00 1.07 H new ATOM 0 HG SER A 19 -27.055 -8.978 9.915 1.00 1.10 H new ATOM 318 N GLY A 20 -29.619 -8.833 5.800 1.00 0.94 N ATOM 319 CA GLY A 20 -31.041 -8.489 5.496 1.00 1.01 C ATOM 320 C GLY A 20 -31.532 -7.374 6.418 1.00 1.07 C ATOM 321 O GLY A 20 -31.993 -7.626 7.514 1.00 1.15 O ATOM 0 H GLY A 20 -28.917 -8.305 5.281 1.00 0.94 H new ATOM 0 HA2 GLY A 20 -31.131 -8.175 4.456 1.00 1.01 H new ATOM 0 HA3 GLY A 20 -31.669 -9.372 5.617 1.00 1.01 H new ATOM 325 N SER A 21 -31.435 -6.140 5.996 1.00 1.06 N ATOM 326 CA SER A 21 -31.898 -5.028 6.872 1.00 1.14 C ATOM 327 C SER A 21 -32.357 -3.845 5.997 1.00 1.14 C ATOM 328 O SER A 21 -31.702 -3.517 5.027 1.00 1.07 O ATOM 329 CB SER A 21 -30.736 -4.589 7.761 1.00 1.14 C ATOM 330 OG SER A 21 -29.800 -5.654 7.865 1.00 1.09 O ATOM 0 H SER A 21 -31.059 -5.858 5.091 1.00 1.06 H new ATOM 0 HA SER A 21 -32.732 -5.360 7.490 1.00 1.14 H new ATOM 0 HB2 SER A 21 -30.255 -3.706 7.341 1.00 1.14 H new ATOM 0 HB3 SER A 21 -31.103 -4.313 8.750 1.00 1.14 H new ATOM 0 HG SER A 21 -29.054 -5.495 7.250 1.00 1.09 H new ATOM 336 N PRO A 22 -33.470 -3.203 6.315 1.00 1.23 N ATOM 337 CA PRO A 22 -33.975 -2.048 5.507 1.00 1.26 C ATOM 338 C PRO A 22 -33.004 -0.863 5.513 1.00 1.26 C ATOM 339 O PRO A 22 -32.031 -0.853 6.237 1.00 1.25 O ATOM 340 CB PRO A 22 -35.298 -1.660 6.177 1.00 1.35 C ATOM 341 CG PRO A 22 -35.250 -2.250 7.545 1.00 1.47 C ATOM 342 CD PRO A 22 -34.366 -3.490 7.455 1.00 1.34 C ATOM 0 HA PRO A 22 -34.091 -2.321 4.458 1.00 1.26 H new ATOM 0 HB2 PRO A 22 -35.410 -0.577 6.222 1.00 1.35 H new ATOM 0 HB3 PRO A 22 -36.149 -2.045 5.615 1.00 1.35 H new ATOM 0 HG2 PRO A 22 -34.843 -1.536 8.261 1.00 1.47 H new ATOM 0 HG3 PRO A 22 -36.251 -2.512 7.889 1.00 1.47 H new ATOM 0 HD2 PRO A 22 -33.804 -3.648 8.375 1.00 1.34 H new ATOM 0 HD3 PRO A 22 -34.956 -4.390 7.283 1.00 1.34 H new ATOM 350 N LYS A 23 -33.262 0.134 4.705 1.00 1.27 N ATOM 351 CA LYS A 23 -32.350 1.313 4.659 1.00 1.28 C ATOM 352 C LYS A 23 -32.303 1.980 6.041 1.00 1.33 C ATOM 353 O LYS A 23 -31.302 2.546 6.431 1.00 1.35 O ATOM 354 CB LYS A 23 -32.863 2.320 3.616 1.00 1.31 C ATOM 355 CG LYS A 23 -31.843 3.459 3.425 1.00 1.27 C ATOM 356 CD LYS A 23 -32.380 4.733 4.083 1.00 1.83 C ATOM 357 CE LYS A 23 -33.546 5.289 3.261 1.00 1.76 C ATOM 358 NZ LYS A 23 -33.135 6.569 2.618 1.00 2.13 N ATOM 0 H LYS A 23 -34.064 0.181 4.077 1.00 1.27 H new ATOM 0 HA LYS A 23 -31.348 0.986 4.382 1.00 1.28 H new ATOM 0 HB2 LYS A 23 -33.035 1.814 2.666 1.00 1.31 H new ATOM 0 HB3 LYS A 23 -33.821 2.730 3.937 1.00 1.31 H new ATOM 0 HG2 LYS A 23 -30.885 3.183 3.867 1.00 1.27 H new ATOM 0 HG3 LYS A 23 -31.667 3.631 2.363 1.00 1.27 H new ATOM 0 HD2 LYS A 23 -32.710 4.517 5.099 1.00 1.83 H new ATOM 0 HD3 LYS A 23 -31.587 5.477 4.156 1.00 1.83 H new ATOM 0 HE2 LYS A 23 -33.846 4.568 2.501 1.00 1.76 H new ATOM 0 HE3 LYS A 23 -34.411 5.454 3.903 1.00 1.76 H new ATOM 0 HZ1 LYS A 23 -33.665 7.357 3.042 1.00 2.13 H new ATOM 0 HZ2 LYS A 23 -32.116 6.719 2.764 1.00 2.13 H new ATOM 0 HZ3 LYS A 23 -33.336 6.526 1.599 1.00 2.13 H new ATOM 372 N THR A 24 -33.378 1.917 6.787 1.00 1.35 N ATOM 373 CA THR A 24 -33.402 2.544 8.146 1.00 1.41 C ATOM 374 C THR A 24 -32.452 1.822 9.113 1.00 1.43 C ATOM 375 O THR A 24 -31.744 2.446 9.877 1.00 1.48 O ATOM 376 CB THR A 24 -34.826 2.486 8.702 1.00 1.40 C ATOM 377 OG1 THR A 24 -35.228 1.129 8.829 1.00 1.42 O ATOM 378 CG2 THR A 24 -35.775 3.217 7.753 1.00 1.42 C ATOM 0 H THR A 24 -34.245 1.456 6.512 1.00 1.35 H new ATOM 0 HA THR A 24 -33.071 3.578 8.051 1.00 1.41 H new ATOM 0 HB THR A 24 -34.855 2.966 9.680 1.00 1.40 H new ATOM 0 HG1 THR A 24 -36.140 1.090 9.187 1.00 1.42 H new ATOM 0 HG21 THR A 24 -36.789 3.175 8.150 1.00 1.42 H new ATOM 0 HG22 THR A 24 -35.465 4.258 7.658 1.00 1.42 H new ATOM 0 HG23 THR A 24 -35.749 2.740 6.773 1.00 1.42 H new ATOM 386 N ARG A 25 -32.434 0.513 9.096 1.00 1.40 N ATOM 387 CA ARG A 25 -31.537 -0.245 10.023 1.00 1.43 C ATOM 388 C ARG A 25 -30.089 0.156 9.759 1.00 1.44 C ATOM 389 O ARG A 25 -29.186 -0.154 10.511 1.00 1.47 O ATOM 390 CB ARG A 25 -31.713 -1.743 9.750 1.00 1.39 C ATOM 391 CG ARG A 25 -32.181 -2.476 11.014 1.00 1.72 C ATOM 392 CD ARG A 25 -31.007 -2.627 11.981 1.00 1.56 C ATOM 393 NE ARG A 25 -31.510 -3.078 13.309 1.00 2.13 N ATOM 394 CZ ARG A 25 -30.668 -3.351 14.268 1.00 2.45 C ATOM 395 NH1 ARG A 25 -29.385 -3.232 14.062 1.00 2.53 N ATOM 396 NH2 ARG A 25 -31.109 -3.743 15.432 1.00 3.15 N ATOM 0 H ARG A 25 -33.003 -0.066 8.478 1.00 1.40 H new ATOM 0 HA ARG A 25 -31.788 -0.023 11.060 1.00 1.43 H new ATOM 0 HB2 ARG A 25 -32.439 -1.889 8.950 1.00 1.39 H new ATOM 0 HB3 ARG A 25 -30.770 -2.168 9.406 1.00 1.39 H new ATOM 0 HG2 ARG A 25 -32.989 -1.921 11.491 1.00 1.72 H new ATOM 0 HG3 ARG A 25 -32.579 -3.457 10.752 1.00 1.72 H new ATOM 0 HD2 ARG A 25 -30.289 -3.348 11.588 1.00 1.56 H new ATOM 0 HD3 ARG A 25 -30.482 -1.677 12.083 1.00 1.56 H new ATOM 0 HE ARG A 25 -32.513 -3.173 13.469 1.00 2.13 H new ATOM 0 HH11 ARG A 25 -29.041 -2.926 13.152 1.00 2.53 H new ATOM 0 HH12 ARG A 25 -28.726 -3.445 14.811 1.00 2.53 H new ATOM 0 HH21 ARG A 25 -32.112 -3.836 15.592 1.00 3.15 H new ATOM 0 HH22 ARG A 25 -30.451 -3.956 16.181 1.00 3.15 H new ATOM 410 N ILE A 26 -29.882 0.857 8.692 1.00 1.41 N ATOM 411 CA ILE A 26 -28.512 1.307 8.358 1.00 1.41 C ATOM 412 C ILE A 26 -28.222 2.592 9.125 1.00 1.49 C ATOM 413 O ILE A 26 -27.082 2.941 9.365 1.00 1.50 O ATOM 414 CB ILE A 26 -28.399 1.500 6.850 1.00 1.34 C ATOM 415 CG1 ILE A 26 -28.971 0.247 6.184 1.00 1.28 C ATOM 416 CG2 ILE A 26 -26.928 1.674 6.464 1.00 1.34 C ATOM 417 CD1 ILE A 26 -28.363 0.046 4.794 1.00 0.96 C ATOM 0 H ILE A 26 -30.606 1.140 8.032 1.00 1.41 H new ATOM 0 HA ILE A 26 -27.772 0.562 8.649 1.00 1.41 H new ATOM 0 HB ILE A 26 -28.946 2.387 6.528 1.00 1.34 H new ATOM 0 HG12 ILE A 26 -28.768 -0.626 6.805 1.00 1.28 H new ATOM 0 HG13 ILE A 26 -30.054 0.335 6.103 1.00 1.28 H new ATOM 0 HG21 ILE A 26 -26.849 1.812 5.386 1.00 1.34 H new ATOM 0 HG22 ILE A 26 -26.519 2.547 6.973 1.00 1.34 H new ATOM 0 HG23 ILE A 26 -26.367 0.787 6.759 1.00 1.34 H new ATOM 0 HD11 ILE A 26 -28.784 -0.851 4.339 1.00 0.96 H new ATOM 0 HD12 ILE A 26 -28.589 0.910 4.170 1.00 0.96 H new ATOM 0 HD13 ILE A 26 -27.282 -0.065 4.882 1.00 0.96 H new ATOM 429 N MET A 27 -29.247 3.291 9.537 1.00 1.55 N ATOM 430 CA MET A 27 -29.021 4.538 10.318 1.00 1.64 C ATOM 431 C MET A 27 -28.198 4.172 11.553 1.00 1.70 C ATOM 432 O MET A 27 -27.264 4.857 11.922 1.00 1.74 O ATOM 433 CB MET A 27 -30.363 5.149 10.737 1.00 1.72 C ATOM 434 CG MET A 27 -31.160 5.590 9.499 1.00 2.02 C ATOM 435 SD MET A 27 -32.916 5.663 9.923 1.00 2.29 S ATOM 436 CE MET A 27 -32.917 7.356 10.562 1.00 1.90 C ATOM 0 H MET A 27 -30.224 3.053 9.367 1.00 1.55 H new ATOM 0 HA MET A 27 -28.491 5.274 9.714 1.00 1.64 H new ATOM 0 HB2 MET A 27 -30.939 4.421 11.308 1.00 1.72 H new ATOM 0 HB3 MET A 27 -30.192 6.004 11.391 1.00 1.72 H new ATOM 0 HG2 MET A 27 -30.815 6.566 9.157 1.00 2.02 H new ATOM 0 HG3 MET A 27 -31.000 4.890 8.679 1.00 2.02 H new ATOM 0 HE1 MET A 27 -33.922 7.621 10.889 1.00 1.90 H new ATOM 0 HE2 MET A 27 -32.231 7.427 11.406 1.00 1.90 H new ATOM 0 HE3 MET A 27 -32.598 8.041 9.777 1.00 1.90 H new ATOM 446 N TYR A 28 -28.531 3.075 12.182 1.00 1.72 N ATOM 447 CA TYR A 28 -27.768 2.625 13.382 1.00 1.80 C ATOM 448 C TYR A 28 -26.282 2.523 13.024 1.00 1.78 C ATOM 449 O TYR A 28 -25.445 2.273 13.869 1.00 2.09 O ATOM 450 CB TYR A 28 -28.283 1.247 13.806 1.00 1.82 C ATOM 451 CG TYR A 28 -27.667 0.846 15.126 1.00 2.02 C ATOM 452 CD1 TYR A 28 -28.152 1.391 16.321 1.00 2.25 C ATOM 453 CD2 TYR A 28 -26.617 -0.081 15.155 1.00 2.64 C ATOM 454 CE1 TYR A 28 -27.587 1.012 17.544 1.00 2.48 C ATOM 455 CE2 TYR A 28 -26.051 -0.460 16.378 1.00 3.00 C ATOM 456 CZ TYR A 28 -26.536 0.086 17.573 1.00 2.69 C ATOM 457 OH TYR A 28 -25.981 -0.290 18.778 1.00 3.10 O ATOM 0 H TYR A 28 -29.305 2.468 11.913 1.00 1.72 H new ATOM 0 HA TYR A 28 -27.899 3.337 14.197 1.00 1.80 H new ATOM 0 HB2 TYR A 28 -29.369 1.267 13.894 1.00 1.82 H new ATOM 0 HB3 TYR A 28 -28.039 0.508 13.043 1.00 1.82 H new ATOM 0 HD1 TYR A 28 -28.963 2.104 16.299 1.00 2.25 H new ATOM 0 HD2 TYR A 28 -26.244 -0.503 14.234 1.00 2.64 H new ATOM 0 HE1 TYR A 28 -27.961 1.433 18.465 1.00 2.48 H new ATOM 0 HE2 TYR A 28 -25.240 -1.173 16.400 1.00 3.00 H new ATOM 0 HH TYR A 28 -25.265 -0.940 18.620 1.00 3.10 H new ATOM 467 N GLY A 29 -25.950 2.731 11.778 1.00 1.51 N ATOM 468 CA GLY A 29 -24.522 2.667 11.356 1.00 1.48 C ATOM 469 C GLY A 29 -23.939 4.083 11.334 1.00 1.54 C ATOM 470 O GLY A 29 -22.780 4.293 11.632 1.00 1.61 O ATOM 0 H GLY A 29 -26.611 2.944 11.031 1.00 1.51 H new ATOM 0 HA2 GLY A 29 -23.955 2.038 12.043 1.00 1.48 H new ATOM 0 HA3 GLY A 29 -24.442 2.213 10.368 1.00 1.48 H new ATOM 474 N ALA A 30 -24.737 5.055 10.978 1.00 1.57 N ATOM 475 CA ALA A 30 -24.232 6.458 10.932 1.00 1.67 C ATOM 476 C ALA A 30 -25.415 7.429 10.891 1.00 1.71 C ATOM 477 O ALA A 30 -26.559 7.027 10.951 1.00 1.72 O ATOM 478 CB ALA A 30 -23.374 6.647 9.676 1.00 1.66 C ATOM 0 H ALA A 30 -25.716 4.938 10.717 1.00 1.57 H new ATOM 0 HA ALA A 30 -23.632 6.657 11.820 1.00 1.67 H new ATOM 0 HB1 ALA A 30 -23.003 7.671 9.639 1.00 1.66 H new ATOM 0 HB2 ALA A 30 -22.531 5.957 9.704 1.00 1.66 H new ATOM 0 HB3 ALA A 30 -23.977 6.447 8.790 1.00 1.66 H new ATOM 484 N ASN A 31 -25.151 8.707 10.765 1.00 1.82 N ATOM 485 CA ASN A 31 -26.272 9.695 10.695 1.00 1.87 C ATOM 486 C ASN A 31 -26.922 9.584 9.317 1.00 1.82 C ATOM 487 O ASN A 31 -27.618 10.469 8.861 1.00 2.17 O ATOM 488 CB ASN A 31 -25.735 11.110 10.900 1.00 2.00 C ATOM 489 CG ASN A 31 -26.619 11.846 11.910 1.00 2.22 C ATOM 490 OD1 ASN A 31 -27.400 12.700 11.543 1.00 2.79 O ATOM 491 ND2 ASN A 31 -26.529 11.546 13.178 1.00 2.38 N ATOM 0 H ASN A 31 -24.214 9.106 10.708 1.00 1.82 H new ATOM 0 HA ASN A 31 -27.003 9.486 11.476 1.00 1.87 H new ATOM 0 HB2 ASN A 31 -24.707 11.072 11.259 1.00 2.00 H new ATOM 0 HB3 ASN A 31 -25.722 11.647 9.952 1.00 2.00 H new ATOM 0 HD21 ASN A 31 -27.115 12.029 13.859 1.00 2.38 H new ATOM 0 HD22 ASN A 31 -25.873 10.829 13.487 1.00 2.38 H new ATOM 498 N LEU A 32 -26.722 8.462 8.689 1.00 1.81 N ATOM 499 CA LEU A 32 -27.321 8.168 7.365 1.00 1.70 C ATOM 500 C LEU A 32 -27.540 9.390 6.500 1.00 1.72 C ATOM 501 O LEU A 32 -28.467 10.157 6.660 1.00 1.84 O ATOM 502 CB LEU A 32 -28.639 7.433 7.570 1.00 1.75 C ATOM 503 CG LEU A 32 -28.669 6.104 6.786 1.00 1.74 C ATOM 504 CD1 LEU A 32 -28.709 6.387 5.286 1.00 1.67 C ATOM 505 CD2 LEU A 32 -27.443 5.237 7.112 1.00 1.69 C ATOM 0 H LEU A 32 -26.143 7.707 9.058 1.00 1.81 H new ATOM 0 HA LEU A 32 -26.604 7.549 6.826 1.00 1.70 H new ATOM 0 HB2 LEU A 32 -28.786 7.235 8.632 1.00 1.75 H new ATOM 0 HB3 LEU A 32 -29.465 8.067 7.247 1.00 1.75 H new ATOM 0 HG LEU A 32 -29.565 5.558 7.083 1.00 1.74 H new ATOM 0 HD11 LEU A 32 -28.730 5.445 4.738 1.00 1.67 H new ATOM 0 HD12 LEU A 32 -29.602 6.965 5.048 1.00 1.67 H new ATOM 0 HD13 LEU A 32 -27.823 6.954 4.999 1.00 1.67 H new ATOM 0 HD21 LEU A 32 -27.493 4.308 6.544 1.00 1.69 H new ATOM 0 HD22 LEU A 32 -26.534 5.777 6.845 1.00 1.69 H new ATOM 0 HD23 LEU A 32 -27.431 5.011 8.178 1.00 1.69 H new ATOM 517 N SER A 33 -26.712 9.485 5.521 1.00 1.63 N ATOM 518 CA SER A 33 -26.806 10.541 4.498 1.00 1.66 C ATOM 519 C SER A 33 -28.117 10.324 3.724 1.00 1.68 C ATOM 520 O SER A 33 -28.266 10.818 2.642 1.00 1.69 O ATOM 521 CB SER A 33 -25.599 10.462 3.561 1.00 1.58 C ATOM 522 OG SER A 33 -24.853 11.669 3.659 1.00 1.75 O ATOM 0 H SER A 33 -25.933 8.841 5.380 1.00 1.63 H new ATOM 0 HA SER A 33 -26.806 11.530 4.956 1.00 1.66 H new ATOM 0 HB2 SER A 33 -24.972 9.610 3.826 1.00 1.58 H new ATOM 0 HB3 SER A 33 -25.930 10.307 2.534 1.00 1.58 H new ATOM 0 HG SER A 33 -24.077 11.623 3.062 1.00 1.75 H new ATOM 528 N TYR A 34 -29.008 9.492 4.249 1.00 1.70 N ATOM 529 CA TYR A 34 -30.284 9.100 3.543 1.00 1.73 C ATOM 530 C TYR A 34 -30.661 10.066 2.419 1.00 1.77 C ATOM 531 O TYR A 34 -30.984 9.637 1.330 1.00 1.71 O ATOM 532 CB TYR A 34 -31.428 9.115 4.557 1.00 1.92 C ATOM 533 CG TYR A 34 -31.944 10.526 4.740 1.00 1.73 C ATOM 534 CD1 TYR A 34 -32.940 11.022 3.888 1.00 1.94 C ATOM 535 CD2 TYR A 34 -31.432 11.335 5.761 1.00 2.49 C ATOM 536 CE1 TYR A 34 -33.420 12.327 4.056 1.00 2.57 C ATOM 537 CE2 TYR A 34 -31.914 12.639 5.929 1.00 3.01 C ATOM 538 CZ TYR A 34 -32.907 13.135 5.076 1.00 2.95 C ATOM 539 OH TYR A 34 -33.382 14.420 5.243 1.00 3.85 O ATOM 0 H TYR A 34 -28.896 9.058 5.165 1.00 1.70 H new ATOM 0 HA TYR A 34 -30.120 8.113 3.110 1.00 1.73 H new ATOM 0 HB2 TYR A 34 -32.235 8.466 4.216 1.00 1.92 H new ATOM 0 HB3 TYR A 34 -31.083 8.719 5.512 1.00 1.92 H new ATOM 0 HD1 TYR A 34 -33.338 10.398 3.102 1.00 1.94 H new ATOM 0 HD2 TYR A 34 -30.665 10.954 6.419 1.00 2.49 H new ATOM 0 HE1 TYR A 34 -34.186 12.709 3.398 1.00 2.57 H new ATOM 0 HE2 TYR A 34 -31.519 13.263 6.717 1.00 3.01 H new ATOM 0 HH TYR A 34 -32.921 14.844 5.997 1.00 3.85 H new ATOM 549 N ALA A 35 -30.603 11.344 2.622 1.00 1.88 N ATOM 550 CA ALA A 35 -30.941 12.244 1.493 1.00 1.95 C ATOM 551 C ALA A 35 -29.986 11.913 0.344 1.00 1.82 C ATOM 552 O ALA A 35 -30.379 11.767 -0.797 1.00 1.78 O ATOM 553 CB ALA A 35 -30.754 13.703 1.918 1.00 2.11 C ATOM 0 H ALA A 35 -30.343 11.799 3.497 1.00 1.88 H new ATOM 0 HA ALA A 35 -31.978 12.106 1.186 1.00 1.95 H new ATOM 0 HB1 ALA A 35 -31.004 14.360 1.085 1.00 2.11 H new ATOM 0 HB2 ALA A 35 -31.408 13.923 2.762 1.00 2.11 H new ATOM 0 HB3 ALA A 35 -29.717 13.867 2.211 1.00 2.11 H new ATOM 559 N LEU A 36 -28.728 11.783 0.661 1.00 1.76 N ATOM 560 CA LEU A 36 -27.698 11.445 -0.367 1.00 1.66 C ATOM 561 C LEU A 36 -27.385 9.936 -0.374 1.00 1.48 C ATOM 562 O LEU A 36 -27.229 9.329 -1.415 1.00 1.40 O ATOM 563 CB LEU A 36 -26.413 12.218 -0.063 1.00 1.73 C ATOM 564 CG LEU A 36 -26.015 13.051 -1.282 1.00 1.83 C ATOM 565 CD1 LEU A 36 -24.753 13.856 -0.963 1.00 2.23 C ATOM 566 CD2 LEU A 36 -25.738 12.121 -2.465 1.00 2.42 C ATOM 0 H LEU A 36 -28.362 11.898 1.606 1.00 1.76 H new ATOM 0 HA LEU A 36 -28.090 11.720 -1.346 1.00 1.66 H new ATOM 0 HB2 LEU A 36 -26.562 12.867 0.800 1.00 1.73 H new ATOM 0 HB3 LEU A 36 -25.612 11.525 0.194 1.00 1.73 H new ATOM 0 HG LEU A 36 -26.827 13.733 -1.535 1.00 1.83 H new ATOM 0 HD11 LEU A 36 -24.470 14.449 -1.833 1.00 2.23 H new ATOM 0 HD12 LEU A 36 -24.947 14.518 -0.119 1.00 2.23 H new ATOM 0 HD13 LEU A 36 -23.941 13.174 -0.709 1.00 2.23 H new ATOM 0 HD21 LEU A 36 -25.454 12.713 -3.335 1.00 2.42 H new ATOM 0 HD22 LEU A 36 -24.927 11.439 -2.210 1.00 2.42 H new ATOM 0 HD23 LEU A 36 -26.636 11.547 -2.694 1.00 2.42 H new ATOM 578 N THR A 37 -27.236 9.345 0.789 1.00 1.43 N ATOM 579 CA THR A 37 -26.865 7.895 0.869 1.00 1.30 C ATOM 580 C THR A 37 -27.642 7.067 -0.149 1.00 1.23 C ATOM 581 O THR A 37 -27.085 6.191 -0.775 1.00 1.15 O ATOM 582 CB THR A 37 -27.121 7.355 2.278 1.00 1.36 C ATOM 583 OG1 THR A 37 -26.012 7.666 3.108 1.00 1.49 O ATOM 584 CG2 THR A 37 -27.305 5.833 2.225 1.00 1.33 C ATOM 0 H THR A 37 -27.356 9.807 1.690 1.00 1.43 H new ATOM 0 HA THR A 37 -25.803 7.813 0.639 1.00 1.30 H new ATOM 0 HB THR A 37 -28.024 7.813 2.682 1.00 1.36 H new ATOM 0 HG1 THR A 37 -25.918 6.978 3.800 1.00 1.49 H new ATOM 0 HG21 THR A 37 -27.487 5.453 3.230 1.00 1.33 H new ATOM 0 HG22 THR A 37 -28.155 5.591 1.587 1.00 1.33 H new ATOM 0 HG23 THR A 37 -26.404 5.371 1.820 1.00 1.33 H new ATOM 592 N GLY A 38 -28.912 7.316 -0.319 1.00 1.26 N ATOM 593 CA GLY A 38 -29.691 6.517 -1.317 1.00 1.21 C ATOM 594 C GLY A 38 -28.850 6.386 -2.590 1.00 1.17 C ATOM 595 O GLY A 38 -28.980 5.452 -3.355 1.00 1.12 O ATOM 0 H GLY A 38 -29.442 8.029 0.182 1.00 1.26 H new ATOM 0 HA2 GLY A 38 -29.926 5.532 -0.914 1.00 1.21 H new ATOM 0 HA3 GLY A 38 -30.640 7.006 -1.537 1.00 1.21 H new ATOM 599 N ARG A 39 -27.974 7.328 -2.792 1.00 1.22 N ATOM 600 CA ARG A 39 -27.076 7.316 -3.980 1.00 1.23 C ATOM 601 C ARG A 39 -26.035 6.200 -3.833 1.00 1.13 C ATOM 602 O ARG A 39 -25.623 5.587 -4.799 1.00 1.10 O ATOM 603 CB ARG A 39 -26.360 8.668 -4.059 1.00 1.33 C ATOM 604 CG ARG A 39 -25.546 8.767 -5.352 1.00 1.36 C ATOM 605 CD ARG A 39 -24.229 9.496 -5.063 1.00 1.39 C ATOM 606 NE ARG A 39 -23.460 9.656 -6.330 1.00 1.58 N ATOM 607 CZ ARG A 39 -22.236 10.109 -6.297 1.00 2.13 C ATOM 608 NH1 ARG A 39 -21.685 10.419 -5.155 1.00 2.75 N ATOM 609 NH2 ARG A 39 -21.563 10.252 -7.406 1.00 2.58 N ATOM 0 H ARG A 39 -27.839 8.124 -2.169 1.00 1.22 H new ATOM 0 HA ARG A 39 -27.659 7.141 -4.884 1.00 1.23 H new ATOM 0 HB2 ARG A 39 -27.090 9.476 -4.019 1.00 1.33 H new ATOM 0 HB3 ARG A 39 -25.703 8.789 -3.198 1.00 1.33 H new ATOM 0 HG2 ARG A 39 -25.345 7.771 -5.747 1.00 1.36 H new ATOM 0 HG3 ARG A 39 -26.113 9.303 -6.113 1.00 1.36 H new ATOM 0 HD2 ARG A 39 -24.431 10.472 -4.622 1.00 1.39 H new ATOM 0 HD3 ARG A 39 -23.642 8.934 -4.337 1.00 1.39 H new ATOM 0 HE ARG A 39 -23.890 9.412 -7.222 1.00 1.58 H new ATOM 0 HH11 ARG A 39 -22.211 10.307 -4.288 1.00 2.75 H new ATOM 0 HH12 ARG A 39 -20.729 10.773 -5.130 1.00 2.75 H new ATOM 0 HH21 ARG A 39 -21.993 10.010 -8.299 1.00 2.58 H new ATOM 0 HH22 ARG A 39 -20.607 10.606 -7.380 1.00 2.58 H new ATOM 623 N TYR A 40 -25.607 5.929 -2.628 1.00 1.10 N ATOM 624 CA TYR A 40 -24.596 4.855 -2.427 1.00 1.01 C ATOM 625 C TYR A 40 -25.281 3.492 -2.470 1.00 0.91 C ATOM 626 O TYR A 40 -24.744 2.536 -2.991 1.00 0.85 O ATOM 627 CB TYR A 40 -23.865 5.062 -1.094 1.00 1.04 C ATOM 628 CG TYR A 40 -22.743 6.052 -1.319 1.00 1.24 C ATOM 629 CD1 TYR A 40 -21.666 5.708 -2.147 1.00 1.74 C ATOM 630 CD2 TYR A 40 -22.787 7.317 -0.722 1.00 1.92 C ATOM 631 CE1 TYR A 40 -20.635 6.625 -2.374 1.00 2.01 C ATOM 632 CE2 TYR A 40 -21.756 8.236 -0.952 1.00 2.17 C ATOM 633 CZ TYR A 40 -20.680 7.889 -1.778 1.00 1.89 C ATOM 634 OH TYR A 40 -19.667 8.795 -2.011 1.00 2.27 O ATOM 0 H TYR A 40 -25.913 6.404 -1.779 1.00 1.10 H new ATOM 0 HA TYR A 40 -23.857 4.897 -3.227 1.00 1.01 H new ATOM 0 HB2 TYR A 40 -24.554 5.434 -0.336 1.00 1.04 H new ATOM 0 HB3 TYR A 40 -23.469 4.115 -0.727 1.00 1.04 H new ATOM 0 HD1 TYR A 40 -21.632 4.733 -2.611 1.00 1.74 H new ATOM 0 HD2 TYR A 40 -23.616 7.584 -0.084 1.00 1.92 H new ATOM 0 HE1 TYR A 40 -19.804 6.357 -3.010 1.00 2.01 H new ATOM 0 HE2 TYR A 40 -21.791 9.213 -0.492 1.00 2.17 H new ATOM 0 HH TYR A 40 -19.564 9.378 -1.230 1.00 2.27 H new ATOM 644 N ILE A 41 -26.473 3.395 -1.949 1.00 0.89 N ATOM 645 CA ILE A 41 -27.191 2.095 -1.990 1.00 0.80 C ATOM 646 C ILE A 41 -27.501 1.746 -3.448 1.00 0.77 C ATOM 647 O ILE A 41 -27.067 0.738 -3.962 1.00 0.70 O ATOM 648 CB ILE A 41 -28.496 2.210 -1.200 1.00 0.82 C ATOM 649 CG1 ILE A 41 -28.176 2.556 0.258 1.00 0.92 C ATOM 650 CG2 ILE A 41 -29.248 0.880 -1.260 1.00 0.77 C ATOM 651 CD1 ILE A 41 -29.473 2.843 1.019 1.00 0.95 C ATOM 0 H ILE A 41 -26.978 4.158 -1.499 1.00 0.89 H new ATOM 0 HA ILE A 41 -26.572 1.314 -1.548 1.00 0.80 H new ATOM 0 HB ILE A 41 -29.118 2.994 -1.632 1.00 0.82 H new ATOM 0 HG12 ILE A 41 -27.642 1.730 0.729 1.00 0.92 H new ATOM 0 HG13 ILE A 41 -27.519 3.425 0.300 1.00 0.92 H new ATOM 0 HG21 ILE A 41 -30.178 0.962 -0.697 1.00 0.77 H new ATOM 0 HG22 ILE A 41 -29.473 0.636 -2.298 1.00 0.77 H new ATOM 0 HG23 ILE A 41 -28.630 0.093 -0.828 1.00 0.77 H new ATOM 0 HD11 ILE A 41 -29.240 3.088 2.055 1.00 0.95 H new ATOM 0 HD12 ILE A 41 -29.989 3.683 0.554 1.00 0.95 H new ATOM 0 HD13 ILE A 41 -30.114 1.962 0.990 1.00 0.95 H new ATOM 663 N LYS A 42 -28.242 2.589 -4.116 1.00 0.85 N ATOM 664 CA LYS A 42 -28.583 2.325 -5.545 1.00 0.86 C ATOM 665 C LYS A 42 -27.299 2.082 -6.338 1.00 0.85 C ATOM 666 O LYS A 42 -27.218 1.198 -7.167 1.00 0.82 O ATOM 667 CB LYS A 42 -29.319 3.545 -6.118 1.00 0.98 C ATOM 668 CG LYS A 42 -29.514 3.392 -7.633 1.00 1.09 C ATOM 669 CD LYS A 42 -30.175 2.046 -7.941 1.00 1.05 C ATOM 670 CE LYS A 42 -30.846 2.107 -9.313 1.00 1.07 C ATOM 671 NZ LYS A 42 -31.223 0.730 -9.743 1.00 1.81 N ATOM 0 H LYS A 42 -28.627 3.452 -3.733 1.00 0.85 H new ATOM 0 HA LYS A 42 -29.222 1.445 -5.616 1.00 0.86 H new ATOM 0 HB2 LYS A 42 -30.287 3.655 -5.630 1.00 0.98 H new ATOM 0 HB3 LYS A 42 -28.751 4.451 -5.908 1.00 0.98 H new ATOM 0 HG2 LYS A 42 -30.132 4.206 -8.013 1.00 1.09 H new ATOM 0 HG3 LYS A 42 -28.552 3.459 -8.141 1.00 1.09 H new ATOM 0 HD2 LYS A 42 -29.430 1.251 -7.924 1.00 1.05 H new ATOM 0 HD3 LYS A 42 -30.912 1.808 -7.174 1.00 1.05 H new ATOM 0 HE2 LYS A 42 -31.732 2.741 -9.269 1.00 1.07 H new ATOM 0 HE3 LYS A 42 -30.169 2.555 -10.041 1.00 1.07 H new ATOM 0 HZ1 LYS A 42 -31.680 0.771 -10.676 1.00 1.81 H new ATOM 0 HZ2 LYS A 42 -30.370 0.138 -9.800 1.00 1.81 H new ATOM 0 HZ3 LYS A 42 -31.883 0.319 -9.052 1.00 1.81 H new ATOM 685 N MET A 43 -26.296 2.867 -6.085 1.00 0.90 N ATOM 686 CA MET A 43 -25.008 2.704 -6.814 1.00 0.93 C ATOM 687 C MET A 43 -24.429 1.318 -6.537 1.00 0.80 C ATOM 688 O MET A 43 -24.026 0.608 -7.434 1.00 0.79 O ATOM 689 CB MET A 43 -24.029 3.781 -6.356 1.00 1.02 C ATOM 690 CG MET A 43 -22.662 3.489 -6.960 1.00 1.13 C ATOM 691 SD MET A 43 -21.595 4.942 -6.790 1.00 2.14 S ATOM 692 CE MET A 43 -22.140 5.813 -8.282 1.00 2.36 C ATOM 0 H MET A 43 -26.310 3.622 -5.399 1.00 0.90 H new ATOM 0 HA MET A 43 -25.180 2.806 -7.886 1.00 0.93 H new ATOM 0 HB2 MET A 43 -24.377 4.765 -6.668 1.00 1.02 H new ATOM 0 HB3 MET A 43 -23.966 3.796 -5.268 1.00 1.02 H new ATOM 0 HG2 MET A 43 -22.209 2.633 -6.460 1.00 1.13 H new ATOM 0 HG3 MET A 43 -22.768 3.225 -8.012 1.00 1.13 H new ATOM 0 HE1 MET A 43 -22.068 6.889 -8.122 1.00 2.36 H new ATOM 0 HE2 MET A 43 -21.506 5.528 -9.122 1.00 2.36 H new ATOM 0 HE3 MET A 43 -23.174 5.547 -8.501 1.00 2.36 H new ATOM 702 N LEU A 44 -24.395 0.928 -5.300 1.00 0.73 N ATOM 703 CA LEU A 44 -23.852 -0.414 -4.959 1.00 0.61 C ATOM 704 C LEU A 44 -24.749 -1.492 -5.585 1.00 0.57 C ATOM 705 O LEU A 44 -24.345 -2.623 -5.775 1.00 0.54 O ATOM 706 CB LEU A 44 -23.816 -0.568 -3.436 1.00 0.57 C ATOM 707 CG LEU A 44 -22.660 0.257 -2.850 1.00 0.69 C ATOM 708 CD1 LEU A 44 -22.722 0.201 -1.323 1.00 1.14 C ATOM 709 CD2 LEU A 44 -21.309 -0.307 -3.313 1.00 0.67 C ATOM 0 H LEU A 44 -24.720 1.480 -4.506 1.00 0.73 H new ATOM 0 HA LEU A 44 -22.840 -0.523 -5.350 1.00 0.61 H new ATOM 0 HB2 LEU A 44 -24.762 -0.239 -3.007 1.00 0.57 H new ATOM 0 HB3 LEU A 44 -23.694 -1.618 -3.172 1.00 0.57 H new ATOM 0 HG LEU A 44 -22.755 1.286 -3.195 1.00 0.69 H new ATOM 0 HD11 LEU A 44 -21.903 0.785 -0.904 1.00 1.14 H new ATOM 0 HD12 LEU A 44 -23.672 0.612 -0.982 1.00 1.14 H new ATOM 0 HD13 LEU A 44 -22.635 -0.834 -0.993 1.00 1.14 H new ATOM 0 HD21 LEU A 44 -20.501 0.289 -2.889 1.00 0.67 H new ATOM 0 HD22 LEU A 44 -21.212 -1.340 -2.978 1.00 0.67 H new ATOM 0 HD23 LEU A 44 -21.253 -0.271 -4.401 1.00 0.67 H new ATOM 721 N MET A 45 -25.960 -1.141 -5.928 1.00 0.60 N ATOM 722 CA MET A 45 -26.879 -2.132 -6.567 1.00 0.58 C ATOM 723 C MET A 45 -26.593 -2.147 -8.062 1.00 0.62 C ATOM 724 O MET A 45 -26.423 -3.181 -8.679 1.00 0.59 O ATOM 725 CB MET A 45 -28.333 -1.697 -6.364 1.00 0.64 C ATOM 726 CG MET A 45 -28.626 -1.533 -4.879 1.00 1.07 C ATOM 727 SD MET A 45 -29.557 -2.970 -4.297 1.00 1.19 S ATOM 728 CE MET A 45 -31.209 -2.350 -4.707 1.00 1.04 C ATOM 0 H MET A 45 -26.354 -0.210 -5.794 1.00 0.60 H new ATOM 0 HA MET A 45 -26.725 -3.116 -6.124 1.00 0.58 H new ATOM 0 HB2 MET A 45 -28.516 -0.757 -6.885 1.00 0.64 H new ATOM 0 HB3 MET A 45 -29.006 -2.437 -6.796 1.00 0.64 H new ATOM 0 HG2 MET A 45 -27.695 -1.437 -4.320 1.00 1.07 H new ATOM 0 HG3 MET A 45 -29.197 -0.620 -4.707 1.00 1.07 H new ATOM 0 HE1 MET A 45 -31.917 -3.179 -4.715 1.00 1.04 H new ATOM 0 HE2 MET A 45 -31.518 -1.617 -3.962 1.00 1.04 H new ATOM 0 HE3 MET A 45 -31.188 -1.881 -5.691 1.00 1.04 H new ATOM 738 N ASP A 46 -26.520 -0.983 -8.628 1.00 0.69 N ATOM 739 CA ASP A 46 -26.220 -0.862 -10.076 1.00 0.76 C ATOM 740 C ASP A 46 -24.850 -1.482 -10.349 1.00 0.75 C ATOM 741 O ASP A 46 -24.551 -1.903 -11.449 1.00 0.81 O ATOM 742 CB ASP A 46 -26.197 0.612 -10.467 1.00 0.85 C ATOM 743 CG ASP A 46 -27.000 0.816 -11.751 1.00 1.03 C ATOM 744 OD1 ASP A 46 -26.905 -0.027 -12.627 1.00 1.26 O ATOM 745 OD2 ASP A 46 -27.699 1.813 -11.837 1.00 1.71 O ATOM 0 H ASP A 46 -26.657 -0.096 -8.143 1.00 0.69 H new ATOM 0 HA ASP A 46 -26.983 -1.378 -10.658 1.00 0.76 H new ATOM 0 HB2 ASP A 46 -26.617 1.218 -9.664 1.00 0.85 H new ATOM 0 HB3 ASP A 46 -25.169 0.944 -10.613 1.00 0.85 H new ATOM 750 N LEU A 47 -24.016 -1.525 -9.348 1.00 0.69 N ATOM 751 CA LEU A 47 -22.653 -2.099 -9.526 1.00 0.70 C ATOM 752 C LEU A 47 -22.640 -3.571 -9.109 1.00 0.62 C ATOM 753 O LEU A 47 -21.678 -4.276 -9.338 1.00 0.63 O ATOM 754 CB LEU A 47 -21.665 -1.303 -8.678 1.00 0.72 C ATOM 755 CG LEU A 47 -21.041 -0.195 -9.535 1.00 0.84 C ATOM 756 CD1 LEU A 47 -22.145 0.652 -10.176 1.00 0.89 C ATOM 757 CD2 LEU A 47 -20.157 0.701 -8.664 1.00 0.89 C ATOM 0 H LEU A 47 -24.221 -1.185 -8.408 1.00 0.69 H new ATOM 0 HA LEU A 47 -22.366 -2.038 -10.576 1.00 0.70 H new ATOM 0 HB2 LEU A 47 -22.174 -0.870 -7.817 1.00 0.72 H new ATOM 0 HB3 LEU A 47 -20.887 -1.961 -8.291 1.00 0.72 H new ATOM 0 HG LEU A 47 -20.435 -0.653 -10.317 1.00 0.84 H new ATOM 0 HD11 LEU A 47 -21.695 1.437 -10.783 1.00 0.89 H new ATOM 0 HD12 LEU A 47 -22.770 0.019 -10.806 1.00 0.89 H new ATOM 0 HD13 LEU A 47 -22.757 1.103 -9.395 1.00 0.89 H new ATOM 0 HD21 LEU A 47 -19.717 1.486 -9.279 1.00 0.89 H new ATOM 0 HD22 LEU A 47 -20.760 1.152 -7.877 1.00 0.89 H new ATOM 0 HD23 LEU A 47 -19.363 0.103 -8.215 1.00 0.89 H new ATOM 769 N GLU A 48 -23.700 -4.038 -8.499 1.00 0.55 N ATOM 770 CA GLU A 48 -23.762 -5.468 -8.066 1.00 0.50 C ATOM 771 C GLU A 48 -22.983 -5.644 -6.756 1.00 0.44 C ATOM 772 O GLU A 48 -21.872 -6.133 -6.737 1.00 0.46 O ATOM 773 CB GLU A 48 -23.183 -6.373 -9.163 1.00 0.56 C ATOM 774 CG GLU A 48 -23.929 -7.709 -9.169 1.00 1.22 C ATOM 775 CD GLU A 48 -25.302 -7.524 -9.818 1.00 1.27 C ATOM 776 OE1 GLU A 48 -25.343 -7.080 -10.954 1.00 1.79 O ATOM 777 OE2 GLU A 48 -26.289 -7.829 -9.169 1.00 1.73 O ATOM 0 H GLU A 48 -24.530 -3.487 -8.281 1.00 0.55 H new ATOM 0 HA GLU A 48 -24.801 -5.751 -7.898 1.00 0.50 H new ATOM 0 HB2 GLU A 48 -23.275 -5.889 -10.135 1.00 0.56 H new ATOM 0 HB3 GLU A 48 -22.120 -6.539 -8.989 1.00 0.56 H new ATOM 0 HG2 GLU A 48 -23.354 -8.456 -9.716 1.00 1.22 H new ATOM 0 HG3 GLU A 48 -24.043 -8.078 -8.150 1.00 1.22 H new ATOM 784 N ILE A 49 -23.567 -5.249 -5.656 1.00 0.40 N ATOM 785 CA ILE A 49 -22.885 -5.386 -4.339 1.00 0.37 C ATOM 786 C ILE A 49 -23.964 -5.547 -3.269 1.00 0.37 C ATOM 787 O ILE A 49 -23.822 -6.330 -2.346 1.00 0.40 O ATOM 788 CB ILE A 49 -22.047 -4.126 -4.049 1.00 0.39 C ATOM 789 CG1 ILE A 49 -20.720 -4.146 -4.828 1.00 0.44 C ATOM 790 CG2 ILE A 49 -21.739 -4.037 -2.553 1.00 0.37 C ATOM 791 CD1 ILE A 49 -20.828 -3.231 -6.050 1.00 0.82 C ATOM 0 H ILE A 49 -24.497 -4.833 -5.615 1.00 0.40 H new ATOM 0 HA ILE A 49 -22.220 -6.249 -4.344 1.00 0.37 H new ATOM 0 HB ILE A 49 -22.629 -3.261 -4.366 1.00 0.39 H new ATOM 0 HG12 ILE A 49 -19.904 -3.816 -4.185 1.00 0.44 H new ATOM 0 HG13 ILE A 49 -20.486 -5.163 -5.142 1.00 0.44 H new ATOM 0 HG21 ILE A 49 -21.146 -3.144 -2.356 1.00 0.37 H new ATOM 0 HG22 ILE A 49 -22.672 -3.984 -1.992 1.00 0.37 H new ATOM 0 HG23 ILE A 49 -21.179 -4.919 -2.244 1.00 0.37 H new ATOM 0 HD11 ILE A 49 -19.887 -3.246 -6.600 1.00 0.82 H new ATOM 0 HD12 ILE A 49 -21.633 -3.581 -6.697 1.00 0.82 H new ATOM 0 HD13 ILE A 49 -21.041 -2.213 -5.724 1.00 0.82 H new ATOM 803 N ILE A 50 -25.055 -4.829 -3.399 1.00 0.43 N ATOM 804 CA ILE A 50 -26.154 -4.962 -2.402 1.00 0.48 C ATOM 805 C ILE A 50 -27.272 -5.815 -3.010 1.00 0.43 C ATOM 806 O ILE A 50 -27.305 -6.049 -4.201 1.00 0.49 O ATOM 807 CB ILE A 50 -26.691 -3.576 -2.032 1.00 0.56 C ATOM 808 CG1 ILE A 50 -25.678 -2.863 -1.128 1.00 0.62 C ATOM 809 CG2 ILE A 50 -28.012 -3.716 -1.275 1.00 0.67 C ATOM 810 CD1 ILE A 50 -26.082 -1.397 -0.927 1.00 0.74 C ATOM 0 H ILE A 50 -25.227 -4.161 -4.150 1.00 0.43 H new ATOM 0 HA ILE A 50 -25.778 -5.441 -1.498 1.00 0.48 H new ATOM 0 HB ILE A 50 -26.850 -3.001 -2.944 1.00 0.56 H new ATOM 0 HG12 ILE A 50 -25.623 -3.368 -0.163 1.00 0.62 H new ATOM 0 HG13 ILE A 50 -24.684 -2.916 -1.572 1.00 0.62 H new ATOM 0 HG21 ILE A 50 -28.389 -2.727 -1.015 1.00 0.67 H new ATOM 0 HG22 ILE A 50 -28.740 -4.227 -1.905 1.00 0.67 H new ATOM 0 HG23 ILE A 50 -27.850 -4.294 -0.365 1.00 0.67 H new ATOM 0 HD11 ILE A 50 -25.354 -0.904 -0.283 1.00 0.74 H new ATOM 0 HD12 ILE A 50 -26.113 -0.892 -1.893 1.00 0.74 H new ATOM 0 HD13 ILE A 50 -27.067 -1.351 -0.462 1.00 0.74 H new ATOM 822 N ARG A 51 -28.175 -6.281 -2.192 1.00 0.58 N ATOM 823 CA ARG A 51 -29.301 -7.130 -2.688 1.00 0.56 C ATOM 824 C ARG A 51 -30.603 -6.463 -2.273 1.00 0.53 C ATOM 825 O ARG A 51 -30.588 -5.478 -1.573 1.00 0.53 O ATOM 826 CB ARG A 51 -29.207 -8.525 -2.073 1.00 0.60 C ATOM 827 CG ARG A 51 -29.113 -9.591 -3.170 1.00 0.83 C ATOM 828 CD ARG A 51 -30.421 -9.678 -3.960 1.00 0.87 C ATOM 829 NE ARG A 51 -30.565 -11.047 -4.532 1.00 1.02 N ATOM 830 CZ ARG A 51 -29.774 -11.444 -5.495 1.00 1.06 C ATOM 831 NH1 ARG A 51 -28.840 -10.650 -5.944 1.00 1.47 N ATOM 832 NH2 ARG A 51 -29.918 -12.636 -6.008 1.00 1.39 N ATOM 0 H ARG A 51 -28.183 -6.108 -1.187 1.00 0.58 H new ATOM 0 HA ARG A 51 -29.256 -7.230 -3.772 1.00 0.56 H new ATOM 0 HB2 ARG A 51 -28.333 -8.585 -1.424 1.00 0.60 H new ATOM 0 HB3 ARG A 51 -30.081 -8.713 -1.449 1.00 0.60 H new ATOM 0 HG2 ARG A 51 -28.291 -9.353 -3.845 1.00 0.83 H new ATOM 0 HG3 ARG A 51 -28.888 -10.559 -2.723 1.00 0.83 H new ATOM 0 HD2 ARG A 51 -31.267 -9.453 -3.310 1.00 0.87 H new ATOM 0 HD3 ARG A 51 -30.426 -8.936 -4.759 1.00 0.87 H new ATOM 0 HE ARG A 51 -31.282 -11.676 -4.171 1.00 1.02 H new ATOM 0 HH11 ARG A 51 -28.726 -9.719 -5.544 1.00 1.47 H new ATOM 0 HH12 ARG A 51 -28.224 -10.961 -6.695 1.00 1.47 H new ATOM 0 HH21 ARG A 51 -30.647 -13.257 -5.658 1.00 1.39 H new ATOM 0 HH22 ARG A 51 -29.301 -12.946 -6.759 1.00 1.39 H new ATOM 846 N GLN A 52 -31.725 -6.954 -2.718 1.00 0.59 N ATOM 847 CA GLN A 52 -33.011 -6.294 -2.344 1.00 0.59 C ATOM 848 C GLN A 52 -34.133 -7.326 -2.263 1.00 0.56 C ATOM 849 O GLN A 52 -34.604 -7.829 -3.263 1.00 0.58 O ATOM 850 CB GLN A 52 -33.366 -5.243 -3.397 1.00 0.68 C ATOM 851 CG GLN A 52 -33.040 -5.782 -4.792 1.00 1.47 C ATOM 852 CD GLN A 52 -34.026 -5.197 -5.804 1.00 1.71 C ATOM 853 OE1 GLN A 52 -35.151 -5.646 -5.902 1.00 2.42 O ATOM 854 NE2 GLN A 52 -33.651 -4.206 -6.565 1.00 1.84 N ATOM 0 H GLN A 52 -31.810 -7.774 -3.318 1.00 0.59 H new ATOM 0 HA GLN A 52 -32.895 -5.820 -1.369 1.00 0.59 H new ATOM 0 HB2 GLN A 52 -34.425 -4.992 -3.332 1.00 0.68 H new ATOM 0 HB3 GLN A 52 -32.808 -4.325 -3.211 1.00 0.68 H new ATOM 0 HG2 GLN A 52 -32.019 -5.517 -5.067 1.00 1.47 H new ATOM 0 HG3 GLN A 52 -33.099 -6.870 -4.797 1.00 1.47 H new ATOM 0 HE21 GLN A 52 -32.707 -3.829 -6.483 1.00 1.84 H new ATOM 0 HE22 GLN A 52 -34.302 -3.808 -7.242 1.00 1.84 H new ATOM 863 N GLU A 53 -34.577 -7.620 -1.064 1.00 0.67 N ATOM 864 CA GLU A 53 -35.687 -8.594 -0.878 1.00 0.78 C ATOM 865 C GLU A 53 -36.788 -7.919 -0.070 1.00 0.77 C ATOM 866 O GLU A 53 -36.686 -7.713 1.121 1.00 0.87 O ATOM 867 CB GLU A 53 -35.178 -9.846 -0.165 1.00 1.04 C ATOM 868 CG GLU A 53 -34.516 -9.479 1.166 1.00 0.85 C ATOM 869 CD GLU A 53 -33.524 -10.574 1.570 1.00 1.59 C ATOM 870 OE1 GLU A 53 -32.811 -11.053 0.703 1.00 2.25 O ATOM 871 OE2 GLU A 53 -33.493 -10.912 2.741 1.00 2.30 O ATOM 0 H GLU A 53 -34.210 -7.220 -0.200 1.00 0.67 H new ATOM 0 HA GLU A 53 -36.082 -8.903 -1.846 1.00 0.78 H new ATOM 0 HB2 GLU A 53 -36.006 -10.532 0.012 1.00 1.04 H new ATOM 0 HB3 GLU A 53 -34.463 -10.367 -0.801 1.00 1.04 H new ATOM 0 HG2 GLU A 53 -34.000 -8.523 1.075 1.00 0.85 H new ATOM 0 HG3 GLU A 53 -35.275 -9.359 1.939 1.00 0.85 H new ATOM 878 N GLY A 54 -37.833 -7.558 -0.738 1.00 0.73 N ATOM 879 CA GLY A 54 -38.961 -6.869 -0.058 1.00 0.75 C ATOM 880 C GLY A 54 -38.395 -5.701 0.756 1.00 0.83 C ATOM 881 O GLY A 54 -38.103 -5.840 1.926 1.00 1.15 O ATOM 0 H GLY A 54 -37.961 -7.710 -1.738 1.00 0.73 H new ATOM 0 HA2 GLY A 54 -39.681 -6.506 -0.791 1.00 0.75 H new ATOM 0 HA3 GLY A 54 -39.492 -7.563 0.594 1.00 0.75 H new ATOM 885 N LYS A 55 -38.299 -4.540 0.152 1.00 0.86 N ATOM 886 CA LYS A 55 -37.802 -3.313 0.863 1.00 1.03 C ATOM 887 C LYS A 55 -36.590 -3.593 1.766 1.00 1.02 C ATOM 888 O LYS A 55 -36.160 -2.723 2.497 1.00 1.27 O ATOM 889 CB LYS A 55 -38.941 -2.740 1.711 1.00 1.21 C ATOM 890 CG LYS A 55 -39.041 -1.225 1.503 1.00 1.38 C ATOM 891 CD LYS A 55 -40.269 -0.696 2.243 1.00 1.67 C ATOM 892 CE LYS A 55 -41.446 -0.616 1.270 1.00 1.89 C ATOM 893 NZ LYS A 55 -41.138 0.374 0.200 1.00 2.27 N ATOM 0 H LYS A 55 -38.549 -4.386 -0.825 1.00 0.86 H new ATOM 0 HA LYS A 55 -37.477 -2.603 0.103 1.00 1.03 H new ATOM 0 HB2 LYS A 55 -39.883 -3.215 1.438 1.00 1.21 H new ATOM 0 HB3 LYS A 55 -38.767 -2.960 2.764 1.00 1.21 H new ATOM 0 HG2 LYS A 55 -38.140 -0.735 1.872 1.00 1.38 H new ATOM 0 HG3 LYS A 55 -39.116 -0.996 0.440 1.00 1.38 H new ATOM 0 HD2 LYS A 55 -40.516 -1.352 3.078 1.00 1.67 H new ATOM 0 HD3 LYS A 55 -40.060 0.288 2.662 1.00 1.67 H new ATOM 0 HE2 LYS A 55 -41.636 -1.595 0.831 1.00 1.89 H new ATOM 0 HE3 LYS A 55 -42.352 -0.324 1.801 1.00 1.89 H new ATOM 0 HZ1 LYS A 55 -42.013 0.857 -0.088 1.00 2.27 H new ATOM 0 HZ2 LYS A 55 -40.458 1.074 0.560 1.00 2.27 H new ATOM 0 HZ3 LYS A 55 -40.728 -0.117 -0.620 1.00 2.27 H new ATOM 907 N GLN A 56 -36.059 -4.782 1.750 1.00 0.87 N ATOM 908 CA GLN A 56 -34.909 -5.102 2.634 1.00 0.97 C ATOM 909 C GLN A 56 -33.669 -5.261 1.777 1.00 0.89 C ATOM 910 O GLN A 56 -33.747 -5.795 0.695 1.00 0.86 O ATOM 911 CB GLN A 56 -35.214 -6.415 3.352 1.00 1.04 C ATOM 912 CG GLN A 56 -34.346 -6.586 4.603 1.00 1.44 C ATOM 913 CD GLN A 56 -35.251 -6.707 5.830 1.00 1.38 C ATOM 914 OE1 GLN A 56 -36.181 -5.943 5.994 1.00 1.49 O ATOM 915 NE2 GLN A 56 -35.019 -7.648 6.704 1.00 2.04 N ATOM 0 H GLN A 56 -36.375 -5.550 1.158 1.00 0.87 H new ATOM 0 HA GLN A 56 -34.744 -4.310 3.364 1.00 0.97 H new ATOM 0 HB2 GLN A 56 -36.267 -6.442 3.632 1.00 1.04 H new ATOM 0 HB3 GLN A 56 -35.044 -7.250 2.673 1.00 1.04 H new ATOM 0 HG2 GLN A 56 -33.721 -7.474 4.508 1.00 1.44 H new ATOM 0 HG3 GLN A 56 -33.675 -5.734 4.714 1.00 1.44 H new ATOM 0 HE21 GLN A 56 -34.238 -8.290 6.567 1.00 2.04 H new ATOM 0 HE22 GLN A 56 -35.618 -7.741 7.524 1.00 2.04 H new ATOM 924 N TYR A 57 -32.529 -4.817 2.238 1.00 0.87 N ATOM 925 CA TYR A 57 -31.302 -4.959 1.413 1.00 0.80 C ATOM 926 C TYR A 57 -30.470 -6.119 1.933 1.00 0.79 C ATOM 927 O TYR A 57 -30.604 -6.530 3.059 1.00 0.95 O ATOM 928 CB TYR A 57 -30.476 -3.684 1.465 1.00 0.81 C ATOM 929 CG TYR A 57 -31.351 -2.499 1.122 1.00 0.85 C ATOM 930 CD1 TYR A 57 -32.261 -1.997 2.060 1.00 1.34 C ATOM 931 CD2 TYR A 57 -31.255 -1.908 -0.144 1.00 1.49 C ATOM 932 CE1 TYR A 57 -33.074 -0.905 1.730 1.00 1.35 C ATOM 933 CE2 TYR A 57 -32.067 -0.816 -0.471 1.00 1.56 C ATOM 934 CZ TYR A 57 -32.977 -0.314 0.466 1.00 0.98 C ATOM 935 OH TYR A 57 -33.777 0.761 0.142 1.00 1.06 O ATOM 0 H TYR A 57 -32.399 -4.366 3.144 1.00 0.87 H new ATOM 0 HA TYR A 57 -31.596 -5.148 0.380 1.00 0.80 H new ATOM 0 HB2 TYR A 57 -30.047 -3.557 2.459 1.00 0.81 H new ATOM 0 HB3 TYR A 57 -29.643 -3.749 0.765 1.00 0.81 H new ATOM 0 HD1 TYR A 57 -32.336 -2.451 3.037 1.00 1.34 H new ATOM 0 HD2 TYR A 57 -30.554 -2.295 -0.868 1.00 1.49 H new ATOM 0 HE1 TYR A 57 -33.777 -0.519 2.453 1.00 1.35 H new ATOM 0 HE2 TYR A 57 -31.991 -0.360 -1.447 1.00 1.56 H new ATOM 0 HH TYR A 57 -33.581 1.050 -0.774 1.00 1.06 H new ATOM 945 N MET A 58 -29.614 -6.651 1.113 1.00 0.66 N ATOM 946 CA MET A 58 -28.778 -7.801 1.542 1.00 0.67 C ATOM 947 C MET A 58 -27.456 -7.764 0.790 1.00 0.57 C ATOM 948 O MET A 58 -27.240 -6.929 -0.064 1.00 0.51 O ATOM 949 CB MET A 58 -29.494 -9.131 1.282 1.00 0.73 C ATOM 950 CG MET A 58 -29.313 -10.073 2.475 1.00 0.90 C ATOM 951 SD MET A 58 -30.296 -11.568 2.206 1.00 1.22 S ATOM 952 CE MET A 58 -28.970 -12.765 2.487 1.00 1.60 C ATOM 0 H MET A 58 -29.456 -6.336 0.156 1.00 0.66 H new ATOM 0 HA MET A 58 -28.597 -7.723 2.614 1.00 0.67 H new ATOM 0 HB2 MET A 58 -30.555 -8.953 1.108 1.00 0.73 H new ATOM 0 HB3 MET A 58 -29.097 -9.595 0.379 1.00 0.73 H new ATOM 0 HG2 MET A 58 -28.261 -10.332 2.593 1.00 0.90 H new ATOM 0 HG3 MET A 58 -29.625 -9.579 3.395 1.00 0.90 H new ATOM 0 HE1 MET A 58 -29.361 -13.776 2.369 1.00 1.60 H new ATOM 0 HE2 MET A 58 -28.171 -12.599 1.765 1.00 1.60 H new ATOM 0 HE3 MET A 58 -28.578 -12.643 3.497 1.00 1.60 H new ATOM 962 N LEU A 59 -26.572 -8.652 1.117 1.00 0.59 N ATOM 963 CA LEU A 59 -25.248 -8.665 0.439 1.00 0.52 C ATOM 964 C LEU A 59 -25.260 -9.720 -0.674 1.00 0.46 C ATOM 965 O LEU A 59 -25.721 -10.828 -0.487 1.00 0.53 O ATOM 966 CB LEU A 59 -24.135 -8.973 1.459 1.00 0.63 C ATOM 967 CG LEU A 59 -24.133 -10.455 1.883 1.00 0.71 C ATOM 968 CD1 LEU A 59 -23.010 -10.676 2.896 1.00 1.03 C ATOM 969 CD2 LEU A 59 -25.469 -10.828 2.536 1.00 1.16 C ATOM 0 H LEU A 59 -26.705 -9.373 1.826 1.00 0.59 H new ATOM 0 HA LEU A 59 -25.052 -7.686 0.002 1.00 0.52 H new ATOM 0 HB2 LEU A 59 -23.167 -8.718 1.027 1.00 0.63 H new ATOM 0 HB3 LEU A 59 -24.266 -8.344 2.340 1.00 0.63 H new ATOM 0 HG LEU A 59 -23.983 -11.077 1.001 1.00 0.71 H new ATOM 0 HD11 LEU A 59 -22.998 -11.722 3.204 1.00 1.03 H new ATOM 0 HD12 LEU A 59 -22.053 -10.421 2.440 1.00 1.03 H new ATOM 0 HD13 LEU A 59 -23.176 -10.043 3.768 1.00 1.03 H new ATOM 0 HD21 LEU A 59 -25.450 -11.878 2.829 1.00 1.16 H new ATOM 0 HD22 LEU A 59 -25.629 -10.208 3.418 1.00 1.16 H new ATOM 0 HD23 LEU A 59 -26.279 -10.664 1.826 1.00 1.16 H new ATOM 981 N THR A 60 -24.766 -9.376 -1.838 1.00 0.39 N ATOM 982 CA THR A 60 -24.761 -10.358 -2.965 1.00 0.41 C ATOM 983 C THR A 60 -23.374 -10.987 -3.061 1.00 0.46 C ATOM 984 O THR A 60 -22.429 -10.498 -2.475 1.00 0.43 O ATOM 985 CB THR A 60 -25.077 -9.656 -4.289 1.00 0.40 C ATOM 986 OG1 THR A 60 -24.305 -10.244 -5.326 1.00 1.12 O ATOM 987 CG2 THR A 60 -24.741 -8.173 -4.187 1.00 1.04 C ATOM 0 H THR A 60 -24.368 -8.462 -2.055 1.00 0.39 H new ATOM 0 HA THR A 60 -25.518 -11.119 -2.777 1.00 0.41 H new ATOM 0 HB THR A 60 -26.139 -9.766 -4.509 1.00 0.40 H new ATOM 0 HG1 THR A 60 -24.505 -9.799 -6.176 1.00 1.12 H new ATOM 0 HG21 THR A 60 -24.969 -7.682 -5.133 1.00 1.04 H new ATOM 0 HG22 THR A 60 -25.332 -7.720 -3.391 1.00 1.04 H new ATOM 0 HG23 THR A 60 -23.681 -8.055 -3.963 1.00 1.04 H new ATOM 995 N LYS A 61 -23.243 -12.065 -3.795 1.00 0.54 N ATOM 996 CA LYS A 61 -21.907 -12.720 -3.933 1.00 0.61 C ATOM 997 C LYS A 61 -20.844 -11.633 -4.126 1.00 0.57 C ATOM 998 O LYS A 61 -19.797 -11.644 -3.511 1.00 0.56 O ATOM 999 CB LYS A 61 -21.905 -13.663 -5.146 1.00 0.70 C ATOM 1000 CG LYS A 61 -22.864 -13.149 -6.227 1.00 1.39 C ATOM 1001 CD LYS A 61 -24.240 -13.805 -6.060 1.00 0.99 C ATOM 1002 CE LYS A 61 -24.267 -15.135 -6.817 1.00 1.84 C ATOM 1003 NZ LYS A 61 -24.693 -14.898 -8.225 1.00 2.26 N ATOM 0 H LYS A 61 -24.002 -12.518 -4.303 1.00 0.54 H new ATOM 0 HA LYS A 61 -21.690 -13.301 -3.037 1.00 0.61 H new ATOM 0 HB2 LYS A 61 -20.897 -13.740 -5.553 1.00 0.70 H new ATOM 0 HB3 LYS A 61 -22.201 -14.665 -4.836 1.00 0.70 H new ATOM 0 HG2 LYS A 61 -22.957 -12.065 -6.157 1.00 1.39 H new ATOM 0 HG3 LYS A 61 -22.463 -13.371 -7.216 1.00 1.39 H new ATOM 0 HD2 LYS A 61 -24.449 -13.972 -5.003 1.00 0.99 H new ATOM 0 HD3 LYS A 61 -25.019 -13.143 -6.439 1.00 0.99 H new ATOM 0 HE2 LYS A 61 -23.280 -15.597 -6.798 1.00 1.84 H new ATOM 0 HE3 LYS A 61 -24.953 -15.829 -6.330 1.00 1.84 H new ATOM 0 HZ1 LYS A 61 -24.711 -15.802 -8.739 1.00 2.26 H new ATOM 0 HZ2 LYS A 61 -25.643 -14.476 -8.234 1.00 2.26 H new ATOM 0 HZ3 LYS A 61 -24.022 -14.251 -8.686 1.00 2.26 H new ATOM 1017 N LYS A 62 -21.112 -10.699 -4.990 1.00 0.57 N ATOM 1018 CA LYS A 62 -20.137 -9.601 -5.245 1.00 0.56 C ATOM 1019 C LYS A 62 -19.902 -8.792 -3.962 1.00 0.50 C ATOM 1020 O LYS A 62 -18.802 -8.354 -3.691 1.00 0.58 O ATOM 1021 CB LYS A 62 -20.684 -8.665 -6.328 1.00 0.59 C ATOM 1022 CG LYS A 62 -20.420 -9.255 -7.718 1.00 0.78 C ATOM 1023 CD LYS A 62 -21.235 -10.536 -7.893 1.00 1.25 C ATOM 1024 CE LYS A 62 -21.235 -10.944 -9.367 1.00 1.29 C ATOM 1025 NZ LYS A 62 -21.139 -12.427 -9.472 1.00 2.14 N ATOM 0 H LYS A 62 -21.972 -10.646 -5.537 1.00 0.57 H new ATOM 0 HA LYS A 62 -19.196 -10.041 -5.574 1.00 0.56 H new ATOM 0 HB2 LYS A 62 -21.754 -8.517 -6.185 1.00 0.59 H new ATOM 0 HB3 LYS A 62 -20.213 -7.686 -6.245 1.00 0.59 H new ATOM 0 HG2 LYS A 62 -20.689 -8.532 -8.488 1.00 0.78 H new ATOM 0 HG3 LYS A 62 -19.358 -9.468 -7.838 1.00 0.78 H new ATOM 0 HD2 LYS A 62 -20.812 -11.335 -7.284 1.00 1.25 H new ATOM 0 HD3 LYS A 62 -22.257 -10.379 -7.548 1.00 1.25 H new ATOM 0 HE2 LYS A 62 -22.145 -10.593 -9.853 1.00 1.29 H new ATOM 0 HE3 LYS A 62 -20.397 -10.477 -9.885 1.00 1.29 H new ATOM 0 HZ1 LYS A 62 -20.836 -12.688 -10.432 1.00 2.14 H new ATOM 0 HZ2 LYS A 62 -20.446 -12.780 -8.782 1.00 2.14 H new ATOM 0 HZ3 LYS A 62 -22.069 -12.850 -9.276 1.00 2.14 H new ATOM 1039 N GLY A 63 -20.930 -8.564 -3.188 1.00 0.43 N ATOM 1040 CA GLY A 63 -20.764 -7.751 -1.947 1.00 0.38 C ATOM 1041 C GLY A 63 -19.936 -8.495 -0.898 1.00 0.40 C ATOM 1042 O GLY A 63 -19.062 -7.923 -0.277 1.00 0.39 O ATOM 0 H GLY A 63 -21.876 -8.905 -3.361 1.00 0.43 H new ATOM 0 HA2 GLY A 63 -20.279 -6.806 -2.192 1.00 0.38 H new ATOM 0 HA3 GLY A 63 -21.744 -7.509 -1.535 1.00 0.38 H new ATOM 1046 N GLU A 64 -20.180 -9.758 -0.694 1.00 0.46 N ATOM 1047 CA GLU A 64 -19.370 -10.499 0.319 1.00 0.51 C ATOM 1048 C GLU A 64 -17.914 -10.550 -0.148 1.00 0.51 C ATOM 1049 O GLU A 64 -16.995 -10.276 0.600 1.00 0.50 O ATOM 1050 CB GLU A 64 -19.905 -11.919 0.510 1.00 0.60 C ATOM 1051 CG GLU A 64 -21.073 -12.148 -0.438 1.00 0.65 C ATOM 1052 CD GLU A 64 -21.568 -13.589 -0.309 1.00 0.80 C ATOM 1053 OE1 GLU A 64 -20.735 -14.474 -0.199 1.00 1.40 O ATOM 1054 OE2 GLU A 64 -22.772 -13.785 -0.323 1.00 1.25 O ATOM 0 H GLU A 64 -20.894 -10.306 -1.175 1.00 0.46 H new ATOM 0 HA GLU A 64 -19.436 -9.980 1.275 1.00 0.51 H new ATOM 0 HB2 GLU A 64 -19.116 -12.646 0.316 1.00 0.60 H new ATOM 0 HB3 GLU A 64 -20.225 -12.064 1.542 1.00 0.60 H new ATOM 0 HG2 GLU A 64 -21.881 -11.454 -0.208 1.00 0.65 H new ATOM 0 HG3 GLU A 64 -20.765 -11.950 -1.465 1.00 0.65 H new ATOM 1061 N GLU A 65 -17.703 -10.895 -1.389 1.00 0.55 N ATOM 1062 CA GLU A 65 -16.315 -10.964 -1.925 1.00 0.58 C ATOM 1063 C GLU A 65 -15.664 -9.584 -1.818 1.00 0.52 C ATOM 1064 O GLU A 65 -14.486 -9.461 -1.551 1.00 0.53 O ATOM 1065 CB GLU A 65 -16.356 -11.395 -3.392 1.00 0.64 C ATOM 1066 CG GLU A 65 -16.663 -12.891 -3.478 1.00 0.72 C ATOM 1067 CD GLU A 65 -16.722 -13.318 -4.946 1.00 1.15 C ATOM 1068 OE1 GLU A 65 -15.671 -13.564 -5.513 1.00 1.82 O ATOM 1069 OE2 GLU A 65 -17.818 -13.388 -5.478 1.00 1.69 O ATOM 0 H GLU A 65 -18.436 -11.133 -2.057 1.00 0.55 H new ATOM 0 HA GLU A 65 -15.737 -11.688 -1.351 1.00 0.58 H new ATOM 0 HB2 GLU A 65 -17.116 -10.826 -3.928 1.00 0.64 H new ATOM 0 HB3 GLU A 65 -15.401 -11.181 -3.871 1.00 0.64 H new ATOM 0 HG2 GLU A 65 -15.896 -13.461 -2.953 1.00 0.72 H new ATOM 0 HG3 GLU A 65 -17.612 -13.107 -2.987 1.00 0.72 H new ATOM 1076 N LEU A 66 -16.425 -8.544 -2.025 1.00 0.50 N ATOM 1077 CA LEU A 66 -15.853 -7.171 -1.934 1.00 0.48 C ATOM 1078 C LEU A 66 -15.566 -6.843 -0.466 1.00 0.44 C ATOM 1079 O LEU A 66 -14.542 -6.279 -0.136 1.00 0.45 O ATOM 1080 CB LEU A 66 -16.858 -6.165 -2.513 1.00 0.46 C ATOM 1081 CG LEU A 66 -16.391 -4.728 -2.248 1.00 0.62 C ATOM 1082 CD1 LEU A 66 -14.966 -4.544 -2.768 1.00 0.77 C ATOM 1083 CD2 LEU A 66 -17.321 -3.754 -2.975 1.00 1.54 C ATOM 0 H LEU A 66 -17.418 -8.586 -2.253 1.00 0.50 H new ATOM 0 HA LEU A 66 -14.924 -7.114 -2.502 1.00 0.48 H new ATOM 0 HB2 LEU A 66 -16.967 -6.327 -3.585 1.00 0.46 H new ATOM 0 HB3 LEU A 66 -17.839 -6.323 -2.066 1.00 0.46 H new ATOM 0 HG LEU A 66 -16.413 -4.533 -1.176 1.00 0.62 H new ATOM 0 HD11 LEU A 66 -14.638 -3.522 -2.578 1.00 0.77 H new ATOM 0 HD12 LEU A 66 -14.300 -5.240 -2.258 1.00 0.77 H new ATOM 0 HD13 LEU A 66 -14.942 -4.739 -3.840 1.00 0.77 H new ATOM 0 HD21 LEU A 66 -16.993 -2.731 -2.790 1.00 1.54 H new ATOM 0 HD22 LEU A 66 -17.294 -3.955 -4.046 1.00 1.54 H new ATOM 0 HD23 LEU A 66 -18.339 -3.881 -2.608 1.00 1.54 H new ATOM 1095 N LEU A 67 -16.456 -7.202 0.420 1.00 0.43 N ATOM 1096 CA LEU A 67 -16.230 -6.920 1.866 1.00 0.43 C ATOM 1097 C LEU A 67 -14.866 -7.470 2.280 1.00 0.46 C ATOM 1098 O LEU A 67 -14.099 -6.812 2.956 1.00 0.48 O ATOM 1099 CB LEU A 67 -17.330 -7.596 2.693 1.00 0.46 C ATOM 1100 CG LEU A 67 -17.163 -7.250 4.180 1.00 0.61 C ATOM 1101 CD1 LEU A 67 -17.329 -5.743 4.391 1.00 0.89 C ATOM 1102 CD2 LEU A 67 -18.226 -7.993 4.992 1.00 1.39 C ATOM 0 H LEU A 67 -17.331 -7.679 0.204 1.00 0.43 H new ATOM 0 HA LEU A 67 -16.256 -5.844 2.040 1.00 0.43 H new ATOM 0 HB2 LEU A 67 -18.310 -7.270 2.344 1.00 0.46 H new ATOM 0 HB3 LEU A 67 -17.286 -8.676 2.556 1.00 0.46 H new ATOM 0 HG LEU A 67 -16.167 -7.549 4.507 1.00 0.61 H new ATOM 0 HD11 LEU A 67 -17.209 -5.508 5.449 1.00 0.89 H new ATOM 0 HD12 LEU A 67 -16.575 -5.209 3.813 1.00 0.89 H new ATOM 0 HD13 LEU A 67 -18.322 -5.437 4.062 1.00 0.89 H new ATOM 0 HD21 LEU A 67 -18.112 -7.751 6.049 1.00 1.39 H new ATOM 0 HD22 LEU A 67 -19.218 -7.691 4.656 1.00 1.39 H new ATOM 0 HD23 LEU A 67 -18.107 -9.067 4.851 1.00 1.39 H new ATOM 1114 N GLU A 68 -14.554 -8.672 1.878 1.00 0.50 N ATOM 1115 CA GLU A 68 -13.236 -9.260 2.249 1.00 0.55 C ATOM 1116 C GLU A 68 -12.128 -8.495 1.528 1.00 0.52 C ATOM 1117 O GLU A 68 -11.119 -8.149 2.110 1.00 0.52 O ATOM 1118 CB GLU A 68 -13.198 -10.731 1.830 1.00 0.62 C ATOM 1119 CG GLU A 68 -12.024 -11.429 2.520 1.00 1.34 C ATOM 1120 CD GLU A 68 -11.386 -12.430 1.555 1.00 1.80 C ATOM 1121 OE1 GLU A 68 -12.004 -13.451 1.298 1.00 2.26 O ATOM 1122 OE2 GLU A 68 -10.293 -12.160 1.089 1.00 2.26 O ATOM 0 H GLU A 68 -15.153 -9.271 1.310 1.00 0.50 H new ATOM 0 HA GLU A 68 -13.091 -9.189 3.327 1.00 0.55 H new ATOM 0 HB2 GLU A 68 -14.134 -11.221 2.098 1.00 0.62 H new ATOM 0 HB3 GLU A 68 -13.096 -10.809 0.748 1.00 0.62 H new ATOM 0 HG2 GLU A 68 -11.286 -10.693 2.838 1.00 1.34 H new ATOM 0 HG3 GLU A 68 -12.369 -11.942 3.417 1.00 1.34 H new ATOM 1129 N ASP A 69 -12.309 -8.223 0.266 1.00 0.51 N ATOM 1130 CA ASP A 69 -11.268 -7.474 -0.490 1.00 0.51 C ATOM 1131 C ASP A 69 -10.981 -6.154 0.228 1.00 0.46 C ATOM 1132 O ASP A 69 -9.846 -5.821 0.502 1.00 0.48 O ATOM 1133 CB ASP A 69 -11.771 -7.189 -1.907 1.00 0.53 C ATOM 1134 CG ASP A 69 -12.000 -8.509 -2.644 1.00 0.62 C ATOM 1135 OD1 ASP A 69 -11.585 -9.533 -2.127 1.00 1.34 O ATOM 1136 OD2 ASP A 69 -12.586 -8.474 -3.713 1.00 1.13 O ATOM 0 H ASP A 69 -13.133 -8.487 -0.274 1.00 0.51 H new ATOM 0 HA ASP A 69 -10.355 -8.067 -0.546 1.00 0.51 H new ATOM 0 HB2 ASP A 69 -12.698 -6.618 -1.867 1.00 0.53 H new ATOM 0 HB3 ASP A 69 -11.045 -6.581 -2.446 1.00 0.53 H new ATOM 1141 N ILE A 70 -12.002 -5.402 0.540 1.00 0.43 N ATOM 1142 CA ILE A 70 -11.783 -4.108 1.246 1.00 0.43 C ATOM 1143 C ILE A 70 -11.051 -4.368 2.565 1.00 0.42 C ATOM 1144 O ILE A 70 -10.169 -3.629 2.955 1.00 0.43 O ATOM 1145 CB ILE A 70 -13.134 -3.447 1.530 1.00 0.48 C ATOM 1146 CG1 ILE A 70 -13.584 -2.658 0.298 1.00 0.89 C ATOM 1147 CG2 ILE A 70 -13.002 -2.494 2.721 1.00 0.78 C ATOM 1148 CD1 ILE A 70 -15.063 -2.295 0.434 1.00 1.29 C ATOM 0 H ILE A 70 -12.976 -5.627 0.337 1.00 0.43 H new ATOM 0 HA ILE A 70 -11.182 -3.447 0.621 1.00 0.43 H new ATOM 0 HB ILE A 70 -13.870 -4.217 1.762 1.00 0.48 H new ATOM 0 HG12 ILE A 70 -12.985 -1.753 0.194 1.00 0.89 H new ATOM 0 HG13 ILE A 70 -13.426 -3.250 -0.603 1.00 0.89 H new ATOM 0 HG21 ILE A 70 -13.966 -2.025 2.920 1.00 0.78 H new ATOM 0 HG22 ILE A 70 -12.681 -3.053 3.600 1.00 0.78 H new ATOM 0 HG23 ILE A 70 -12.265 -1.725 2.491 1.00 0.78 H new ATOM 0 HD11 ILE A 70 -15.382 -1.733 -0.444 1.00 1.29 H new ATOM 0 HD12 ILE A 70 -15.655 -3.206 0.517 1.00 1.29 H new ATOM 0 HD13 ILE A 70 -15.208 -1.686 1.327 1.00 1.29 H new ATOM 1160 N ARG A 71 -11.410 -5.419 3.247 1.00 0.43 N ATOM 1161 CA ARG A 71 -10.740 -5.743 4.538 1.00 0.47 C ATOM 1162 C ARG A 71 -9.239 -5.941 4.312 1.00 0.48 C ATOM 1163 O ARG A 71 -8.415 -5.347 4.978 1.00 0.51 O ATOM 1164 CB ARG A 71 -11.340 -7.029 5.107 1.00 0.51 C ATOM 1165 CG ARG A 71 -11.649 -6.838 6.592 1.00 0.81 C ATOM 1166 CD ARG A 71 -12.215 -8.137 7.168 1.00 1.02 C ATOM 1167 NE ARG A 71 -11.229 -9.237 6.974 1.00 1.58 N ATOM 1168 CZ ARG A 71 -11.621 -10.480 7.013 1.00 2.24 C ATOM 1169 NH1 ARG A 71 -12.878 -10.763 7.224 1.00 2.68 N ATOM 1170 NH2 ARG A 71 -10.757 -11.444 6.841 1.00 3.04 N ATOM 0 H ARG A 71 -12.142 -6.071 2.965 1.00 0.43 H new ATOM 0 HA ARG A 71 -10.891 -4.921 5.238 1.00 0.47 H new ATOM 0 HB2 ARG A 71 -12.250 -7.288 4.566 1.00 0.51 H new ATOM 0 HB3 ARG A 71 -10.644 -7.857 4.974 1.00 0.51 H new ATOM 0 HG2 ARG A 71 -10.744 -6.554 7.129 1.00 0.81 H new ATOM 0 HG3 ARG A 71 -12.365 -6.027 6.724 1.00 0.81 H new ATOM 0 HD2 ARG A 71 -12.433 -8.012 8.229 1.00 1.02 H new ATOM 0 HD3 ARG A 71 -13.155 -8.386 6.676 1.00 1.02 H new ATOM 0 HE ARG A 71 -10.246 -9.018 6.811 1.00 1.58 H new ATOM 0 HH11 ARG A 71 -13.554 -10.011 7.358 1.00 2.68 H new ATOM 0 HH12 ARG A 71 -13.184 -11.736 7.254 1.00 2.68 H new ATOM 0 HH21 ARG A 71 -9.775 -11.225 6.676 1.00 3.04 H new ATOM 0 HH22 ARG A 71 -11.065 -12.416 6.872 1.00 3.04 H new ATOM 1184 N LYS A 72 -8.881 -6.791 3.387 1.00 0.49 N ATOM 1185 CA LYS A 72 -7.438 -7.054 3.121 1.00 0.52 C ATOM 1186 C LYS A 72 -6.725 -5.765 2.699 1.00 0.49 C ATOM 1187 O LYS A 72 -5.809 -5.310 3.355 1.00 0.50 O ATOM 1188 CB LYS A 72 -7.312 -8.092 2.007 1.00 0.57 C ATOM 1189 CG LYS A 72 -8.147 -9.324 2.360 1.00 0.69 C ATOM 1190 CD LYS A 72 -7.247 -10.561 2.384 1.00 0.93 C ATOM 1191 CE LYS A 72 -8.063 -11.779 2.818 1.00 1.44 C ATOM 1192 NZ LYS A 72 -8.027 -12.809 1.741 1.00 1.87 N ATOM 0 H LYS A 72 -9.530 -7.317 2.802 1.00 0.49 H new ATOM 0 HA LYS A 72 -6.974 -7.428 4.034 1.00 0.52 H new ATOM 0 HB2 LYS A 72 -7.651 -7.669 1.061 1.00 0.57 H new ATOM 0 HB3 LYS A 72 -6.267 -8.373 1.874 1.00 0.57 H new ATOM 0 HG2 LYS A 72 -8.622 -9.188 3.331 1.00 0.69 H new ATOM 0 HG3 LYS A 72 -8.946 -9.456 1.630 1.00 0.69 H new ATOM 0 HD2 LYS A 72 -6.818 -10.731 1.396 1.00 0.93 H new ATOM 0 HD3 LYS A 72 -6.415 -10.405 3.070 1.00 0.93 H new ATOM 0 HE2 LYS A 72 -7.659 -12.190 3.743 1.00 1.44 H new ATOM 0 HE3 LYS A 72 -9.093 -11.486 3.022 1.00 1.44 H new ATOM 0 HZ1 LYS A 72 -7.951 -13.755 2.167 1.00 1.87 H new ATOM 0 HZ2 LYS A 72 -8.899 -12.752 1.177 1.00 1.87 H new ATOM 0 HZ3 LYS A 72 -7.205 -12.640 1.126 1.00 1.87 H new ATOM 1206 N PHE A 73 -7.131 -5.182 1.603 1.00 0.48 N ATOM 1207 CA PHE A 73 -6.472 -3.930 1.123 1.00 0.47 C ATOM 1208 C PHE A 73 -6.243 -2.972 2.295 1.00 0.46 C ATOM 1209 O PHE A 73 -5.145 -2.511 2.524 1.00 0.46 O ATOM 1210 CB PHE A 73 -7.370 -3.261 0.081 1.00 0.45 C ATOM 1211 CG PHE A 73 -7.470 -1.781 0.366 1.00 0.46 C ATOM 1212 CD1 PHE A 73 -6.498 -0.905 -0.135 1.00 1.35 C ATOM 1213 CD2 PHE A 73 -8.535 -1.283 1.125 1.00 1.20 C ATOM 1214 CE1 PHE A 73 -6.592 0.468 0.126 1.00 1.34 C ATOM 1215 CE2 PHE A 73 -8.629 0.090 1.386 1.00 1.27 C ATOM 1216 CZ PHE A 73 -7.657 0.965 0.887 1.00 0.58 C ATOM 0 H PHE A 73 -7.894 -5.520 1.016 1.00 0.48 H new ATOM 0 HA PHE A 73 -5.508 -4.177 0.678 1.00 0.47 H new ATOM 0 HB2 PHE A 73 -6.965 -3.422 -0.918 1.00 0.45 H new ATOM 0 HB3 PHE A 73 -8.362 -3.712 0.099 1.00 0.45 H new ATOM 0 HD1 PHE A 73 -5.677 -1.288 -0.722 1.00 1.35 H new ATOM 0 HD2 PHE A 73 -9.285 -1.958 1.510 1.00 1.20 H new ATOM 0 HE1 PHE A 73 -5.843 1.143 -0.260 1.00 1.34 H new ATOM 0 HE2 PHE A 73 -9.451 0.473 1.972 1.00 1.27 H new ATOM 0 HZ PHE A 73 -7.729 2.024 1.089 1.00 0.58 H new ATOM 1226 N ASN A 74 -7.270 -2.663 3.033 1.00 0.47 N ATOM 1227 CA ASN A 74 -7.099 -1.727 4.180 1.00 0.48 C ATOM 1228 C ASN A 74 -6.085 -2.311 5.161 1.00 0.50 C ATOM 1229 O ASN A 74 -5.320 -1.595 5.771 1.00 0.52 O ATOM 1230 CB ASN A 74 -8.440 -1.520 4.885 1.00 0.48 C ATOM 1231 CG ASN A 74 -8.224 -0.705 6.161 1.00 0.67 C ATOM 1232 OD1 ASN A 74 -8.153 0.507 6.117 1.00 1.58 O ATOM 1233 ND2 ASN A 74 -8.115 -1.323 7.305 1.00 1.06 N ATOM 0 H ASN A 74 -8.217 -3.015 2.894 1.00 0.47 H new ATOM 0 HA ASN A 74 -6.739 -0.766 3.813 1.00 0.48 H new ATOM 0 HB2 ASN A 74 -9.135 -1.003 4.223 1.00 0.48 H new ATOM 0 HB3 ASN A 74 -8.888 -2.484 5.128 1.00 0.48 H new ATOM 0 HD21 ASN A 74 -7.970 -0.789 8.162 1.00 1.06 H new ATOM 0 HD22 ASN A 74 -8.175 -2.341 7.343 1.00 1.06 H new ATOM 1240 N GLU A 75 -6.068 -3.604 5.316 1.00 0.51 N ATOM 1241 CA GLU A 75 -5.098 -4.223 6.251 1.00 0.55 C ATOM 1242 C GLU A 75 -3.696 -4.125 5.657 1.00 0.55 C ATOM 1243 O GLU A 75 -2.770 -3.691 6.309 1.00 0.65 O ATOM 1244 CB GLU A 75 -5.457 -5.693 6.457 1.00 0.59 C ATOM 1245 CG GLU A 75 -6.363 -5.828 7.677 1.00 0.87 C ATOM 1246 CD GLU A 75 -6.750 -7.296 7.867 1.00 1.22 C ATOM 1247 OE1 GLU A 75 -5.893 -8.144 7.680 1.00 1.77 O ATOM 1248 OE2 GLU A 75 -7.898 -7.548 8.197 1.00 1.79 O ATOM 0 H GLU A 75 -6.686 -4.257 4.834 1.00 0.51 H new ATOM 0 HA GLU A 75 -5.130 -3.703 7.208 1.00 0.55 H new ATOM 0 HB2 GLU A 75 -5.960 -6.083 5.572 1.00 0.59 H new ATOM 0 HB3 GLU A 75 -4.552 -6.284 6.596 1.00 0.59 H new ATOM 0 HG2 GLU A 75 -5.851 -5.458 8.566 1.00 0.87 H new ATOM 0 HG3 GLU A 75 -7.258 -5.219 7.548 1.00 0.87 H new ATOM 1255 N MET A 76 -3.523 -4.528 4.425 1.00 0.52 N ATOM 1256 CA MET A 76 -2.178 -4.458 3.806 1.00 0.51 C ATOM 1257 C MET A 76 -1.849 -3.007 3.474 1.00 0.51 C ATOM 1258 O MET A 76 -0.725 -2.570 3.621 1.00 0.52 O ATOM 1259 CB MET A 76 -2.171 -5.291 2.525 1.00 0.50 C ATOM 1260 CG MET A 76 -2.339 -6.770 2.882 1.00 0.52 C ATOM 1261 SD MET A 76 -0.751 -7.619 2.706 1.00 0.55 S ATOM 1262 CE MET A 76 -1.313 -9.258 3.230 1.00 0.65 C ATOM 0 H MET A 76 -4.259 -4.902 3.825 1.00 0.52 H new ATOM 0 HA MET A 76 -1.432 -4.848 4.499 1.00 0.51 H new ATOM 0 HB2 MET A 76 -2.977 -4.971 1.865 1.00 0.50 H new ATOM 0 HB3 MET A 76 -1.237 -5.139 1.984 1.00 0.50 H new ATOM 0 HG2 MET A 76 -2.705 -6.869 3.904 1.00 0.52 H new ATOM 0 HG3 MET A 76 -3.083 -7.230 2.231 1.00 0.52 H new ATOM 0 HE1 MET A 76 -0.477 -9.957 3.197 1.00 0.65 H new ATOM 0 HE2 MET A 76 -1.700 -9.202 4.248 1.00 0.65 H new ATOM 0 HE3 MET A 76 -2.101 -9.603 2.561 1.00 0.65 H new ATOM 1272 N ARG A 77 -2.817 -2.245 3.037 1.00 0.50 N ATOM 1273 CA ARG A 77 -2.541 -0.822 2.714 1.00 0.50 C ATOM 1274 C ARG A 77 -2.028 -0.110 3.966 1.00 0.51 C ATOM 1275 O ARG A 77 -1.026 0.577 3.938 1.00 0.52 O ATOM 1276 CB ARG A 77 -3.819 -0.138 2.227 1.00 0.49 C ATOM 1277 CG ARG A 77 -3.495 1.299 1.809 1.00 0.52 C ATOM 1278 CD ARG A 77 -4.282 2.278 2.684 1.00 0.54 C ATOM 1279 NE ARG A 77 -4.042 3.669 2.209 1.00 0.85 N ATOM 1280 CZ ARG A 77 -2.949 4.296 2.549 1.00 1.35 C ATOM 1281 NH1 ARG A 77 -2.068 3.705 3.309 1.00 1.85 N ATOM 1282 NH2 ARG A 77 -2.736 5.513 2.129 1.00 1.84 N ATOM 0 H ARG A 77 -3.780 -2.548 2.892 1.00 0.50 H new ATOM 0 HA ARG A 77 -1.789 -0.772 1.927 1.00 0.50 H new ATOM 0 HB2 ARG A 77 -4.241 -0.687 1.386 1.00 0.49 H new ATOM 0 HB3 ARG A 77 -4.570 -0.139 3.017 1.00 0.49 H new ATOM 0 HG2 ARG A 77 -2.426 1.485 1.909 1.00 0.52 H new ATOM 0 HG3 ARG A 77 -3.748 1.449 0.759 1.00 0.52 H new ATOM 0 HD2 ARG A 77 -5.346 2.046 2.642 1.00 0.54 H new ATOM 0 HD3 ARG A 77 -3.975 2.180 3.725 1.00 0.54 H new ATOM 0 HE ARG A 77 -4.732 4.132 1.618 1.00 0.85 H new ATOM 0 HH11 ARG A 77 -2.234 2.754 3.637 1.00 1.85 H new ATOM 0 HH12 ARG A 77 -1.214 4.195 3.575 1.00 1.85 H new ATOM 0 HH21 ARG A 77 -3.424 5.975 1.534 1.00 1.84 H new ATOM 0 HH22 ARG A 77 -1.881 6.002 2.395 1.00 1.84 H new ATOM 1296 N LYS A 78 -2.703 -0.287 5.070 1.00 0.51 N ATOM 1297 CA LYS A 78 -2.250 0.361 6.333 1.00 0.52 C ATOM 1298 C LYS A 78 -0.880 -0.206 6.691 1.00 0.53 C ATOM 1299 O LYS A 78 0.000 0.497 7.146 1.00 0.55 O ATOM 1300 CB LYS A 78 -3.252 0.058 7.454 1.00 0.52 C ATOM 1301 CG LYS A 78 -2.538 0.072 8.808 1.00 0.90 C ATOM 1302 CD LYS A 78 -3.566 0.204 9.936 1.00 1.04 C ATOM 1303 CE LYS A 78 -3.573 1.640 10.470 1.00 1.45 C ATOM 1304 NZ LYS A 78 -4.842 1.883 11.212 1.00 2.15 N ATOM 0 H LYS A 78 -3.548 -0.852 5.151 1.00 0.51 H new ATOM 0 HA LYS A 78 -2.186 1.442 6.206 1.00 0.52 H new ATOM 0 HB2 LYS A 78 -4.053 0.797 7.448 1.00 0.52 H new ATOM 0 HB3 LYS A 78 -3.715 -0.915 7.287 1.00 0.52 H new ATOM 0 HG2 LYS A 78 -1.961 -0.844 8.935 1.00 0.90 H new ATOM 0 HG3 LYS A 78 -1.832 0.901 8.848 1.00 0.90 H new ATOM 0 HD2 LYS A 78 -4.557 -0.062 9.569 1.00 1.04 H new ATOM 0 HD3 LYS A 78 -3.327 -0.491 10.741 1.00 1.04 H new ATOM 0 HE2 LYS A 78 -2.718 1.800 11.127 1.00 1.45 H new ATOM 0 HE3 LYS A 78 -3.479 2.347 9.646 1.00 1.45 H new ATOM 0 HZ1 LYS A 78 -4.850 2.857 11.576 1.00 2.15 H new ATOM 0 HZ2 LYS A 78 -5.650 1.746 10.572 1.00 2.15 H new ATOM 0 HZ3 LYS A 78 -4.913 1.216 12.007 1.00 2.15 H new ATOM 1318 N ASN A 79 -0.686 -1.473 6.453 1.00 0.52 N ATOM 1319 CA ASN A 79 0.640 -2.085 6.741 1.00 0.53 C ATOM 1320 C ASN A 79 1.661 -1.448 5.805 1.00 0.54 C ATOM 1321 O ASN A 79 2.725 -1.029 6.211 1.00 0.54 O ATOM 1322 CB ASN A 79 0.591 -3.593 6.491 1.00 0.54 C ATOM 1323 CG ASN A 79 1.168 -4.330 7.701 1.00 0.60 C ATOM 1324 OD1 ASN A 79 0.600 -5.299 8.163 1.00 1.17 O ATOM 1325 ND2 ASN A 79 2.282 -3.910 8.234 1.00 1.14 N ATOM 0 H ASN A 79 -1.386 -2.109 6.073 1.00 0.52 H new ATOM 0 HA ASN A 79 0.912 -1.916 7.783 1.00 0.53 H new ATOM 0 HB2 ASN A 79 -0.437 -3.910 6.315 1.00 0.54 H new ATOM 0 HB3 ASN A 79 1.159 -3.842 5.595 1.00 0.54 H new ATOM 0 HD21 ASN A 79 2.677 -4.395 9.039 1.00 1.14 H new ATOM 0 HD22 ASN A 79 2.758 -3.096 7.845 1.00 1.14 H new ATOM 1332 N MET A 80 1.328 -1.368 4.546 1.00 0.56 N ATOM 1333 CA MET A 80 2.257 -0.753 3.563 1.00 0.58 C ATOM 1334 C MET A 80 2.668 0.634 4.060 1.00 0.57 C ATOM 1335 O MET A 80 3.834 0.904 4.264 1.00 0.56 O ATOM 1336 CB MET A 80 1.549 -0.652 2.203 1.00 0.60 C ATOM 1337 CG MET A 80 2.068 0.557 1.411 1.00 0.64 C ATOM 1338 SD MET A 80 1.483 0.456 -0.297 1.00 1.38 S ATOM 1339 CE MET A 80 2.153 2.041 -0.858 1.00 1.16 C ATOM 0 H MET A 80 0.447 -1.705 4.156 1.00 0.56 H new ATOM 0 HA MET A 80 3.152 -1.365 3.452 1.00 0.58 H new ATOM 0 HB2 MET A 80 1.715 -1.566 1.632 1.00 0.60 H new ATOM 0 HB3 MET A 80 0.473 -0.561 2.353 1.00 0.60 H new ATOM 0 HG2 MET A 80 1.721 1.482 1.871 1.00 0.64 H new ATOM 0 HG3 MET A 80 3.158 0.579 1.433 1.00 0.64 H new ATOM 0 HE1 MET A 80 1.951 2.165 -1.922 1.00 1.16 H new ATOM 0 HE2 MET A 80 1.682 2.852 -0.302 1.00 1.16 H new ATOM 0 HE3 MET A 80 3.229 2.062 -0.688 1.00 1.16 H new ATOM 1349 N ASP A 81 1.725 1.519 4.262 1.00 0.58 N ATOM 1350 CA ASP A 81 2.069 2.885 4.751 1.00 0.58 C ATOM 1351 C ASP A 81 2.830 2.793 6.070 1.00 0.56 C ATOM 1352 O ASP A 81 3.788 3.505 6.300 1.00 0.56 O ATOM 1353 CB ASP A 81 0.777 3.669 4.974 1.00 0.59 C ATOM 1354 CG ASP A 81 0.917 5.070 4.378 1.00 0.61 C ATOM 1355 OD1 ASP A 81 1.996 5.630 4.480 1.00 1.12 O ATOM 1356 OD2 ASP A 81 -0.057 5.561 3.832 1.00 1.22 O ATOM 0 H ASP A 81 0.730 1.352 4.109 1.00 0.58 H new ATOM 0 HA ASP A 81 2.694 3.386 4.012 1.00 0.58 H new ATOM 0 HB2 ASP A 81 -0.061 3.148 4.511 1.00 0.59 H new ATOM 0 HB3 ASP A 81 0.560 3.736 6.040 1.00 0.59 H new ATOM 1361 N GLN A 82 2.426 1.904 6.931 1.00 0.56 N ATOM 1362 CA GLN A 82 3.129 1.736 8.223 1.00 0.54 C ATOM 1363 C GLN A 82 4.556 1.285 7.911 1.00 0.53 C ATOM 1364 O GLN A 82 5.532 1.839 8.385 1.00 0.55 O ATOM 1365 CB GLN A 82 2.377 0.661 9.000 1.00 0.55 C ATOM 1366 CG GLN A 82 2.976 0.473 10.386 1.00 1.12 C ATOM 1367 CD GLN A 82 2.125 1.215 11.417 1.00 0.77 C ATOM 1368 OE1 GLN A 82 2.357 2.377 11.692 1.00 1.13 O ATOM 1369 NE2 GLN A 82 1.139 0.591 12.003 1.00 1.43 N ATOM 0 H GLN A 82 1.630 1.282 6.790 1.00 0.56 H new ATOM 0 HA GLN A 82 3.165 2.654 8.810 1.00 0.54 H new ATOM 0 HB2 GLN A 82 1.327 0.938 9.088 1.00 0.55 H new ATOM 0 HB3 GLN A 82 2.413 -0.281 8.453 1.00 0.55 H new ATOM 0 HG2 GLN A 82 3.022 -0.588 10.633 1.00 1.12 H new ATOM 0 HG3 GLN A 82 3.999 0.849 10.405 1.00 1.12 H new ATOM 0 HE21 GLN A 82 0.944 -0.383 11.773 1.00 1.43 H new ATOM 0 HE22 GLN A 82 0.564 1.078 12.691 1.00 1.43 H new ATOM 1378 N LEU A 83 4.663 0.296 7.076 1.00 0.51 N ATOM 1379 CA LEU A 83 6.002 -0.200 6.674 1.00 0.51 C ATOM 1380 C LEU A 83 6.712 0.935 5.936 1.00 0.52 C ATOM 1381 O LEU A 83 7.872 1.214 6.165 1.00 0.53 O ATOM 1382 CB LEU A 83 5.844 -1.414 5.761 1.00 0.49 C ATOM 1383 CG LEU A 83 5.294 -2.591 6.576 1.00 0.47 C ATOM 1384 CD1 LEU A 83 4.792 -3.675 5.627 1.00 0.52 C ATOM 1385 CD2 LEU A 83 6.386 -3.174 7.488 1.00 0.48 C ATOM 0 H LEU A 83 3.875 -0.193 6.652 1.00 0.51 H new ATOM 0 HA LEU A 83 6.584 -0.503 7.544 1.00 0.51 H new ATOM 0 HB2 LEU A 83 5.169 -1.179 4.938 1.00 0.49 H new ATOM 0 HB3 LEU A 83 6.805 -1.679 5.320 1.00 0.49 H new ATOM 0 HG LEU A 83 4.473 -2.233 7.198 1.00 0.47 H new ATOM 0 HD11 LEU A 83 4.401 -4.512 6.205 1.00 0.52 H new ATOM 0 HD12 LEU A 83 4.001 -3.269 4.996 1.00 0.52 H new ATOM 0 HD13 LEU A 83 5.615 -4.020 5.001 1.00 0.52 H new ATOM 0 HD21 LEU A 83 5.977 -4.008 8.058 1.00 0.48 H new ATOM 0 HD22 LEU A 83 7.219 -3.525 6.879 1.00 0.48 H new ATOM 0 HD23 LEU A 83 6.737 -2.403 8.174 1.00 0.48 H new ATOM 1397 N LYS A 84 6.009 1.605 5.060 1.00 0.53 N ATOM 1398 CA LYS A 84 6.620 2.741 4.316 1.00 0.56 C ATOM 1399 C LYS A 84 7.294 3.688 5.310 1.00 0.56 C ATOM 1400 O LYS A 84 8.425 4.095 5.132 1.00 0.57 O ATOM 1401 CB LYS A 84 5.529 3.504 3.562 1.00 0.57 C ATOM 1402 CG LYS A 84 6.173 4.532 2.628 1.00 0.58 C ATOM 1403 CD LYS A 84 5.575 5.915 2.900 1.00 0.75 C ATOM 1404 CE LYS A 84 6.254 6.951 2.004 1.00 0.77 C ATOM 1405 NZ LYS A 84 7.050 7.890 2.845 1.00 1.42 N ATOM 0 H LYS A 84 5.035 1.412 4.829 1.00 0.53 H new ATOM 0 HA LYS A 84 7.356 2.359 3.608 1.00 0.56 H new ATOM 0 HB2 LYS A 84 4.916 2.809 2.987 1.00 0.57 H new ATOM 0 HB3 LYS A 84 4.867 4.004 4.268 1.00 0.57 H new ATOM 0 HG2 LYS A 84 7.252 4.554 2.783 1.00 0.58 H new ATOM 0 HG3 LYS A 84 6.006 4.250 1.589 1.00 0.58 H new ATOM 0 HD2 LYS A 84 4.502 5.902 2.710 1.00 0.75 H new ATOM 0 HD3 LYS A 84 5.710 6.181 3.948 1.00 0.75 H new ATOM 0 HE2 LYS A 84 6.902 6.454 1.282 1.00 0.77 H new ATOM 0 HE3 LYS A 84 5.505 7.502 1.434 1.00 0.77 H new ATOM 0 HZ1 LYS A 84 7.669 8.463 2.236 1.00 1.42 H new ATOM 0 HZ2 LYS A 84 6.407 8.516 3.371 1.00 1.42 H new ATOM 0 HZ3 LYS A 84 7.631 7.348 3.516 1.00 1.42 H new ATOM 1419 N GLU A 85 6.600 4.044 6.357 1.00 0.55 N ATOM 1420 CA GLU A 85 7.186 4.968 7.368 1.00 0.55 C ATOM 1421 C GLU A 85 8.409 4.321 8.011 1.00 0.57 C ATOM 1422 O GLU A 85 9.363 4.988 8.363 1.00 0.57 O ATOM 1423 CB GLU A 85 6.147 5.264 8.451 1.00 0.55 C ATOM 1424 CG GLU A 85 6.860 5.656 9.747 1.00 0.56 C ATOM 1425 CD GLU A 85 5.890 6.410 10.657 1.00 0.56 C ATOM 1426 OE1 GLU A 85 5.022 5.769 11.226 1.00 1.18 O ATOM 1427 OE2 GLU A 85 6.030 7.617 10.770 1.00 1.12 O ATOM 0 H GLU A 85 5.649 3.733 6.556 1.00 0.55 H new ATOM 0 HA GLU A 85 7.481 5.895 6.877 1.00 0.55 H new ATOM 0 HB2 GLU A 85 5.488 6.070 8.128 1.00 0.55 H new ATOM 0 HB3 GLU A 85 5.521 4.388 8.618 1.00 0.55 H new ATOM 0 HG2 GLU A 85 7.232 4.765 10.253 1.00 0.56 H new ATOM 0 HG3 GLU A 85 7.725 6.280 9.524 1.00 0.56 H new ATOM 1434 N LYS A 86 8.405 3.029 8.151 1.00 0.58 N ATOM 1435 CA LYS A 86 9.585 2.348 8.752 1.00 0.61 C ATOM 1436 C LYS A 86 10.773 2.515 7.807 1.00 0.62 C ATOM 1437 O LYS A 86 11.907 2.648 8.225 1.00 0.63 O ATOM 1438 CB LYS A 86 9.282 0.861 8.941 1.00 0.62 C ATOM 1439 CG LYS A 86 9.545 0.464 10.394 1.00 0.65 C ATOM 1440 CD LYS A 86 9.191 -1.011 10.593 1.00 0.83 C ATOM 1441 CE LYS A 86 9.323 -1.375 12.073 1.00 1.01 C ATOM 1442 NZ LYS A 86 8.813 -2.758 12.291 1.00 1.24 N ATOM 0 H LYS A 86 7.639 2.414 7.877 1.00 0.58 H new ATOM 0 HA LYS A 86 9.815 2.786 9.723 1.00 0.61 H new ATOM 0 HB2 LYS A 86 8.244 0.655 8.679 1.00 0.62 H new ATOM 0 HB3 LYS A 86 9.903 0.265 8.273 1.00 0.62 H new ATOM 0 HG2 LYS A 86 10.592 0.635 10.645 1.00 0.65 H new ATOM 0 HG3 LYS A 86 8.951 1.085 11.065 1.00 0.65 H new ATOM 0 HD2 LYS A 86 8.174 -1.201 10.251 1.00 0.83 H new ATOM 0 HD3 LYS A 86 9.851 -1.638 9.994 1.00 0.83 H new ATOM 0 HE2 LYS A 86 10.366 -1.307 12.384 1.00 1.01 H new ATOM 0 HE3 LYS A 86 8.762 -0.668 12.684 1.00 1.01 H new ATOM 0 HZ1 LYS A 86 8.902 -3.006 13.297 1.00 1.24 H new ATOM 0 HZ2 LYS A 86 7.813 -2.808 12.010 1.00 1.24 H new ATOM 0 HZ3 LYS A 86 9.367 -3.427 11.719 1.00 1.24 H new ATOM 1456 N ILE A 87 10.512 2.510 6.527 1.00 0.64 N ATOM 1457 CA ILE A 87 11.608 2.667 5.534 1.00 0.67 C ATOM 1458 C ILE A 87 12.200 4.068 5.638 1.00 0.65 C ATOM 1459 O ILE A 87 13.389 4.231 5.818 1.00 0.63 O ATOM 1460 CB ILE A 87 11.050 2.467 4.123 1.00 0.71 C ATOM 1461 CG1 ILE A 87 10.523 1.037 3.974 1.00 0.79 C ATOM 1462 CG2 ILE A 87 12.156 2.711 3.094 1.00 0.80 C ATOM 1463 CD1 ILE A 87 9.763 0.903 2.650 1.00 0.84 C ATOM 0 H ILE A 87 9.580 2.403 6.127 1.00 0.64 H new ATOM 0 HA ILE A 87 12.382 1.926 5.736 1.00 0.67 H new ATOM 0 HB ILE A 87 10.236 3.172 3.956 1.00 0.71 H new ATOM 0 HG12 ILE A 87 11.351 0.329 4.003 1.00 0.79 H new ATOM 0 HG13 ILE A 87 9.866 0.792 4.808 1.00 0.79 H new ATOM 0 HG21 ILE A 87 11.757 2.568 2.090 1.00 0.80 H new ATOM 0 HG22 ILE A 87 12.528 3.730 3.195 1.00 0.80 H new ATOM 0 HG23 ILE A 87 12.972 2.008 3.263 1.00 0.80 H new ATOM 0 HD11 ILE A 87 9.389 -0.116 2.547 1.00 0.84 H new ATOM 0 HD12 ILE A 87 8.925 1.600 2.639 1.00 0.84 H new ATOM 0 HD13 ILE A 87 10.434 1.129 1.821 1.00 0.84 H new ATOM 1475 N ASN A 88 11.388 5.084 5.546 1.00 0.66 N ATOM 1476 CA ASN A 88 11.920 6.467 5.657 1.00 0.65 C ATOM 1477 C ASN A 88 12.583 6.657 7.017 1.00 0.62 C ATOM 1478 O ASN A 88 13.488 7.446 7.168 1.00 0.62 O ATOM 1479 CB ASN A 88 10.772 7.469 5.507 1.00 0.69 C ATOM 1480 CG ASN A 88 9.991 7.163 4.228 1.00 1.66 C ATOM 1481 OD1 ASN A 88 9.812 6.016 3.871 1.00 2.38 O ATOM 1482 ND2 ASN A 88 9.513 8.149 3.518 1.00 2.46 N ATOM 0 H ASN A 88 10.381 5.015 5.399 1.00 0.66 H new ATOM 0 HA ASN A 88 12.656 6.633 4.870 1.00 0.65 H new ATOM 0 HB2 ASN A 88 10.111 7.413 6.372 1.00 0.69 H new ATOM 0 HB3 ASN A 88 11.165 8.485 5.472 1.00 0.69 H new ATOM 0 HD21 ASN A 88 8.990 7.956 2.664 1.00 2.46 H new ATOM 0 HD22 ASN A 88 9.663 9.113 3.817 1.00 2.46 H new ATOM 1489 N SER A 89 12.131 5.950 8.015 1.00 0.61 N ATOM 1490 CA SER A 89 12.732 6.111 9.367 1.00 0.61 C ATOM 1491 C SER A 89 14.192 5.646 9.373 1.00 0.63 C ATOM 1492 O SER A 89 15.083 6.393 9.724 1.00 0.71 O ATOM 1493 CB SER A 89 11.934 5.283 10.375 1.00 0.62 C ATOM 1494 OG SER A 89 12.154 5.799 11.682 1.00 1.29 O ATOM 0 H SER A 89 11.374 5.270 7.953 1.00 0.61 H new ATOM 0 HA SER A 89 12.702 7.166 9.639 1.00 0.61 H new ATOM 0 HB2 SER A 89 10.872 5.317 10.132 1.00 0.62 H new ATOM 0 HB3 SER A 89 12.239 4.238 10.328 1.00 0.62 H new ATOM 0 HG SER A 89 11.643 5.273 12.332 1.00 1.29 H new ATOM 1500 N VAL A 90 14.451 4.419 9.003 1.00 0.58 N ATOM 1501 CA VAL A 90 15.853 3.906 9.003 1.00 0.60 C ATOM 1502 C VAL A 90 16.634 4.431 7.796 1.00 0.59 C ATOM 1503 O VAL A 90 17.787 4.802 7.899 1.00 0.63 O ATOM 1504 CB VAL A 90 15.812 2.383 8.937 1.00 0.61 C ATOM 1505 CG1 VAL A 90 17.168 1.805 9.346 1.00 0.52 C ATOM 1506 CG2 VAL A 90 14.728 1.861 9.883 1.00 0.81 C ATOM 0 H VAL A 90 13.747 3.746 8.699 1.00 0.58 H new ATOM 0 HA VAL A 90 16.350 4.247 9.911 1.00 0.60 H new ATOM 0 HB VAL A 90 15.587 2.075 7.916 1.00 0.61 H new ATOM 0 HG11 VAL A 90 17.130 0.717 9.296 1.00 0.52 H new ATOM 0 HG12 VAL A 90 17.939 2.172 8.669 1.00 0.52 H new ATOM 0 HG13 VAL A 90 17.403 2.113 10.365 1.00 0.52 H new ATOM 0 HG21 VAL A 90 14.698 0.772 9.836 1.00 0.81 H new ATOM 0 HG22 VAL A 90 14.953 2.175 10.902 1.00 0.81 H new ATOM 0 HG23 VAL A 90 13.760 2.264 9.585 1.00 0.81 H new ATOM 1516 N LEU A 91 16.013 4.458 6.650 1.00 0.57 N ATOM 1517 CA LEU A 91 16.712 4.949 5.431 1.00 0.61 C ATOM 1518 C LEU A 91 16.783 6.468 5.479 1.00 0.67 C ATOM 1519 O LEU A 91 17.549 7.079 4.766 1.00 0.70 O ATOM 1520 CB LEU A 91 15.917 4.517 4.187 1.00 0.62 C ATOM 1521 CG LEU A 91 16.609 4.992 2.902 1.00 0.72 C ATOM 1522 CD1 LEU A 91 18.028 4.429 2.823 1.00 0.91 C ATOM 1523 CD2 LEU A 91 15.811 4.500 1.692 1.00 0.97 C ATOM 0 H LEU A 91 15.048 4.160 6.505 1.00 0.57 H new ATOM 0 HA LEU A 91 17.719 4.534 5.386 1.00 0.61 H new ATOM 0 HB2 LEU A 91 15.819 3.432 4.172 1.00 0.62 H new ATOM 0 HB3 LEU A 91 14.908 4.927 4.235 1.00 0.62 H new ATOM 0 HG LEU A 91 16.657 6.081 2.907 1.00 0.72 H new ATOM 0 HD11 LEU A 91 18.506 4.775 1.906 1.00 0.91 H new ATOM 0 HD12 LEU A 91 18.603 4.771 3.683 1.00 0.91 H new ATOM 0 HD13 LEU A 91 17.988 3.340 2.823 1.00 0.91 H new ATOM 0 HD21 LEU A 91 16.297 4.834 0.775 1.00 0.97 H new ATOM 0 HD22 LEU A 91 15.767 3.411 1.703 1.00 0.97 H new ATOM 0 HD23 LEU A 91 14.800 4.904 1.734 1.00 0.97 H new ATOM 1535 N SER A 92 16.023 7.073 6.353 1.00 0.71 N ATOM 1536 CA SER A 92 16.048 8.570 6.490 1.00 0.81 C ATOM 1537 C SER A 92 15.735 9.267 5.149 1.00 0.88 C ATOM 1538 O SER A 92 15.280 10.389 5.134 1.00 1.04 O ATOM 1539 CB SER A 92 17.427 9.017 6.961 1.00 0.85 C ATOM 1540 OG SER A 92 17.350 9.431 8.320 1.00 0.94 O ATOM 0 H SER A 92 15.380 6.596 6.985 1.00 0.71 H new ATOM 0 HA SER A 92 15.284 8.850 7.216 1.00 0.81 H new ATOM 0 HB2 SER A 92 18.141 8.200 6.858 1.00 0.85 H new ATOM 0 HB3 SER A 92 17.788 9.836 6.339 1.00 0.85 H new ATOM 0 HG SER A 92 18.236 9.717 8.625 1.00 0.94 H new ATOM 1546 N ILE A 93 16.030 8.626 4.042 1.00 0.85 N ATOM 1547 CA ILE A 93 15.825 9.223 2.678 1.00 0.92 C ATOM 1548 C ILE A 93 16.995 10.163 2.378 1.00 1.05 C ATOM 1549 O ILE A 93 17.868 9.850 1.594 1.00 1.13 O ATOM 1550 CB ILE A 93 14.495 9.999 2.565 1.00 1.02 C ATOM 1551 CG1 ILE A 93 13.325 9.161 3.106 1.00 1.07 C ATOM 1552 CG2 ILE A 93 14.230 10.315 1.093 1.00 1.16 C ATOM 1553 CD1 ILE A 93 13.381 7.749 2.518 1.00 1.65 C ATOM 0 H ILE A 93 16.417 7.682 4.026 1.00 0.85 H new ATOM 0 HA ILE A 93 15.780 8.408 1.955 1.00 0.92 H new ATOM 0 HB ILE A 93 14.574 10.915 3.151 1.00 1.02 H new ATOM 0 HG12 ILE A 93 13.373 9.114 4.194 1.00 1.07 H new ATOM 0 HG13 ILE A 93 12.377 9.634 2.849 1.00 1.07 H new ATOM 0 HG21 ILE A 93 13.292 10.863 1.002 1.00 1.16 H new ATOM 0 HG22 ILE A 93 15.045 10.922 0.699 1.00 1.16 H new ATOM 0 HG23 ILE A 93 14.163 9.385 0.528 1.00 1.16 H new ATOM 0 HD11 ILE A 93 12.549 7.160 2.905 1.00 1.65 H new ATOM 0 HD12 ILE A 93 13.312 7.804 1.432 1.00 1.65 H new ATOM 0 HD13 ILE A 93 14.322 7.275 2.798 1.00 1.65 H new ATOM 1565 N ARG A 94 17.025 11.307 2.998 1.00 1.20 N ATOM 1566 CA ARG A 94 18.142 12.260 2.751 1.00 1.42 C ATOM 1567 C ARG A 94 18.375 13.114 4.000 1.00 1.49 C ATOM 1568 O ARG A 94 19.010 14.148 3.946 1.00 1.74 O ATOM 1569 CB ARG A 94 17.806 13.169 1.560 1.00 1.79 C ATOM 1570 CG ARG A 94 16.320 13.551 1.580 1.00 2.10 C ATOM 1571 CD ARG A 94 16.002 14.338 2.854 1.00 2.55 C ATOM 1572 NE ARG A 94 14.769 15.148 2.642 1.00 3.16 N ATOM 1573 CZ ARG A 94 14.074 15.559 3.667 1.00 3.74 C ATOM 1574 NH1 ARG A 94 14.457 15.262 4.878 1.00 3.85 N ATOM 1575 NH2 ARG A 94 12.994 16.269 3.479 1.00 4.56 N ATOM 0 H ARG A 94 16.323 11.625 3.667 1.00 1.20 H new ATOM 0 HA ARG A 94 19.046 11.696 2.523 1.00 1.42 H new ATOM 0 HB2 ARG A 94 18.420 14.069 1.597 1.00 1.79 H new ATOM 0 HB3 ARG A 94 18.044 12.659 0.627 1.00 1.79 H new ATOM 0 HG2 ARG A 94 16.078 14.150 0.702 1.00 2.10 H new ATOM 0 HG3 ARG A 94 15.704 12.653 1.533 1.00 2.10 H new ATOM 0 HD2 ARG A 94 15.862 13.654 3.691 1.00 2.55 H new ATOM 0 HD3 ARG A 94 16.838 14.989 3.111 1.00 2.55 H new ATOM 0 HE ARG A 94 14.468 15.381 1.696 1.00 3.16 H new ATOM 0 HH11 ARG A 94 15.301 14.708 5.025 1.00 3.85 H new ATOM 0 HH12 ARG A 94 13.913 15.584 5.678 1.00 3.85 H new ATOM 0 HH21 ARG A 94 12.695 16.501 2.532 1.00 4.56 H new ATOM 0 HH22 ARG A 94 12.450 16.591 4.279 1.00 4.56 H new ATOM 1589 N GLN A 95 17.864 12.687 5.125 1.00 1.46 N ATOM 1590 CA GLN A 95 18.054 13.469 6.380 1.00 1.61 C ATOM 1591 C GLN A 95 17.147 14.701 6.358 1.00 2.21 C ATOM 1592 O GLN A 95 17.377 15.567 5.531 1.00 2.75 O ATOM 1593 CB GLN A 95 19.517 13.913 6.496 1.00 1.83 C ATOM 1594 CG GLN A 95 19.949 13.876 7.963 1.00 2.35 C ATOM 1595 CD GLN A 95 21.396 14.357 8.082 1.00 2.88 C ATOM 1596 OE1 GLN A 95 21.878 15.083 7.235 1.00 3.43 O ATOM 1597 NE2 GLN A 95 22.113 13.982 9.105 1.00 3.20 N ATOM 1598 OXT GLN A 95 16.237 14.756 7.169 1.00 2.78 O ATOM 0 H GLN A 95 17.322 11.829 5.228 1.00 1.46 H new ATOM 0 HA GLN A 95 17.798 12.844 7.235 1.00 1.61 H new ATOM 0 HB2 GLN A 95 20.155 13.258 5.902 1.00 1.83 H new ATOM 0 HB3 GLN A 95 19.635 14.920 6.097 1.00 1.83 H new ATOM 0 HG2 GLN A 95 19.294 14.509 8.562 1.00 2.35 H new ATOM 0 HG3 GLN A 95 19.858 12.863 8.354 1.00 2.35 H new ATOM 0 HE21 GLN A 95 21.708 13.373 9.816 1.00 3.20 H new ATOM 0 HE22 GLN A 95 23.079 14.298 9.194 1.00 3.20 H new TER 1607 GLN A 95 ATOM 1608 N ALA B 1 13.731 5.403 -12.215 1.00 5.31 N ATOM 1609 CA ALA B 1 12.296 5.367 -12.613 1.00 4.73 C ATOM 1610 C ALA B 1 11.495 4.585 -11.570 1.00 4.10 C ATOM 1611 O ALA B 1 10.691 3.738 -11.898 1.00 3.94 O ATOM 1612 CB ALA B 1 12.162 4.683 -13.975 1.00 4.76 C ATOM 0 H1 ALA B 1 14.283 5.891 -12.949 1.00 5.31 H new ATOM 0 H2 ALA B 1 13.829 5.912 -11.313 1.00 5.31 H new ATOM 0 H3 ALA B 1 14.085 4.431 -12.104 1.00 5.31 H new ATOM 0 HA ALA B 1 11.912 6.385 -12.677 1.00 4.73 H new ATOM 0 HB1 ALA B 1 11.112 4.656 -14.267 1.00 4.76 H new ATOM 0 HB2 ALA B 1 12.732 5.240 -14.719 1.00 4.76 H new ATOM 0 HB3 ALA B 1 12.547 3.665 -13.910 1.00 4.76 H new ATOM 1620 N LYS B 2 11.710 4.865 -10.314 1.00 4.19 N ATOM 1621 CA LYS B 2 10.962 4.137 -9.251 1.00 4.06 C ATOM 1622 C LYS B 2 11.183 2.632 -9.414 1.00 3.61 C ATOM 1623 O LYS B 2 10.249 1.854 -9.412 1.00 4.29 O ATOM 1624 CB LYS B 2 9.469 4.446 -9.373 1.00 4.79 C ATOM 1625 CG LYS B 2 9.273 5.946 -9.608 1.00 5.69 C ATOM 1626 CD LYS B 2 7.777 6.262 -9.662 1.00 6.62 C ATOM 1627 CE LYS B 2 7.580 7.752 -9.949 1.00 7.56 C ATOM 1628 NZ LYS B 2 6.125 8.041 -10.096 1.00 7.96 N ATOM 0 H LYS B 2 12.371 5.566 -9.978 1.00 4.19 H new ATOM 0 HA LYS B 2 11.320 4.456 -8.272 1.00 4.06 H new ATOM 0 HB2 LYS B 2 9.036 3.879 -10.197 1.00 4.79 H new ATOM 0 HB3 LYS B 2 8.948 4.139 -8.466 1.00 4.79 H new ATOM 0 HG2 LYS B 2 9.747 6.515 -8.809 1.00 5.69 H new ATOM 0 HG3 LYS B 2 9.753 6.245 -10.540 1.00 5.69 H new ATOM 0 HD2 LYS B 2 7.296 5.665 -10.437 1.00 6.62 H new ATOM 0 HD3 LYS B 2 7.304 5.997 -8.716 1.00 6.62 H new ATOM 0 HE2 LYS B 2 8.000 8.348 -9.139 1.00 7.56 H new ATOM 0 HE3 LYS B 2 8.111 8.031 -10.859 1.00 7.56 H new ATOM 0 HZ1 LYS B 2 5.990 9.054 -10.291 1.00 7.96 H new ATOM 0 HZ2 LYS B 2 5.738 7.482 -10.883 1.00 7.96 H new ATOM 0 HZ3 LYS B 2 5.630 7.789 -9.216 1.00 7.96 H new ATOM 1642 N LYS B 3 12.411 2.213 -9.554 1.00 2.84 N ATOM 1643 CA LYS B 3 12.691 0.759 -9.718 1.00 2.84 C ATOM 1644 C LYS B 3 14.202 0.548 -9.677 1.00 2.25 C ATOM 1645 O LYS B 3 14.689 -0.476 -9.244 1.00 2.75 O ATOM 1646 CB LYS B 3 12.142 0.275 -11.062 1.00 3.27 C ATOM 1647 CG LYS B 3 12.699 1.150 -12.187 1.00 3.74 C ATOM 1648 CD LYS B 3 12.071 0.736 -13.521 1.00 4.47 C ATOM 1649 CE LYS B 3 12.428 -0.720 -13.832 1.00 5.15 C ATOM 1650 NZ LYS B 3 11.408 -1.622 -13.224 1.00 5.62 N ATOM 0 H LYS B 3 13.234 2.816 -9.562 1.00 2.84 H new ATOM 0 HA LYS B 3 12.212 0.196 -8.917 1.00 2.84 H new ATOM 0 HB2 LYS B 3 12.419 -0.766 -11.226 1.00 3.27 H new ATOM 0 HB3 LYS B 3 11.053 0.318 -11.059 1.00 3.27 H new ATOM 0 HG2 LYS B 3 12.486 2.200 -11.984 1.00 3.74 H new ATOM 0 HG3 LYS B 3 13.783 1.048 -12.237 1.00 3.74 H new ATOM 0 HD2 LYS B 3 10.988 0.853 -13.476 1.00 4.47 H new ATOM 0 HD3 LYS B 3 12.429 1.386 -14.319 1.00 4.47 H new ATOM 0 HE2 LYS B 3 12.468 -0.873 -14.910 1.00 5.15 H new ATOM 0 HE3 LYS B 3 13.417 -0.955 -13.439 1.00 5.15 H new ATOM 0 HZ1 LYS B 3 11.879 -2.306 -12.597 1.00 5.62 H new ATOM 0 HZ2 LYS B 3 10.729 -1.058 -12.674 1.00 5.62 H new ATOM 0 HZ3 LYS B 3 10.904 -2.133 -13.977 1.00 5.62 H new ATOM 1664 N LYS B 4 14.941 1.525 -10.120 1.00 1.66 N ATOM 1665 CA LYS B 4 16.424 1.414 -10.110 1.00 1.45 C ATOM 1666 C LYS B 4 17.012 2.780 -9.771 1.00 1.21 C ATOM 1667 O LYS B 4 16.300 3.702 -9.423 1.00 1.74 O ATOM 1668 CB LYS B 4 16.921 0.987 -11.494 1.00 1.77 C ATOM 1669 CG LYS B 4 16.502 -0.458 -11.774 1.00 2.27 C ATOM 1670 CD LYS B 4 16.953 -0.855 -13.180 1.00 2.87 C ATOM 1671 CE LYS B 4 16.537 -2.300 -13.462 1.00 3.35 C ATOM 1672 NZ LYS B 4 16.571 -2.549 -14.931 1.00 3.94 N ATOM 0 H LYS B 4 14.578 2.403 -10.492 1.00 1.66 H new ATOM 0 HA LYS B 4 16.732 0.673 -9.372 1.00 1.45 H new ATOM 0 HB2 LYS B 4 16.511 1.648 -12.257 1.00 1.77 H new ATOM 0 HB3 LYS B 4 18.006 1.077 -11.544 1.00 1.77 H new ATOM 0 HG2 LYS B 4 16.945 -1.126 -11.036 1.00 2.27 H new ATOM 0 HG3 LYS B 4 15.420 -0.558 -11.685 1.00 2.27 H new ATOM 0 HD2 LYS B 4 16.508 -0.187 -13.918 1.00 2.87 H new ATOM 0 HD3 LYS B 4 18.035 -0.753 -13.269 1.00 2.87 H new ATOM 0 HE2 LYS B 4 17.208 -2.989 -12.950 1.00 3.35 H new ATOM 0 HE3 LYS B 4 15.535 -2.484 -13.074 1.00 3.35 H new ATOM 0 HZ1 LYS B 4 16.288 -3.531 -15.123 1.00 3.94 H new ATOM 0 HZ2 LYS B 4 15.914 -1.900 -15.408 1.00 3.94 H new ATOM 0 HZ3 LYS B 4 17.535 -2.390 -15.288 1.00 3.94 H new ATOM 1686 N SER B 5 18.301 2.922 -9.887 1.00 1.06 N ATOM 1687 CA SER B 5 18.946 4.230 -9.589 1.00 1.29 C ATOM 1688 C SER B 5 18.351 4.860 -8.333 1.00 1.14 C ATOM 1689 O SER B 5 18.239 6.064 -8.241 1.00 1.52 O ATOM 1690 CB SER B 5 18.716 5.168 -10.758 1.00 1.71 C ATOM 1691 OG SER B 5 19.542 6.316 -10.615 1.00 2.58 O ATOM 0 H SER B 5 18.941 2.183 -10.178 1.00 1.06 H new ATOM 0 HA SER B 5 20.011 4.063 -9.427 1.00 1.29 H new ATOM 0 HB2 SER B 5 18.941 4.660 -11.696 1.00 1.71 H new ATOM 0 HB3 SER B 5 17.668 5.464 -10.800 1.00 1.71 H new ATOM 0 HG SER B 5 19.396 6.716 -9.732 1.00 2.58 H new ATOM 1697 N LYS B 6 17.978 4.063 -7.367 1.00 1.03 N ATOM 1698 CA LYS B 6 17.398 4.627 -6.113 1.00 1.04 C ATOM 1699 C LYS B 6 16.698 3.517 -5.332 1.00 0.96 C ATOM 1700 O LYS B 6 16.830 3.414 -4.130 1.00 1.02 O ATOM 1701 CB LYS B 6 16.381 5.731 -6.457 1.00 1.37 C ATOM 1702 CG LYS B 6 15.259 5.774 -5.411 1.00 2.21 C ATOM 1703 CD LYS B 6 14.500 7.097 -5.537 1.00 2.52 C ATOM 1704 CE LYS B 6 13.016 6.864 -5.245 1.00 3.33 C ATOM 1705 NZ LYS B 6 12.868 6.225 -3.907 1.00 3.75 N ATOM 0 H LYS B 6 18.050 3.046 -7.392 1.00 1.03 H new ATOM 0 HA LYS B 6 18.198 5.052 -5.508 1.00 1.04 H new ATOM 0 HB2 LYS B 6 16.884 6.697 -6.499 1.00 1.37 H new ATOM 0 HB3 LYS B 6 15.958 5.549 -7.445 1.00 1.37 H new ATOM 0 HG2 LYS B 6 14.578 4.936 -5.557 1.00 2.21 H new ATOM 0 HG3 LYS B 6 15.676 5.675 -4.409 1.00 2.21 H new ATOM 0 HD2 LYS B 6 14.908 7.830 -4.841 1.00 2.52 H new ATOM 0 HD3 LYS B 6 14.624 7.506 -6.540 1.00 2.52 H new ATOM 0 HE2 LYS B 6 12.476 7.811 -5.270 1.00 3.33 H new ATOM 0 HE3 LYS B 6 12.578 6.228 -6.014 1.00 3.33 H new ATOM 0 HZ1 LYS B 6 11.899 6.370 -3.558 1.00 3.75 H new ATOM 0 HZ2 LYS B 6 13.059 5.206 -3.986 1.00 3.75 H new ATOM 0 HZ3 LYS B 6 13.543 6.653 -3.241 1.00 3.75 H new ATOM 1719 N LEU B 7 15.931 2.703 -6.002 1.00 0.91 N ATOM 1720 CA LEU B 7 15.193 1.618 -5.288 1.00 0.98 C ATOM 1721 C LEU B 7 15.959 0.290 -5.346 1.00 0.86 C ATOM 1722 O LEU B 7 16.377 -0.242 -4.336 1.00 0.86 O ATOM 1723 CB LEU B 7 13.823 1.430 -5.941 1.00 1.15 C ATOM 1724 CG LEU B 7 12.724 1.694 -4.909 1.00 1.40 C ATOM 1725 CD1 LEU B 7 11.356 1.601 -5.588 1.00 2.06 C ATOM 1726 CD2 LEU B 7 12.810 0.649 -3.794 1.00 1.70 C ATOM 0 H LEU B 7 15.782 2.740 -7.010 1.00 0.91 H new ATOM 0 HA LEU B 7 15.085 1.909 -4.243 1.00 0.98 H new ATOM 0 HB2 LEU B 7 13.715 2.111 -6.785 1.00 1.15 H new ATOM 0 HB3 LEU B 7 13.732 0.417 -6.334 1.00 1.15 H new ATOM 0 HG LEU B 7 12.854 2.690 -4.485 1.00 1.40 H new ATOM 0 HD11 LEU B 7 10.572 1.789 -4.854 1.00 2.06 H new ATOM 0 HD12 LEU B 7 11.294 2.343 -6.384 1.00 2.06 H new ATOM 0 HD13 LEU B 7 11.226 0.605 -6.010 1.00 2.06 H new ATOM 0 HD21 LEU B 7 12.028 0.836 -3.059 1.00 1.70 H new ATOM 0 HD22 LEU B 7 12.679 -0.347 -4.218 1.00 1.70 H new ATOM 0 HD23 LEU B 7 13.785 0.712 -3.311 1.00 1.70 H new ATOM 1738 N GLU B 8 16.112 -0.265 -6.515 1.00 0.85 N ATOM 1739 CA GLU B 8 16.811 -1.578 -6.620 1.00 0.91 C ATOM 1740 C GLU B 8 18.321 -1.406 -6.471 1.00 0.79 C ATOM 1741 O GLU B 8 18.896 -1.853 -5.509 1.00 0.74 O ATOM 1742 CB GLU B 8 16.510 -2.217 -7.975 1.00 1.08 C ATOM 1743 CG GLU B 8 17.242 -3.557 -8.077 1.00 1.20 C ATOM 1744 CD GLU B 8 16.719 -4.336 -9.285 1.00 1.47 C ATOM 1745 OE1 GLU B 8 15.730 -5.033 -9.133 1.00 2.06 O ATOM 1746 OE2 GLU B 8 17.319 -4.225 -10.341 1.00 1.97 O ATOM 0 H GLU B 8 15.786 0.129 -7.398 1.00 0.85 H new ATOM 0 HA GLU B 8 16.450 -2.220 -5.817 1.00 0.91 H new ATOM 0 HB2 GLU B 8 15.436 -2.367 -8.089 1.00 1.08 H new ATOM 0 HB3 GLU B 8 16.827 -1.555 -8.781 1.00 1.08 H new ATOM 0 HG2 GLU B 8 18.315 -3.390 -8.175 1.00 1.20 H new ATOM 0 HG3 GLU B 8 17.092 -4.135 -7.165 1.00 1.20 H new ATOM 1753 N ILE B 9 18.951 -0.755 -7.413 1.00 0.80 N ATOM 1754 CA ILE B 9 20.438 -0.572 -7.328 1.00 0.81 C ATOM 1755 C ILE B 9 20.810 -0.487 -5.845 1.00 0.71 C ATOM 1756 O ILE B 9 21.724 -1.134 -5.374 1.00 0.82 O ATOM 1757 CB ILE B 9 20.847 0.722 -8.048 1.00 0.85 C ATOM 1758 CG1 ILE B 9 21.213 0.401 -9.501 1.00 1.52 C ATOM 1759 CG2 ILE B 9 22.063 1.352 -7.358 1.00 1.50 C ATOM 1760 CD1 ILE B 9 20.055 -0.338 -10.171 1.00 1.88 C ATOM 0 H ILE B 9 18.508 -0.343 -8.234 1.00 0.80 H new ATOM 0 HA ILE B 9 20.955 -1.405 -7.804 1.00 0.81 H new ATOM 0 HB ILE B 9 20.012 1.421 -8.016 1.00 0.85 H new ATOM 0 HG12 ILE B 9 21.433 1.321 -10.043 1.00 1.52 H new ATOM 0 HG13 ILE B 9 22.115 -0.211 -9.533 1.00 1.52 H new ATOM 0 HG21 ILE B 9 22.342 2.268 -7.878 1.00 1.50 H new ATOM 0 HG22 ILE B 9 21.814 1.584 -6.323 1.00 1.50 H new ATOM 0 HG23 ILE B 9 22.898 0.652 -7.382 1.00 1.50 H new ATOM 0 HD11 ILE B 9 20.318 -0.565 -11.204 1.00 1.88 H new ATOM 0 HD12 ILE B 9 19.857 -1.266 -9.635 1.00 1.88 H new ATOM 0 HD13 ILE B 9 19.164 0.289 -10.153 1.00 1.88 H new ATOM 1772 N ILE B 10 20.068 0.288 -5.114 1.00 0.59 N ATOM 1773 CA ILE B 10 20.317 0.431 -3.650 1.00 0.59 C ATOM 1774 C ILE B 10 20.170 -0.935 -2.983 1.00 0.51 C ATOM 1775 O ILE B 10 21.083 -1.428 -2.350 1.00 0.54 O ATOM 1776 CB ILE B 10 19.333 1.445 -3.045 1.00 0.67 C ATOM 1777 CG1 ILE B 10 20.028 2.814 -2.998 1.00 0.85 C ATOM 1778 CG2 ILE B 10 18.924 1.017 -1.624 1.00 0.74 C ATOM 1779 CD1 ILE B 10 19.058 3.894 -2.515 1.00 1.31 C ATOM 0 H ILE B 10 19.287 0.839 -5.470 1.00 0.59 H new ATOM 0 HA ILE B 10 21.328 0.801 -3.481 1.00 0.59 H new ATOM 0 HB ILE B 10 18.431 1.496 -3.656 1.00 0.67 H new ATOM 0 HG12 ILE B 10 20.890 2.768 -2.332 1.00 0.85 H new ATOM 0 HG13 ILE B 10 20.404 3.071 -3.988 1.00 0.85 H new ATOM 0 HG21 ILE B 10 18.227 1.746 -1.211 1.00 0.74 H new ATOM 0 HG22 ILE B 10 18.445 0.039 -1.662 1.00 0.74 H new ATOM 0 HG23 ILE B 10 19.810 0.963 -0.991 1.00 0.74 H new ATOM 0 HD11 ILE B 10 19.569 4.856 -2.488 1.00 1.31 H new ATOM 0 HD12 ILE B 10 18.210 3.952 -3.197 1.00 1.31 H new ATOM 0 HD13 ILE B 10 18.703 3.644 -1.515 1.00 1.31 H new ATOM 1791 N GLN B 11 19.025 -1.548 -3.116 1.00 0.50 N ATOM 1792 CA GLN B 11 18.820 -2.881 -2.489 1.00 0.50 C ATOM 1793 C GLN B 11 20.024 -3.771 -2.796 1.00 0.52 C ATOM 1794 O GLN B 11 20.488 -4.516 -1.954 1.00 0.52 O ATOM 1795 CB GLN B 11 17.548 -3.518 -3.052 1.00 0.55 C ATOM 1796 CG GLN B 11 17.495 -4.996 -2.659 1.00 1.24 C ATOM 1797 CD GLN B 11 16.072 -5.526 -2.854 1.00 1.53 C ATOM 1798 OE1 GLN B 11 15.309 -5.614 -1.912 1.00 2.22 O ATOM 1799 NE2 GLN B 11 15.681 -5.884 -4.047 1.00 1.91 N ATOM 0 H GLN B 11 18.225 -1.182 -3.632 1.00 0.50 H new ATOM 0 HA GLN B 11 18.717 -2.769 -1.410 1.00 0.50 H new ATOM 0 HB2 GLN B 11 16.669 -2.998 -2.670 1.00 0.55 H new ATOM 0 HB3 GLN B 11 17.530 -3.419 -4.137 1.00 0.55 H new ATOM 0 HG2 GLN B 11 18.195 -5.570 -3.267 1.00 1.24 H new ATOM 0 HG3 GLN B 11 17.801 -5.118 -1.620 1.00 1.24 H new ATOM 0 HE21 GLN B 11 16.322 -5.810 -4.837 1.00 1.91 H new ATOM 0 HE22 GLN B 11 14.735 -6.238 -4.189 1.00 1.91 H new ATOM 1808 N ALA B 12 20.550 -3.688 -3.989 1.00 0.57 N ATOM 1809 CA ALA B 12 21.738 -4.515 -4.337 1.00 0.62 C ATOM 1810 C ALA B 12 22.930 -4.084 -3.477 1.00 0.57 C ATOM 1811 O ALA B 12 23.758 -4.890 -3.108 1.00 0.57 O ATOM 1812 CB ALA B 12 22.077 -4.330 -5.817 1.00 0.71 C ATOM 0 H ALA B 12 20.208 -3.083 -4.736 1.00 0.57 H new ATOM 0 HA ALA B 12 21.517 -5.565 -4.148 1.00 0.62 H new ATOM 0 HB1 ALA B 12 22.947 -4.936 -6.070 1.00 0.71 H new ATOM 0 HB2 ALA B 12 21.228 -4.641 -6.426 1.00 0.71 H new ATOM 0 HB3 ALA B 12 22.297 -3.280 -6.011 1.00 0.71 H new ATOM 1818 N ILE B 13 23.014 -2.821 -3.138 1.00 0.55 N ATOM 1819 CA ILE B 13 24.151 -2.366 -2.285 1.00 0.51 C ATOM 1820 C ILE B 13 23.956 -2.911 -0.868 1.00 0.44 C ATOM 1821 O ILE B 13 24.904 -3.249 -0.186 1.00 0.45 O ATOM 1822 CB ILE B 13 24.224 -0.833 -2.263 1.00 0.52 C ATOM 1823 CG1 ILE B 13 24.319 -0.329 -3.711 1.00 0.65 C ATOM 1824 CG2 ILE B 13 25.464 -0.383 -1.471 1.00 0.52 C ATOM 1825 CD1 ILE B 13 25.122 0.972 -3.786 1.00 0.84 C ATOM 0 H ILE B 13 22.352 -2.095 -3.412 1.00 0.55 H new ATOM 0 HA ILE B 13 25.088 -2.742 -2.695 1.00 0.51 H new ATOM 0 HB ILE B 13 23.335 -0.423 -1.784 1.00 0.52 H new ATOM 0 HG12 ILE B 13 24.791 -1.089 -4.334 1.00 0.65 H new ATOM 0 HG13 ILE B 13 23.318 -0.166 -4.110 1.00 0.65 H new ATOM 0 HG21 ILE B 13 25.512 0.706 -1.458 1.00 0.52 H new ATOM 0 HG22 ILE B 13 25.398 -0.756 -0.449 1.00 0.52 H new ATOM 0 HG23 ILE B 13 26.362 -0.780 -1.944 1.00 0.52 H new ATOM 0 HD11 ILE B 13 25.175 1.308 -4.822 1.00 0.84 H new ATOM 0 HD12 ILE B 13 24.634 1.736 -3.181 1.00 0.84 H new ATOM 0 HD13 ILE B 13 26.130 0.800 -3.409 1.00 0.84 H new ATOM 1837 N LEU B 14 22.736 -2.998 -0.419 1.00 0.45 N ATOM 1838 CA LEU B 14 22.478 -3.518 0.952 1.00 0.41 C ATOM 1839 C LEU B 14 22.761 -5.021 0.998 1.00 0.42 C ATOM 1840 O LEU B 14 23.369 -5.522 1.923 1.00 0.41 O ATOM 1841 CB LEU B 14 21.007 -3.280 1.302 1.00 0.45 C ATOM 1842 CG LEU B 14 20.908 -2.411 2.557 1.00 0.57 C ATOM 1843 CD1 LEU B 14 19.442 -2.058 2.818 1.00 0.54 C ATOM 1844 CD2 LEU B 14 21.465 -3.187 3.752 1.00 1.01 C ATOM 0 H LEU B 14 21.904 -2.730 -0.944 1.00 0.45 H new ATOM 0 HA LEU B 14 23.125 -3.005 1.663 1.00 0.41 H new ATOM 0 HB2 LEU B 14 20.500 -2.792 0.470 1.00 0.45 H new ATOM 0 HB3 LEU B 14 20.504 -4.233 1.467 1.00 0.45 H new ATOM 0 HG LEU B 14 21.482 -1.495 2.415 1.00 0.57 H new ATOM 0 HD11 LEU B 14 19.370 -1.439 3.712 1.00 0.54 H new ATOM 0 HD12 LEU B 14 19.042 -1.511 1.965 1.00 0.54 H new ATOM 0 HD13 LEU B 14 18.868 -2.973 2.963 1.00 0.54 H new ATOM 0 HD21 LEU B 14 21.397 -2.572 4.649 1.00 1.01 H new ATOM 0 HD22 LEU B 14 20.888 -4.101 3.894 1.00 1.01 H new ATOM 0 HD23 LEU B 14 22.508 -3.442 3.566 1.00 1.01 H new ATOM 1856 N GLU B 15 22.319 -5.740 0.008 1.00 0.47 N ATOM 1857 CA GLU B 15 22.552 -7.208 -0.008 1.00 0.52 C ATOM 1858 C GLU B 15 24.039 -7.508 -0.203 1.00 0.53 C ATOM 1859 O GLU B 15 24.547 -8.503 0.266 1.00 0.60 O ATOM 1860 CB GLU B 15 21.751 -7.849 -1.137 1.00 0.59 C ATOM 1861 CG GLU B 15 20.938 -9.010 -0.570 1.00 0.80 C ATOM 1862 CD GLU B 15 20.361 -9.842 -1.717 1.00 0.73 C ATOM 1863 OE1 GLU B 15 19.404 -9.392 -2.325 1.00 1.29 O ATOM 1864 OE2 GLU B 15 20.886 -10.914 -1.967 1.00 1.28 O ATOM 0 H GLU B 15 21.805 -5.374 -0.793 1.00 0.47 H new ATOM 0 HA GLU B 15 22.228 -7.622 0.947 1.00 0.52 H new ATOM 0 HB2 GLU B 15 21.089 -7.113 -1.594 1.00 0.59 H new ATOM 0 HB3 GLU B 15 22.421 -8.205 -1.920 1.00 0.59 H new ATOM 0 HG2 GLU B 15 21.569 -9.634 0.063 1.00 0.80 H new ATOM 0 HG3 GLU B 15 20.132 -8.630 0.058 1.00 0.80 H new ATOM 1871 N ALA B 16 24.745 -6.663 -0.890 1.00 0.49 N ATOM 1872 CA ALA B 16 26.189 -6.924 -1.087 1.00 0.52 C ATOM 1873 C ALA B 16 26.896 -6.694 0.237 1.00 0.50 C ATOM 1874 O ALA B 16 27.824 -7.391 0.592 1.00 0.54 O ATOM 1875 CB ALA B 16 26.758 -5.976 -2.139 1.00 0.53 C ATOM 0 H ALA B 16 24.388 -5.810 -1.320 1.00 0.49 H new ATOM 0 HA ALA B 16 26.337 -7.949 -1.428 1.00 0.52 H new ATOM 0 HB1 ALA B 16 27.820 -6.178 -2.274 1.00 0.53 H new ATOM 0 HB2 ALA B 16 26.237 -6.126 -3.084 1.00 0.53 H new ATOM 0 HB3 ALA B 16 26.624 -4.945 -1.811 1.00 0.53 H new ATOM 1881 N CYS B 17 26.469 -5.706 0.968 1.00 0.46 N ATOM 1882 CA CYS B 17 27.118 -5.409 2.259 1.00 0.46 C ATOM 1883 C CYS B 17 26.647 -6.397 3.339 1.00 0.47 C ATOM 1884 O CYS B 17 27.244 -6.516 4.384 1.00 0.49 O ATOM 1885 CB CYS B 17 26.770 -3.981 2.660 1.00 0.42 C ATOM 1886 SG CYS B 17 25.070 -3.912 3.272 1.00 0.42 S ATOM 0 H CYS B 17 25.694 -5.091 0.720 1.00 0.46 H new ATOM 0 HA CYS B 17 28.198 -5.513 2.159 1.00 0.46 H new ATOM 0 HB2 CYS B 17 27.458 -3.632 3.430 1.00 0.42 H new ATOM 0 HB3 CYS B 17 26.885 -3.315 1.805 1.00 0.42 H new ATOM 0 HG CYS B 17 24.366 -4.844 2.702 1.00 0.42 H new ATOM 1892 N LYS B 18 25.576 -7.101 3.108 1.00 0.49 N ATOM 1893 CA LYS B 18 25.080 -8.067 4.136 1.00 0.51 C ATOM 1894 C LYS B 18 26.229 -8.991 4.613 1.00 0.55 C ATOM 1895 O LYS B 18 26.050 -9.808 5.492 1.00 0.58 O ATOM 1896 CB LYS B 18 23.891 -8.849 3.525 1.00 0.56 C ATOM 1897 CG LYS B 18 23.826 -10.310 4.001 1.00 1.18 C ATOM 1898 CD LYS B 18 24.907 -11.149 3.305 1.00 1.89 C ATOM 1899 CE LYS B 18 24.240 -12.247 2.474 1.00 2.29 C ATOM 1900 NZ LYS B 18 25.285 -13.044 1.771 1.00 2.90 N ATOM 0 H LYS B 18 25.020 -7.052 2.254 1.00 0.49 H new ATOM 0 HA LYS B 18 24.729 -7.544 5.026 1.00 0.51 H new ATOM 0 HB2 LYS B 18 22.960 -8.346 3.785 1.00 0.56 H new ATOM 0 HB3 LYS B 18 23.970 -8.830 2.438 1.00 0.56 H new ATOM 0 HG2 LYS B 18 23.963 -10.353 5.082 1.00 1.18 H new ATOM 0 HG3 LYS B 18 22.841 -10.725 3.787 1.00 1.18 H new ATOM 0 HD2 LYS B 18 25.520 -10.514 2.665 1.00 1.89 H new ATOM 0 HD3 LYS B 18 25.573 -11.592 4.046 1.00 1.89 H new ATOM 0 HE2 LYS B 18 23.646 -12.895 3.118 1.00 2.29 H new ATOM 0 HE3 LYS B 18 23.556 -11.805 1.749 1.00 2.29 H new ATOM 0 HZ1 LYS B 18 24.831 -13.790 1.206 1.00 2.90 H new ATOM 0 HZ2 LYS B 18 25.834 -12.421 1.145 1.00 2.90 H new ATOM 0 HZ3 LYS B 18 25.920 -13.478 2.471 1.00 2.90 H new ATOM 1914 N SER B 19 27.420 -8.868 4.072 1.00 0.57 N ATOM 1915 CA SER B 19 28.525 -9.758 4.547 1.00 0.63 C ATOM 1916 C SER B 19 29.901 -9.117 4.285 1.00 0.66 C ATOM 1917 O SER B 19 30.888 -9.801 4.097 1.00 0.84 O ATOM 1918 CB SER B 19 28.428 -11.107 3.820 1.00 0.70 C ATOM 1919 OG SER B 19 27.792 -10.918 2.563 1.00 0.93 O ATOM 0 H SER B 19 27.670 -8.205 3.338 1.00 0.57 H new ATOM 0 HA SER B 19 28.423 -9.906 5.622 1.00 0.63 H new ATOM 0 HB2 SER B 19 29.423 -11.529 3.677 1.00 0.70 H new ATOM 0 HB3 SER B 19 27.864 -11.818 4.423 1.00 0.70 H new ATOM 0 HG SER B 19 27.730 -11.777 2.095 1.00 0.93 H new ATOM 1925 N GLY B 20 29.985 -7.814 4.293 1.00 0.65 N ATOM 1926 CA GLY B 20 31.309 -7.156 4.063 1.00 0.66 C ATOM 1927 C GLY B 20 31.770 -7.423 2.631 1.00 0.70 C ATOM 1928 O GLY B 20 32.164 -8.522 2.297 1.00 0.77 O ATOM 0 H GLY B 20 29.202 -7.179 4.447 1.00 0.65 H new ATOM 0 HA2 GLY B 20 31.228 -6.083 4.236 1.00 0.66 H new ATOM 0 HA3 GLY B 20 32.045 -7.539 4.770 1.00 0.66 H new ATOM 1932 N SER B 21 31.692 -6.444 1.766 1.00 0.67 N ATOM 1933 CA SER B 21 32.096 -6.691 0.352 1.00 0.74 C ATOM 1934 C SER B 21 32.556 -5.377 -0.309 1.00 0.72 C ATOM 1935 O SER B 21 31.841 -4.397 -0.271 1.00 0.63 O ATOM 1936 CB SER B 21 30.882 -7.223 -0.402 1.00 0.74 C ATOM 1937 OG SER B 21 30.086 -7.993 0.488 1.00 0.72 O ATOM 0 H SER B 21 31.371 -5.499 1.974 1.00 0.67 H new ATOM 0 HA SER B 21 32.918 -7.407 0.325 1.00 0.74 H new ATOM 0 HB2 SER B 21 30.300 -6.396 -0.809 1.00 0.74 H new ATOM 0 HB3 SER B 21 31.201 -7.834 -1.246 1.00 0.74 H new ATOM 0 HG SER B 21 29.272 -7.496 0.712 1.00 0.72 H new ATOM 1943 N PRO B 22 33.726 -5.341 -0.925 1.00 0.82 N ATOM 1944 CA PRO B 22 34.222 -4.107 -1.597 1.00 0.83 C ATOM 1945 C PRO B 22 33.158 -3.480 -2.495 1.00 0.81 C ATOM 1946 O PRO B 22 32.206 -4.126 -2.887 1.00 0.80 O ATOM 1947 CB PRO B 22 35.405 -4.575 -2.447 1.00 0.93 C ATOM 1948 CG PRO B 22 35.845 -5.883 -1.882 1.00 1.08 C ATOM 1949 CD PRO B 22 34.692 -6.450 -1.049 1.00 0.95 C ATOM 0 HA PRO B 22 34.492 -3.344 -0.867 1.00 0.83 H new ATOM 0 HB2 PRO B 22 35.113 -4.683 -3.492 1.00 0.93 H new ATOM 0 HB3 PRO B 22 36.216 -3.847 -2.416 1.00 0.93 H new ATOM 0 HG2 PRO B 22 36.113 -6.573 -2.682 1.00 1.08 H new ATOM 0 HG3 PRO B 22 36.733 -5.752 -1.264 1.00 1.08 H new ATOM 0 HD2 PRO B 22 34.240 -7.314 -1.537 1.00 0.95 H new ATOM 0 HD3 PRO B 22 35.039 -6.782 -0.070 1.00 0.95 H new ATOM 1957 N LYS B 23 33.315 -2.233 -2.836 1.00 0.80 N ATOM 1958 CA LYS B 23 32.315 -1.578 -3.719 1.00 0.80 C ATOM 1959 C LYS B 23 32.276 -2.326 -5.058 1.00 0.79 C ATOM 1960 O LYS B 23 31.265 -2.362 -5.729 1.00 0.79 O ATOM 1961 CB LYS B 23 32.716 -0.112 -3.940 1.00 0.82 C ATOM 1962 CG LYS B 23 31.784 0.543 -4.966 1.00 0.78 C ATOM 1963 CD LYS B 23 32.507 0.646 -6.311 1.00 1.42 C ATOM 1964 CE LYS B 23 33.510 1.801 -6.269 1.00 1.27 C ATOM 1965 NZ LYS B 23 32.947 2.976 -6.995 1.00 1.83 N ATOM 0 H LYS B 23 34.091 -1.640 -2.542 1.00 0.80 H new ATOM 0 HA LYS B 23 31.327 -1.607 -3.260 1.00 0.80 H new ATOM 0 HB2 LYS B 23 32.669 0.432 -2.996 1.00 0.82 H new ATOM 0 HB3 LYS B 23 33.747 -0.058 -4.288 1.00 0.82 H new ATOM 0 HG2 LYS B 23 30.872 -0.045 -5.074 1.00 0.78 H new ATOM 0 HG3 LYS B 23 31.486 1.534 -4.623 1.00 0.78 H new ATOM 0 HD2 LYS B 23 33.023 -0.289 -6.530 1.00 1.42 H new ATOM 0 HD3 LYS B 23 31.785 0.807 -7.112 1.00 1.42 H new ATOM 0 HE2 LYS B 23 33.729 2.069 -5.235 1.00 1.27 H new ATOM 0 HE3 LYS B 23 34.452 1.496 -6.725 1.00 1.27 H new ATOM 0 HZ1 LYS B 23 33.545 3.196 -7.817 1.00 1.83 H new ATOM 0 HZ2 LYS B 23 31.983 2.756 -7.317 1.00 1.83 H new ATOM 0 HZ3 LYS B 23 32.919 3.797 -6.358 1.00 1.83 H new ATOM 1979 N THR B 24 33.371 -2.933 -5.449 1.00 0.79 N ATOM 1980 CA THR B 24 33.406 -3.693 -6.735 1.00 0.79 C ATOM 1981 C THR B 24 32.519 -4.946 -6.663 1.00 0.82 C ATOM 1982 O THR B 24 31.808 -5.266 -7.594 1.00 0.84 O ATOM 1983 CB THR B 24 34.848 -4.119 -7.026 1.00 0.78 C ATOM 1984 OG1 THR B 24 35.296 -4.997 -6.002 1.00 0.85 O ATOM 1985 CG2 THR B 24 35.751 -2.886 -7.074 1.00 0.82 C ATOM 0 H THR B 24 34.247 -2.933 -4.927 1.00 0.79 H new ATOM 0 HA THR B 24 33.029 -3.047 -7.528 1.00 0.79 H new ATOM 0 HB THR B 24 34.887 -4.630 -7.988 1.00 0.78 H new ATOM 0 HG1 THR B 24 36.218 -5.272 -6.187 1.00 0.85 H new ATOM 0 HG21 THR B 24 36.776 -3.194 -7.281 1.00 0.82 H new ATOM 0 HG22 THR B 24 35.408 -2.214 -7.861 1.00 0.82 H new ATOM 0 HG23 THR B 24 35.714 -2.370 -6.114 1.00 0.82 H new ATOM 1993 N ARG B 25 32.565 -5.665 -5.569 1.00 0.84 N ATOM 1994 CA ARG B 25 31.739 -6.906 -5.438 1.00 0.89 C ATOM 1995 C ARG B 25 30.257 -6.546 -5.561 1.00 0.90 C ATOM 1996 O ARG B 25 29.391 -7.398 -5.589 1.00 0.96 O ATOM 1997 CB ARG B 25 32.003 -7.521 -4.054 1.00 0.90 C ATOM 1998 CG ARG B 25 32.582 -8.935 -4.186 1.00 1.33 C ATOM 1999 CD ARG B 25 31.468 -9.913 -4.563 1.00 1.07 C ATOM 2000 NE ARG B 25 32.060 -11.255 -4.831 1.00 1.67 N ATOM 2001 CZ ARG B 25 31.284 -12.278 -5.060 1.00 2.00 C ATOM 2002 NH1 ARG B 25 29.988 -12.132 -5.048 1.00 2.14 N ATOM 2003 NH2 ARG B 25 31.807 -13.451 -5.299 1.00 2.74 N ATOM 0 H ARG B 25 33.142 -5.445 -4.757 1.00 0.84 H new ATOM 0 HA ARG B 25 32.001 -7.617 -6.222 1.00 0.89 H new ATOM 0 HB2 ARG B 25 32.696 -6.890 -3.497 1.00 0.90 H new ATOM 0 HB3 ARG B 25 31.075 -7.555 -3.484 1.00 0.90 H new ATOM 0 HG2 ARG B 25 33.364 -8.949 -4.945 1.00 1.33 H new ATOM 0 HG3 ARG B 25 33.044 -9.239 -3.247 1.00 1.33 H new ATOM 0 HD2 ARG B 25 30.738 -9.979 -3.756 1.00 1.07 H new ATOM 0 HD3 ARG B 25 30.937 -9.555 -5.445 1.00 1.07 H new ATOM 0 HE ARG B 25 33.073 -11.373 -4.835 1.00 1.67 H new ATOM 0 HH11 ARG B 25 29.580 -11.217 -4.859 1.00 2.14 H new ATOM 0 HH12 ARG B 25 29.383 -12.933 -5.227 1.00 2.14 H new ATOM 0 HH21 ARG B 25 32.821 -13.566 -5.306 1.00 2.74 H new ATOM 0 HH22 ARG B 25 31.202 -14.252 -5.478 1.00 2.74 H new ATOM 2017 N ILE B 26 29.980 -5.282 -5.636 1.00 0.86 N ATOM 2018 CA ILE B 26 28.573 -4.841 -5.754 1.00 0.89 C ATOM 2019 C ILE B 26 28.186 -4.798 -7.238 1.00 0.93 C ATOM 2020 O ILE B 26 27.023 -4.767 -7.591 1.00 0.96 O ATOM 2021 CB ILE B 26 28.420 -3.503 -5.032 1.00 0.86 C ATOM 2022 CG1 ILE B 26 29.019 -3.684 -3.626 1.00 0.92 C ATOM 2023 CG2 ILE B 26 26.940 -3.130 -4.947 1.00 0.90 C ATOM 2024 CD1 ILE B 26 28.405 -2.706 -2.618 1.00 0.62 C ATOM 0 H ILE B 26 30.671 -4.532 -5.621 1.00 0.86 H new ATOM 0 HA ILE B 26 27.884 -5.538 -5.277 1.00 0.89 H new ATOM 0 HB ILE B 26 28.932 -2.701 -5.564 1.00 0.86 H new ATOM 0 HG12 ILE B 26 28.852 -4.707 -3.288 1.00 0.92 H new ATOM 0 HG13 ILE B 26 30.098 -3.534 -3.668 1.00 0.92 H new ATOM 0 HG21 ILE B 26 26.834 -2.175 -4.432 1.00 0.90 H new ATOM 0 HG22 ILE B 26 26.527 -3.047 -5.952 1.00 0.90 H new ATOM 0 HG23 ILE B 26 26.401 -3.901 -4.396 1.00 0.90 H new ATOM 0 HD11 ILE B 26 28.854 -2.865 -1.637 1.00 0.62 H new ATOM 0 HD12 ILE B 26 28.594 -1.683 -2.942 1.00 0.62 H new ATOM 0 HD13 ILE B 26 27.330 -2.874 -2.557 1.00 0.62 H new ATOM 2036 N MET B 27 29.159 -4.858 -8.113 1.00 0.94 N ATOM 2037 CA MET B 27 28.856 -4.887 -9.576 1.00 0.99 C ATOM 2038 C MET B 27 28.174 -6.214 -9.888 1.00 1.06 C ATOM 2039 O MET B 27 27.217 -6.274 -10.632 1.00 1.10 O ATOM 2040 CB MET B 27 30.153 -4.720 -10.368 1.00 0.98 C ATOM 2041 CG MET B 27 29.873 -4.670 -11.870 1.00 1.55 C ATOM 2042 SD MET B 27 31.398 -5.048 -12.775 1.00 1.89 S ATOM 2043 CE MET B 27 32.354 -3.595 -12.269 1.00 1.25 C ATOM 0 H MET B 27 30.151 -4.888 -7.876 1.00 0.94 H new ATOM 0 HA MET B 27 28.192 -4.070 -9.858 1.00 0.99 H new ATOM 0 HB2 MET B 27 30.658 -3.805 -10.058 1.00 0.98 H new ATOM 0 HB3 MET B 27 30.828 -5.547 -10.147 1.00 0.98 H new ATOM 0 HG2 MET B 27 29.094 -5.387 -12.131 1.00 1.55 H new ATOM 0 HG3 MET B 27 29.505 -3.683 -12.151 1.00 1.55 H new ATOM 0 HE1 MET B 27 33.224 -3.488 -12.917 1.00 1.25 H new ATOM 0 HE2 MET B 27 31.731 -2.704 -12.349 1.00 1.25 H new ATOM 0 HE3 MET B 27 32.683 -3.717 -11.237 1.00 1.25 H new ATOM 2053 N TYR B 28 28.635 -7.281 -9.296 1.00 1.07 N ATOM 2054 CA TYR B 28 27.981 -8.597 -9.534 1.00 1.14 C ATOM 2055 C TYR B 28 26.473 -8.430 -9.316 1.00 1.09 C ATOM 2056 O TYR B 28 25.677 -9.273 -9.679 1.00 1.20 O ATOM 2057 CB TYR B 28 28.539 -9.621 -8.543 1.00 1.17 C ATOM 2058 CG TYR B 28 28.085 -11.007 -8.931 1.00 1.43 C ATOM 2059 CD1 TYR B 28 28.661 -11.650 -10.033 1.00 1.71 C ATOM 2060 CD2 TYR B 28 27.089 -11.648 -8.187 1.00 2.20 C ATOM 2061 CE1 TYR B 28 28.241 -12.938 -10.389 1.00 1.98 C ATOM 2062 CE2 TYR B 28 26.667 -12.934 -8.544 1.00 2.58 C ATOM 2063 CZ TYR B 28 27.244 -13.580 -9.645 1.00 2.21 C ATOM 2064 OH TYR B 28 26.830 -14.848 -9.995 1.00 2.65 O ATOM 0 H TYR B 28 29.433 -7.298 -8.661 1.00 1.07 H new ATOM 0 HA TYR B 28 28.173 -8.943 -10.549 1.00 1.14 H new ATOM 0 HB2 TYR B 28 29.628 -9.575 -8.532 1.00 1.17 H new ATOM 0 HB3 TYR B 28 28.200 -9.386 -7.534 1.00 1.17 H new ATOM 0 HD1 TYR B 28 29.428 -11.153 -10.608 1.00 1.71 H new ATOM 0 HD2 TYR B 28 26.646 -11.151 -7.337 1.00 2.20 H new ATOM 0 HE1 TYR B 28 28.686 -13.436 -11.238 1.00 1.98 H new ATOM 0 HE2 TYR B 28 25.897 -13.428 -7.971 1.00 2.58 H new ATOM 0 HH TYR B 28 26.133 -15.147 -9.375 1.00 2.65 H new ATOM 2074 N GLY B 29 26.086 -7.319 -8.749 1.00 1.05 N ATOM 2075 CA GLY B 29 24.642 -7.039 -8.523 1.00 1.02 C ATOM 2076 C GLY B 29 24.123 -6.173 -9.675 1.00 1.05 C ATOM 2077 O GLY B 29 22.972 -6.248 -10.055 1.00 1.10 O ATOM 0 H GLY B 29 26.719 -6.585 -8.429 1.00 1.05 H new ATOM 0 HA2 GLY B 29 24.080 -7.972 -8.469 1.00 1.02 H new ATOM 0 HA3 GLY B 29 24.501 -6.526 -7.572 1.00 1.02 H new ATOM 2081 N ALA B 30 24.974 -5.348 -10.235 1.00 1.06 N ATOM 2082 CA ALA B 30 24.543 -4.471 -11.364 1.00 1.10 C ATOM 2083 C ALA B 30 25.782 -3.923 -12.088 1.00 1.16 C ATOM 2084 O ALA B 30 26.900 -4.245 -11.753 1.00 1.24 O ATOM 2085 CB ALA B 30 23.709 -3.307 -10.821 1.00 1.13 C ATOM 0 H ALA B 30 25.950 -5.245 -9.957 1.00 1.06 H new ATOM 0 HA ALA B 30 23.940 -5.050 -12.064 1.00 1.10 H new ATOM 0 HB1 ALA B 30 23.395 -2.668 -11.646 1.00 1.13 H new ATOM 0 HB2 ALA B 30 22.829 -3.697 -10.310 1.00 1.13 H new ATOM 0 HB3 ALA B 30 24.308 -2.726 -10.120 1.00 1.13 H new ATOM 2091 N ASN B 31 25.593 -3.097 -13.080 1.00 1.19 N ATOM 2092 CA ASN B 31 26.766 -2.532 -13.816 1.00 1.26 C ATOM 2093 C ASN B 31 27.410 -1.428 -12.966 1.00 1.28 C ATOM 2094 O ASN B 31 27.986 -0.491 -13.481 1.00 1.73 O ATOM 2095 CB ASN B 31 26.283 -1.943 -15.147 1.00 1.34 C ATOM 2096 CG ASN B 31 27.157 -2.465 -16.290 1.00 1.68 C ATOM 2097 OD1 ASN B 31 28.088 -1.806 -16.708 1.00 2.40 O ATOM 2098 ND2 ASN B 31 26.893 -3.630 -16.817 1.00 1.85 N ATOM 0 H ASN B 31 24.680 -2.788 -13.414 1.00 1.19 H new ATOM 0 HA ASN B 31 27.500 -3.315 -14.008 1.00 1.26 H new ATOM 0 HB2 ASN B 31 25.242 -2.215 -15.319 1.00 1.34 H new ATOM 0 HB3 ASN B 31 26.327 -0.854 -15.111 1.00 1.34 H new ATOM 0 HD21 ASN B 31 27.469 -3.987 -17.580 1.00 1.85 H new ATOM 0 HD22 ASN B 31 26.111 -4.183 -16.466 1.00 1.85 H new ATOM 2105 N LEU B 32 27.300 -1.545 -11.666 1.00 1.11 N ATOM 2106 CA LEU B 32 27.872 -0.526 -10.735 1.00 1.05 C ATOM 2107 C LEU B 32 27.802 0.881 -11.317 1.00 1.03 C ATOM 2108 O LEU B 32 28.661 1.320 -12.054 1.00 1.08 O ATOM 2109 CB LEU B 32 29.323 -0.859 -10.386 1.00 1.08 C ATOM 2110 CG LEU B 32 29.587 -0.739 -8.865 1.00 1.11 C ATOM 2111 CD1 LEU B 32 29.258 0.663 -8.319 1.00 1.07 C ATOM 2112 CD2 LEU B 32 28.773 -1.773 -8.088 1.00 1.16 C ATOM 0 H LEU B 32 26.827 -2.321 -11.202 1.00 1.11 H new ATOM 0 HA LEU B 32 27.266 -0.553 -9.830 1.00 1.05 H new ATOM 0 HB2 LEU B 32 29.554 -1.872 -10.717 1.00 1.08 H new ATOM 0 HB3 LEU B 32 29.991 -0.187 -10.926 1.00 1.08 H new ATOM 0 HG LEU B 32 30.653 -0.921 -8.726 1.00 1.11 H new ATOM 0 HD11 LEU B 32 29.461 0.693 -7.248 1.00 1.07 H new ATOM 0 HD12 LEU B 32 29.875 1.405 -8.826 1.00 1.07 H new ATOM 0 HD13 LEU B 32 28.205 0.884 -8.495 1.00 1.07 H new ATOM 0 HD21 LEU B 32 28.975 -1.669 -7.022 1.00 1.16 H new ATOM 0 HD22 LEU B 32 27.711 -1.614 -8.273 1.00 1.16 H new ATOM 0 HD23 LEU B 32 29.052 -2.775 -8.414 1.00 1.16 H new ATOM 2124 N SER B 33 26.808 1.607 -10.931 1.00 0.99 N ATOM 2125 CA SER B 33 26.662 3.020 -11.361 1.00 1.01 C ATOM 2126 C SER B 33 27.875 3.812 -10.835 1.00 0.96 C ATOM 2127 O SER B 33 27.841 5.014 -10.774 1.00 0.96 O ATOM 2128 CB SER B 33 25.356 3.599 -10.812 1.00 0.99 C ATOM 2129 OG SER B 33 24.639 4.221 -11.871 1.00 1.33 O ATOM 0 H SER B 33 26.065 1.275 -10.316 1.00 0.99 H new ATOM 0 HA SER B 33 26.627 3.086 -12.448 1.00 1.01 H new ATOM 0 HB2 SER B 33 24.754 2.809 -10.364 1.00 0.99 H new ATOM 0 HB3 SER B 33 25.568 4.323 -10.025 1.00 0.99 H new ATOM 0 HG SER B 33 23.801 4.592 -11.525 1.00 1.33 H new ATOM 2135 N TYR B 34 28.897 3.113 -10.366 1.00 0.95 N ATOM 2136 CA TYR B 34 30.105 3.743 -9.718 1.00 0.94 C ATOM 2137 C TYR B 34 30.272 5.216 -10.062 1.00 0.96 C ATOM 2138 O TYR B 34 30.524 6.013 -9.180 1.00 0.89 O ATOM 2139 CB TYR B 34 31.359 3.018 -10.212 1.00 1.10 C ATOM 2140 CG TYR B 34 31.823 3.617 -11.520 1.00 1.01 C ATOM 2141 CD1 TYR B 34 32.699 4.709 -11.520 1.00 1.77 C ATOM 2142 CD2 TYR B 34 31.375 3.081 -12.734 1.00 1.81 C ATOM 2143 CE1 TYR B 34 33.126 5.264 -12.733 1.00 2.53 C ATOM 2144 CE2 TYR B 34 31.801 3.636 -13.945 1.00 2.56 C ATOM 2145 CZ TYR B 34 32.677 4.728 -13.945 1.00 2.75 C ATOM 2146 OH TYR B 34 33.097 5.274 -15.140 1.00 3.76 O ATOM 0 H TYR B 34 28.941 2.095 -10.409 1.00 0.95 H new ATOM 0 HA TYR B 34 29.964 3.659 -8.641 1.00 0.94 H new ATOM 0 HB2 TYR B 34 32.151 3.095 -9.467 1.00 1.10 H new ATOM 0 HB3 TYR B 34 31.147 1.957 -10.344 1.00 1.10 H new ATOM 0 HD1 TYR B 34 33.045 5.123 -10.585 1.00 1.77 H new ATOM 0 HD2 TYR B 34 30.700 2.238 -12.735 1.00 1.81 H new ATOM 0 HE1 TYR B 34 33.802 6.106 -12.733 1.00 2.53 H new ATOM 0 HE2 TYR B 34 31.454 3.222 -14.880 1.00 2.56 H new ATOM 0 HH TYR B 34 32.692 4.782 -15.885 1.00 3.76 H new ATOM 2156 N ALA B 35 30.128 5.619 -11.281 1.00 1.07 N ATOM 2157 CA ALA B 35 30.271 7.068 -11.540 1.00 1.15 C ATOM 2158 C ALA B 35 29.290 7.778 -10.607 1.00 1.05 C ATOM 2159 O ALA B 35 29.625 8.718 -9.915 1.00 1.03 O ATOM 2160 CB ALA B 35 29.924 7.375 -12.998 1.00 1.30 C ATOM 0 H ALA B 35 29.924 5.031 -12.089 1.00 1.07 H new ATOM 0 HA ALA B 35 31.293 7.401 -11.362 1.00 1.15 H new ATOM 0 HB1 ALA B 35 30.032 8.444 -13.180 1.00 1.30 H new ATOM 0 HB2 ALA B 35 30.597 6.825 -13.656 1.00 1.30 H new ATOM 0 HB3 ALA B 35 28.895 7.075 -13.198 1.00 1.30 H new ATOM 2166 N LEU B 36 28.081 7.294 -10.579 1.00 1.02 N ATOM 2167 CA LEU B 36 27.032 7.874 -9.690 1.00 0.96 C ATOM 2168 C LEU B 36 26.861 7.046 -8.399 1.00 0.83 C ATOM 2169 O LEU B 36 26.755 7.584 -7.315 1.00 0.79 O ATOM 2170 CB LEU B 36 25.701 7.914 -10.445 1.00 1.03 C ATOM 2171 CG LEU B 36 25.205 9.359 -10.530 1.00 1.16 C ATOM 2172 CD1 LEU B 36 23.917 9.409 -11.353 1.00 1.74 C ATOM 2173 CD2 LEU B 36 24.927 9.885 -9.120 1.00 1.99 C ATOM 0 H LEU B 36 27.768 6.505 -11.145 1.00 1.02 H new ATOM 0 HA LEU B 36 27.342 8.880 -9.408 1.00 0.96 H new ATOM 0 HB2 LEU B 36 25.826 7.502 -11.446 1.00 1.03 H new ATOM 0 HB3 LEU B 36 24.963 7.294 -9.935 1.00 1.03 H new ATOM 0 HG LEU B 36 25.966 9.977 -11.007 1.00 1.16 H new ATOM 0 HD11 LEU B 36 23.564 10.438 -11.414 1.00 1.74 H new ATOM 0 HD12 LEU B 36 24.112 9.033 -12.357 1.00 1.74 H new ATOM 0 HD13 LEU B 36 23.156 8.792 -10.876 1.00 1.74 H new ATOM 0 HD21 LEU B 36 24.574 10.914 -9.179 1.00 1.99 H new ATOM 0 HD22 LEU B 36 24.166 9.267 -8.644 1.00 1.99 H new ATOM 0 HD23 LEU B 36 25.843 9.849 -8.531 1.00 1.99 H new ATOM 2185 N THR B 37 26.769 5.739 -8.529 1.00 0.80 N ATOM 2186 CA THR B 37 26.529 4.850 -7.338 1.00 0.71 C ATOM 2187 C THR B 37 27.296 5.332 -6.111 1.00 0.66 C ATOM 2188 O THR B 37 26.748 5.376 -5.033 1.00 0.61 O ATOM 2189 CB THR B 37 26.929 3.406 -7.650 1.00 0.80 C ATOM 2190 OG1 THR B 37 25.865 2.757 -8.328 1.00 0.93 O ATOM 2191 CG2 THR B 37 27.228 2.655 -6.348 1.00 0.81 C ATOM 0 H THR B 37 26.851 5.245 -9.418 1.00 0.80 H new ATOM 0 HA THR B 37 25.462 4.893 -7.118 1.00 0.71 H new ATOM 0 HB THR B 37 27.820 3.410 -8.278 1.00 0.80 H new ATOM 0 HG1 THR B 37 26.053 1.797 -8.388 1.00 0.93 H new ATOM 0 HG21 THR B 37 27.512 1.628 -6.577 1.00 0.81 H new ATOM 0 HG22 THR B 37 28.045 3.149 -5.823 1.00 0.81 H new ATOM 0 HG23 THR B 37 26.339 2.653 -5.717 1.00 0.81 H new ATOM 2199 N GLY B 38 28.548 5.671 -6.250 1.00 0.69 N ATOM 2200 CA GLY B 38 29.319 6.143 -5.055 1.00 0.68 C ATOM 2201 C GLY B 38 28.421 7.079 -4.237 1.00 0.65 C ATOM 2202 O GLY B 38 28.553 7.213 -3.035 1.00 0.64 O ATOM 0 H GLY B 38 29.069 5.644 -7.126 1.00 0.69 H new ATOM 0 HA2 GLY B 38 29.635 5.294 -4.448 1.00 0.68 H new ATOM 0 HA3 GLY B 38 30.223 6.664 -5.369 1.00 0.68 H new ATOM 2206 N ARG B 39 27.493 7.708 -4.904 1.00 0.67 N ATOM 2207 CA ARG B 39 26.537 8.635 -4.231 1.00 0.69 C ATOM 2208 C ARG B 39 25.536 7.837 -3.381 1.00 0.64 C ATOM 2209 O ARG B 39 25.084 8.293 -2.349 1.00 0.64 O ATOM 2210 CB ARG B 39 25.778 9.411 -5.312 1.00 0.76 C ATOM 2211 CG ARG B 39 24.877 10.477 -4.678 1.00 0.80 C ATOM 2212 CD ARG B 39 23.532 10.499 -5.411 1.00 0.82 C ATOM 2213 NE ARG B 39 22.699 11.619 -4.890 1.00 1.17 N ATOM 2214 CZ ARG B 39 21.468 11.761 -5.301 1.00 1.79 C ATOM 2215 NH1 ARG B 39 20.969 10.924 -6.169 1.00 2.44 N ATOM 2216 NH2 ARG B 39 20.736 12.742 -4.846 1.00 2.34 N ATOM 0 H ARG B 39 27.354 7.617 -5.910 1.00 0.67 H new ATOM 0 HA ARG B 39 27.083 9.318 -3.580 1.00 0.69 H new ATOM 0 HB2 ARG B 39 26.486 9.883 -5.993 1.00 0.76 H new ATOM 0 HB3 ARG B 39 25.175 8.724 -5.905 1.00 0.76 H new ATOM 0 HG2 ARG B 39 24.725 10.260 -3.621 1.00 0.80 H new ATOM 0 HG3 ARG B 39 25.353 11.456 -4.738 1.00 0.80 H new ATOM 0 HD2 ARG B 39 23.692 10.619 -6.483 1.00 0.82 H new ATOM 0 HD3 ARG B 39 23.014 9.550 -5.270 1.00 0.82 H new ATOM 0 HE ARG B 39 23.090 12.274 -4.213 1.00 1.17 H new ATOM 0 HH11 ARG B 39 21.541 10.159 -6.526 1.00 2.44 H new ATOM 0 HH12 ARG B 39 20.007 11.035 -6.490 1.00 2.44 H new ATOM 0 HH21 ARG B 39 21.126 13.398 -4.169 1.00 2.34 H new ATOM 0 HH22 ARG B 39 19.774 12.852 -5.168 1.00 2.34 H new ATOM 2230 N TYR B 40 25.186 6.653 -3.806 1.00 0.60 N ATOM 2231 CA TYR B 40 24.213 5.841 -3.019 1.00 0.56 C ATOM 2232 C TYR B 40 24.927 5.170 -1.850 1.00 0.48 C ATOM 2233 O TYR B 40 24.393 5.069 -0.764 1.00 0.47 O ATOM 2234 CB TYR B 40 23.547 4.796 -3.922 1.00 0.58 C ATOM 2235 CG TYR B 40 22.373 5.450 -4.613 1.00 0.81 C ATOM 2236 CD1 TYR B 40 21.264 5.861 -3.862 1.00 1.51 C ATOM 2237 CD2 TYR B 40 22.399 5.667 -5.996 1.00 1.61 C ATOM 2238 CE1 TYR B 40 20.183 6.486 -4.493 1.00 1.79 C ATOM 2239 CE2 TYR B 40 21.319 6.295 -6.626 1.00 1.88 C ATOM 2240 CZ TYR B 40 20.210 6.704 -5.874 1.00 1.59 C ATOM 2241 OH TYR B 40 19.148 7.329 -6.493 1.00 2.01 O ATOM 0 H TYR B 40 25.530 6.214 -4.660 1.00 0.60 H new ATOM 0 HA TYR B 40 23.436 6.495 -2.622 1.00 0.56 H new ATOM 0 HB2 TYR B 40 24.259 4.419 -4.656 1.00 0.58 H new ATOM 0 HB3 TYR B 40 23.214 3.941 -3.333 1.00 0.58 H new ATOM 0 HD1 TYR B 40 21.244 5.695 -2.795 1.00 1.51 H new ATOM 0 HD2 TYR B 40 23.253 5.350 -6.576 1.00 1.61 H new ATOM 0 HE1 TYR B 40 19.328 6.800 -3.913 1.00 1.79 H new ATOM 0 HE2 TYR B 40 21.340 6.465 -7.692 1.00 1.88 H new ATOM 0 HH TYR B 40 19.052 6.984 -7.405 1.00 2.01 H new ATOM 2251 N ILE B 41 26.135 4.721 -2.050 1.00 0.44 N ATOM 2252 CA ILE B 41 26.869 4.076 -0.932 1.00 0.40 C ATOM 2253 C ILE B 41 27.075 5.103 0.182 1.00 0.41 C ATOM 2254 O ILE B 41 26.730 4.878 1.324 1.00 0.41 O ATOM 2255 CB ILE B 41 28.226 3.569 -1.433 1.00 0.41 C ATOM 2256 CG1 ILE B 41 28.001 2.490 -2.494 1.00 0.53 C ATOM 2257 CG2 ILE B 41 29.018 2.975 -0.264 1.00 0.47 C ATOM 2258 CD1 ILE B 41 29.337 2.117 -3.141 1.00 0.54 C ATOM 0 H ILE B 41 26.641 4.773 -2.934 1.00 0.44 H new ATOM 0 HA ILE B 41 26.296 3.231 -0.549 1.00 0.40 H new ATOM 0 HB ILE B 41 28.787 4.398 -1.864 1.00 0.41 H new ATOM 0 HG12 ILE B 41 27.547 1.609 -2.040 1.00 0.53 H new ATOM 0 HG13 ILE B 41 27.307 2.851 -3.253 1.00 0.53 H new ATOM 0 HG21 ILE B 41 29.982 2.615 -0.623 1.00 0.47 H new ATOM 0 HG22 ILE B 41 29.176 3.741 0.495 1.00 0.47 H new ATOM 0 HG23 ILE B 41 28.460 2.145 0.169 1.00 0.47 H new ATOM 0 HD11 ILE B 41 29.173 1.348 -3.896 1.00 0.54 H new ATOM 0 HD12 ILE B 41 29.773 2.999 -3.610 1.00 0.54 H new ATOM 0 HD13 ILE B 41 30.017 1.738 -2.378 1.00 0.54 H new ATOM 2270 N LYS B 42 27.634 6.236 -0.150 1.00 0.46 N ATOM 2271 CA LYS B 42 27.863 7.290 0.878 1.00 0.50 C ATOM 2272 C LYS B 42 26.527 7.676 1.522 1.00 0.51 C ATOM 2273 O LYS B 42 26.387 7.672 2.728 1.00 0.53 O ATOM 2274 CB LYS B 42 28.497 8.517 0.208 1.00 0.59 C ATOM 2275 CG LYS B 42 28.612 9.678 1.207 1.00 0.89 C ATOM 2276 CD LYS B 42 29.374 9.224 2.454 1.00 0.61 C ATOM 2277 CE LYS B 42 30.033 10.436 3.117 1.00 0.65 C ATOM 2278 NZ LYS B 42 30.496 10.064 4.483 1.00 1.61 N ATOM 0 H LYS B 42 27.942 6.477 -1.092 1.00 0.46 H new ATOM 0 HA LYS B 42 28.533 6.914 1.651 1.00 0.50 H new ATOM 0 HB2 LYS B 42 29.485 8.260 -0.174 1.00 0.59 H new ATOM 0 HB3 LYS B 42 27.894 8.824 -0.647 1.00 0.59 H new ATOM 0 HG2 LYS B 42 29.127 10.519 0.742 1.00 0.89 H new ATOM 0 HG3 LYS B 42 27.618 10.028 1.486 1.00 0.89 H new ATOM 0 HD2 LYS B 42 28.693 8.739 3.153 1.00 0.61 H new ATOM 0 HD3 LYS B 42 30.131 8.488 2.183 1.00 0.61 H new ATOM 0 HE2 LYS B 42 30.876 10.779 2.517 1.00 0.65 H new ATOM 0 HE3 LYS B 42 29.325 11.263 3.174 1.00 0.65 H new ATOM 0 HZ1 LYS B 42 30.944 10.887 4.934 1.00 1.61 H new ATOM 0 HZ2 LYS B 42 29.683 9.757 5.054 1.00 1.61 H new ATOM 0 HZ3 LYS B 42 31.185 9.288 4.417 1.00 1.61 H new ATOM 2292 N MET B 43 25.546 8.019 0.729 1.00 0.55 N ATOM 2293 CA MET B 43 24.227 8.414 1.306 1.00 0.60 C ATOM 2294 C MET B 43 23.757 7.350 2.293 1.00 0.50 C ATOM 2295 O MET B 43 23.364 7.652 3.395 1.00 0.52 O ATOM 2296 CB MET B 43 23.181 8.564 0.195 1.00 0.68 C ATOM 2297 CG MET B 43 21.892 9.152 0.786 1.00 0.78 C ATOM 2298 SD MET B 43 22.177 10.869 1.276 1.00 1.39 S ATOM 2299 CE MET B 43 21.678 11.639 -0.284 1.00 2.16 C ATOM 0 H MET B 43 25.600 8.043 -0.289 1.00 0.55 H new ATOM 0 HA MET B 43 24.345 9.369 1.819 1.00 0.60 H new ATOM 0 HB2 MET B 43 23.562 9.213 -0.593 1.00 0.68 H new ATOM 0 HB3 MET B 43 22.977 7.595 -0.261 1.00 0.68 H new ATOM 0 HG2 MET B 43 21.088 9.101 0.052 1.00 0.78 H new ATOM 0 HG3 MET B 43 21.575 8.565 1.648 1.00 0.78 H new ATOM 0 HE1 MET B 43 21.777 12.721 -0.204 1.00 2.16 H new ATOM 0 HE2 MET B 43 22.316 11.275 -1.090 1.00 2.16 H new ATOM 0 HE3 MET B 43 20.640 11.385 -0.500 1.00 2.16 H new ATOM 2309 N LEU B 44 23.794 6.107 1.913 1.00 0.43 N ATOM 2310 CA LEU B 44 23.340 5.037 2.848 1.00 0.35 C ATOM 2311 C LEU B 44 24.259 5.009 4.069 1.00 0.32 C ATOM 2312 O LEU B 44 23.827 4.806 5.189 1.00 0.35 O ATOM 2313 CB LEU B 44 23.386 3.687 2.131 1.00 0.33 C ATOM 2314 CG LEU B 44 22.291 3.619 1.059 1.00 0.49 C ATOM 2315 CD1 LEU B 44 22.396 2.289 0.314 1.00 0.90 C ATOM 2316 CD2 LEU B 44 20.908 3.713 1.706 1.00 0.68 C ATOM 0 H LEU B 44 24.117 5.783 1.001 1.00 0.43 H new ATOM 0 HA LEU B 44 22.319 5.238 3.172 1.00 0.35 H new ATOM 0 HB2 LEU B 44 24.364 3.544 1.672 1.00 0.33 H new ATOM 0 HB3 LEU B 44 23.251 2.880 2.851 1.00 0.33 H new ATOM 0 HG LEU B 44 22.423 4.452 0.368 1.00 0.49 H new ATOM 0 HD11 LEU B 44 21.619 2.237 -0.449 1.00 0.90 H new ATOM 0 HD12 LEU B 44 23.375 2.213 -0.159 1.00 0.90 H new ATOM 0 HD13 LEU B 44 22.269 1.467 1.018 1.00 0.90 H new ATOM 0 HD21 LEU B 44 20.141 3.663 0.933 1.00 0.68 H new ATOM 0 HD22 LEU B 44 20.775 2.885 2.403 1.00 0.68 H new ATOM 0 HD23 LEU B 44 20.821 4.657 2.243 1.00 0.68 H new ATOM 2328 N MET B 45 25.523 5.230 3.868 1.00 0.40 N ATOM 2329 CA MET B 45 26.460 5.236 5.017 1.00 0.42 C ATOM 2330 C MET B 45 26.211 6.511 5.823 1.00 0.44 C ATOM 2331 O MET B 45 26.091 6.498 7.033 1.00 0.43 O ATOM 2332 CB MET B 45 27.895 5.238 4.482 1.00 0.52 C ATOM 2333 CG MET B 45 28.882 4.974 5.617 1.00 1.13 C ATOM 2334 SD MET B 45 29.850 3.495 5.236 1.00 0.80 S ATOM 2335 CE MET B 45 31.129 4.301 4.241 1.00 0.83 C ATOM 0 H MET B 45 25.948 5.407 2.958 1.00 0.40 H new ATOM 0 HA MET B 45 26.310 4.359 5.647 1.00 0.42 H new ATOM 0 HB2 MET B 45 28.004 4.476 3.711 1.00 0.52 H new ATOM 0 HB3 MET B 45 28.115 6.198 4.015 1.00 0.52 H new ATOM 0 HG2 MET B 45 29.542 5.831 5.747 1.00 1.13 H new ATOM 0 HG3 MET B 45 28.346 4.840 6.557 1.00 1.13 H new ATOM 0 HE1 MET B 45 31.116 3.891 3.231 1.00 0.83 H new ATOM 0 HE2 MET B 45 30.936 5.373 4.200 1.00 0.83 H new ATOM 0 HE3 MET B 45 32.106 4.125 4.692 1.00 0.83 H new ATOM 2345 N ASP B 46 26.113 7.608 5.132 1.00 0.48 N ATOM 2346 CA ASP B 46 25.847 8.914 5.797 1.00 0.53 C ATOM 2347 C ASP B 46 24.489 8.877 6.504 1.00 0.51 C ATOM 2348 O ASP B 46 24.233 9.644 7.411 1.00 0.55 O ATOM 2349 CB ASP B 46 25.827 10.021 4.747 1.00 0.59 C ATOM 2350 CG ASP B 46 26.350 11.322 5.360 1.00 0.71 C ATOM 2351 OD1 ASP B 46 26.126 11.529 6.542 1.00 1.26 O ATOM 2352 OD2 ASP B 46 26.965 12.089 4.638 1.00 1.30 O ATOM 0 H ASP B 46 26.207 7.658 4.118 1.00 0.48 H new ATOM 0 HA ASP B 46 26.632 9.105 6.529 1.00 0.53 H new ATOM 0 HB2 ASP B 46 26.442 9.737 3.893 1.00 0.59 H new ATOM 0 HB3 ASP B 46 24.812 10.165 4.375 1.00 0.59 H new ATOM 2357 N LEU B 47 23.614 7.994 6.090 1.00 0.48 N ATOM 2358 CA LEU B 47 22.269 7.918 6.735 1.00 0.50 C ATOM 2359 C LEU B 47 22.266 6.815 7.789 1.00 0.46 C ATOM 2360 O LEU B 47 21.302 6.637 8.506 1.00 0.50 O ATOM 2361 CB LEU B 47 21.195 7.645 5.679 1.00 0.51 C ATOM 2362 CG LEU B 47 20.558 8.975 5.253 1.00 0.59 C ATOM 2363 CD1 LEU B 47 21.639 9.988 4.864 1.00 0.59 C ATOM 2364 CD2 LEU B 47 19.632 8.748 4.055 1.00 0.62 C ATOM 0 H LEU B 47 23.773 7.325 5.336 1.00 0.48 H new ATOM 0 HA LEU B 47 22.049 8.870 7.217 1.00 0.50 H new ATOM 0 HB2 LEU B 47 21.635 7.146 4.816 1.00 0.51 H new ATOM 0 HB3 LEU B 47 20.434 6.976 6.081 1.00 0.51 H new ATOM 0 HG LEU B 47 19.986 9.367 6.094 1.00 0.59 H new ATOM 0 HD11 LEU B 47 21.169 10.925 4.565 1.00 0.59 H new ATOM 0 HD12 LEU B 47 22.294 10.167 5.717 1.00 0.59 H new ATOM 0 HD13 LEU B 47 22.225 9.594 4.033 1.00 0.59 H new ATOM 0 HD21 LEU B 47 19.183 9.696 3.757 1.00 0.62 H new ATOM 0 HD22 LEU B 47 20.207 8.342 3.223 1.00 0.62 H new ATOM 0 HD23 LEU B 47 18.846 8.045 4.331 1.00 0.62 H new ATOM 2376 N GLU B 48 23.341 6.078 7.880 1.00 0.42 N ATOM 2377 CA GLU B 48 23.436 4.977 8.884 1.00 0.42 C ATOM 2378 C GLU B 48 22.742 3.729 8.335 1.00 0.39 C ATOM 2379 O GLU B 48 21.695 3.326 8.797 1.00 0.47 O ATOM 2380 CB GLU B 48 22.797 5.411 10.211 1.00 0.47 C ATOM 2381 CG GLU B 48 23.531 4.738 11.371 1.00 1.16 C ATOM 2382 CD GLU B 48 24.878 5.429 11.592 1.00 1.19 C ATOM 2383 OE1 GLU B 48 24.875 6.624 11.835 1.00 1.69 O ATOM 2384 OE2 GLU B 48 25.889 4.751 11.512 1.00 1.72 O ATOM 0 H GLU B 48 24.168 6.193 7.294 1.00 0.42 H new ATOM 0 HA GLU B 48 24.485 4.747 9.072 1.00 0.42 H new ATOM 0 HB2 GLU B 48 22.847 6.495 10.314 1.00 0.47 H new ATOM 0 HB3 GLU B 48 21.742 5.138 10.226 1.00 0.47 H new ATOM 0 HG2 GLU B 48 22.929 4.794 12.278 1.00 1.16 H new ATOM 0 HG3 GLU B 48 23.684 3.681 11.154 1.00 1.16 H new ATOM 2391 N ILE B 49 23.329 3.114 7.350 1.00 0.32 N ATOM 2392 CA ILE B 49 22.732 1.890 6.757 1.00 0.30 C ATOM 2393 C ILE B 49 23.876 1.009 6.270 1.00 0.30 C ATOM 2394 O ILE B 49 23.838 -0.205 6.396 1.00 0.31 O ATOM 2395 CB ILE B 49 21.835 2.275 5.564 1.00 0.29 C ATOM 2396 CG1 ILE B 49 20.491 2.848 6.047 1.00 0.35 C ATOM 2397 CG2 ILE B 49 21.570 1.049 4.686 1.00 0.29 C ATOM 2398 CD1 ILE B 49 20.522 4.376 5.947 1.00 0.51 C ATOM 0 H ILE B 49 24.208 3.411 6.926 1.00 0.32 H new ATOM 0 HA ILE B 49 22.126 1.364 7.494 1.00 0.30 H new ATOM 0 HB ILE B 49 22.357 3.037 4.986 1.00 0.29 H new ATOM 0 HG12 ILE B 49 19.676 2.450 5.443 1.00 0.35 H new ATOM 0 HG13 ILE B 49 20.303 2.544 7.077 1.00 0.35 H new ATOM 0 HG21 ILE B 49 20.935 1.333 3.847 1.00 0.29 H new ATOM 0 HG22 ILE B 49 22.516 0.659 4.310 1.00 0.29 H new ATOM 0 HG23 ILE B 49 21.070 0.281 5.275 1.00 0.29 H new ATOM 0 HD11 ILE B 49 19.570 4.782 6.289 1.00 0.51 H new ATOM 0 HD12 ILE B 49 21.327 4.765 6.570 1.00 0.51 H new ATOM 0 HD13 ILE B 49 20.690 4.669 4.911 1.00 0.51 H new ATOM 2410 N ILE B 50 24.902 1.617 5.723 1.00 0.30 N ATOM 2411 CA ILE B 50 26.054 0.813 5.232 1.00 0.31 C ATOM 2412 C ILE B 50 27.226 0.916 6.201 1.00 0.36 C ATOM 2413 O ILE B 50 27.473 1.939 6.807 1.00 0.57 O ATOM 2414 CB ILE B 50 26.492 1.301 3.853 1.00 0.31 C ATOM 2415 CG1 ILE B 50 25.532 0.739 2.799 1.00 0.35 C ATOM 2416 CG2 ILE B 50 27.910 0.795 3.570 1.00 0.36 C ATOM 2417 CD1 ILE B 50 25.842 1.343 1.427 1.00 0.70 C ATOM 0 H ILE B 50 24.987 2.626 5.598 1.00 0.30 H new ATOM 0 HA ILE B 50 25.738 -0.228 5.162 1.00 0.31 H new ATOM 0 HB ILE B 50 26.479 2.390 3.820 1.00 0.31 H new ATOM 0 HG12 ILE B 50 25.623 -0.346 2.756 1.00 0.35 H new ATOM 0 HG13 ILE B 50 24.502 0.962 3.078 1.00 0.35 H new ATOM 0 HG21 ILE B 50 28.230 1.140 2.587 1.00 0.36 H new ATOM 0 HG22 ILE B 50 28.592 1.180 4.329 1.00 0.36 H new ATOM 0 HG23 ILE B 50 27.919 -0.295 3.593 1.00 0.36 H new ATOM 0 HD11 ILE B 50 25.154 0.936 0.686 1.00 0.70 H new ATOM 0 HD12 ILE B 50 25.728 2.426 1.472 1.00 0.70 H new ATOM 0 HD13 ILE B 50 26.866 1.097 1.144 1.00 0.70 H new ATOM 2429 N ARG B 51 27.949 -0.152 6.326 1.00 0.42 N ATOM 2430 CA ARG B 51 29.130 -0.188 7.222 1.00 0.44 C ATOM 2431 C ARG B 51 30.386 -0.073 6.366 1.00 0.44 C ATOM 2432 O ARG B 51 30.323 -0.111 5.156 1.00 0.54 O ATOM 2433 CB ARG B 51 29.159 -1.503 7.988 1.00 0.52 C ATOM 2434 CG ARG B 51 29.897 -1.308 9.315 1.00 0.75 C ATOM 2435 CD ARG B 51 28.905 -0.914 10.405 1.00 0.89 C ATOM 2436 NE ARG B 51 29.632 -0.759 11.696 1.00 0.89 N ATOM 2437 CZ ARG B 51 29.147 0.005 12.637 1.00 0.95 C ATOM 2438 NH1 ARG B 51 28.034 0.658 12.444 1.00 1.50 N ATOM 2439 NH2 ARG B 51 29.780 0.118 13.771 1.00 1.24 N ATOM 0 H ARG B 51 27.767 -1.025 5.832 1.00 0.42 H new ATOM 0 HA ARG B 51 29.080 0.635 7.935 1.00 0.44 H new ATOM 0 HB2 ARG B 51 28.142 -1.850 8.173 1.00 0.52 H new ATOM 0 HB3 ARG B 51 29.655 -2.271 7.394 1.00 0.52 H new ATOM 0 HG2 ARG B 51 30.412 -2.227 9.594 1.00 0.75 H new ATOM 0 HG3 ARG B 51 30.659 -0.536 9.208 1.00 0.75 H new ATOM 0 HD2 ARG B 51 28.407 0.019 10.140 1.00 0.89 H new ATOM 0 HD3 ARG B 51 28.129 -1.674 10.500 1.00 0.89 H new ATOM 0 HE ARG B 51 30.512 -1.252 11.845 1.00 0.89 H new ATOM 0 HH11 ARG B 51 27.540 0.572 11.556 1.00 1.50 H new ATOM 0 HH12 ARG B 51 27.658 1.254 13.181 1.00 1.50 H new ATOM 0 HH21 ARG B 51 30.652 -0.390 13.921 1.00 1.24 H new ATOM 0 HH22 ARG B 51 29.404 0.714 14.508 1.00 1.24 H new ATOM 2453 N GLN B 52 31.523 0.075 6.977 1.00 0.44 N ATOM 2454 CA GLN B 52 32.778 0.201 6.185 1.00 0.48 C ATOM 2455 C GLN B 52 33.934 -0.371 6.995 1.00 0.53 C ATOM 2456 O GLN B 52 34.408 0.242 7.931 1.00 0.65 O ATOM 2457 CB GLN B 52 33.046 1.680 5.891 1.00 0.61 C ATOM 2458 CG GLN B 52 32.731 2.520 7.135 1.00 1.46 C ATOM 2459 CD GLN B 52 33.753 3.652 7.258 1.00 1.70 C ATOM 2460 OE1 GLN B 52 34.876 3.430 7.666 1.00 2.42 O ATOM 2461 NE2 GLN B 52 33.409 4.865 6.922 1.00 1.80 N ATOM 0 H GLN B 52 31.641 0.115 7.989 1.00 0.44 H new ATOM 0 HA GLN B 52 32.680 -0.344 5.246 1.00 0.48 H new ATOM 0 HB2 GLN B 52 34.087 1.820 5.600 1.00 0.61 H new ATOM 0 HB3 GLN B 52 32.433 2.011 5.052 1.00 0.61 H new ATOM 0 HG2 GLN B 52 31.724 2.931 7.064 1.00 1.46 H new ATOM 0 HG3 GLN B 52 32.757 1.893 8.026 1.00 1.46 H new ATOM 0 HE21 GLN B 52 32.466 5.051 6.580 1.00 1.80 H new ATOM 0 HE22 GLN B 52 34.083 5.627 7.002 1.00 1.80 H new ATOM 2470 N GLU B 53 34.393 -1.548 6.640 1.00 0.57 N ATOM 2471 CA GLU B 53 35.516 -2.169 7.386 1.00 0.74 C ATOM 2472 C GLU B 53 36.680 -2.477 6.448 1.00 0.75 C ATOM 2473 O GLU B 53 36.584 -3.247 5.513 1.00 0.76 O ATOM 2474 CB GLU B 53 35.018 -3.444 8.052 1.00 0.90 C ATOM 2475 CG GLU B 53 34.881 -4.564 7.020 1.00 1.02 C ATOM 2476 CD GLU B 53 33.920 -5.630 7.551 1.00 1.37 C ATOM 2477 OE1 GLU B 53 33.511 -5.515 8.696 1.00 1.95 O ATOM 2478 OE2 GLU B 53 33.610 -6.544 6.806 1.00 2.11 O ATOM 0 H GLU B 53 34.032 -2.101 5.863 1.00 0.57 H new ATOM 0 HA GLU B 53 35.875 -1.475 8.146 1.00 0.74 H new ATOM 0 HB2 GLU B 53 35.711 -3.747 8.837 1.00 0.90 H new ATOM 0 HB3 GLU B 53 34.055 -3.261 8.530 1.00 0.90 H new ATOM 0 HG2 GLU B 53 34.510 -4.161 6.077 1.00 1.02 H new ATOM 0 HG3 GLU B 53 35.856 -5.007 6.816 1.00 1.02 H new ATOM 2485 N GLY B 54 37.785 -1.877 6.739 1.00 0.80 N ATOM 2486 CA GLY B 54 39.024 -2.092 5.945 1.00 0.85 C ATOM 2487 C GLY B 54 38.796 -1.871 4.444 1.00 0.74 C ATOM 2488 O GLY B 54 39.395 -2.551 3.637 1.00 0.88 O ATOM 0 H GLY B 54 37.891 -1.225 7.517 1.00 0.80 H new ATOM 0 HA2 GLY B 54 39.801 -1.413 6.297 1.00 0.85 H new ATOM 0 HA3 GLY B 54 39.388 -3.106 6.110 1.00 0.85 H new ATOM 2492 N LYS B 55 37.932 -0.952 4.064 1.00 0.78 N ATOM 2493 CA LYS B 55 37.646 -0.685 2.610 1.00 0.78 C ATOM 2494 C LYS B 55 36.484 -1.551 2.115 1.00 0.69 C ATOM 2495 O LYS B 55 36.048 -1.407 0.989 1.00 0.70 O ATOM 2496 CB LYS B 55 38.883 -0.938 1.733 1.00 0.91 C ATOM 2497 CG LYS B 55 38.806 -0.060 0.480 1.00 1.13 C ATOM 2498 CD LYS B 55 40.019 -0.330 -0.419 1.00 1.34 C ATOM 2499 CE LYS B 55 41.154 0.627 -0.051 1.00 1.60 C ATOM 2500 NZ LYS B 55 40.761 2.022 -0.395 1.00 2.11 N ATOM 0 H LYS B 55 37.404 -0.366 4.711 1.00 0.78 H new ATOM 0 HA LYS B 55 37.373 0.367 2.527 1.00 0.78 H new ATOM 0 HB2 LYS B 55 39.791 -0.714 2.292 1.00 0.91 H new ATOM 0 HB3 LYS B 55 38.934 -1.990 1.451 1.00 0.91 H new ATOM 0 HG2 LYS B 55 37.885 -0.268 -0.065 1.00 1.13 H new ATOM 0 HG3 LYS B 55 38.779 0.992 0.763 1.00 1.13 H new ATOM 0 HD2 LYS B 55 40.348 -1.363 -0.302 1.00 1.34 H new ATOM 0 HD3 LYS B 55 39.745 -0.199 -1.466 1.00 1.34 H new ATOM 0 HE2 LYS B 55 41.375 0.553 1.014 1.00 1.60 H new ATOM 0 HE3 LYS B 55 42.063 0.352 -0.586 1.00 1.60 H new ATOM 0 HZ1 LYS B 55 41.603 2.558 -0.685 1.00 2.11 H new ATOM 0 HZ2 LYS B 55 40.074 2.007 -1.176 1.00 2.11 H new ATOM 0 HZ3 LYS B 55 40.331 2.476 0.436 1.00 2.11 H new ATOM 2514 N GLN B 56 35.961 -2.423 2.942 1.00 0.70 N ATOM 2515 CA GLN B 56 34.804 -3.256 2.488 1.00 0.70 C ATOM 2516 C GLN B 56 33.547 -2.672 3.077 1.00 0.60 C ATOM 2517 O GLN B 56 33.580 -2.045 4.108 1.00 0.60 O ATOM 2518 CB GLN B 56 34.901 -4.719 2.926 1.00 0.85 C ATOM 2519 CG GLN B 56 36.360 -5.161 3.045 1.00 1.17 C ATOM 2520 CD GLN B 56 36.497 -6.596 2.534 1.00 1.15 C ATOM 2521 OE1 GLN B 56 37.367 -6.889 1.739 1.00 1.54 O ATOM 2522 NE2 GLN B 56 35.668 -7.511 2.958 1.00 1.66 N ATOM 0 H GLN B 56 36.278 -2.593 3.896 1.00 0.70 H new ATOM 0 HA GLN B 56 34.802 -3.243 1.398 1.00 0.70 H new ATOM 0 HB2 GLN B 56 34.399 -4.849 3.885 1.00 0.85 H new ATOM 0 HB3 GLN B 56 34.383 -5.353 2.206 1.00 0.85 H new ATOM 0 HG2 GLN B 56 37.002 -4.495 2.469 1.00 1.17 H new ATOM 0 HG3 GLN B 56 36.687 -5.100 4.083 1.00 1.17 H new ATOM 0 HE21 GLN B 56 34.937 -7.267 3.626 1.00 1.66 H new ATOM 0 HE22 GLN B 56 35.752 -8.470 2.622 1.00 1.66 H new ATOM 2531 N TYR B 57 32.444 -2.871 2.425 1.00 0.56 N ATOM 2532 CA TYR B 57 31.169 -2.316 2.934 1.00 0.48 C ATOM 2533 C TYR B 57 30.346 -3.425 3.564 1.00 0.47 C ATOM 2534 O TYR B 57 30.136 -4.466 2.975 1.00 0.53 O ATOM 2535 CB TYR B 57 30.396 -1.702 1.778 1.00 0.46 C ATOM 2536 CG TYR B 57 31.267 -0.677 1.086 1.00 0.49 C ATOM 2537 CD1 TYR B 57 32.238 -1.090 0.167 1.00 1.27 C ATOM 2538 CD2 TYR B 57 31.110 0.686 1.370 1.00 1.18 C ATOM 2539 CE1 TYR B 57 33.049 -0.143 -0.470 1.00 1.30 C ATOM 2540 CE2 TYR B 57 31.920 1.632 0.733 1.00 1.18 C ATOM 2541 CZ TYR B 57 32.889 1.218 -0.189 1.00 0.57 C ATOM 2542 OH TYR B 57 33.687 2.152 -0.817 1.00 0.63 O ATOM 0 H TYR B 57 32.370 -3.398 1.555 1.00 0.56 H new ATOM 0 HA TYR B 57 31.375 -1.553 3.684 1.00 0.48 H new ATOM 0 HB2 TYR B 57 30.096 -2.477 1.073 1.00 0.46 H new ATOM 0 HB3 TYR B 57 29.483 -1.233 2.144 1.00 0.46 H new ATOM 0 HD1 TYR B 57 32.362 -2.140 -0.051 1.00 1.27 H new ATOM 0 HD2 TYR B 57 30.363 1.006 2.081 1.00 1.18 H new ATOM 0 HE1 TYR B 57 33.798 -0.463 -1.179 1.00 1.30 H new ATOM 0 HE2 TYR B 57 31.798 2.682 0.953 1.00 1.18 H new ATOM 0 HH TYR B 57 33.444 3.050 -0.509 1.00 0.63 H new ATOM 2552 N MET B 58 29.889 -3.198 4.761 1.00 0.44 N ATOM 2553 CA MET B 58 29.082 -4.216 5.477 1.00 0.45 C ATOM 2554 C MET B 58 27.778 -3.577 5.923 1.00 0.42 C ATOM 2555 O MET B 58 27.554 -2.405 5.716 1.00 0.40 O ATOM 2556 CB MET B 58 29.897 -4.829 6.634 1.00 0.50 C ATOM 2557 CG MET B 58 29.082 -5.018 7.922 1.00 1.04 C ATOM 2558 SD MET B 58 30.194 -5.578 9.239 1.00 1.10 S ATOM 2559 CE MET B 58 29.467 -7.218 9.474 1.00 1.52 C ATOM 0 H MET B 58 30.044 -2.334 5.281 1.00 0.44 H new ATOM 0 HA MET B 58 28.831 -5.048 4.819 1.00 0.45 H new ATOM 0 HB2 MET B 58 30.292 -5.794 6.318 1.00 0.50 H new ATOM 0 HB3 MET B 58 30.753 -4.188 6.845 1.00 0.50 H new ATOM 0 HG2 MET B 58 28.602 -4.081 8.206 1.00 1.04 H new ATOM 0 HG3 MET B 58 28.288 -5.748 7.763 1.00 1.04 H new ATOM 0 HE1 MET B 58 30.010 -7.748 10.257 1.00 1.52 H new ATOM 0 HE2 MET B 58 28.421 -7.114 9.764 1.00 1.52 H new ATOM 0 HE3 MET B 58 29.531 -7.781 8.543 1.00 1.52 H new ATOM 2569 N LEU B 59 26.895 -4.352 6.461 1.00 0.44 N ATOM 2570 CA LEU B 59 25.561 -3.791 6.845 1.00 0.43 C ATOM 2571 C LEU B 59 25.539 -3.435 8.334 1.00 0.41 C ATOM 2572 O LEU B 59 26.047 -4.159 9.165 1.00 0.47 O ATOM 2573 CB LEU B 59 24.447 -4.809 6.508 1.00 0.51 C ATOM 2574 CG LEU B 59 24.305 -5.918 7.572 1.00 0.77 C ATOM 2575 CD1 LEU B 59 23.149 -6.836 7.176 1.00 1.05 C ATOM 2576 CD2 LEU B 59 25.581 -6.758 7.652 1.00 1.25 C ATOM 0 H LEU B 59 27.026 -5.345 6.655 1.00 0.44 H new ATOM 0 HA LEU B 59 25.383 -2.878 6.277 1.00 0.43 H new ATOM 0 HB2 LEU B 59 23.498 -4.282 6.411 1.00 0.51 H new ATOM 0 HB3 LEU B 59 24.659 -5.265 5.541 1.00 0.51 H new ATOM 0 HG LEU B 59 24.122 -5.452 8.540 1.00 0.77 H new ATOM 0 HD11 LEU B 59 23.039 -7.624 7.921 1.00 1.05 H new ATOM 0 HD12 LEU B 59 22.227 -6.257 7.121 1.00 1.05 H new ATOM 0 HD13 LEU B 59 23.356 -7.282 6.203 1.00 1.05 H new ATOM 0 HD21 LEU B 59 25.459 -7.534 8.408 1.00 1.25 H new ATOM 0 HD22 LEU B 59 25.773 -7.221 6.684 1.00 1.25 H new ATOM 0 HD23 LEU B 59 26.422 -6.118 7.921 1.00 1.25 H new ATOM 2588 N THR B 60 24.956 -2.304 8.673 1.00 0.38 N ATOM 2589 CA THR B 60 24.911 -1.890 10.110 1.00 0.41 C ATOM 2590 C THR B 60 23.546 -2.263 10.692 1.00 0.44 C ATOM 2591 O THR B 60 22.622 -2.567 9.963 1.00 0.43 O ATOM 2592 CB THR B 60 25.100 -0.376 10.238 1.00 0.40 C ATOM 2593 OG1 THR B 60 24.289 0.110 11.299 1.00 1.04 O ATOM 2594 CG2 THR B 60 24.699 0.312 8.939 1.00 1.01 C ATOM 0 H THR B 60 24.514 -1.657 8.020 1.00 0.38 H new ATOM 0 HA THR B 60 25.712 -2.398 10.648 1.00 0.41 H new ATOM 0 HB THR B 60 26.148 -0.162 10.446 1.00 0.40 H new ATOM 0 HG1 THR B 60 24.409 1.079 11.385 1.00 1.04 H new ATOM 0 HG21 THR B 60 24.837 1.389 9.040 1.00 1.01 H new ATOM 0 HG22 THR B 60 25.321 -0.059 8.124 1.00 1.01 H new ATOM 0 HG23 THR B 60 23.652 0.099 8.723 1.00 1.01 H new ATOM 2602 N LYS B 61 23.410 -2.245 11.996 1.00 0.51 N ATOM 2603 CA LYS B 61 22.096 -2.595 12.620 1.00 0.54 C ATOM 2604 C LYS B 61 20.972 -1.920 11.827 1.00 0.51 C ATOM 2605 O LYS B 61 19.940 -2.500 11.557 1.00 0.50 O ATOM 2606 CB LYS B 61 22.057 -2.105 14.075 1.00 0.61 C ATOM 2607 CG LYS B 61 22.856 -0.804 14.220 1.00 1.28 C ATOM 2608 CD LYS B 61 24.271 -1.112 14.720 1.00 1.04 C ATOM 2609 CE LYS B 61 24.262 -1.222 16.247 1.00 1.73 C ATOM 2610 NZ LYS B 61 24.587 0.107 16.840 1.00 2.19 N ATOM 0 H LYS B 61 24.151 -2.003 12.654 1.00 0.51 H new ATOM 0 HA LYS B 61 21.966 -3.677 12.606 1.00 0.54 H new ATOM 0 HB2 LYS B 61 21.024 -1.942 14.383 1.00 0.61 H new ATOM 0 HB3 LYS B 61 22.470 -2.869 14.734 1.00 0.61 H new ATOM 0 HG2 LYS B 61 22.904 -0.288 13.261 1.00 1.28 H new ATOM 0 HG3 LYS B 61 22.353 -0.134 14.917 1.00 1.28 H new ATOM 0 HD2 LYS B 61 24.629 -2.043 14.280 1.00 1.04 H new ATOM 0 HD3 LYS B 61 24.958 -0.326 14.406 1.00 1.04 H new ATOM 0 HE2 LYS B 61 23.284 -1.558 16.593 1.00 1.73 H new ATOM 0 HE3 LYS B 61 24.989 -1.966 16.574 1.00 1.73 H new ATOM 0 HZ1 LYS B 61 24.582 0.035 17.877 1.00 2.19 H new ATOM 0 HZ2 LYS B 61 25.529 0.409 16.519 1.00 2.19 H new ATOM 0 HZ3 LYS B 61 23.878 0.805 16.538 1.00 2.19 H new ATOM 2624 N LYS B 62 21.169 -0.689 11.465 1.00 0.51 N ATOM 2625 CA LYS B 62 20.126 0.039 10.693 1.00 0.49 C ATOM 2626 C LYS B 62 19.920 -0.638 9.332 1.00 0.45 C ATOM 2627 O LYS B 62 18.813 -0.742 8.844 1.00 0.53 O ATOM 2628 CB LYS B 62 20.559 1.492 10.475 1.00 0.54 C ATOM 2629 CG LYS B 62 20.201 2.340 11.702 1.00 0.75 C ATOM 2630 CD LYS B 62 21.034 1.891 12.903 1.00 1.16 C ATOM 2631 CE LYS B 62 20.940 2.944 14.010 1.00 1.17 C ATOM 2632 NZ LYS B 62 20.885 2.269 15.337 1.00 2.08 N ATOM 0 H LYS B 62 22.011 -0.151 11.670 1.00 0.51 H new ATOM 0 HA LYS B 62 19.192 0.019 11.255 1.00 0.49 H new ATOM 0 HB2 LYS B 62 21.633 1.536 10.294 1.00 0.54 H new ATOM 0 HB3 LYS B 62 20.070 1.896 9.589 1.00 0.54 H new ATOM 0 HG2 LYS B 62 20.385 3.394 11.493 1.00 0.75 H new ATOM 0 HG3 LYS B 62 19.139 2.241 11.927 1.00 0.75 H new ATOM 0 HD2 LYS B 62 20.675 0.929 13.269 1.00 1.16 H new ATOM 0 HD3 LYS B 62 22.074 1.751 12.607 1.00 1.16 H new ATOM 0 HE2 LYS B 62 21.801 3.611 13.965 1.00 1.17 H new ATOM 0 HE3 LYS B 62 20.052 3.559 13.866 1.00 1.17 H new ATOM 0 HZ1 LYS B 62 20.619 2.960 16.067 1.00 2.08 H new ATOM 0 HZ2 LYS B 62 20.179 1.505 15.309 1.00 2.08 H new ATOM 0 HZ3 LYS B 62 21.818 1.870 15.562 1.00 2.08 H new ATOM 2646 N GLY B 63 20.977 -1.079 8.701 1.00 0.41 N ATOM 2647 CA GLY B 63 20.830 -1.718 7.361 1.00 0.39 C ATOM 2648 C GLY B 63 20.026 -3.016 7.451 1.00 0.38 C ATOM 2649 O GLY B 63 19.149 -3.261 6.647 1.00 0.39 O ATOM 0 H GLY B 63 21.932 -1.024 9.055 1.00 0.41 H new ATOM 0 HA2 GLY B 63 20.335 -1.027 6.678 1.00 0.39 H new ATOM 0 HA3 GLY B 63 21.816 -1.926 6.945 1.00 0.39 H new ATOM 2653 N GLU B 64 20.300 -3.852 8.415 1.00 0.40 N ATOM 2654 CA GLU B 64 19.518 -5.121 8.519 1.00 0.43 C ATOM 2655 C GLU B 64 18.055 -4.790 8.823 1.00 0.43 C ATOM 2656 O GLU B 64 17.144 -5.311 8.206 1.00 0.42 O ATOM 2657 CB GLU B 64 20.083 -6.016 9.624 1.00 0.52 C ATOM 2658 CG GLU B 64 21.247 -5.308 10.298 1.00 0.63 C ATOM 2659 CD GLU B 64 21.788 -6.173 11.436 1.00 0.88 C ATOM 2660 OE1 GLU B 64 20.986 -6.786 12.121 1.00 1.45 O ATOM 2661 OE2 GLU B 64 22.996 -6.209 11.604 1.00 1.51 O ATOM 0 H GLU B 64 21.019 -3.717 9.126 1.00 0.40 H new ATOM 0 HA GLU B 64 19.588 -5.656 7.572 1.00 0.43 H new ATOM 0 HB2 GLU B 64 19.308 -6.243 10.356 1.00 0.52 H new ATOM 0 HB3 GLU B 64 20.414 -6.966 9.205 1.00 0.52 H new ATOM 0 HG2 GLU B 64 22.035 -5.112 9.571 1.00 0.63 H new ATOM 0 HG3 GLU B 64 20.923 -4.342 10.685 1.00 0.63 H new ATOM 2668 N GLU B 65 17.828 -3.924 9.771 1.00 0.46 N ATOM 2669 CA GLU B 65 16.430 -3.549 10.128 1.00 0.49 C ATOM 2670 C GLU B 65 15.743 -2.937 8.906 1.00 0.45 C ATOM 2671 O GLU B 65 14.563 -3.127 8.685 1.00 0.48 O ATOM 2672 CB GLU B 65 16.452 -2.527 11.266 1.00 0.54 C ATOM 2673 CG GLU B 65 16.762 -3.238 12.585 1.00 0.62 C ATOM 2674 CD GLU B 65 16.746 -2.222 13.727 1.00 1.07 C ATOM 2675 OE1 GLU B 65 15.671 -1.943 14.232 1.00 1.68 O ATOM 2676 OE2 GLU B 65 17.811 -1.740 14.080 1.00 1.66 O ATOM 0 H GLU B 65 18.553 -3.458 10.316 1.00 0.46 H new ATOM 0 HA GLU B 65 15.884 -4.436 10.448 1.00 0.49 H new ATOM 0 HB2 GLU B 65 17.203 -1.762 11.068 1.00 0.54 H new ATOM 0 HB3 GLU B 65 15.490 -2.019 11.332 1.00 0.54 H new ATOM 0 HG2 GLU B 65 16.027 -4.021 12.770 1.00 0.62 H new ATOM 0 HG3 GLU B 65 17.737 -3.723 12.529 1.00 0.62 H new ATOM 2683 N LEU B 66 16.472 -2.204 8.111 1.00 0.44 N ATOM 2684 CA LEU B 66 15.864 -1.581 6.903 1.00 0.45 C ATOM 2685 C LEU B 66 15.615 -2.661 5.848 1.00 0.43 C ATOM 2686 O LEU B 66 14.580 -2.693 5.211 1.00 0.45 O ATOM 2687 CB LEU B 66 16.822 -0.515 6.351 1.00 0.46 C ATOM 2688 CG LEU B 66 16.348 -0.028 4.977 1.00 0.64 C ATOM 2689 CD1 LEU B 66 14.906 0.471 5.077 1.00 0.72 C ATOM 2690 CD2 LEU B 66 17.250 1.115 4.515 1.00 1.57 C ATOM 0 H LEU B 66 17.464 -2.009 8.246 1.00 0.44 H new ATOM 0 HA LEU B 66 14.915 -1.112 7.162 1.00 0.45 H new ATOM 0 HB2 LEU B 66 16.877 0.326 7.042 1.00 0.46 H new ATOM 0 HB3 LEU B 66 17.828 -0.928 6.270 1.00 0.46 H new ATOM 0 HG LEU B 66 16.395 -0.849 4.262 1.00 0.64 H new ATOM 0 HD11 LEU B 66 14.572 0.817 4.099 1.00 0.72 H new ATOM 0 HD12 LEU B 66 14.262 -0.342 5.414 1.00 0.72 H new ATOM 0 HD13 LEU B 66 14.854 1.294 5.790 1.00 0.72 H new ATOM 0 HD21 LEU B 66 16.919 1.467 3.538 1.00 1.57 H new ATOM 0 HD22 LEU B 66 17.197 1.933 5.233 1.00 1.57 H new ATOM 0 HD23 LEU B 66 18.278 0.761 4.444 1.00 1.57 H new ATOM 2702 N LEU B 67 16.552 -3.550 5.657 1.00 0.42 N ATOM 2703 CA LEU B 67 16.366 -4.628 4.647 1.00 0.43 C ATOM 2704 C LEU B 67 15.034 -5.333 4.896 1.00 0.45 C ATOM 2705 O LEU B 67 14.257 -5.555 3.988 1.00 0.48 O ATOM 2706 CB LEU B 67 17.514 -5.637 4.768 1.00 0.45 C ATOM 2707 CG LEU B 67 17.407 -6.696 3.663 1.00 0.51 C ATOM 2708 CD1 LEU B 67 17.562 -6.041 2.287 1.00 0.90 C ATOM 2709 CD2 LEU B 67 18.512 -7.738 3.853 1.00 1.26 C ATOM 0 H LEU B 67 17.440 -3.575 6.159 1.00 0.42 H new ATOM 0 HA LEU B 67 16.364 -4.198 3.646 1.00 0.43 H new ATOM 0 HB2 LEU B 67 18.471 -5.120 4.695 1.00 0.45 H new ATOM 0 HB3 LEU B 67 17.484 -6.117 5.746 1.00 0.45 H new ATOM 0 HG LEU B 67 16.429 -7.175 3.722 1.00 0.51 H new ATOM 0 HD11 LEU B 67 17.484 -6.802 1.511 1.00 0.90 H new ATOM 0 HD12 LEU B 67 16.776 -5.298 2.147 1.00 0.90 H new ATOM 0 HD13 LEU B 67 18.536 -5.555 2.223 1.00 0.90 H new ATOM 0 HD21 LEU B 67 18.439 -8.492 3.070 1.00 1.26 H new ATOM 0 HD22 LEU B 67 19.485 -7.250 3.798 1.00 1.26 H new ATOM 0 HD23 LEU B 67 18.399 -8.214 4.827 1.00 1.26 H new ATOM 2721 N GLU B 68 14.759 -5.683 6.123 1.00 0.44 N ATOM 2722 CA GLU B 68 13.473 -6.369 6.428 1.00 0.48 C ATOM 2723 C GLU B 68 12.319 -5.398 6.180 1.00 0.46 C ATOM 2724 O GLU B 68 11.313 -5.748 5.597 1.00 0.47 O ATOM 2725 CB GLU B 68 13.465 -6.811 7.893 1.00 0.52 C ATOM 2726 CG GLU B 68 12.348 -7.832 8.114 1.00 1.26 C ATOM 2727 CD GLU B 68 11.689 -7.580 9.470 1.00 1.77 C ATOM 2728 OE1 GLU B 68 12.319 -7.864 10.475 1.00 2.25 O ATOM 2729 OE2 GLU B 68 10.563 -7.109 9.482 1.00 2.23 O ATOM 0 H GLU B 68 15.368 -5.524 6.925 1.00 0.44 H new ATOM 0 HA GLU B 68 13.361 -7.244 5.788 1.00 0.48 H new ATOM 0 HB2 GLU B 68 14.428 -7.248 8.157 1.00 0.52 H new ATOM 0 HB3 GLU B 68 13.317 -5.949 8.543 1.00 0.52 H new ATOM 0 HG2 GLU B 68 11.608 -7.755 7.318 1.00 1.26 H new ATOM 0 HG3 GLU B 68 12.752 -8.843 8.076 1.00 1.26 H new ATOM 2736 N ASP B 69 12.463 -4.176 6.616 1.00 0.44 N ATOM 2737 CA ASP B 69 11.380 -3.178 6.401 1.00 0.45 C ATOM 2738 C ASP B 69 11.082 -3.074 4.904 1.00 0.45 C ATOM 2739 O ASP B 69 9.948 -3.172 4.481 1.00 0.46 O ATOM 2740 CB ASP B 69 11.825 -1.815 6.930 1.00 0.46 C ATOM 2741 CG ASP B 69 12.083 -1.908 8.435 1.00 0.51 C ATOM 2742 OD1 ASP B 69 11.724 -2.920 9.015 1.00 1.25 O ATOM 2743 OD2 ASP B 69 12.634 -0.967 8.982 1.00 1.12 O ATOM 0 H ASP B 69 13.284 -3.827 7.111 1.00 0.44 H new ATOM 0 HA ASP B 69 10.482 -3.493 6.933 1.00 0.45 H new ATOM 0 HB2 ASP B 69 12.730 -1.491 6.415 1.00 0.46 H new ATOM 0 HB3 ASP B 69 11.058 -1.067 6.728 1.00 0.46 H new ATOM 2748 N ILE B 70 12.092 -2.880 4.097 1.00 0.45 N ATOM 2749 CA ILE B 70 11.858 -2.774 2.629 1.00 0.49 C ATOM 2750 C ILE B 70 11.182 -4.052 2.130 1.00 0.48 C ATOM 2751 O ILE B 70 10.287 -4.015 1.311 1.00 0.50 O ATOM 2752 CB ILE B 70 13.196 -2.586 1.909 1.00 0.56 C ATOM 2753 CG1 ILE B 70 13.558 -1.098 1.892 1.00 0.90 C ATOM 2754 CG2 ILE B 70 13.091 -3.096 0.470 1.00 0.85 C ATOM 2755 CD1 ILE B 70 15.026 -0.934 1.493 1.00 1.29 C ATOM 0 H ILE B 70 13.065 -2.791 4.391 1.00 0.45 H new ATOM 0 HA ILE B 70 11.215 -1.918 2.423 1.00 0.49 H new ATOM 0 HB ILE B 70 13.967 -3.149 2.435 1.00 0.56 H new ATOM 0 HG12 ILE B 70 12.917 -0.565 1.189 1.00 0.90 H new ATOM 0 HG13 ILE B 70 13.386 -0.660 2.875 1.00 0.90 H new ATOM 0 HG21 ILE B 70 14.047 -2.959 -0.035 1.00 0.85 H new ATOM 0 HG22 ILE B 70 12.833 -4.155 0.477 1.00 0.85 H new ATOM 0 HG23 ILE B 70 12.318 -2.538 -0.058 1.00 0.85 H new ATOM 0 HD11 ILE B 70 15.284 0.125 1.481 1.00 1.29 H new ATOM 0 HD12 ILE B 70 15.659 -1.453 2.213 1.00 1.29 H new ATOM 0 HD13 ILE B 70 15.183 -1.357 0.501 1.00 1.29 H new ATOM 2767 N ARG B 71 11.603 -5.182 2.621 1.00 0.47 N ATOM 2768 CA ARG B 71 10.988 -6.461 2.180 1.00 0.50 C ATOM 2769 C ARG B 71 9.477 -6.417 2.420 1.00 0.50 C ATOM 2770 O ARG B 71 8.688 -6.467 1.499 1.00 0.54 O ATOM 2771 CB ARG B 71 11.597 -7.616 2.978 1.00 0.52 C ATOM 2772 CG ARG B 71 12.019 -8.733 2.022 1.00 0.82 C ATOM 2773 CD ARG B 71 12.651 -9.877 2.819 1.00 1.02 C ATOM 2774 NE ARG B 71 11.684 -10.360 3.845 1.00 1.57 N ATOM 2775 CZ ARG B 71 12.108 -11.058 4.862 1.00 2.17 C ATOM 2776 NH1 ARG B 71 13.378 -11.330 4.984 1.00 2.58 N ATOM 2777 NH2 ARG B 71 11.260 -11.485 5.759 1.00 2.98 N ATOM 0 H ARG B 71 12.349 -5.275 3.311 1.00 0.47 H new ATOM 0 HA ARG B 71 11.179 -6.608 1.117 1.00 0.50 H new ATOM 0 HB2 ARG B 71 12.458 -7.265 3.546 1.00 0.52 H new ATOM 0 HB3 ARG B 71 10.873 -7.995 3.699 1.00 0.52 H new ATOM 0 HG2 ARG B 71 11.154 -9.097 1.467 1.00 0.82 H new ATOM 0 HG3 ARG B 71 12.730 -8.350 1.290 1.00 0.82 H new ATOM 0 HD2 ARG B 71 12.926 -10.693 2.150 1.00 1.02 H new ATOM 0 HD3 ARG B 71 13.568 -9.537 3.300 1.00 1.02 H new ATOM 0 HE ARG B 71 10.691 -10.145 3.752 1.00 1.57 H new ATOM 0 HH11 ARG B 71 14.041 -10.997 4.284 1.00 2.58 H new ATOM 0 HH12 ARG B 71 13.708 -11.876 5.780 1.00 2.58 H new ATOM 0 HH21 ARG B 71 10.267 -11.273 5.664 1.00 2.98 H new ATOM 0 HH22 ARG B 71 11.591 -12.031 6.555 1.00 2.98 H new ATOM 2791 N LYS B 72 9.072 -6.337 3.658 1.00 0.48 N ATOM 2792 CA LYS B 72 7.616 -6.307 3.981 1.00 0.49 C ATOM 2793 C LYS B 72 6.889 -5.260 3.127 1.00 0.48 C ATOM 2794 O LYS B 72 6.001 -5.587 2.365 1.00 0.51 O ATOM 2795 CB LYS B 72 7.436 -5.970 5.461 1.00 0.49 C ATOM 2796 CG LYS B 72 8.340 -6.872 6.304 1.00 0.65 C ATOM 2797 CD LYS B 72 7.512 -7.545 7.402 1.00 0.91 C ATOM 2798 CE LYS B 72 8.407 -8.486 8.210 1.00 1.46 C ATOM 2799 NZ LYS B 72 8.358 -8.104 9.650 1.00 1.81 N ATOM 0 H LYS B 72 9.692 -6.291 4.466 1.00 0.48 H new ATOM 0 HA LYS B 72 7.189 -7.286 3.765 1.00 0.49 H new ATOM 0 HB2 LYS B 72 7.682 -4.923 5.639 1.00 0.49 H new ATOM 0 HB3 LYS B 72 6.395 -6.107 5.752 1.00 0.49 H new ATOM 0 HG2 LYS B 72 8.808 -7.627 5.673 1.00 0.65 H new ATOM 0 HG3 LYS B 72 9.144 -6.285 6.748 1.00 0.65 H new ATOM 0 HD2 LYS B 72 7.074 -6.791 8.056 1.00 0.91 H new ATOM 0 HD3 LYS B 72 6.686 -8.102 6.960 1.00 0.91 H new ATOM 0 HE2 LYS B 72 8.076 -9.517 8.085 1.00 1.46 H new ATOM 0 HE3 LYS B 72 9.432 -8.434 7.844 1.00 1.46 H new ATOM 0 HZ1 LYS B 72 8.419 -8.959 10.238 1.00 1.81 H new ATOM 0 HZ2 LYS B 72 9.156 -7.475 9.870 1.00 1.81 H new ATOM 0 HZ3 LYS B 72 7.464 -7.611 9.848 1.00 1.81 H new ATOM 2813 N PHE B 73 7.245 -4.006 3.265 1.00 0.47 N ATOM 2814 CA PHE B 73 6.564 -2.929 2.477 1.00 0.48 C ATOM 2815 C PHE B 73 6.322 -3.397 1.042 1.00 0.51 C ATOM 2816 O PHE B 73 5.208 -3.432 0.572 1.00 0.52 O ATOM 2817 CB PHE B 73 7.446 -1.680 2.458 1.00 0.48 C ATOM 2818 CG PHE B 73 7.475 -1.096 1.066 1.00 0.52 C ATOM 2819 CD1 PHE B 73 6.426 -0.282 0.626 1.00 1.37 C ATOM 2820 CD2 PHE B 73 8.554 -1.366 0.215 1.00 1.25 C ATOM 2821 CE1 PHE B 73 6.453 0.261 -0.664 1.00 1.40 C ATOM 2822 CE2 PHE B 73 8.582 -0.824 -1.075 1.00 1.29 C ATOM 2823 CZ PHE B 73 7.532 -0.010 -1.514 1.00 0.67 C ATOM 0 H PHE B 73 7.981 -3.680 3.892 1.00 0.47 H new ATOM 0 HA PHE B 73 5.606 -2.700 2.944 1.00 0.48 H new ATOM 0 HB2 PHE B 73 7.063 -0.943 3.164 1.00 0.48 H new ATOM 0 HB3 PHE B 73 8.457 -1.933 2.778 1.00 0.48 H new ATOM 0 HD1 PHE B 73 5.594 -0.072 1.282 1.00 1.37 H new ATOM 0 HD2 PHE B 73 9.365 -1.993 0.555 1.00 1.25 H new ATOM 0 HE1 PHE B 73 5.642 0.888 -1.003 1.00 1.40 H new ATOM 0 HE2 PHE B 73 9.414 -1.034 -1.731 1.00 1.29 H new ATOM 0 HZ PHE B 73 7.554 0.409 -2.509 1.00 0.67 H new ATOM 2833 N ASN B 74 7.358 -3.757 0.349 1.00 0.52 N ATOM 2834 CA ASN B 74 7.179 -4.225 -1.053 1.00 0.55 C ATOM 2835 C ASN B 74 6.304 -5.474 -1.046 1.00 0.57 C ATOM 2836 O ASN B 74 5.538 -5.718 -1.957 1.00 0.60 O ATOM 2837 CB ASN B 74 8.541 -4.555 -1.668 1.00 0.57 C ATOM 2838 CG ASN B 74 8.338 -5.268 -3.005 1.00 0.79 C ATOM 2839 OD1 ASN B 74 8.177 -4.632 -4.027 1.00 1.73 O ATOM 2840 ND2 ASN B 74 8.338 -6.572 -3.041 1.00 0.99 N ATOM 0 H ASN B 74 8.320 -3.749 0.688 1.00 0.52 H new ATOM 0 HA ASN B 74 6.705 -3.442 -1.645 1.00 0.55 H new ATOM 0 HB2 ASN B 74 9.117 -3.641 -1.815 1.00 0.57 H new ATOM 0 HB3 ASN B 74 9.114 -5.187 -0.990 1.00 0.57 H new ATOM 0 HD21 ASN B 74 8.203 -7.058 -3.928 1.00 0.99 H new ATOM 0 HD22 ASN B 74 8.473 -7.106 -2.182 1.00 0.99 H new ATOM 2847 N GLU B 75 6.421 -6.272 -0.025 1.00 0.55 N ATOM 2848 CA GLU B 75 5.615 -7.512 0.052 1.00 0.59 C ATOM 2849 C GLU B 75 4.162 -7.171 0.395 1.00 0.57 C ATOM 2850 O GLU B 75 3.252 -7.879 0.015 1.00 0.68 O ATOM 2851 CB GLU B 75 6.208 -8.407 1.137 1.00 0.62 C ATOM 2852 CG GLU B 75 5.853 -9.868 0.859 1.00 1.10 C ATOM 2853 CD GLU B 75 6.495 -10.757 1.925 1.00 1.46 C ATOM 2854 OE1 GLU B 75 7.686 -11.004 1.824 1.00 1.88 O ATOM 2855 OE2 GLU B 75 5.786 -11.177 2.825 1.00 2.12 O ATOM 0 H GLU B 75 7.047 -6.114 0.765 1.00 0.55 H new ATOM 0 HA GLU B 75 5.632 -8.027 -0.908 1.00 0.59 H new ATOM 0 HB2 GLU B 75 7.291 -8.287 1.168 1.00 0.62 H new ATOM 0 HB3 GLU B 75 5.826 -8.111 2.114 1.00 0.62 H new ATOM 0 HG2 GLU B 75 4.771 -9.998 0.864 1.00 1.10 H new ATOM 0 HG3 GLU B 75 6.204 -10.157 -0.132 1.00 1.10 H new ATOM 2862 N MET B 76 3.926 -6.089 1.096 1.00 0.53 N ATOM 2863 CA MET B 76 2.531 -5.711 1.440 1.00 0.51 C ATOM 2864 C MET B 76 2.054 -4.687 0.419 1.00 0.52 C ATOM 2865 O MET B 76 0.906 -4.668 0.023 1.00 0.53 O ATOM 2866 CB MET B 76 2.503 -5.090 2.840 1.00 0.48 C ATOM 2867 CG MET B 76 2.666 -6.189 3.895 1.00 0.48 C ATOM 2868 SD MET B 76 1.104 -6.410 4.784 1.00 0.51 S ATOM 2869 CE MET B 76 1.636 -7.775 5.844 1.00 0.60 C ATOM 0 H MET B 76 4.645 -5.454 1.443 1.00 0.53 H new ATOM 0 HA MET B 76 1.884 -6.588 1.427 1.00 0.51 H new ATOM 0 HB2 MET B 76 3.303 -4.356 2.939 1.00 0.48 H new ATOM 0 HB3 MET B 76 1.563 -4.560 2.995 1.00 0.48 H new ATOM 0 HG2 MET B 76 2.961 -7.124 3.419 1.00 0.48 H new ATOM 0 HG3 MET B 76 3.460 -5.923 4.593 1.00 0.48 H new ATOM 0 HE1 MET B 76 0.811 -8.077 6.489 1.00 0.60 H new ATOM 0 HE2 MET B 76 1.941 -8.619 5.225 1.00 0.60 H new ATOM 0 HE3 MET B 76 2.477 -7.453 6.458 1.00 0.60 H new ATOM 2879 N ARG B 77 2.943 -3.836 -0.017 1.00 0.52 N ATOM 2880 CA ARG B 77 2.570 -2.808 -1.019 1.00 0.54 C ATOM 2881 C ARG B 77 2.053 -3.491 -2.284 1.00 0.57 C ATOM 2882 O ARG B 77 1.025 -3.132 -2.823 1.00 0.57 O ATOM 2883 CB ARG B 77 3.795 -1.957 -1.364 1.00 0.54 C ATOM 2884 CG ARG B 77 3.389 -0.842 -2.330 1.00 0.57 C ATOM 2885 CD ARG B 77 4.162 -0.996 -3.641 1.00 0.62 C ATOM 2886 NE ARG B 77 3.841 0.144 -4.545 1.00 0.86 N ATOM 2887 CZ ARG B 77 2.735 0.136 -5.237 1.00 1.32 C ATOM 2888 NH1 ARG B 77 1.909 -0.868 -5.135 1.00 1.81 N ATOM 2889 NH2 ARG B 77 2.456 1.133 -6.033 1.00 1.80 N ATOM 0 H ARG B 77 3.918 -3.812 0.283 1.00 0.52 H new ATOM 0 HA ARG B 77 1.790 -2.169 -0.606 1.00 0.54 H new ATOM 0 HB2 ARG B 77 4.220 -1.529 -0.456 1.00 0.54 H new ATOM 0 HB3 ARG B 77 4.568 -2.580 -1.815 1.00 0.54 H new ATOM 0 HG2 ARG B 77 2.317 -0.884 -2.521 1.00 0.57 H new ATOM 0 HG3 ARG B 77 3.596 0.132 -1.886 1.00 0.57 H new ATOM 0 HD2 ARG B 77 5.233 -1.026 -3.442 1.00 0.62 H new ATOM 0 HD3 ARG B 77 3.901 -1.939 -4.121 1.00 0.62 H new ATOM 0 HE ARG B 77 4.486 0.931 -4.623 1.00 0.86 H new ATOM 0 HH11 ARG B 77 2.128 -1.647 -4.514 1.00 1.81 H new ATOM 0 HH12 ARG B 77 1.044 -0.874 -5.676 1.00 1.81 H new ATOM 0 HH21 ARG B 77 3.103 1.918 -6.114 1.00 1.80 H new ATOM 0 HH22 ARG B 77 1.591 1.127 -6.574 1.00 1.80 H new ATOM 2903 N LYS B 78 2.752 -4.490 -2.751 1.00 0.58 N ATOM 2904 CA LYS B 78 2.301 -5.214 -3.961 1.00 0.61 C ATOM 2905 C LYS B 78 0.991 -5.903 -3.628 1.00 0.60 C ATOM 2906 O LYS B 78 0.079 -5.956 -4.425 1.00 0.62 O ATOM 2907 CB LYS B 78 3.349 -6.254 -4.357 1.00 0.63 C ATOM 2908 CG LYS B 78 3.068 -6.739 -5.777 1.00 1.17 C ATOM 2909 CD LYS B 78 3.551 -8.180 -5.937 1.00 1.22 C ATOM 2910 CE LYS B 78 3.747 -8.493 -7.422 1.00 1.57 C ATOM 2911 NZ LYS B 78 5.188 -8.362 -7.774 1.00 2.26 N ATOM 0 H LYS B 78 3.620 -4.833 -2.340 1.00 0.58 H new ATOM 0 HA LYS B 78 2.165 -4.523 -4.793 1.00 0.61 H new ATOM 0 HB2 LYS B 78 4.348 -5.821 -4.299 1.00 0.63 H new ATOM 0 HB3 LYS B 78 3.325 -7.094 -3.662 1.00 0.63 H new ATOM 0 HG2 LYS B 78 2.000 -6.678 -5.987 1.00 1.17 H new ATOM 0 HG3 LYS B 78 3.572 -6.095 -6.498 1.00 1.17 H new ATOM 0 HD2 LYS B 78 4.488 -8.322 -5.398 1.00 1.22 H new ATOM 0 HD3 LYS B 78 2.826 -8.868 -5.503 1.00 1.22 H new ATOM 0 HE2 LYS B 78 3.399 -9.503 -7.640 1.00 1.57 H new ATOM 0 HE3 LYS B 78 3.151 -7.812 -8.029 1.00 1.57 H new ATOM 0 HZ1 LYS B 78 5.320 -8.575 -8.783 1.00 2.26 H new ATOM 0 HZ2 LYS B 78 5.506 -7.391 -7.581 1.00 2.26 H new ATOM 0 HZ3 LYS B 78 5.747 -9.029 -7.204 1.00 2.26 H new ATOM 2925 N ASN B 79 0.876 -6.397 -2.428 1.00 0.58 N ATOM 2926 CA ASN B 79 -0.394 -7.047 -2.021 1.00 0.58 C ATOM 2927 C ASN B 79 -1.480 -5.981 -2.017 1.00 0.57 C ATOM 2928 O ASN B 79 -2.548 -6.158 -2.566 1.00 0.57 O ATOM 2929 CB ASN B 79 -0.248 -7.647 -0.623 1.00 0.57 C ATOM 2930 CG ASN B 79 -0.778 -9.081 -0.624 1.00 0.62 C ATOM 2931 OD1 ASN B 79 -0.193 -9.959 -0.020 1.00 1.18 O ATOM 2932 ND2 ASN B 79 -1.870 -9.361 -1.282 1.00 1.16 N ATOM 0 H ASN B 79 1.605 -6.378 -1.715 1.00 0.58 H new ATOM 0 HA ASN B 79 -0.650 -7.850 -2.713 1.00 0.58 H new ATOM 0 HB2 ASN B 79 0.799 -7.635 -0.318 1.00 0.57 H new ATOM 0 HB3 ASN B 79 -0.797 -7.046 0.101 1.00 0.57 H new ATOM 0 HD21 ASN B 79 -2.231 -10.315 -1.289 1.00 1.16 H new ATOM 0 HD22 ASN B 79 -2.362 -8.626 -1.789 1.00 1.16 H new ATOM 2939 N MET B 80 -1.201 -4.856 -1.413 1.00 0.57 N ATOM 2940 CA MET B 80 -2.201 -3.760 -1.389 1.00 0.57 C ATOM 2941 C MET B 80 -2.636 -3.486 -2.828 1.00 0.58 C ATOM 2942 O MET B 80 -3.805 -3.538 -3.151 1.00 0.57 O ATOM 2943 CB MET B 80 -1.567 -2.505 -0.756 1.00 0.60 C ATOM 2944 CG MET B 80 -2.095 -1.227 -1.428 1.00 0.69 C ATOM 2945 SD MET B 80 -1.534 0.223 -0.502 1.00 1.27 S ATOM 2946 CE MET B 80 -2.423 1.470 -1.466 1.00 1.05 C ATOM 0 H MET B 80 -0.322 -4.653 -0.936 1.00 0.57 H new ATOM 0 HA MET B 80 -3.071 -4.037 -0.794 1.00 0.57 H new ATOM 0 HB2 MET B 80 -1.790 -2.479 0.311 1.00 0.60 H new ATOM 0 HB3 MET B 80 -0.482 -2.551 -0.854 1.00 0.60 H new ATOM 0 HG2 MET B 80 -1.741 -1.173 -2.457 1.00 0.69 H new ATOM 0 HG3 MET B 80 -3.184 -1.248 -1.466 1.00 0.69 H new ATOM 0 HE1 MET B 80 -2.484 2.396 -0.894 1.00 1.05 H new ATOM 0 HE2 MET B 80 -1.892 1.654 -2.400 1.00 1.05 H new ATOM 0 HE3 MET B 80 -3.429 1.112 -1.685 1.00 1.05 H new ATOM 2956 N ASP B 81 -1.703 -3.201 -3.703 1.00 0.60 N ATOM 2957 CA ASP B 81 -2.059 -2.934 -5.125 1.00 0.62 C ATOM 2958 C ASP B 81 -2.790 -4.136 -5.722 1.00 0.63 C ATOM 2959 O ASP B 81 -3.769 -3.988 -6.428 1.00 0.64 O ATOM 2960 CB ASP B 81 -0.772 -2.677 -5.912 1.00 0.65 C ATOM 2961 CG ASP B 81 -1.001 -1.546 -6.916 1.00 0.67 C ATOM 2962 OD1 ASP B 81 -2.081 -1.493 -7.482 1.00 1.19 O ATOM 2963 OD2 ASP B 81 -0.093 -0.753 -7.102 1.00 1.23 O ATOM 0 H ASP B 81 -0.707 -3.142 -3.490 1.00 0.60 H new ATOM 0 HA ASP B 81 -2.714 -2.065 -5.179 1.00 0.62 H new ATOM 0 HB2 ASP B 81 0.036 -2.413 -5.230 1.00 0.65 H new ATOM 0 HB3 ASP B 81 -0.466 -3.584 -6.434 1.00 0.65 H new ATOM 2968 N GLN B 82 -2.346 -5.329 -5.427 1.00 0.64 N ATOM 2969 CA GLN B 82 -3.045 -6.532 -5.961 1.00 0.66 C ATOM 2970 C GLN B 82 -4.470 -6.508 -5.420 1.00 0.63 C ATOM 2971 O GLN B 82 -5.440 -6.681 -6.132 1.00 0.65 O ATOM 2972 CB GLN B 82 -2.333 -7.796 -5.466 1.00 0.68 C ATOM 2973 CG GLN B 82 -0.916 -7.852 -6.031 1.00 1.09 C ATOM 2974 CD GLN B 82 -0.850 -8.909 -7.135 1.00 0.83 C ATOM 2975 OE1 GLN B 82 -1.287 -8.674 -8.244 1.00 1.28 O ATOM 2976 NE2 GLN B 82 -0.321 -10.074 -6.877 1.00 1.41 N ATOM 0 H GLN B 82 -1.533 -5.521 -4.842 1.00 0.64 H new ATOM 0 HA GLN B 82 -3.044 -6.530 -7.051 1.00 0.66 H new ATOM 0 HB2 GLN B 82 -2.299 -7.801 -4.377 1.00 0.68 H new ATOM 0 HB3 GLN B 82 -2.891 -8.681 -5.772 1.00 0.68 H new ATOM 0 HG2 GLN B 82 -0.632 -6.877 -6.428 1.00 1.09 H new ATOM 0 HG3 GLN B 82 -0.206 -8.092 -5.239 1.00 1.09 H new ATOM 0 HE21 GLN B 82 0.046 -10.273 -5.946 1.00 1.41 H new ATOM 0 HE22 GLN B 82 -0.275 -10.786 -7.606 1.00 1.41 H new ATOM 2985 N LEU B 83 -4.577 -6.263 -4.149 1.00 0.59 N ATOM 2986 CA LEU B 83 -5.913 -6.189 -3.506 1.00 0.56 C ATOM 2987 C LEU B 83 -6.651 -4.987 -4.099 1.00 0.55 C ATOM 2988 O LEU B 83 -7.815 -5.063 -4.438 1.00 0.56 O ATOM 2989 CB LEU B 83 -5.743 -6.022 -1.996 1.00 0.53 C ATOM 2990 CG LEU B 83 -5.145 -7.310 -1.410 1.00 0.53 C ATOM 2991 CD1 LEU B 83 -4.653 -7.048 0.012 1.00 0.55 C ATOM 2992 CD2 LEU B 83 -6.195 -8.431 -1.384 1.00 0.56 C ATOM 0 H LEU B 83 -3.788 -6.109 -3.521 1.00 0.59 H new ATOM 0 HA LEU B 83 -6.483 -7.100 -3.686 1.00 0.56 H new ATOM 0 HB2 LEU B 83 -5.092 -5.174 -1.783 1.00 0.53 H new ATOM 0 HB3 LEU B 83 -6.706 -5.809 -1.531 1.00 0.53 H new ATOM 0 HG LEU B 83 -4.311 -7.621 -2.039 1.00 0.53 H new ATOM 0 HD11 LEU B 83 -4.229 -7.964 0.425 1.00 0.55 H new ATOM 0 HD12 LEU B 83 -3.890 -6.270 -0.005 1.00 0.55 H new ATOM 0 HD13 LEU B 83 -5.489 -6.723 0.632 1.00 0.55 H new ATOM 0 HD21 LEU B 83 -5.752 -9.335 -0.966 1.00 0.56 H new ATOM 0 HD22 LEU B 83 -7.041 -8.123 -0.769 1.00 0.56 H new ATOM 0 HD23 LEU B 83 -6.538 -8.632 -2.399 1.00 0.56 H new ATOM 3004 N LYS B 84 -5.971 -3.881 -4.242 1.00 0.55 N ATOM 3005 CA LYS B 84 -6.618 -2.674 -4.829 1.00 0.55 C ATOM 3006 C LYS B 84 -7.278 -3.043 -6.161 1.00 0.58 C ATOM 3007 O LYS B 84 -8.422 -2.720 -6.411 1.00 0.58 O ATOM 3008 CB LYS B 84 -5.560 -1.597 -5.077 1.00 0.56 C ATOM 3009 CG LYS B 84 -6.247 -0.286 -5.467 1.00 0.57 C ATOM 3010 CD LYS B 84 -5.656 0.231 -6.782 1.00 0.80 C ATOM 3011 CE LYS B 84 -6.378 1.514 -7.197 1.00 0.80 C ATOM 3012 NZ LYS B 84 -7.203 1.250 -8.409 1.00 1.40 N ATOM 0 H LYS B 84 -4.993 -3.762 -3.977 1.00 0.55 H new ATOM 0 HA LYS B 84 -7.372 -2.298 -4.137 1.00 0.55 H new ATOM 0 HB2 LYS B 84 -4.957 -1.451 -4.181 1.00 0.56 H new ATOM 0 HB3 LYS B 84 -4.882 -1.914 -5.869 1.00 0.56 H new ATOM 0 HG2 LYS B 84 -7.320 -0.444 -5.576 1.00 0.57 H new ATOM 0 HG3 LYS B 84 -6.112 0.455 -4.679 1.00 0.57 H new ATOM 0 HD2 LYS B 84 -4.590 0.424 -6.663 1.00 0.80 H new ATOM 0 HD3 LYS B 84 -5.758 -0.525 -7.561 1.00 0.80 H new ATOM 0 HE2 LYS B 84 -7.011 1.867 -6.383 1.00 0.80 H new ATOM 0 HE3 LYS B 84 -5.653 2.302 -7.402 1.00 0.80 H new ATOM 0 HZ1 LYS B 84 -7.880 2.027 -8.544 1.00 1.40 H new ATOM 0 HZ2 LYS B 84 -6.584 1.182 -9.242 1.00 1.40 H new ATOM 0 HZ3 LYS B 84 -7.721 0.356 -8.288 1.00 1.40 H new ATOM 3026 N GLU B 85 -6.557 -3.712 -7.021 1.00 0.60 N ATOM 3027 CA GLU B 85 -7.128 -4.098 -8.344 1.00 0.63 C ATOM 3028 C GLU B 85 -8.296 -5.063 -8.146 1.00 0.63 C ATOM 3029 O GLU B 85 -9.260 -5.046 -8.887 1.00 0.64 O ATOM 3030 CB GLU B 85 -6.048 -4.788 -9.182 1.00 0.66 C ATOM 3031 CG GLU B 85 -6.709 -5.720 -10.201 1.00 0.69 C ATOM 3032 CD GLU B 85 -5.723 -6.027 -11.330 1.00 0.73 C ATOM 3033 OE1 GLU B 85 -4.809 -6.801 -11.097 1.00 1.21 O ATOM 3034 OE2 GLU B 85 -5.898 -5.483 -12.407 1.00 1.28 O ATOM 0 H GLU B 85 -5.594 -4.009 -6.863 1.00 0.60 H new ATOM 0 HA GLU B 85 -7.480 -3.202 -8.855 1.00 0.63 H new ATOM 0 HB2 GLU B 85 -5.440 -4.043 -9.696 1.00 0.66 H new ATOM 0 HB3 GLU B 85 -5.378 -5.355 -8.536 1.00 0.66 H new ATOM 0 HG2 GLU B 85 -7.020 -6.645 -9.715 1.00 0.69 H new ATOM 0 HG3 GLU B 85 -7.608 -5.254 -10.606 1.00 0.69 H new ATOM 3041 N LYS B 86 -8.228 -5.891 -7.148 1.00 0.63 N ATOM 3042 CA LYS B 86 -9.345 -6.843 -6.898 1.00 0.63 C ATOM 3043 C LYS B 86 -10.589 -6.040 -6.527 1.00 0.61 C ATOM 3044 O LYS B 86 -11.700 -6.384 -6.879 1.00 0.62 O ATOM 3045 CB LYS B 86 -8.976 -7.781 -5.747 1.00 0.64 C ATOM 3046 CG LYS B 86 -9.128 -9.234 -6.201 1.00 0.70 C ATOM 3047 CD LYS B 86 -8.730 -10.169 -5.057 1.00 0.89 C ATOM 3048 CE LYS B 86 -8.796 -11.621 -5.535 1.00 1.09 C ATOM 3049 NZ LYS B 86 -8.239 -12.516 -4.481 1.00 0.99 N ATOM 0 H LYS B 86 -7.449 -5.952 -6.493 1.00 0.63 H new ATOM 0 HA LYS B 86 -9.535 -7.439 -7.791 1.00 0.63 H new ATOM 0 HB2 LYS B 86 -7.951 -7.595 -5.427 1.00 0.64 H new ATOM 0 HB3 LYS B 86 -9.618 -7.589 -4.888 1.00 0.64 H new ATOM 0 HG2 LYS B 86 -10.158 -9.427 -6.501 1.00 0.70 H new ATOM 0 HG3 LYS B 86 -8.501 -9.421 -7.073 1.00 0.70 H new ATOM 0 HD2 LYS B 86 -7.722 -9.933 -4.715 1.00 0.89 H new ATOM 0 HD3 LYS B 86 -9.397 -10.025 -4.207 1.00 0.89 H new ATOM 0 HE2 LYS B 86 -9.828 -11.897 -5.754 1.00 1.09 H new ATOM 0 HE3 LYS B 86 -8.232 -11.737 -6.461 1.00 1.09 H new ATOM 0 HZ1 LYS B 86 -8.283 -13.503 -4.805 1.00 0.99 H new ATOM 0 HZ2 LYS B 86 -7.249 -12.257 -4.293 1.00 0.99 H new ATOM 0 HZ3 LYS B 86 -8.795 -12.413 -3.608 1.00 0.99 H new ATOM 3063 N ILE B 87 -10.399 -4.962 -5.818 1.00 0.59 N ATOM 3064 CA ILE B 87 -11.552 -4.118 -5.412 1.00 0.57 C ATOM 3065 C ILE B 87 -12.164 -3.459 -6.643 1.00 0.57 C ATOM 3066 O ILE B 87 -13.356 -3.535 -6.863 1.00 0.55 O ATOM 3067 CB ILE B 87 -11.072 -3.033 -4.447 1.00 0.59 C ATOM 3068 CG1 ILE B 87 -10.540 -3.685 -3.168 1.00 0.65 C ATOM 3069 CG2 ILE B 87 -12.239 -2.106 -4.100 1.00 0.68 C ATOM 3070 CD1 ILE B 87 -9.791 -2.643 -2.332 1.00 0.70 C ATOM 0 H ILE B 87 -9.488 -4.629 -5.502 1.00 0.59 H new ATOM 0 HA ILE B 87 -12.301 -4.741 -4.923 1.00 0.57 H new ATOM 0 HB ILE B 87 -10.276 -2.455 -4.917 1.00 0.59 H new ATOM 0 HG12 ILE B 87 -11.365 -4.104 -2.591 1.00 0.65 H new ATOM 0 HG13 ILE B 87 -9.875 -4.511 -3.419 1.00 0.65 H new ATOM 0 HG21 ILE B 87 -11.897 -1.333 -3.412 1.00 0.68 H new ATOM 0 HG22 ILE B 87 -12.617 -1.641 -5.010 1.00 0.68 H new ATOM 0 HG23 ILE B 87 -13.035 -2.683 -3.630 1.00 0.68 H new ATOM 0 HD11 ILE B 87 -9.413 -3.110 -1.422 1.00 0.70 H new ATOM 0 HD12 ILE B 87 -8.956 -2.245 -2.909 1.00 0.70 H new ATOM 0 HD13 ILE B 87 -10.470 -1.832 -2.069 1.00 0.70 H new ATOM 3082 N ASN B 88 -11.369 -2.824 -7.462 1.00 0.60 N ATOM 3083 CA ASN B 88 -11.927 -2.180 -8.678 1.00 0.63 C ATOM 3084 C ASN B 88 -12.575 -3.234 -9.572 1.00 0.63 C ATOM 3085 O ASN B 88 -13.508 -2.956 -10.294 1.00 0.64 O ATOM 3086 CB ASN B 88 -10.806 -1.479 -9.448 1.00 0.70 C ATOM 3087 CG ASN B 88 -10.079 -0.505 -8.519 1.00 1.78 C ATOM 3088 OD1 ASN B 88 -9.863 -0.799 -7.360 1.00 2.47 O ATOM 3089 ND2 ASN B 88 -9.689 0.651 -8.982 1.00 2.62 N ATOM 0 H ASN B 88 -10.361 -2.725 -7.339 1.00 0.60 H new ATOM 0 HA ASN B 88 -12.678 -1.448 -8.381 1.00 0.63 H new ATOM 0 HB2 ASN B 88 -10.105 -2.215 -9.841 1.00 0.70 H new ATOM 0 HB3 ASN B 88 -11.218 -0.943 -10.303 1.00 0.70 H new ATOM 0 HD21 ASN B 88 -9.203 1.307 -8.371 1.00 2.62 H new ATOM 0 HD22 ASN B 88 -9.870 0.898 -9.955 1.00 2.62 H new ATOM 3096 N SER B 89 -12.080 -4.439 -9.546 1.00 0.64 N ATOM 3097 CA SER B 89 -12.662 -5.499 -10.411 1.00 0.68 C ATOM 3098 C SER B 89 -14.089 -5.853 -9.970 1.00 0.67 C ATOM 3099 O SER B 89 -14.997 -5.898 -10.774 1.00 0.74 O ATOM 3100 CB SER B 89 -11.787 -6.750 -10.330 1.00 0.70 C ATOM 3101 OG SER B 89 -11.991 -7.542 -11.492 1.00 1.23 O ATOM 0 H SER B 89 -11.297 -4.735 -8.963 1.00 0.64 H new ATOM 0 HA SER B 89 -12.700 -5.126 -11.435 1.00 0.68 H new ATOM 0 HB2 SER B 89 -10.737 -6.469 -10.247 1.00 0.70 H new ATOM 0 HB3 SER B 89 -12.035 -7.324 -9.437 1.00 0.70 H new ATOM 0 HG SER B 89 -11.430 -8.344 -11.444 1.00 1.23 H new ATOM 3107 N VAL B 90 -14.295 -6.117 -8.706 1.00 0.63 N ATOM 3108 CA VAL B 90 -15.662 -6.485 -8.223 1.00 0.64 C ATOM 3109 C VAL B 90 -16.525 -5.240 -8.025 1.00 0.57 C ATOM 3110 O VAL B 90 -17.682 -5.206 -8.395 1.00 0.59 O ATOM 3111 CB VAL B 90 -15.538 -7.216 -6.892 1.00 0.66 C ATOM 3112 CG1 VAL B 90 -16.845 -7.951 -6.588 1.00 0.66 C ATOM 3113 CG2 VAL B 90 -14.391 -8.226 -6.969 1.00 0.89 C ATOM 0 H VAL B 90 -13.574 -6.094 -7.985 1.00 0.63 H new ATOM 0 HA VAL B 90 -16.135 -7.123 -8.970 1.00 0.64 H new ATOM 0 HB VAL B 90 -15.335 -6.495 -6.100 1.00 0.66 H new ATOM 0 HG11 VAL B 90 -16.755 -8.474 -5.636 1.00 0.66 H new ATOM 0 HG12 VAL B 90 -17.662 -7.232 -6.532 1.00 0.66 H new ATOM 0 HG13 VAL B 90 -17.050 -8.672 -7.380 1.00 0.66 H new ATOM 0 HG21 VAL B 90 -14.302 -8.749 -6.017 1.00 0.89 H new ATOM 0 HG22 VAL B 90 -14.593 -8.947 -7.761 1.00 0.89 H new ATOM 0 HG23 VAL B 90 -13.459 -7.703 -7.184 1.00 0.89 H new ATOM 3123 N LEU B 91 -15.966 -4.217 -7.442 1.00 0.51 N ATOM 3124 CA LEU B 91 -16.746 -2.970 -7.213 1.00 0.49 C ATOM 3125 C LEU B 91 -16.883 -2.247 -8.546 1.00 0.57 C ATOM 3126 O LEU B 91 -17.622 -1.296 -8.677 1.00 0.61 O ATOM 3127 CB LEU B 91 -15.997 -2.091 -6.199 1.00 0.47 C ATOM 3128 CG LEU B 91 -16.722 -0.756 -5.987 1.00 0.59 C ATOM 3129 CD1 LEU B 91 -18.183 -1.003 -5.606 1.00 0.91 C ATOM 3130 CD2 LEU B 91 -16.031 0.012 -4.859 1.00 0.84 C ATOM 0 H LEU B 91 -15.001 -4.191 -7.114 1.00 0.51 H new ATOM 0 HA LEU B 91 -17.736 -3.195 -6.816 1.00 0.49 H new ATOM 0 HB2 LEU B 91 -15.912 -2.618 -5.249 1.00 0.47 H new ATOM 0 HB3 LEU B 91 -14.983 -1.906 -6.552 1.00 0.47 H new ATOM 0 HG LEU B 91 -16.689 -0.179 -6.911 1.00 0.59 H new ATOM 0 HD11 LEU B 91 -18.687 -0.048 -5.458 1.00 0.91 H new ATOM 0 HD12 LEU B 91 -18.679 -1.555 -6.404 1.00 0.91 H new ATOM 0 HD13 LEU B 91 -18.226 -1.582 -4.684 1.00 0.91 H new ATOM 0 HD21 LEU B 91 -16.540 0.963 -4.701 1.00 0.84 H new ATOM 0 HD22 LEU B 91 -16.069 -0.576 -3.942 1.00 0.84 H new ATOM 0 HD23 LEU B 91 -14.991 0.197 -5.129 1.00 0.84 H new ATOM 3142 N SER B 92 -16.195 -2.733 -9.545 1.00 0.63 N ATOM 3143 CA SER B 92 -16.277 -2.112 -10.903 1.00 0.76 C ATOM 3144 C SER B 92 -16.321 -0.585 -10.792 1.00 0.83 C ATOM 3145 O SER B 92 -16.737 0.087 -11.708 1.00 1.11 O ATOM 3146 CB SER B 92 -17.546 -2.604 -11.601 1.00 0.72 C ATOM 3147 OG SER B 92 -17.191 -3.277 -12.801 1.00 0.89 O ATOM 0 H SER B 92 -15.574 -3.540 -9.479 1.00 0.63 H new ATOM 0 HA SER B 92 -15.396 -2.397 -11.478 1.00 0.76 H new ATOM 0 HB2 SER B 92 -18.099 -3.275 -10.944 1.00 0.72 H new ATOM 0 HB3 SER B 92 -18.202 -1.763 -11.823 1.00 0.72 H new ATOM 0 HG SER B 92 -18.002 -3.595 -13.250 1.00 0.89 H new ATOM 3153 N ILE B 93 -15.867 -0.045 -9.687 1.00 0.74 N ATOM 3154 CA ILE B 93 -15.849 1.452 -9.495 1.00 0.82 C ATOM 3155 C ILE B 93 -17.121 2.112 -10.055 1.00 1.03 C ATOM 3156 O ILE B 93 -18.014 2.475 -9.315 1.00 1.11 O ATOM 3157 CB ILE B 93 -14.613 2.039 -10.183 1.00 0.92 C ATOM 3158 CG1 ILE B 93 -13.370 1.226 -9.788 1.00 0.87 C ATOM 3159 CG2 ILE B 93 -14.424 3.505 -9.767 1.00 1.13 C ATOM 3160 CD1 ILE B 93 -13.270 1.114 -8.261 1.00 1.43 C ATOM 0 H ILE B 93 -15.503 -0.578 -8.897 1.00 0.74 H new ATOM 0 HA ILE B 93 -15.813 1.656 -8.425 1.00 0.82 H new ATOM 0 HB ILE B 93 -14.751 1.992 -11.263 1.00 0.92 H new ATOM 0 HG12 ILE B 93 -13.422 0.231 -10.230 1.00 0.87 H new ATOM 0 HG13 ILE B 93 -12.474 1.704 -10.184 1.00 0.87 H new ATOM 0 HG21 ILE B 93 -13.543 3.913 -10.262 1.00 1.13 H new ATOM 0 HG22 ILE B 93 -15.302 4.082 -10.057 1.00 1.13 H new ATOM 0 HG23 ILE B 93 -14.293 3.563 -8.686 1.00 1.13 H new ATOM 0 HD11 ILE B 93 -12.385 0.536 -7.996 1.00 1.43 H new ATOM 0 HD12 ILE B 93 -13.195 2.111 -7.827 1.00 1.43 H new ATOM 0 HD13 ILE B 93 -14.159 0.616 -7.874 1.00 1.43 H new ATOM 3172 N ARG B 94 -17.213 2.283 -11.347 1.00 1.25 N ATOM 3173 CA ARG B 94 -18.423 2.921 -11.939 1.00 1.52 C ATOM 3174 C ARG B 94 -18.651 2.361 -13.345 1.00 1.60 C ATOM 3175 O ARG B 94 -19.324 2.958 -14.162 1.00 1.76 O ATOM 3176 CB ARG B 94 -18.226 4.442 -12.024 1.00 1.97 C ATOM 3177 CG ARG B 94 -16.774 4.775 -12.389 1.00 2.23 C ATOM 3178 CD ARG B 94 -16.426 4.173 -13.754 1.00 2.52 C ATOM 3179 NE ARG B 94 -15.248 4.885 -14.326 1.00 3.12 N ATOM 3180 CZ ARG B 94 -14.518 4.309 -15.244 1.00 3.73 C ATOM 3181 NH1 ARG B 94 -14.823 3.112 -15.664 1.00 3.88 N ATOM 3182 NH2 ARG B 94 -13.486 4.933 -15.742 1.00 4.55 N ATOM 0 H ARG B 94 -16.498 2.007 -12.020 1.00 1.25 H new ATOM 0 HA ARG B 94 -19.287 2.707 -11.309 1.00 1.52 H new ATOM 0 HB2 ARG B 94 -18.900 4.861 -12.771 1.00 1.97 H new ATOM 0 HB3 ARG B 94 -18.482 4.902 -11.070 1.00 1.97 H new ATOM 0 HG2 ARG B 94 -16.635 5.856 -12.413 1.00 2.23 H new ATOM 0 HG3 ARG B 94 -16.100 4.384 -11.627 1.00 2.23 H new ATOM 0 HD2 ARG B 94 -16.206 3.110 -13.649 1.00 2.52 H new ATOM 0 HD3 ARG B 94 -17.278 4.258 -14.428 1.00 2.52 H new ATOM 0 HE ARG B 94 -15.012 5.822 -14.001 1.00 3.12 H new ATOM 0 HH11 ARG B 94 -15.631 2.626 -15.276 1.00 3.88 H new ATOM 0 HH12 ARG B 94 -14.253 2.662 -16.381 1.00 3.88 H new ATOM 0 HH21 ARG B 94 -13.250 5.870 -15.415 1.00 4.55 H new ATOM 0 HH22 ARG B 94 -12.916 4.484 -16.459 1.00 4.55 H new ATOM 3196 N GLN B 95 -18.090 1.215 -13.629 1.00 1.55 N ATOM 3197 CA GLN B 95 -18.265 0.606 -14.980 1.00 1.73 C ATOM 3198 C GLN B 95 -17.400 1.358 -15.994 1.00 2.40 C ATOM 3199 O GLN B 95 -17.700 2.509 -16.261 1.00 2.92 O ATOM 3200 CB GLN B 95 -19.734 0.688 -15.400 1.00 1.94 C ATOM 3201 CG GLN B 95 -20.111 -0.571 -16.183 1.00 2.44 C ATOM 3202 CD GLN B 95 -21.563 -0.470 -16.651 1.00 2.98 C ATOM 3203 OE1 GLN B 95 -22.097 0.612 -16.785 1.00 3.53 O ATOM 3204 NE2 GLN B 95 -22.230 -1.563 -16.904 1.00 3.31 N ATOM 3205 OXT GLN B 95 -16.452 0.767 -16.486 1.00 3.00 O ATOM 0 H GLN B 95 -17.517 0.674 -12.982 1.00 1.55 H new ATOM 0 HA GLN B 95 -17.960 -0.440 -14.945 1.00 1.73 H new ATOM 0 HB2 GLN B 95 -20.370 0.786 -14.520 1.00 1.94 H new ATOM 0 HB3 GLN B 95 -19.899 1.574 -16.013 1.00 1.94 H new ATOM 0 HG2 GLN B 95 -19.449 -0.689 -17.041 1.00 2.44 H new ATOM 0 HG3 GLN B 95 -19.981 -1.453 -15.556 1.00 2.44 H new ATOM 0 HE21 GLN B 95 -21.781 -2.472 -16.791 1.00 3.31 H new ATOM 0 HE22 GLN B 95 -23.200 -1.508 -17.214 1.00 3.31 H new TER 3214 GLN B 95