USER MOD reduce.3.24.130724 H: found=0, std=0, add=1474, rem=0, adj=47 USER MOD reduce.3.24.130724 removed 1470 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 17 HIS : no HE2:sc= -0.312 K(o=2.3,f=-2.4!) USER MOD Set 1.2: A 27 HIS : no HE2:sc= 0.8 K(o=2.3,f=-5) USER MOD Set 1.3: B 89 LYS NZ :NH3+ -163:sc= 1.77 (180deg=0.353) USER MOD Set 2.1: B 46 SER OG : rot 130:sc= 1.39 USER MOD Set 2.2: B 49 GLN : amide:sc= 1.02 K(o=2.4,f=-2.2) USER MOD Set 3.1: B 39 GLN : amide:sc= 0.477 K(o=1.9,f=-1.8) USER MOD Set 3.2: B 47 LYS NZ :NH3+ -169:sc= 1.4 (180deg=0.574) USER MOD Set 4.1: B 17 HIS : no HE2:sc= 1.08 K(o=2.1,f=-7.4!) USER MOD Set 4.2: B 27 HIS : no HE2:sc= 0.995 K(o=2.1,f=-7.9!) USER MOD Set 5.1: A 85 ASN : amide:sc= 1.8 K(o=2.4,f=-1.6) USER MOD Set 5.2: A 89 LYS NZ :NH3+ 163:sc= 0.551 (180deg=-0.0416) USER MOD Set 6.1: A 43 THR OG1 : rot 45:sc= 0.87 USER MOD Set 6.2: B 1 MET N :NH3+ -165:sc= 1.18 (180deg=0) USER MOD Set 7.1: A 31 LYS NZ :NH3+ -151:sc= 0.914 (180deg=0) USER MOD Set 7.2: A 66 GLN : amide:sc= 0.926 K(o=1.8,f=-2.6) USER MOD Set 8.1: A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 8.2: B 18 LYS NZ :NH3+ 173:sc= 0.511 (180deg=0.449) USER MOD Single : A 1 MET N :NH3+ 147:sc= 0.74 (180deg=-0.216) USER MOD Single : A 3 SER OG : rot 180:sc= 0.0618 USER MOD Single : A 7 GLN : amide:sc= 0 X(o=0,f=-0.041) USER MOD Single : A 18 LYS NZ :NH3+ 173:sc= -0.0104 (180deg=-0.0593) USER MOD Single : A 19 TYR OH : rot 119:sc= 1.06 USER MOD Single : A 20 SER OG : rot 73:sc= 0.937 USER MOD Single : A 22 LYS NZ :NH3+ -175:sc= 0.543 (180deg=0.537) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot -109:sc= 1.06 USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ -169:sc=-0.00496 (180deg=-0.115) USER MOD Single : A 35 LYS NZ :NH3+ -171:sc=-0.000129 (180deg=-0.0954) USER MOD Single : A 39 GLN : amide:sc= 0.223 X(o=0.22,f=0) USER MOD Single : A 40 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0338) USER MOD Single : A 46 SER OG : rot 180:sc= -0.0827 USER MOD Single : A 47 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00391) USER MOD Single : A 49 GLN : amide:sc= -0.0891 X(o=-0.089,f=-0.089) USER MOD Single : A 55 LYS NZ :NH3+ 174:sc= 0.0554 (180deg=0.0514) USER MOD Single : A 57 MET CE :methyl 172:sc= 0 (180deg=-0.0685) USER MOD Single : A 63 ASN : amide:sc= 1.09 K(o=1.1,f=-0.03) USER MOD Single : A 64 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.046) USER MOD Single : A 69 ASN : amide:sc= 1.14 K(o=1.1,f=-1) USER MOD Single : A 71 GLN : amide:sc= 1.16 K(o=1.2,f=-0.22) USER MOD Single : A 73 TYR OH : rot -24:sc= 1 USER MOD Single : A 75 THR OG1 : rot 74:sc= 0.993 USER MOD Single : A 82 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 84 TYR OH : rot 175:sc= 1.26 USER MOD Single : B 1 MET CE :methyl 179:sc= 0 (180deg=-0.00257) USER MOD Single : B 3 SER OG : rot 180:sc= 0.0865 USER MOD Single : B 7 GLN : amide:sc= 0.755 K(o=0.76,f=0) USER MOD Single : B 19 TYR OH : rot 18:sc= 1.25 USER MOD Single : B 20 SER OG : rot -82:sc= 0.966 USER MOD Single : B 22 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.018) USER MOD Single : B 26 LYS NZ :NH3+ 180:sc= 0.576 (180deg=0.576) USER MOD Single : B 28 THR OG1 : rot 180:sc= 0 USER MOD Single : B 30 SER OG : rot -77:sc= 1.08 USER MOD Single : B 31 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00528) USER MOD Single : B 32 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0723) USER MOD Single : B 35 LYS NZ :NH3+ -165:sc= 0 (180deg=-0.225) USER MOD Single : B 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 43 THR OG1 : rot -74:sc= 1.33 USER MOD Single : B 55 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0301) USER MOD Single : B 57 MET CE :methyl -165:sc=-0.00874 (180deg=-0.23) USER MOD Single : B 63 ASN : amide:sc= 0.00725 K(o=0.0073,f=-7.6!) USER MOD Single : B 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 66 GLN : amide:sc= 1.17 K(o=1.2,f=0) USER MOD Single : B 69 ASN : amide:sc= 0.0678 K(o=0.068,f=-2.2!) USER MOD Single : B 71 GLN : amide:sc= 0 K(o=0,f=-0.97) USER MOD Single : B 73 TYR OH : rot 153:sc= 1.17 USER MOD Single : B 75 THR OG1 : rot 78:sc= 0.996 USER MOD Single : B 82 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 84 TYR OH : rot 180:sc= 0 USER MOD Single : B 85 ASN : amide:sc= 1.04 K(o=1,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -12.145 1.676 -5.680 1.00 0.00 N ATOM 2 CA MET A 1 -10.689 1.447 -5.612 1.00 0.00 C ATOM 3 C MET A 1 -10.330 0.168 -4.834 1.00 0.00 C ATOM 4 O MET A 1 -9.185 0.006 -4.421 1.00 0.00 O ATOM 5 CB MET A 1 -9.948 2.678 -5.061 1.00 0.00 C ATOM 6 CG MET A 1 -9.998 3.877 -6.014 1.00 0.00 C ATOM 7 SD MET A 1 -8.972 5.278 -5.492 1.00 0.00 S ATOM 8 CE MET A 1 -9.237 6.394 -6.888 1.00 0.00 C ATOM 0 H1 MET A 1 -12.336 2.698 -5.677 1.00 0.00 H new ATOM 0 H2 MET A 1 -12.522 1.256 -6.553 1.00 0.00 H new ATOM 0 H3 MET A 1 -12.604 1.236 -4.857 1.00 0.00 H new ATOM 0 HA MET A 1 -10.348 1.291 -6.636 1.00 0.00 H new ATOM 0 HB2 MET A 1 -10.386 2.962 -4.104 1.00 0.00 H new ATOM 0 HB3 MET A 1 -8.908 2.415 -4.870 1.00 0.00 H new ATOM 0 HG2 MET A 1 -9.677 3.554 -7.004 1.00 0.00 H new ATOM 0 HG3 MET A 1 -11.031 4.211 -6.107 1.00 0.00 H new ATOM 0 HE1 MET A 1 -8.674 7.314 -6.730 1.00 0.00 H new ATOM 0 HE2 MET A 1 -8.899 5.914 -7.807 1.00 0.00 H new ATOM 0 HE3 MET A 1 -10.298 6.628 -6.970 1.00 0.00 H new ATOM 20 N ALA A 2 -11.284 -0.755 -4.666 1.00 0.00 N ATOM 21 CA ALA A 2 -11.085 -2.050 -4.024 1.00 0.00 C ATOM 22 C ALA A 2 -9.795 -2.721 -4.501 1.00 0.00 C ATOM 23 O ALA A 2 -8.856 -2.893 -3.726 1.00 0.00 O ATOM 24 CB ALA A 2 -12.298 -2.948 -4.302 1.00 0.00 C ATOM 0 H ALA A 2 -12.243 -0.613 -4.984 1.00 0.00 H new ATOM 0 HA ALA A 2 -10.988 -1.893 -2.950 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -12.151 -3.916 -3.823 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -13.197 -2.479 -3.903 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -12.408 -3.088 -5.377 1.00 0.00 H new ATOM 30 N SER A 3 -9.744 -3.077 -5.786 1.00 0.00 N ATOM 31 CA SER A 3 -8.601 -3.714 -6.411 1.00 0.00 C ATOM 32 C SER A 3 -7.317 -2.899 -6.193 1.00 0.00 C ATOM 33 O SER A 3 -6.387 -3.444 -5.606 1.00 0.00 O ATOM 34 CB SER A 3 -8.932 -4.027 -7.878 1.00 0.00 C ATOM 35 OG SER A 3 -10.065 -3.277 -8.298 1.00 0.00 O ATOM 0 H SER A 3 -10.520 -2.923 -6.430 1.00 0.00 H new ATOM 0 HA SER A 3 -8.391 -4.671 -5.934 1.00 0.00 H new ATOM 0 HB2 SER A 3 -8.076 -3.790 -8.510 1.00 0.00 H new ATOM 0 HB3 SER A 3 -9.129 -5.093 -7.994 1.00 0.00 H new ATOM 0 HG SER A 3 -10.265 -3.484 -9.235 1.00 0.00 H new ATOM 41 N PRO A 4 -7.250 -1.617 -6.605 1.00 0.00 N ATOM 42 CA PRO A 4 -6.164 -0.704 -6.264 1.00 0.00 C ATOM 43 C PRO A 4 -5.662 -0.821 -4.816 1.00 0.00 C ATOM 44 O PRO A 4 -4.461 -0.980 -4.588 1.00 0.00 O ATOM 45 CB PRO A 4 -6.687 0.690 -6.601 1.00 0.00 C ATOM 46 CG PRO A 4 -7.584 0.420 -7.805 1.00 0.00 C ATOM 47 CD PRO A 4 -8.185 -0.953 -7.502 1.00 0.00 C ATOM 0 HA PRO A 4 -5.271 -0.952 -6.837 1.00 0.00 H new ATOM 0 HB2 PRO A 4 -7.242 1.128 -5.771 1.00 0.00 H new ATOM 0 HB3 PRO A 4 -5.879 1.380 -6.843 1.00 0.00 H new ATOM 0 HG2 PRO A 4 -8.356 1.182 -7.909 1.00 0.00 H new ATOM 0 HG3 PRO A 4 -7.016 0.413 -8.735 1.00 0.00 H new ATOM 0 HD2 PRO A 4 -9.166 -0.854 -7.038 1.00 0.00 H new ATOM 0 HD3 PRO A 4 -8.322 -1.529 -8.417 1.00 0.00 H new ATOM 55 N LEU A 5 -6.551 -0.762 -3.822 1.00 0.00 N ATOM 56 CA LEU A 5 -6.115 -0.916 -2.443 1.00 0.00 C ATOM 57 C LEU A 5 -5.557 -2.319 -2.216 1.00 0.00 C ATOM 58 O LEU A 5 -4.480 -2.461 -1.643 1.00 0.00 O ATOM 59 CB LEU A 5 -7.232 -0.606 -1.442 1.00 0.00 C ATOM 60 CG LEU A 5 -6.728 -0.760 0.008 1.00 0.00 C ATOM 61 CD1 LEU A 5 -5.566 0.178 0.345 1.00 0.00 C ATOM 62 CD2 LEU A 5 -7.849 -0.462 0.997 1.00 0.00 C ATOM 0 H LEU A 5 -7.552 -0.612 -3.946 1.00 0.00 H new ATOM 0 HA LEU A 5 -5.323 -0.187 -2.269 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -7.596 0.409 -1.599 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -8.075 -1.276 -1.612 1.00 0.00 H new ATOM 0 HG LEU A 5 -6.384 -1.791 0.089 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -5.259 0.020 1.379 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -4.727 -0.029 -0.319 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -5.884 1.212 0.215 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -7.476 -0.575 2.015 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -8.201 0.559 0.851 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -8.673 -1.156 0.833 1.00 0.00 H new ATOM 74 N ASP A 6 -6.285 -3.352 -2.646 1.00 0.00 N ATOM 75 CA ASP A 6 -5.884 -4.740 -2.449 1.00 0.00 C ATOM 76 C ASP A 6 -4.472 -4.968 -2.990 1.00 0.00 C ATOM 77 O ASP A 6 -3.638 -5.543 -2.295 1.00 0.00 O ATOM 78 CB ASP A 6 -6.884 -5.712 -3.091 1.00 0.00 C ATOM 79 CG ASP A 6 -8.274 -5.668 -2.457 1.00 0.00 C ATOM 80 OD1 ASP A 6 -8.338 -5.537 -1.214 1.00 0.00 O ATOM 81 OD2 ASP A 6 -9.250 -5.797 -3.227 1.00 0.00 O ATOM 0 H ASP A 6 -7.170 -3.246 -3.141 1.00 0.00 H new ATOM 0 HA ASP A 6 -5.880 -4.940 -1.378 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -6.971 -5.482 -4.153 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -6.492 -6.726 -3.016 1.00 0.00 H new ATOM 86 N GLN A 7 -4.182 -4.500 -4.207 1.00 0.00 N ATOM 87 CA GLN A 7 -2.834 -4.598 -4.754 1.00 0.00 C ATOM 88 C GLN A 7 -1.842 -3.782 -3.922 1.00 0.00 C ATOM 89 O GLN A 7 -0.733 -4.247 -3.682 1.00 0.00 O ATOM 90 CB GLN A 7 -2.782 -4.253 -6.250 1.00 0.00 C ATOM 91 CG GLN A 7 -3.203 -2.819 -6.585 1.00 0.00 C ATOM 92 CD GLN A 7 -3.176 -2.566 -8.087 1.00 0.00 C ATOM 93 OE1 GLN A 7 -4.218 -2.484 -8.728 1.00 0.00 O ATOM 94 NE2 GLN A 7 -1.985 -2.440 -8.664 1.00 0.00 N ATOM 0 H GLN A 7 -4.859 -4.053 -4.825 1.00 0.00 H new ATOM 0 HA GLN A 7 -2.527 -5.642 -4.684 1.00 0.00 H new ATOM 0 HB2 GLN A 7 -1.767 -4.414 -6.612 1.00 0.00 H new ATOM 0 HB3 GLN A 7 -3.427 -4.944 -6.792 1.00 0.00 H new ATOM 0 HG2 GLN A 7 -4.207 -2.634 -6.202 1.00 0.00 H new ATOM 0 HG3 GLN A 7 -2.536 -2.117 -6.085 1.00 0.00 H new ATOM 0 HE21 GLN A 7 -1.136 -2.513 -8.103 1.00 0.00 H new ATOM 0 HE22 GLN A 7 -1.920 -2.270 -9.668 1.00 0.00 H new ATOM 103 N ALA A 8 -2.214 -2.582 -3.467 1.00 0.00 N ATOM 104 CA ALA A 8 -1.322 -1.778 -2.641 1.00 0.00 C ATOM 105 C ALA A 8 -0.953 -2.496 -1.340 1.00 0.00 C ATOM 106 O ALA A 8 0.229 -2.702 -1.077 1.00 0.00 O ATOM 107 CB ALA A 8 -1.924 -0.404 -2.378 1.00 0.00 C ATOM 0 H ALA A 8 -3.120 -2.153 -3.657 1.00 0.00 H new ATOM 0 HA ALA A 8 -0.393 -1.635 -3.193 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -1.242 0.180 -1.760 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -2.085 0.110 -3.326 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -2.876 -0.517 -1.860 1.00 0.00 H new ATOM 113 N ILE A 9 -1.937 -2.906 -0.532 1.00 0.00 N ATOM 114 CA ILE A 9 -1.648 -3.679 0.675 1.00 0.00 C ATOM 115 C ILE A 9 -0.872 -4.945 0.279 1.00 0.00 C ATOM 116 O ILE A 9 0.145 -5.277 0.886 1.00 0.00 O ATOM 117 CB ILE A 9 -2.908 -3.924 1.537 1.00 0.00 C ATOM 118 CG1 ILE A 9 -3.953 -4.836 0.887 1.00 0.00 C ATOM 119 CG2 ILE A 9 -3.518 -2.576 1.944 1.00 0.00 C ATOM 120 CD1 ILE A 9 -5.166 -5.093 1.789 1.00 0.00 C ATOM 0 H ILE A 9 -2.927 -2.717 -0.691 1.00 0.00 H new ATOM 0 HA ILE A 9 -1.005 -3.104 1.341 1.00 0.00 H new ATOM 0 HB ILE A 9 -2.581 -4.469 2.422 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -4.290 -4.386 -0.047 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -3.488 -5.788 0.632 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -4.406 -2.747 2.552 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -2.789 -2.006 2.520 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -3.792 -2.016 1.050 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -5.871 -5.745 1.274 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -4.838 -5.570 2.712 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -5.652 -4.146 2.023 1.00 0.00 H new ATOM 132 N GLY A 10 -1.304 -5.595 -0.808 1.00 0.00 N ATOM 133 CA GLY A 10 -0.617 -6.695 -1.464 1.00 0.00 C ATOM 134 C GLY A 10 0.872 -6.425 -1.675 1.00 0.00 C ATOM 135 O GLY A 10 1.687 -7.313 -1.456 1.00 0.00 O ATOM 0 H GLY A 10 -2.181 -5.352 -1.268 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -0.736 -7.599 -0.867 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -1.087 -6.886 -2.429 1.00 0.00 H new ATOM 139 N LEU A 11 1.239 -5.214 -2.099 1.00 0.00 N ATOM 140 CA LEU A 11 2.618 -4.822 -2.349 1.00 0.00 C ATOM 141 C LEU A 11 3.425 -4.966 -1.058 1.00 0.00 C ATOM 142 O LEU A 11 4.375 -5.745 -1.003 1.00 0.00 O ATOM 143 CB LEU A 11 2.641 -3.385 -2.908 1.00 0.00 C ATOM 144 CG LEU A 11 3.896 -2.960 -3.684 1.00 0.00 C ATOM 145 CD1 LEU A 11 5.191 -3.180 -2.907 1.00 0.00 C ATOM 146 CD2 LEU A 11 3.961 -3.615 -5.066 1.00 0.00 C ATOM 0 H LEU A 11 0.569 -4.467 -2.280 1.00 0.00 H new ATOM 0 HA LEU A 11 3.080 -5.470 -3.094 1.00 0.00 H new ATOM 0 HB2 LEU A 11 1.779 -3.263 -3.564 1.00 0.00 H new ATOM 0 HB3 LEU A 11 2.508 -2.695 -2.075 1.00 0.00 H new ATOM 0 HG LEU A 11 3.803 -1.883 -3.826 1.00 0.00 H new ATOM 0 HD11 LEU A 11 6.038 -2.859 -3.513 1.00 0.00 H new ATOM 0 HD12 LEU A 11 5.165 -2.600 -1.984 1.00 0.00 H new ATOM 0 HD13 LEU A 11 5.297 -4.238 -2.668 1.00 0.00 H new ATOM 0 HD21 LEU A 11 4.864 -3.288 -5.582 1.00 0.00 H new ATOM 0 HD22 LEU A 11 3.980 -4.699 -4.954 1.00 0.00 H new ATOM 0 HD23 LEU A 11 3.086 -3.325 -5.648 1.00 0.00 H new ATOM 158 N LEU A 12 3.027 -4.237 -0.012 1.00 0.00 N ATOM 159 CA LEU A 12 3.652 -4.301 1.306 1.00 0.00 C ATOM 160 C LEU A 12 3.743 -5.756 1.773 1.00 0.00 C ATOM 161 O LEU A 12 4.796 -6.221 2.216 1.00 0.00 O ATOM 162 CB LEU A 12 2.835 -3.479 2.322 1.00 0.00 C ATOM 163 CG LEU A 12 3.037 -1.956 2.241 1.00 0.00 C ATOM 164 CD1 LEU A 12 2.515 -1.334 0.941 1.00 0.00 C ATOM 165 CD2 LEU A 12 2.315 -1.270 3.406 1.00 0.00 C ATOM 0 H LEU A 12 2.250 -3.577 -0.061 1.00 0.00 H new ATOM 0 HA LEU A 12 4.657 -3.884 1.237 1.00 0.00 H new ATOM 0 HB2 LEU A 12 1.777 -3.698 2.176 1.00 0.00 H new ATOM 0 HB3 LEU A 12 3.094 -3.811 3.327 1.00 0.00 H new ATOM 0 HG LEU A 12 4.115 -1.800 2.281 1.00 0.00 H new ATOM 0 HD11 LEU A 12 2.692 -0.259 0.956 1.00 0.00 H new ATOM 0 HD12 LEU A 12 3.036 -1.776 0.091 1.00 0.00 H new ATOM 0 HD13 LEU A 12 1.446 -1.525 0.850 1.00 0.00 H new ATOM 0 HD21 LEU A 12 2.463 -0.192 3.342 1.00 0.00 H new ATOM 0 HD22 LEU A 12 1.249 -1.494 3.356 1.00 0.00 H new ATOM 0 HD23 LEU A 12 2.719 -1.636 4.350 1.00 0.00 H new ATOM 177 N ILE A 13 2.623 -6.477 1.675 1.00 0.00 N ATOM 178 CA ILE A 13 2.530 -7.855 2.129 1.00 0.00 C ATOM 179 C ILE A 13 3.553 -8.717 1.393 1.00 0.00 C ATOM 180 O ILE A 13 4.313 -9.445 2.027 1.00 0.00 O ATOM 181 CB ILE A 13 1.087 -8.369 1.951 1.00 0.00 C ATOM 182 CG1 ILE A 13 0.142 -7.647 2.925 1.00 0.00 C ATOM 183 CG2 ILE A 13 0.994 -9.877 2.197 1.00 0.00 C ATOM 184 CD1 ILE A 13 -1.323 -7.750 2.492 1.00 0.00 C ATOM 0 H ILE A 13 1.757 -6.115 1.277 1.00 0.00 H new ATOM 0 HA ILE A 13 2.766 -7.913 3.192 1.00 0.00 H new ATOM 0 HB ILE A 13 0.793 -8.163 0.922 1.00 0.00 H new ATOM 0 HG12 ILE A 13 0.255 -8.073 3.922 1.00 0.00 H new ATOM 0 HG13 ILE A 13 0.426 -6.597 2.993 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -0.037 -10.205 2.063 1.00 0.00 H new ATOM 0 HG22 ILE A 13 1.636 -10.401 1.489 1.00 0.00 H new ATOM 0 HG23 ILE A 13 1.316 -10.100 3.214 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -1.953 -7.225 3.211 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -1.444 -7.300 1.507 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -1.617 -8.799 2.450 1.00 0.00 H new ATOM 196 N GLY A 14 3.571 -8.633 0.064 1.00 0.00 N ATOM 197 CA GLY A 14 4.476 -9.373 -0.789 1.00 0.00 C ATOM 198 C GLY A 14 5.919 -9.053 -0.427 1.00 0.00 C ATOM 199 O GLY A 14 6.698 -9.964 -0.151 1.00 0.00 O ATOM 0 H GLY A 14 2.935 -8.029 -0.456 1.00 0.00 H new ATOM 0 HA2 GLY A 14 4.295 -10.443 -0.682 1.00 0.00 H new ATOM 0 HA3 GLY A 14 4.291 -9.121 -1.833 1.00 0.00 H new ATOM 203 N ILE A 15 6.271 -7.763 -0.410 1.00 0.00 N ATOM 204 CA ILE A 15 7.601 -7.307 -0.031 1.00 0.00 C ATOM 205 C ILE A 15 8.020 -7.973 1.283 1.00 0.00 C ATOM 206 O ILE A 15 9.081 -8.590 1.364 1.00 0.00 O ATOM 207 CB ILE A 15 7.647 -5.762 -0.020 1.00 0.00 C ATOM 208 CG1 ILE A 15 8.000 -5.288 -1.441 1.00 0.00 C ATOM 209 CG2 ILE A 15 8.647 -5.213 0.999 1.00 0.00 C ATOM 210 CD1 ILE A 15 8.101 -3.769 -1.594 1.00 0.00 C ATOM 0 H ILE A 15 5.634 -7.007 -0.661 1.00 0.00 H new ATOM 0 HA ILE A 15 8.344 -7.613 -0.767 1.00 0.00 H new ATOM 0 HB ILE A 15 6.671 -5.382 0.282 1.00 0.00 H new ATOM 0 HG12 ILE A 15 8.950 -5.734 -1.734 1.00 0.00 H new ATOM 0 HG13 ILE A 15 7.245 -5.661 -2.133 1.00 0.00 H new ATOM 0 HG21 ILE A 15 8.640 -4.124 0.966 1.00 0.00 H new ATOM 0 HG22 ILE A 15 8.369 -5.547 1.998 1.00 0.00 H new ATOM 0 HG23 ILE A 15 9.646 -5.576 0.760 1.00 0.00 H new ATOM 0 HD11 ILE A 15 8.353 -3.523 -2.626 1.00 0.00 H new ATOM 0 HD12 ILE A 15 7.145 -3.313 -1.335 1.00 0.00 H new ATOM 0 HD13 ILE A 15 8.877 -3.387 -0.930 1.00 0.00 H new ATOM 222 N PHE A 16 7.164 -7.890 2.300 1.00 0.00 N ATOM 223 CA PHE A 16 7.443 -8.494 3.590 1.00 0.00 C ATOM 224 C PHE A 16 7.644 -10.009 3.478 1.00 0.00 C ATOM 225 O PHE A 16 8.632 -10.562 3.969 1.00 0.00 O ATOM 226 CB PHE A 16 6.304 -8.140 4.548 1.00 0.00 C ATOM 227 CG PHE A 16 6.566 -8.522 5.986 1.00 0.00 C ATOM 228 CD1 PHE A 16 6.335 -9.836 6.425 1.00 0.00 C ATOM 229 CD2 PHE A 16 7.085 -7.573 6.881 1.00 0.00 C ATOM 230 CE1 PHE A 16 6.505 -10.167 7.776 1.00 0.00 C ATOM 231 CE2 PHE A 16 7.239 -7.898 8.238 1.00 0.00 C ATOM 232 CZ PHE A 16 6.907 -9.181 8.691 1.00 0.00 C ATOM 0 H PHE A 16 6.268 -7.406 2.249 1.00 0.00 H new ATOM 0 HA PHE A 16 8.380 -8.097 3.980 1.00 0.00 H new ATOM 0 HB2 PHE A 16 6.120 -7.067 4.496 1.00 0.00 H new ATOM 0 HB3 PHE A 16 5.393 -8.636 4.212 1.00 0.00 H new ATOM 0 HD1 PHE A 16 6.026 -10.593 5.720 1.00 0.00 H new ATOM 0 HD2 PHE A 16 7.366 -6.593 6.525 1.00 0.00 H new ATOM 0 HE1 PHE A 16 6.327 -11.178 8.112 1.00 0.00 H new ATOM 0 HE2 PHE A 16 7.613 -7.160 8.932 1.00 0.00 H new ATOM 0 HZ PHE A 16 6.960 -9.412 9.745 1.00 0.00 H new ATOM 242 N HIS A 17 6.683 -10.702 2.869 1.00 0.00 N ATOM 243 CA HIS A 17 6.645 -12.155 2.904 1.00 0.00 C ATOM 244 C HIS A 17 7.675 -12.810 1.992 1.00 0.00 C ATOM 245 O HIS A 17 8.079 -13.934 2.274 1.00 0.00 O ATOM 246 CB HIS A 17 5.220 -12.674 2.720 1.00 0.00 C ATOM 247 CG HIS A 17 4.397 -12.343 3.939 1.00 0.00 C ATOM 248 ND1 HIS A 17 3.788 -11.136 4.176 1.00 0.00 N ATOM 249 CD2 HIS A 17 4.428 -13.028 5.125 1.00 0.00 C ATOM 250 CE1 HIS A 17 3.447 -11.101 5.474 1.00 0.00 C ATOM 251 NE2 HIS A 17 3.824 -12.227 6.099 1.00 0.00 N ATOM 0 H HIS A 17 5.920 -10.275 2.345 1.00 0.00 H new ATOM 0 HA HIS A 17 6.955 -12.464 3.902 1.00 0.00 H new ATOM 0 HB2 HIS A 17 4.771 -12.226 1.834 1.00 0.00 H new ATOM 0 HB3 HIS A 17 5.233 -13.752 2.560 1.00 0.00 H new ATOM 0 HD1 HIS A 17 3.624 -10.399 3.490 1.00 0.00 H new ATOM 0 HD2 HIS A 17 4.845 -14.012 5.280 1.00 0.00 H new ATOM 0 HE1 HIS A 17 2.937 -10.277 5.951 1.00 0.00 H new ATOM 259 N LYS A 18 8.162 -12.122 0.957 1.00 0.00 N ATOM 260 CA LYS A 18 9.311 -12.615 0.200 1.00 0.00 C ATOM 261 C LYS A 18 10.495 -12.794 1.159 1.00 0.00 C ATOM 262 O LYS A 18 11.061 -13.880 1.298 1.00 0.00 O ATOM 263 CB LYS A 18 9.667 -11.620 -0.913 1.00 0.00 C ATOM 264 CG LYS A 18 8.648 -11.648 -2.059 1.00 0.00 C ATOM 265 CD LYS A 18 8.852 -10.410 -2.945 1.00 0.00 C ATOM 266 CE LYS A 18 7.878 -10.364 -4.127 1.00 0.00 C ATOM 267 NZ LYS A 18 6.476 -10.282 -3.685 1.00 0.00 N ATOM 0 H LYS A 18 7.784 -11.234 0.628 1.00 0.00 H new ATOM 0 HA LYS A 18 9.071 -13.573 -0.261 1.00 0.00 H new ATOM 0 HB2 LYS A 18 9.717 -10.614 -0.497 1.00 0.00 H new ATOM 0 HB3 LYS A 18 10.658 -11.853 -1.304 1.00 0.00 H new ATOM 0 HG2 LYS A 18 8.771 -12.556 -2.649 1.00 0.00 H new ATOM 0 HG3 LYS A 18 7.634 -11.661 -1.660 1.00 0.00 H new ATOM 0 HD2 LYS A 18 8.727 -9.511 -2.341 1.00 0.00 H new ATOM 0 HD3 LYS A 18 9.875 -10.402 -3.321 1.00 0.00 H new ATOM 0 HE2 LYS A 18 8.111 -9.504 -4.755 1.00 0.00 H new ATOM 0 HE3 LYS A 18 8.013 -11.254 -4.742 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 5.860 -10.134 -4.510 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 6.210 -11.167 -3.209 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 6.366 -9.487 -3.024 1.00 0.00 H new ATOM 281 N TYR A 19 10.853 -11.704 1.839 1.00 0.00 N ATOM 282 CA TYR A 19 11.967 -11.691 2.770 1.00 0.00 C ATOM 283 C TYR A 19 11.717 -12.614 3.957 1.00 0.00 C ATOM 284 O TYR A 19 12.637 -13.299 4.396 1.00 0.00 O ATOM 285 CB TYR A 19 12.264 -10.255 3.193 1.00 0.00 C ATOM 286 CG TYR A 19 13.130 -9.536 2.184 1.00 0.00 C ATOM 287 CD1 TYR A 19 12.552 -8.890 1.076 1.00 0.00 C ATOM 288 CD2 TYR A 19 14.528 -9.633 2.281 1.00 0.00 C ATOM 289 CE1 TYR A 19 13.369 -8.283 0.110 1.00 0.00 C ATOM 290 CE2 TYR A 19 15.343 -9.061 1.295 1.00 0.00 C ATOM 291 CZ TYR A 19 14.768 -8.367 0.220 1.00 0.00 C ATOM 292 OH TYR A 19 15.559 -7.579 -0.555 1.00 0.00 O ATOM 0 H TYR A 19 10.374 -10.807 1.755 1.00 0.00 H new ATOM 0 HA TYR A 19 12.853 -12.084 2.271 1.00 0.00 H new ATOM 0 HB2 TYR A 19 11.327 -9.713 3.318 1.00 0.00 H new ATOM 0 HB3 TYR A 19 12.763 -10.258 4.162 1.00 0.00 H new ATOM 0 HD1 TYR A 19 11.478 -8.861 0.969 1.00 0.00 H new ATOM 0 HD2 TYR A 19 14.976 -10.149 3.117 1.00 0.00 H new ATOM 0 HE1 TYR A 19 12.923 -7.751 -0.718 1.00 0.00 H new ATOM 0 HE2 TYR A 19 16.417 -9.155 1.363 1.00 0.00 H new ATOM 0 HH TYR A 19 16.102 -6.997 0.017 1.00 0.00 H new ATOM 302 N SER A 20 10.483 -12.663 4.465 1.00 0.00 N ATOM 303 CA SER A 20 10.150 -13.619 5.512 1.00 0.00 C ATOM 304 C SER A 20 10.411 -15.035 5.006 1.00 0.00 C ATOM 305 O SER A 20 11.165 -15.774 5.626 1.00 0.00 O ATOM 306 CB SER A 20 8.709 -13.453 5.991 1.00 0.00 C ATOM 307 OG SER A 20 8.445 -12.100 6.305 1.00 0.00 O ATOM 0 H SER A 20 9.713 -12.061 4.172 1.00 0.00 H new ATOM 0 HA SER A 20 10.787 -13.428 6.376 1.00 0.00 H new ATOM 0 HB2 SER A 20 8.021 -13.794 5.218 1.00 0.00 H new ATOM 0 HB3 SER A 20 8.537 -14.076 6.868 1.00 0.00 H new ATOM 0 HG SER A 20 8.384 -11.578 5.478 1.00 0.00 H new ATOM 313 N GLY A 21 9.833 -15.391 3.855 1.00 0.00 N ATOM 314 CA GLY A 21 9.979 -16.683 3.203 1.00 0.00 C ATOM 315 C GLY A 21 11.427 -17.162 3.174 1.00 0.00 C ATOM 316 O GLY A 21 11.692 -18.324 3.480 1.00 0.00 O ATOM 0 H GLY A 21 9.227 -14.756 3.336 1.00 0.00 H new ATOM 0 HA2 GLY A 21 9.366 -17.420 3.722 1.00 0.00 H new ATOM 0 HA3 GLY A 21 9.601 -16.616 2.183 1.00 0.00 H new ATOM 320 N LYS A 22 12.364 -16.265 2.851 1.00 0.00 N ATOM 321 CA LYS A 22 13.795 -16.557 2.882 1.00 0.00 C ATOM 322 C LYS A 22 14.220 -17.241 4.194 1.00 0.00 C ATOM 323 O LYS A 22 15.052 -18.145 4.173 1.00 0.00 O ATOM 324 CB LYS A 22 14.586 -15.264 2.645 1.00 0.00 C ATOM 325 CG LYS A 22 16.021 -15.553 2.180 1.00 0.00 C ATOM 326 CD LYS A 22 16.920 -14.312 2.264 1.00 0.00 C ATOM 327 CE LYS A 22 16.379 -13.125 1.460 1.00 0.00 C ATOM 328 NZ LYS A 22 17.264 -11.955 1.592 1.00 0.00 N ATOM 0 H LYS A 22 12.147 -15.312 2.560 1.00 0.00 H new ATOM 0 HA LYS A 22 14.017 -17.264 2.083 1.00 0.00 H new ATOM 0 HB2 LYS A 22 14.076 -14.658 1.896 1.00 0.00 H new ATOM 0 HB3 LYS A 22 14.612 -14.680 3.565 1.00 0.00 H new ATOM 0 HG2 LYS A 22 16.446 -16.349 2.792 1.00 0.00 H new ATOM 0 HG3 LYS A 22 16.002 -15.916 1.153 1.00 0.00 H new ATOM 0 HD2 LYS A 22 17.027 -14.018 3.308 1.00 0.00 H new ATOM 0 HD3 LYS A 22 17.916 -14.566 1.901 1.00 0.00 H new ATOM 0 HE2 LYS A 22 16.290 -13.402 0.410 1.00 0.00 H new ATOM 0 HE3 LYS A 22 15.378 -12.870 1.808 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 16.835 -11.139 1.110 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 17.396 -11.732 2.599 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 18.186 -12.167 1.161 1.00 0.00 H new ATOM 342 N GLU A 23 13.645 -16.816 5.324 1.00 0.00 N ATOM 343 CA GLU A 23 13.833 -17.400 6.647 1.00 0.00 C ATOM 344 C GLU A 23 12.526 -18.022 7.173 1.00 0.00 C ATOM 345 O GLU A 23 12.264 -17.991 8.376 1.00 0.00 O ATOM 346 CB GLU A 23 14.419 -16.338 7.596 1.00 0.00 C ATOM 347 CG GLU A 23 13.570 -15.057 7.687 1.00 0.00 C ATOM 348 CD GLU A 23 14.120 -14.045 8.693 1.00 0.00 C ATOM 349 OE1 GLU A 23 15.183 -14.320 9.291 1.00 0.00 O ATOM 350 OE2 GLU A 23 13.463 -12.993 8.859 1.00 0.00 O ATOM 0 H GLU A 23 13.008 -16.019 5.337 1.00 0.00 H new ATOM 0 HA GLU A 23 14.547 -18.221 6.587 1.00 0.00 H new ATOM 0 HB2 GLU A 23 14.519 -16.769 8.592 1.00 0.00 H new ATOM 0 HB3 GLU A 23 15.422 -16.076 7.259 1.00 0.00 H new ATOM 0 HG2 GLU A 23 13.519 -14.591 6.703 1.00 0.00 H new ATOM 0 HG3 GLU A 23 12.551 -15.323 7.968 1.00 0.00 H new ATOM 357 N GLY A 24 11.726 -18.624 6.284 1.00 0.00 N ATOM 358 CA GLY A 24 10.469 -19.277 6.626 1.00 0.00 C ATOM 359 C GLY A 24 9.296 -18.290 6.621 1.00 0.00 C ATOM 360 O GLY A 24 9.387 -17.196 7.172 1.00 0.00 O ATOM 0 H GLY A 24 11.944 -18.668 5.289 1.00 0.00 H new ATOM 0 HA2 GLY A 24 10.271 -20.080 5.916 1.00 0.00 H new ATOM 0 HA3 GLY A 24 10.554 -19.736 7.611 1.00 0.00 H new ATOM 364 N ASP A 25 8.171 -18.674 6.008 1.00 0.00 N ATOM 365 CA ASP A 25 6.998 -17.813 5.843 1.00 0.00 C ATOM 366 C ASP A 25 6.215 -17.649 7.153 1.00 0.00 C ATOM 367 O ASP A 25 5.044 -18.016 7.234 1.00 0.00 O ATOM 368 CB ASP A 25 6.095 -18.354 4.724 1.00 0.00 C ATOM 369 CG ASP A 25 6.801 -18.366 3.374 1.00 0.00 C ATOM 370 OD1 ASP A 25 7.455 -19.393 3.091 1.00 0.00 O ATOM 371 OD2 ASP A 25 6.693 -17.343 2.664 1.00 0.00 O ATOM 0 H ASP A 25 8.049 -19.604 5.608 1.00 0.00 H new ATOM 0 HA ASP A 25 7.351 -16.821 5.560 1.00 0.00 H new ATOM 0 HB2 ASP A 25 5.775 -19.365 4.974 1.00 0.00 H new ATOM 0 HB3 ASP A 25 5.195 -17.742 4.657 1.00 0.00 H new ATOM 376 N LYS A 26 6.862 -17.073 8.167 1.00 0.00 N ATOM 377 CA LYS A 26 6.256 -16.622 9.407 1.00 0.00 C ATOM 378 C LYS A 26 6.040 -15.114 9.276 1.00 0.00 C ATOM 379 O LYS A 26 6.820 -14.436 8.610 1.00 0.00 O ATOM 380 CB LYS A 26 7.153 -16.984 10.602 1.00 0.00 C ATOM 381 CG LYS A 26 8.590 -16.448 10.486 1.00 0.00 C ATOM 382 CD LYS A 26 9.410 -16.791 11.735 1.00 0.00 C ATOM 383 CE LYS A 26 10.816 -16.192 11.605 1.00 0.00 C ATOM 384 NZ LYS A 26 11.613 -16.417 12.823 1.00 0.00 N ATOM 0 H LYS A 26 7.867 -16.903 8.139 1.00 0.00 H new ATOM 0 HA LYS A 26 5.299 -17.112 9.588 1.00 0.00 H new ATOM 0 HB2 LYS A 26 6.702 -16.593 11.514 1.00 0.00 H new ATOM 0 HB3 LYS A 26 7.187 -18.069 10.703 1.00 0.00 H new ATOM 0 HG2 LYS A 26 9.070 -16.873 9.604 1.00 0.00 H new ATOM 0 HG3 LYS A 26 8.568 -15.367 10.347 1.00 0.00 H new ATOM 0 HD2 LYS A 26 8.917 -16.400 12.625 1.00 0.00 H new ATOM 0 HD3 LYS A 26 9.474 -17.872 11.855 1.00 0.00 H new ATOM 0 HE2 LYS A 26 11.324 -16.636 10.749 1.00 0.00 H new ATOM 0 HE3 LYS A 26 10.740 -15.122 11.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 12.558 -16.000 12.702 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 11.139 -15.972 13.635 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 11.705 -17.439 12.994 1.00 0.00 H new ATOM 398 N HIS A 27 4.993 -14.567 9.895 1.00 0.00 N ATOM 399 CA HIS A 27 4.605 -13.172 9.690 1.00 0.00 C ATOM 400 C HIS A 27 5.464 -12.220 10.538 1.00 0.00 C ATOM 401 O HIS A 27 4.948 -11.299 11.170 1.00 0.00 O ATOM 402 CB HIS A 27 3.101 -13.024 9.970 1.00 0.00 C ATOM 403 CG HIS A 27 2.212 -13.930 9.147 1.00 0.00 C ATOM 404 ND1 HIS A 27 0.891 -14.217 9.416 1.00 0.00 N ATOM 405 CD2 HIS A 27 2.544 -14.588 7.990 1.00 0.00 C ATOM 406 CE1 HIS A 27 0.446 -15.032 8.444 1.00 0.00 C ATOM 407 NE2 HIS A 27 1.419 -15.293 7.559 1.00 0.00 N ATOM 0 H HIS A 27 4.395 -15.074 10.547 1.00 0.00 H new ATOM 0 HA HIS A 27 4.788 -12.889 8.653 1.00 0.00 H new ATOM 0 HB2 HIS A 27 2.921 -13.223 11.026 1.00 0.00 H new ATOM 0 HB3 HIS A 27 2.811 -11.989 9.787 1.00 0.00 H new ATOM 0 HD1 HIS A 27 0.349 -13.873 10.209 1.00 0.00 H new ATOM 0 HD2 HIS A 27 3.506 -14.565 7.499 1.00 0.00 H new ATOM 0 HE1 HIS A 27 -0.559 -15.423 8.384 1.00 0.00 H new ATOM 415 N THR A 28 6.784 -12.429 10.540 1.00 0.00 N ATOM 416 CA THR A 28 7.730 -11.706 11.369 1.00 0.00 C ATOM 417 C THR A 28 9.128 -11.823 10.753 1.00 0.00 C ATOM 418 O THR A 28 9.611 -12.931 10.536 1.00 0.00 O ATOM 419 CB THR A 28 7.614 -12.162 12.837 1.00 0.00 C ATOM 420 OG1 THR A 28 8.580 -11.528 13.644 1.00 0.00 O ATOM 421 CG2 THR A 28 7.701 -13.676 13.033 1.00 0.00 C ATOM 0 H THR A 28 7.228 -13.128 9.945 1.00 0.00 H new ATOM 0 HA THR A 28 7.503 -10.640 11.395 1.00 0.00 H new ATOM 0 HB THR A 28 6.612 -11.862 13.145 1.00 0.00 H new ATOM 0 HG1 THR A 28 9.258 -12.181 13.917 1.00 0.00 H new ATOM 0 HG21 THR A 28 7.611 -13.911 14.093 1.00 0.00 H new ATOM 0 HG22 THR A 28 6.894 -14.161 12.484 1.00 0.00 H new ATOM 0 HG23 THR A 28 8.660 -14.036 12.662 1.00 0.00 H new ATOM 429 N LEU A 29 9.752 -10.685 10.432 1.00 0.00 N ATOM 430 CA LEU A 29 11.097 -10.628 9.872 1.00 0.00 C ATOM 431 C LEU A 29 12.101 -10.497 11.013 1.00 0.00 C ATOM 432 O LEU A 29 11.815 -9.838 12.007 1.00 0.00 O ATOM 433 CB LEU A 29 11.252 -9.379 8.987 1.00 0.00 C ATOM 434 CG LEU A 29 10.482 -9.410 7.663 1.00 0.00 C ATOM 435 CD1 LEU A 29 10.394 -7.996 7.084 1.00 0.00 C ATOM 436 CD2 LEU A 29 11.209 -10.264 6.627 1.00 0.00 C ATOM 0 H LEU A 29 9.327 -9.767 10.558 1.00 0.00 H new ATOM 0 HA LEU A 29 11.269 -11.531 9.286 1.00 0.00 H new ATOM 0 HB2 LEU A 29 10.926 -8.509 9.557 1.00 0.00 H new ATOM 0 HB3 LEU A 29 12.311 -9.239 8.769 1.00 0.00 H new ATOM 0 HG LEU A 29 9.494 -9.822 7.869 1.00 0.00 H new ATOM 0 HD11 LEU A 29 9.846 -8.022 6.142 1.00 0.00 H new ATOM 0 HD12 LEU A 29 9.875 -7.346 7.788 1.00 0.00 H new ATOM 0 HD13 LEU A 29 11.399 -7.612 6.908 1.00 0.00 H new ATOM 0 HD21 LEU A 29 10.641 -10.269 5.697 1.00 0.00 H new ATOM 0 HD22 LEU A 29 12.200 -9.849 6.445 1.00 0.00 H new ATOM 0 HD23 LEU A 29 11.305 -11.284 6.999 1.00 0.00 H new ATOM 448 N SER A 30 13.295 -11.070 10.872 1.00 0.00 N ATOM 449 CA SER A 30 14.391 -10.757 11.780 1.00 0.00 C ATOM 450 C SER A 30 14.986 -9.424 11.319 1.00 0.00 C ATOM 451 O SER A 30 14.992 -9.132 10.122 1.00 0.00 O ATOM 452 CB SER A 30 15.432 -11.881 11.748 1.00 0.00 C ATOM 453 OG SER A 30 16.508 -11.571 12.613 1.00 0.00 O ATOM 0 H SER A 30 13.525 -11.747 10.144 1.00 0.00 H new ATOM 0 HA SER A 30 14.046 -10.672 12.811 1.00 0.00 H new ATOM 0 HB2 SER A 30 14.972 -12.822 12.050 1.00 0.00 H new ATOM 0 HB3 SER A 30 15.800 -12.018 10.731 1.00 0.00 H new ATOM 0 HG SER A 30 17.167 -12.295 12.587 1.00 0.00 H new ATOM 459 N LYS A 31 15.477 -8.601 12.250 1.00 0.00 N ATOM 460 CA LYS A 31 15.860 -7.224 11.958 1.00 0.00 C ATOM 461 C LYS A 31 16.850 -7.103 10.790 1.00 0.00 C ATOM 462 O LYS A 31 16.721 -6.211 9.954 1.00 0.00 O ATOM 463 CB LYS A 31 16.334 -6.529 13.240 1.00 0.00 C ATOM 464 CG LYS A 31 17.645 -7.068 13.823 1.00 0.00 C ATOM 465 CD LYS A 31 17.935 -6.351 15.147 1.00 0.00 C ATOM 466 CE LYS A 31 19.339 -6.688 15.654 1.00 0.00 C ATOM 467 NZ LYS A 31 19.615 -6.032 16.944 1.00 0.00 N ATOM 0 H LYS A 31 15.618 -8.873 13.223 1.00 0.00 H new ATOM 0 HA LYS A 31 14.974 -6.696 11.605 1.00 0.00 H new ATOM 0 HB2 LYS A 31 16.455 -5.465 13.035 1.00 0.00 H new ATOM 0 HB3 LYS A 31 15.553 -6.621 13.995 1.00 0.00 H new ATOM 0 HG2 LYS A 31 17.571 -8.143 13.986 1.00 0.00 H new ATOM 0 HG3 LYS A 31 18.463 -6.908 13.121 1.00 0.00 H new ATOM 0 HD2 LYS A 31 17.842 -5.274 15.010 1.00 0.00 H new ATOM 0 HD3 LYS A 31 17.195 -6.642 15.893 1.00 0.00 H new ATOM 0 HE2 LYS A 31 19.438 -7.768 15.764 1.00 0.00 H new ATOM 0 HE3 LYS A 31 20.079 -6.373 14.918 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 20.636 -5.851 17.030 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 19.098 -5.131 16.993 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 19.306 -6.651 17.721 1.00 0.00 H new ATOM 481 N LYS A 32 17.824 -8.011 10.693 1.00 0.00 N ATOM 482 CA LYS A 32 18.784 -7.966 9.595 1.00 0.00 C ATOM 483 C LYS A 32 18.128 -8.384 8.271 1.00 0.00 C ATOM 484 O LYS A 32 18.454 -7.843 7.214 1.00 0.00 O ATOM 485 CB LYS A 32 20.036 -8.806 9.881 1.00 0.00 C ATOM 486 CG LYS A 32 20.651 -8.609 11.276 1.00 0.00 C ATOM 487 CD LYS A 32 20.256 -9.732 12.252 1.00 0.00 C ATOM 488 CE LYS A 32 20.976 -9.589 13.599 1.00 0.00 C ATOM 489 NZ LYS A 32 22.426 -9.825 13.483 1.00 0.00 N ATOM 0 H LYS A 32 17.966 -8.775 11.353 1.00 0.00 H new ATOM 0 HA LYS A 32 19.112 -6.931 9.502 1.00 0.00 H new ATOM 0 HB2 LYS A 32 19.783 -9.859 9.758 1.00 0.00 H new ATOM 0 HB3 LYS A 32 20.792 -8.570 9.132 1.00 0.00 H new ATOM 0 HG2 LYS A 32 21.737 -8.571 11.190 1.00 0.00 H new ATOM 0 HG3 LYS A 32 20.329 -7.649 11.680 1.00 0.00 H new ATOM 0 HD2 LYS A 32 19.178 -9.714 12.411 1.00 0.00 H new ATOM 0 HD3 LYS A 32 20.497 -10.699 11.811 1.00 0.00 H new ATOM 0 HE2 LYS A 32 20.803 -8.589 13.997 1.00 0.00 H new ATOM 0 HE3 LYS A 32 20.551 -10.294 14.313 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 22.842 -9.903 14.433 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 22.593 -10.707 12.958 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 22.867 -9.032 12.976 1.00 0.00 H new ATOM 503 N GLU A 33 17.183 -9.330 8.316 1.00 0.00 N ATOM 504 CA GLU A 33 16.427 -9.717 7.132 1.00 0.00 C ATOM 505 C GLU A 33 15.632 -8.501 6.655 1.00 0.00 C ATOM 506 O GLU A 33 15.642 -8.160 5.473 1.00 0.00 O ATOM 507 CB GLU A 33 15.509 -10.909 7.445 1.00 0.00 C ATOM 508 CG GLU A 33 14.907 -11.511 6.170 1.00 0.00 C ATOM 509 CD GLU A 33 15.933 -12.313 5.380 1.00 0.00 C ATOM 510 OE1 GLU A 33 16.126 -13.494 5.741 1.00 0.00 O ATOM 511 OE2 GLU A 33 16.521 -11.725 4.447 1.00 0.00 O ATOM 0 H GLU A 33 16.928 -9.839 9.163 1.00 0.00 H new ATOM 0 HA GLU A 33 17.101 -10.038 6.338 1.00 0.00 H new ATOM 0 HB2 GLU A 33 16.075 -11.674 7.977 1.00 0.00 H new ATOM 0 HB3 GLU A 33 14.707 -10.586 8.109 1.00 0.00 H new ATOM 0 HG2 GLU A 33 14.068 -12.155 6.434 1.00 0.00 H new ATOM 0 HG3 GLU A 33 14.511 -10.712 5.544 1.00 0.00 H new ATOM 518 N LEU A 34 14.982 -7.816 7.600 1.00 0.00 N ATOM 519 CA LEU A 34 14.364 -6.529 7.344 1.00 0.00 C ATOM 520 C LEU A 34 15.390 -5.571 6.729 1.00 0.00 C ATOM 521 O LEU A 34 15.089 -4.912 5.742 1.00 0.00 O ATOM 522 CB LEU A 34 13.669 -6.016 8.618 1.00 0.00 C ATOM 523 CG LEU A 34 13.198 -4.551 8.602 1.00 0.00 C ATOM 524 CD1 LEU A 34 14.379 -3.576 8.724 1.00 0.00 C ATOM 525 CD2 LEU A 34 12.270 -4.256 7.416 1.00 0.00 C ATOM 0 H LEU A 34 14.874 -8.144 8.560 1.00 0.00 H new ATOM 0 HA LEU A 34 13.571 -6.617 6.602 1.00 0.00 H new ATOM 0 HB2 LEU A 34 12.804 -6.650 8.813 1.00 0.00 H new ATOM 0 HB3 LEU A 34 14.354 -6.145 9.456 1.00 0.00 H new ATOM 0 HG LEU A 34 12.587 -4.388 9.490 1.00 0.00 H new ATOM 0 HD11 LEU A 34 14.008 -2.551 8.709 1.00 0.00 H new ATOM 0 HD12 LEU A 34 14.905 -3.758 9.661 1.00 0.00 H new ATOM 0 HD13 LEU A 34 15.063 -3.726 7.889 1.00 0.00 H new ATOM 0 HD21 LEU A 34 11.963 -3.211 7.446 1.00 0.00 H new ATOM 0 HD22 LEU A 34 12.798 -4.453 6.483 1.00 0.00 H new ATOM 0 HD23 LEU A 34 11.389 -4.895 7.476 1.00 0.00 H new ATOM 537 N LYS A 35 16.617 -5.476 7.245 1.00 0.00 N ATOM 538 CA LYS A 35 17.605 -4.613 6.604 1.00 0.00 C ATOM 539 C LYS A 35 17.795 -4.983 5.124 1.00 0.00 C ATOM 540 O LYS A 35 17.857 -4.112 4.250 1.00 0.00 O ATOM 541 CB LYS A 35 18.937 -4.620 7.365 1.00 0.00 C ATOM 542 CG LYS A 35 19.707 -3.363 6.956 1.00 0.00 C ATOM 543 CD LYS A 35 21.083 -3.262 7.611 1.00 0.00 C ATOM 544 CE LYS A 35 21.689 -1.886 7.302 1.00 0.00 C ATOM 545 NZ LYS A 35 21.943 -1.696 5.862 1.00 0.00 N ATOM 0 H LYS A 35 16.941 -5.969 8.077 1.00 0.00 H new ATOM 0 HA LYS A 35 17.221 -3.594 6.638 1.00 0.00 H new ATOM 0 HB2 LYS A 35 18.764 -4.630 8.441 1.00 0.00 H new ATOM 0 HB3 LYS A 35 19.510 -5.516 7.126 1.00 0.00 H new ATOM 0 HG2 LYS A 35 19.826 -3.354 5.873 1.00 0.00 H new ATOM 0 HG3 LYS A 35 19.120 -2.483 7.220 1.00 0.00 H new ATOM 0 HD2 LYS A 35 20.997 -3.401 8.689 1.00 0.00 H new ATOM 0 HD3 LYS A 35 21.735 -4.052 7.239 1.00 0.00 H new ATOM 0 HE2 LYS A 35 21.014 -1.107 7.655 1.00 0.00 H new ATOM 0 HE3 LYS A 35 22.623 -1.771 7.852 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 22.488 -0.822 5.718 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 22.483 -2.506 5.495 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 21.037 -1.626 5.356 1.00 0.00 H new ATOM 559 N GLU A 36 17.900 -6.280 4.837 1.00 0.00 N ATOM 560 CA GLU A 36 18.009 -6.780 3.472 1.00 0.00 C ATOM 561 C GLU A 36 16.763 -6.429 2.648 1.00 0.00 C ATOM 562 O GLU A 36 16.861 -6.163 1.447 1.00 0.00 O ATOM 563 CB GLU A 36 18.325 -8.285 3.506 1.00 0.00 C ATOM 564 CG GLU A 36 19.170 -8.722 2.297 1.00 0.00 C ATOM 565 CD GLU A 36 20.565 -8.091 2.257 1.00 0.00 C ATOM 566 OE1 GLU A 36 21.023 -7.608 3.317 1.00 0.00 O ATOM 567 OE2 GLU A 36 21.150 -8.103 1.153 1.00 0.00 O ATOM 0 H GLU A 36 17.912 -7.012 5.547 1.00 0.00 H new ATOM 0 HA GLU A 36 18.836 -6.287 2.961 1.00 0.00 H new ATOM 0 HB2 GLU A 36 18.858 -8.523 4.426 1.00 0.00 H new ATOM 0 HB3 GLU A 36 17.394 -8.851 3.521 1.00 0.00 H new ATOM 0 HG2 GLU A 36 19.273 -9.807 2.310 1.00 0.00 H new ATOM 0 HG3 GLU A 36 18.638 -8.463 1.381 1.00 0.00 H new ATOM 574 N LEU A 37 15.593 -6.404 3.290 1.00 0.00 N ATOM 575 CA LEU A 37 14.368 -5.885 2.703 1.00 0.00 C ATOM 576 C LEU A 37 14.540 -4.413 2.341 1.00 0.00 C ATOM 577 O LEU A 37 14.391 -4.063 1.171 1.00 0.00 O ATOM 578 CB LEU A 37 13.170 -6.184 3.622 1.00 0.00 C ATOM 579 CG LEU A 37 11.795 -5.783 3.075 1.00 0.00 C ATOM 580 CD1 LEU A 37 10.721 -6.501 3.889 1.00 0.00 C ATOM 581 CD2 LEU A 37 11.501 -4.291 3.249 1.00 0.00 C ATOM 0 H LEU A 37 15.474 -6.749 4.243 1.00 0.00 H new ATOM 0 HA LEU A 37 14.150 -6.394 1.764 1.00 0.00 H new ATOM 0 HB2 LEU A 37 13.158 -7.253 3.836 1.00 0.00 H new ATOM 0 HB3 LEU A 37 13.327 -5.671 4.571 1.00 0.00 H new ATOM 0 HG LEU A 37 11.794 -6.040 2.016 1.00 0.00 H new ATOM 0 HD11 LEU A 37 9.735 -6.227 3.513 1.00 0.00 H new ATOM 0 HD12 LEU A 37 10.857 -7.579 3.800 1.00 0.00 H new ATOM 0 HD13 LEU A 37 10.803 -6.211 4.936 1.00 0.00 H new ATOM 0 HD21 LEU A 37 10.515 -4.065 2.844 1.00 0.00 H new ATOM 0 HD22 LEU A 37 11.525 -4.037 4.309 1.00 0.00 H new ATOM 0 HD23 LEU A 37 12.254 -3.708 2.719 1.00 0.00 H new ATOM 593 N ILE A 38 14.849 -3.549 3.314 1.00 0.00 N ATOM 594 CA ILE A 38 14.908 -2.108 3.088 1.00 0.00 C ATOM 595 C ILE A 38 15.821 -1.796 1.912 1.00 0.00 C ATOM 596 O ILE A 38 15.460 -1.008 1.043 1.00 0.00 O ATOM 597 CB ILE A 38 15.381 -1.314 4.314 1.00 0.00 C ATOM 598 CG1 ILE A 38 14.432 -1.497 5.503 1.00 0.00 C ATOM 599 CG2 ILE A 38 15.407 0.180 3.930 1.00 0.00 C ATOM 600 CD1 ILE A 38 15.133 -1.039 6.779 1.00 0.00 C ATOM 0 H ILE A 38 15.063 -3.829 4.271 1.00 0.00 H new ATOM 0 HA ILE A 38 13.885 -1.796 2.876 1.00 0.00 H new ATOM 0 HB ILE A 38 16.367 -1.673 4.608 1.00 0.00 H new ATOM 0 HG12 ILE A 38 13.520 -0.921 5.348 1.00 0.00 H new ATOM 0 HG13 ILE A 38 14.137 -2.543 5.591 1.00 0.00 H new ATOM 0 HG21 ILE A 38 15.740 0.769 4.784 1.00 0.00 H new ATOM 0 HG22 ILE A 38 16.093 0.329 3.096 1.00 0.00 H new ATOM 0 HG23 ILE A 38 14.406 0.498 3.638 1.00 0.00 H new ATOM 0 HD11 ILE A 38 14.462 -1.167 7.629 1.00 0.00 H new ATOM 0 HD12 ILE A 38 16.033 -1.635 6.934 1.00 0.00 H new ATOM 0 HD13 ILE A 38 15.406 0.012 6.687 1.00 0.00 H new ATOM 612 N GLN A 39 17.017 -2.390 1.907 1.00 0.00 N ATOM 613 CA GLN A 39 18.004 -2.091 0.884 1.00 0.00 C ATOM 614 C GLN A 39 17.427 -2.270 -0.525 1.00 0.00 C ATOM 615 O GLN A 39 17.709 -1.456 -1.403 1.00 0.00 O ATOM 616 CB GLN A 39 19.267 -2.925 1.117 1.00 0.00 C ATOM 617 CG GLN A 39 20.055 -2.361 2.309 1.00 0.00 C ATOM 618 CD GLN A 39 21.085 -3.358 2.815 1.00 0.00 C ATOM 619 OE1 GLN A 39 22.281 -3.206 2.595 1.00 0.00 O ATOM 620 NE2 GLN A 39 20.611 -4.381 3.512 1.00 0.00 N ATOM 0 H GLN A 39 17.318 -3.076 2.599 1.00 0.00 H new ATOM 0 HA GLN A 39 18.284 -1.040 0.960 1.00 0.00 H new ATOM 0 HB2 GLN A 39 18.997 -3.964 1.307 1.00 0.00 H new ATOM 0 HB3 GLN A 39 19.889 -2.916 0.222 1.00 0.00 H new ATOM 0 HG2 GLN A 39 20.554 -1.438 2.013 1.00 0.00 H new ATOM 0 HG3 GLN A 39 19.366 -2.107 3.115 1.00 0.00 H new ATOM 0 HE21 GLN A 39 19.607 -4.468 3.671 1.00 0.00 H new ATOM 0 HE22 GLN A 39 21.250 -5.081 3.889 1.00 0.00 H new ATOM 629 N LYS A 40 16.593 -3.295 -0.733 1.00 0.00 N ATOM 630 CA LYS A 40 15.889 -3.474 -1.995 1.00 0.00 C ATOM 631 C LYS A 40 14.724 -2.482 -2.092 1.00 0.00 C ATOM 632 O LYS A 40 14.672 -1.664 -3.007 1.00 0.00 O ATOM 633 CB LYS A 40 15.421 -4.932 -2.094 1.00 0.00 C ATOM 634 CG LYS A 40 14.706 -5.287 -3.406 1.00 0.00 C ATOM 635 CD LYS A 40 15.561 -5.084 -4.668 1.00 0.00 C ATOM 636 CE LYS A 40 16.915 -5.807 -4.620 1.00 0.00 C ATOM 637 NZ LYS A 40 16.767 -7.241 -4.309 1.00 0.00 N ATOM 0 H LYS A 40 16.393 -4.013 -0.037 1.00 0.00 H new ATOM 0 HA LYS A 40 16.551 -3.269 -2.836 1.00 0.00 H new ATOM 0 HB2 LYS A 40 16.285 -5.586 -1.978 1.00 0.00 H new ATOM 0 HB3 LYS A 40 14.749 -5.141 -1.261 1.00 0.00 H new ATOM 0 HG2 LYS A 40 14.386 -6.328 -3.362 1.00 0.00 H new ATOM 0 HG3 LYS A 40 13.805 -4.680 -3.491 1.00 0.00 H new ATOM 0 HD2 LYS A 40 15.002 -5.436 -5.535 1.00 0.00 H new ATOM 0 HD3 LYS A 40 15.734 -4.017 -4.811 1.00 0.00 H new ATOM 0 HE2 LYS A 40 17.420 -5.695 -5.580 1.00 0.00 H new ATOM 0 HE3 LYS A 40 17.550 -5.337 -3.869 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 17.681 -7.720 -4.436 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 16.452 -7.352 -3.324 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 16.063 -7.664 -4.948 1.00 0.00 H new ATOM 651 N GLU A 41 13.791 -2.574 -1.140 1.00 0.00 N ATOM 652 CA GLU A 41 12.545 -1.817 -1.057 1.00 0.00 C ATOM 653 C GLU A 41 12.752 -0.332 -1.376 1.00 0.00 C ATOM 654 O GLU A 41 12.048 0.226 -2.215 1.00 0.00 O ATOM 655 CB GLU A 41 11.991 -2.028 0.360 1.00 0.00 C ATOM 656 CG GLU A 41 10.706 -1.274 0.725 1.00 0.00 C ATOM 657 CD GLU A 41 10.422 -1.373 2.226 1.00 0.00 C ATOM 658 OE1 GLU A 41 11.247 -0.830 2.993 1.00 0.00 O ATOM 659 OE2 GLU A 41 9.394 -1.990 2.590 1.00 0.00 O ATOM 0 H GLU A 41 13.895 -3.221 -0.359 1.00 0.00 H new ATOM 0 HA GLU A 41 11.833 -2.172 -1.803 1.00 0.00 H new ATOM 0 HB2 GLU A 41 11.809 -3.094 0.497 1.00 0.00 H new ATOM 0 HB3 GLU A 41 12.765 -1.743 1.072 1.00 0.00 H new ATOM 0 HG2 GLU A 41 10.800 -0.227 0.437 1.00 0.00 H new ATOM 0 HG3 GLU A 41 9.867 -1.685 0.164 1.00 0.00 H new ATOM 666 N LEU A 42 13.703 0.303 -0.686 1.00 0.00 N ATOM 667 CA LEU A 42 14.010 1.719 -0.835 1.00 0.00 C ATOM 668 C LEU A 42 15.250 1.944 -1.707 1.00 0.00 C ATOM 669 O LEU A 42 15.802 3.045 -1.703 1.00 0.00 O ATOM 670 CB LEU A 42 14.178 2.380 0.544 1.00 0.00 C ATOM 671 CG LEU A 42 12.988 2.189 1.502 1.00 0.00 C ATOM 672 CD1 LEU A 42 13.244 2.993 2.783 1.00 0.00 C ATOM 673 CD2 LEU A 42 11.659 2.658 0.898 1.00 0.00 C ATOM 0 H LEU A 42 14.290 -0.166 0.004 1.00 0.00 H new ATOM 0 HA LEU A 42 13.169 2.189 -1.345 1.00 0.00 H new ATOM 0 HB2 LEU A 42 15.075 1.979 1.017 1.00 0.00 H new ATOM 0 HB3 LEU A 42 14.344 3.448 0.401 1.00 0.00 H new ATOM 0 HG LEU A 42 12.906 1.121 1.705 1.00 0.00 H new ATOM 0 HD11 LEU A 42 12.406 2.863 3.468 1.00 0.00 H new ATOM 0 HD12 LEU A 42 14.159 2.639 3.258 1.00 0.00 H new ATOM 0 HD13 LEU A 42 13.350 4.049 2.535 1.00 0.00 H new ATOM 0 HD21 LEU A 42 10.856 2.499 1.618 1.00 0.00 H new ATOM 0 HD22 LEU A 42 11.724 3.719 0.655 1.00 0.00 H new ATOM 0 HD23 LEU A 42 11.451 2.090 -0.009 1.00 0.00 H new ATOM 685 N THR A 43 15.683 0.935 -2.474 1.00 0.00 N ATOM 686 CA THR A 43 16.763 1.048 -3.449 1.00 0.00 C ATOM 687 C THR A 43 17.985 1.765 -2.857 1.00 0.00 C ATOM 688 O THR A 43 18.399 2.790 -3.390 1.00 0.00 O ATOM 689 CB THR A 43 16.231 1.740 -4.719 1.00 0.00 C ATOM 690 OG1 THR A 43 15.649 2.995 -4.422 1.00 0.00 O ATOM 691 CG2 THR A 43 15.164 0.884 -5.408 1.00 0.00 C ATOM 0 H THR A 43 15.280 -0.001 -2.429 1.00 0.00 H new ATOM 0 HA THR A 43 17.107 0.050 -3.722 1.00 0.00 H new ATOM 0 HB THR A 43 17.090 1.876 -5.377 1.00 0.00 H new ATOM 0 HG1 THR A 43 16.231 3.488 -3.806 1.00 0.00 H new ATOM 0 HG21 THR A 43 14.807 1.397 -6.301 1.00 0.00 H new ATOM 0 HG22 THR A 43 15.594 -0.077 -5.689 1.00 0.00 H new ATOM 0 HG23 THR A 43 14.330 0.722 -4.725 1.00 0.00 H new ATOM 699 N ILE A 44 18.510 1.230 -1.744 1.00 0.00 N ATOM 700 CA ILE A 44 19.524 1.808 -0.856 1.00 0.00 C ATOM 701 C ILE A 44 20.152 3.115 -1.365 1.00 0.00 C ATOM 702 O ILE A 44 21.203 3.112 -2.006 1.00 0.00 O ATOM 703 CB ILE A 44 20.550 0.732 -0.437 1.00 0.00 C ATOM 704 CG1 ILE A 44 21.557 1.231 0.616 1.00 0.00 C ATOM 705 CG2 ILE A 44 21.297 0.093 -1.618 1.00 0.00 C ATOM 706 CD1 ILE A 44 20.888 1.733 1.901 1.00 0.00 C ATOM 0 H ILE A 44 18.212 0.311 -1.418 1.00 0.00 H new ATOM 0 HA ILE A 44 19.007 2.134 0.046 1.00 0.00 H new ATOM 0 HB ILE A 44 19.938 -0.045 0.021 1.00 0.00 H new ATOM 0 HG12 ILE A 44 22.244 0.422 0.864 1.00 0.00 H new ATOM 0 HG13 ILE A 44 22.153 2.036 0.186 1.00 0.00 H new ATOM 0 HG21 ILE A 44 21.999 -0.652 -1.244 1.00 0.00 H new ATOM 0 HG22 ILE A 44 20.581 -0.386 -2.285 1.00 0.00 H new ATOM 0 HG23 ILE A 44 21.842 0.863 -2.164 1.00 0.00 H new ATOM 0 HD11 ILE A 44 21.652 2.070 2.601 1.00 0.00 H new ATOM 0 HD12 ILE A 44 20.222 2.562 1.664 1.00 0.00 H new ATOM 0 HD13 ILE A 44 20.314 0.924 2.352 1.00 0.00 H new ATOM 718 N GLY A 45 19.499 4.245 -1.071 1.00 0.00 N ATOM 719 CA GLY A 45 19.846 5.551 -1.617 1.00 0.00 C ATOM 720 C GLY A 45 21.130 6.126 -1.018 1.00 0.00 C ATOM 721 O GLY A 45 21.084 7.131 -0.313 1.00 0.00 O ATOM 0 H GLY A 45 18.702 4.272 -0.435 1.00 0.00 H new ATOM 0 HA2 GLY A 45 19.961 5.468 -2.698 1.00 0.00 H new ATOM 0 HA3 GLY A 45 19.025 6.244 -1.436 1.00 0.00 H new ATOM 725 N SER A 46 22.270 5.518 -1.353 1.00 0.00 N ATOM 726 CA SER A 46 23.628 5.832 -0.915 1.00 0.00 C ATOM 727 C SER A 46 23.980 4.991 0.312 1.00 0.00 C ATOM 728 O SER A 46 23.314 5.075 1.341 1.00 0.00 O ATOM 729 CB SER A 46 23.873 7.329 -0.653 1.00 0.00 C ATOM 730 OG SER A 46 23.275 8.123 -1.656 1.00 0.00 O ATOM 0 H SER A 46 22.264 4.724 -1.994 1.00 0.00 H new ATOM 0 HA SER A 46 24.291 5.577 -1.742 1.00 0.00 H new ATOM 0 HB2 SER A 46 23.468 7.602 0.322 1.00 0.00 H new ATOM 0 HB3 SER A 46 24.945 7.525 -0.620 1.00 0.00 H new ATOM 0 HG SER A 46 23.443 9.070 -1.467 1.00 0.00 H new ATOM 736 N LYS A 47 25.047 4.191 0.217 1.00 0.00 N ATOM 737 CA LYS A 47 25.481 3.303 1.292 1.00 0.00 C ATOM 738 C LYS A 47 25.707 4.061 2.605 1.00 0.00 C ATOM 739 O LYS A 47 25.483 3.514 3.681 1.00 0.00 O ATOM 740 CB LYS A 47 26.745 2.540 0.867 1.00 0.00 C ATOM 741 CG LYS A 47 26.601 1.758 -0.451 1.00 0.00 C ATOM 742 CD LYS A 47 25.427 0.766 -0.419 1.00 0.00 C ATOM 743 CE LYS A 47 25.411 -0.138 -1.656 1.00 0.00 C ATOM 744 NZ LYS A 47 25.172 0.625 -2.895 1.00 0.00 N ATOM 0 H LYS A 47 25.635 4.144 -0.615 1.00 0.00 H new ATOM 0 HA LYS A 47 24.683 2.584 1.477 1.00 0.00 H new ATOM 0 HB2 LYS A 47 27.567 3.249 0.767 1.00 0.00 H new ATOM 0 HB3 LYS A 47 27.019 1.844 1.660 1.00 0.00 H new ATOM 0 HG2 LYS A 47 26.458 2.460 -1.273 1.00 0.00 H new ATOM 0 HG3 LYS A 47 27.525 1.216 -0.652 1.00 0.00 H new ATOM 0 HD2 LYS A 47 25.495 0.152 0.479 1.00 0.00 H new ATOM 0 HD3 LYS A 47 24.488 1.316 -0.359 1.00 0.00 H new ATOM 0 HE2 LYS A 47 26.362 -0.665 -1.732 1.00 0.00 H new ATOM 0 HE3 LYS A 47 24.636 -0.895 -1.541 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 25.152 -0.026 -3.705 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 24.260 1.121 -2.827 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 25.935 1.319 -3.028 1.00 0.00 H new ATOM 758 N LEU A 48 26.106 5.334 2.517 1.00 0.00 N ATOM 759 CA LEU A 48 26.278 6.224 3.659 1.00 0.00 C ATOM 760 C LEU A 48 25.034 6.263 4.557 1.00 0.00 C ATOM 761 O LEU A 48 25.147 6.495 5.758 1.00 0.00 O ATOM 762 CB LEU A 48 26.619 7.646 3.179 1.00 0.00 C ATOM 763 CG LEU A 48 28.019 7.855 2.569 1.00 0.00 C ATOM 764 CD1 LEU A 48 29.140 7.519 3.561 1.00 0.00 C ATOM 765 CD2 LEU A 48 28.247 7.110 1.249 1.00 0.00 C ATOM 0 H LEU A 48 26.322 5.780 1.626 1.00 0.00 H new ATOM 0 HA LEU A 48 27.102 5.829 4.253 1.00 0.00 H new ATOM 0 HB2 LEU A 48 25.877 7.941 2.437 1.00 0.00 H new ATOM 0 HB3 LEU A 48 26.512 8.325 4.025 1.00 0.00 H new ATOM 0 HG LEU A 48 28.056 8.920 2.339 1.00 0.00 H new ATOM 0 HD11 LEU A 48 30.107 7.682 3.086 1.00 0.00 H new ATOM 0 HD12 LEU A 48 29.054 8.161 4.438 1.00 0.00 H new ATOM 0 HD13 LEU A 48 29.056 6.476 3.865 1.00 0.00 H new ATOM 0 HD21 LEU A 48 29.256 7.310 0.888 1.00 0.00 H new ATOM 0 HD22 LEU A 48 28.125 6.039 1.410 1.00 0.00 H new ATOM 0 HD23 LEU A 48 27.522 7.450 0.509 1.00 0.00 H new ATOM 777 N GLN A 49 23.844 6.028 3.996 1.00 0.00 N ATOM 778 CA GLN A 49 22.616 6.015 4.776 1.00 0.00 C ATOM 779 C GLN A 49 22.529 4.806 5.713 1.00 0.00 C ATOM 780 O GLN A 49 21.622 4.769 6.539 1.00 0.00 O ATOM 781 CB GLN A 49 21.389 6.074 3.854 1.00 0.00 C ATOM 782 CG GLN A 49 21.396 7.287 2.914 1.00 0.00 C ATOM 783 CD GLN A 49 21.592 8.606 3.650 1.00 0.00 C ATOM 784 OE1 GLN A 49 22.607 9.273 3.480 1.00 0.00 O ATOM 785 NE2 GLN A 49 20.633 8.990 4.486 1.00 0.00 N ATOM 0 H GLN A 49 23.711 5.844 3.001 1.00 0.00 H new ATOM 0 HA GLN A 49 22.630 6.905 5.406 1.00 0.00 H new ATOM 0 HB2 GLN A 49 21.346 5.162 3.259 1.00 0.00 H new ATOM 0 HB3 GLN A 49 20.486 6.100 4.463 1.00 0.00 H new ATOM 0 HG2 GLN A 49 22.191 7.166 2.178 1.00 0.00 H new ATOM 0 HG3 GLN A 49 20.455 7.320 2.364 1.00 0.00 H new ATOM 0 HE21 GLN A 49 19.800 8.414 4.606 1.00 0.00 H new ATOM 0 HE22 GLN A 49 20.730 9.861 5.008 1.00 0.00 H new ATOM 794 N ASP A 50 23.428 3.819 5.611 1.00 0.00 N ATOM 795 CA ASP A 50 23.405 2.600 6.415 1.00 0.00 C ATOM 796 C ASP A 50 23.130 2.865 7.895 1.00 0.00 C ATOM 797 O ASP A 50 22.286 2.200 8.487 1.00 0.00 O ATOM 798 CB ASP A 50 24.689 1.775 6.226 1.00 0.00 C ATOM 799 CG ASP A 50 25.961 2.423 6.778 1.00 0.00 C ATOM 800 OD1 ASP A 50 26.023 3.672 6.804 1.00 0.00 O ATOM 801 OD2 ASP A 50 26.852 1.645 7.180 1.00 0.00 O ATOM 0 H ASP A 50 24.206 3.850 4.952 1.00 0.00 H new ATOM 0 HA ASP A 50 22.566 2.010 6.046 1.00 0.00 H new ATOM 0 HB2 ASP A 50 24.555 0.806 6.707 1.00 0.00 H new ATOM 0 HB3 ASP A 50 24.828 1.586 5.162 1.00 0.00 H new ATOM 806 N ALA A 51 23.810 3.849 8.481 1.00 0.00 N ATOM 807 CA ALA A 51 23.582 4.277 9.858 1.00 0.00 C ATOM 808 C ALA A 51 22.101 4.600 10.099 1.00 0.00 C ATOM 809 O ALA A 51 21.497 4.154 11.077 1.00 0.00 O ATOM 810 CB ALA A 51 24.461 5.495 10.149 1.00 0.00 C ATOM 0 H ALA A 51 24.543 4.377 8.007 1.00 0.00 H new ATOM 0 HA ALA A 51 23.848 3.466 10.536 1.00 0.00 H new ATOM 0 HB1 ALA A 51 24.299 5.824 11.176 1.00 0.00 H new ATOM 0 HB2 ALA A 51 25.509 5.228 10.015 1.00 0.00 H new ATOM 0 HB3 ALA A 51 24.202 6.303 9.464 1.00 0.00 H new ATOM 816 N GLU A 52 21.506 5.358 9.178 1.00 0.00 N ATOM 817 CA GLU A 52 20.108 5.741 9.254 1.00 0.00 C ATOM 818 C GLU A 52 19.242 4.495 9.101 1.00 0.00 C ATOM 819 O GLU A 52 18.288 4.316 9.856 1.00 0.00 O ATOM 820 CB GLU A 52 19.773 6.800 8.192 1.00 0.00 C ATOM 821 CG GLU A 52 20.782 7.959 8.159 1.00 0.00 C ATOM 822 CD GLU A 52 20.980 8.592 9.534 1.00 0.00 C ATOM 823 OE1 GLU A 52 20.015 9.230 10.005 1.00 0.00 O ATOM 824 OE2 GLU A 52 22.086 8.416 10.089 1.00 0.00 O ATOM 0 H GLU A 52 21.988 5.722 8.356 1.00 0.00 H new ATOM 0 HA GLU A 52 19.904 6.192 10.225 1.00 0.00 H new ATOM 0 HB2 GLU A 52 19.741 6.325 7.211 1.00 0.00 H new ATOM 0 HB3 GLU A 52 18.777 7.198 8.386 1.00 0.00 H new ATOM 0 HG2 GLU A 52 21.740 7.594 7.788 1.00 0.00 H new ATOM 0 HG3 GLU A 52 20.437 8.719 7.458 1.00 0.00 H new ATOM 831 N ILE A 53 19.590 3.618 8.151 1.00 0.00 N ATOM 832 CA ILE A 53 18.900 2.347 7.986 1.00 0.00 C ATOM 833 C ILE A 53 18.885 1.598 9.313 1.00 0.00 C ATOM 834 O ILE A 53 17.825 1.151 9.723 1.00 0.00 O ATOM 835 CB ILE A 53 19.497 1.459 6.874 1.00 0.00 C ATOM 836 CG1 ILE A 53 19.595 2.153 5.506 1.00 0.00 C ATOM 837 CG2 ILE A 53 18.670 0.166 6.754 1.00 0.00 C ATOM 838 CD1 ILE A 53 18.238 2.375 4.846 1.00 0.00 C ATOM 0 H ILE A 53 20.348 3.773 7.487 1.00 0.00 H new ATOM 0 HA ILE A 53 17.883 2.579 7.671 1.00 0.00 H new ATOM 0 HB ILE A 53 20.522 1.236 7.169 1.00 0.00 H new ATOM 0 HG12 ILE A 53 20.094 3.114 5.629 1.00 0.00 H new ATOM 0 HG13 ILE A 53 20.219 1.552 4.845 1.00 0.00 H new ATOM 0 HG21 ILE A 53 19.090 -0.463 5.969 1.00 0.00 H new ATOM 0 HG22 ILE A 53 18.695 -0.371 7.702 1.00 0.00 H new ATOM 0 HG23 ILE A 53 17.638 0.416 6.506 1.00 0.00 H new ATOM 0 HD11 ILE A 53 18.378 2.869 3.884 1.00 0.00 H new ATOM 0 HD12 ILE A 53 17.746 1.414 4.693 1.00 0.00 H new ATOM 0 HD13 ILE A 53 17.619 3.001 5.489 1.00 0.00 H new ATOM 850 N VAL A 54 20.030 1.432 9.982 1.00 0.00 N ATOM 851 CA VAL A 54 20.053 0.656 11.221 1.00 0.00 C ATOM 852 C VAL A 54 19.309 1.348 12.369 1.00 0.00 C ATOM 853 O VAL A 54 18.693 0.664 13.184 1.00 0.00 O ATOM 854 CB VAL A 54 21.438 0.119 11.618 1.00 0.00 C ATOM 855 CG1 VAL A 54 21.885 -0.953 10.615 1.00 0.00 C ATOM 856 CG2 VAL A 54 22.505 1.199 11.787 1.00 0.00 C ATOM 0 H VAL A 54 20.931 1.814 9.695 1.00 0.00 H new ATOM 0 HA VAL A 54 19.484 -0.245 10.994 1.00 0.00 H new ATOM 0 HB VAL A 54 21.328 -0.323 12.608 1.00 0.00 H new ATOM 0 HG11 VAL A 54 22.867 -1.331 10.900 1.00 0.00 H new ATOM 0 HG12 VAL A 54 21.167 -1.773 10.614 1.00 0.00 H new ATOM 0 HG13 VAL A 54 21.939 -0.518 9.617 1.00 0.00 H new ATOM 0 HG21 VAL A 54 23.451 0.735 12.067 1.00 0.00 H new ATOM 0 HG22 VAL A 54 22.629 1.738 10.848 1.00 0.00 H new ATOM 0 HG23 VAL A 54 22.197 1.895 12.567 1.00 0.00 H new ATOM 866 N LYS A 55 19.302 2.683 12.442 1.00 0.00 N ATOM 867 CA LYS A 55 18.418 3.356 13.393 1.00 0.00 C ATOM 868 C LYS A 55 16.955 3.022 13.071 1.00 0.00 C ATOM 869 O LYS A 55 16.190 2.595 13.935 1.00 0.00 O ATOM 870 CB LYS A 55 18.694 4.867 13.399 1.00 0.00 C ATOM 871 CG LYS A 55 17.736 5.675 14.294 1.00 0.00 C ATOM 872 CD LYS A 55 17.556 5.138 15.724 1.00 0.00 C ATOM 873 CE LYS A 55 18.872 5.057 16.507 1.00 0.00 C ATOM 874 NZ LYS A 55 18.647 4.515 17.860 1.00 0.00 N ATOM 0 H LYS A 55 19.880 3.301 11.872 1.00 0.00 H new ATOM 0 HA LYS A 55 18.617 2.995 14.402 1.00 0.00 H new ATOM 0 HB2 LYS A 55 19.717 5.038 13.733 1.00 0.00 H new ATOM 0 HB3 LYS A 55 18.625 5.243 12.378 1.00 0.00 H new ATOM 0 HG2 LYS A 55 18.100 6.701 14.353 1.00 0.00 H new ATOM 0 HG3 LYS A 55 16.759 5.710 13.812 1.00 0.00 H new ATOM 0 HD2 LYS A 55 16.859 5.781 16.262 1.00 0.00 H new ATOM 0 HD3 LYS A 55 17.105 4.147 15.679 1.00 0.00 H new ATOM 0 HE2 LYS A 55 19.580 4.425 15.971 1.00 0.00 H new ATOM 0 HE3 LYS A 55 19.319 6.048 16.578 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 19.562 4.374 18.334 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 18.071 5.183 18.410 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 18.149 3.604 17.791 1.00 0.00 H new ATOM 888 N LEU A 56 16.565 3.186 11.810 1.00 0.00 N ATOM 889 CA LEU A 56 15.228 2.863 11.337 1.00 0.00 C ATOM 890 C LEU A 56 14.889 1.379 11.582 1.00 0.00 C ATOM 891 O LEU A 56 13.770 1.057 11.974 1.00 0.00 O ATOM 892 CB LEU A 56 15.126 3.352 9.883 1.00 0.00 C ATOM 893 CG LEU A 56 13.938 2.802 9.087 1.00 0.00 C ATOM 894 CD1 LEU A 56 13.363 3.872 8.153 1.00 0.00 C ATOM 895 CD2 LEU A 56 14.435 1.635 8.238 1.00 0.00 C ATOM 0 H LEU A 56 17.178 3.552 11.081 1.00 0.00 H new ATOM 0 HA LEU A 56 14.453 3.380 11.902 1.00 0.00 H new ATOM 0 HB2 LEU A 56 15.066 4.440 9.887 1.00 0.00 H new ATOM 0 HB3 LEU A 56 16.046 3.085 9.362 1.00 0.00 H new ATOM 0 HG LEU A 56 13.159 2.488 9.781 1.00 0.00 H new ATOM 0 HD11 LEU A 56 12.521 3.457 7.599 1.00 0.00 H new ATOM 0 HD12 LEU A 56 13.025 4.725 8.741 1.00 0.00 H new ATOM 0 HD13 LEU A 56 14.133 4.196 7.453 1.00 0.00 H new ATOM 0 HD21 LEU A 56 13.606 1.226 7.661 1.00 0.00 H new ATOM 0 HD22 LEU A 56 15.212 1.985 7.559 1.00 0.00 H new ATOM 0 HD23 LEU A 56 14.842 0.860 8.887 1.00 0.00 H new ATOM 907 N MET A 57 15.855 0.473 11.410 1.00 0.00 N ATOM 908 CA MET A 57 15.741 -0.946 11.716 1.00 0.00 C ATOM 909 C MET A 57 15.442 -1.115 13.201 1.00 0.00 C ATOM 910 O MET A 57 14.490 -1.801 13.559 1.00 0.00 O ATOM 911 CB MET A 57 17.046 -1.665 11.345 1.00 0.00 C ATOM 912 CG MET A 57 17.062 -3.153 11.710 1.00 0.00 C ATOM 913 SD MET A 57 18.631 -4.015 11.420 1.00 0.00 S ATOM 914 CE MET A 57 19.651 -3.308 12.734 1.00 0.00 C ATOM 0 H MET A 57 16.772 0.723 11.039 1.00 0.00 H new ATOM 0 HA MET A 57 14.929 -1.385 11.136 1.00 0.00 H new ATOM 0 HB2 MET A 57 17.213 -1.562 10.273 1.00 0.00 H new ATOM 0 HB3 MET A 57 17.877 -1.169 11.846 1.00 0.00 H new ATOM 0 HG2 MET A 57 16.803 -3.253 12.764 1.00 0.00 H new ATOM 0 HG3 MET A 57 16.281 -3.657 11.141 1.00 0.00 H new ATOM 0 HE1 MET A 57 20.602 -3.838 12.781 1.00 0.00 H new ATOM 0 HE2 MET A 57 19.833 -2.254 12.526 1.00 0.00 H new ATOM 0 HE3 MET A 57 19.134 -3.406 13.688 1.00 0.00 H new ATOM 924 N ASP A 58 16.266 -0.499 14.055 1.00 0.00 N ATOM 925 CA ASP A 58 16.070 -0.505 15.496 1.00 0.00 C ATOM 926 C ASP A 58 14.634 -0.084 15.807 1.00 0.00 C ATOM 927 O ASP A 58 13.912 -0.821 16.469 1.00 0.00 O ATOM 928 CB ASP A 58 17.129 0.373 16.179 1.00 0.00 C ATOM 929 CG ASP A 58 16.933 0.487 17.686 1.00 0.00 C ATOM 930 OD1 ASP A 58 16.612 -0.544 18.314 1.00 0.00 O ATOM 931 OD2 ASP A 58 17.119 1.617 18.193 1.00 0.00 O ATOM 0 H ASP A 58 17.092 0.020 13.757 1.00 0.00 H new ATOM 0 HA ASP A 58 16.206 -1.508 15.900 1.00 0.00 H new ATOM 0 HB2 ASP A 58 18.118 -0.039 15.978 1.00 0.00 H new ATOM 0 HB3 ASP A 58 17.104 1.370 15.739 1.00 0.00 H new ATOM 936 N ASP A 59 14.195 1.059 15.270 1.00 0.00 N ATOM 937 CA ASP A 59 12.821 1.529 15.431 1.00 0.00 C ATOM 938 C ASP A 59 11.804 0.464 15.002 1.00 0.00 C ATOM 939 O ASP A 59 10.896 0.142 15.766 1.00 0.00 O ATOM 940 CB ASP A 59 12.588 2.844 14.671 1.00 0.00 C ATOM 941 CG ASP A 59 13.481 3.987 15.146 1.00 0.00 C ATOM 942 OD1 ASP A 59 13.595 4.148 16.381 1.00 0.00 O ATOM 943 OD2 ASP A 59 14.019 4.696 14.267 1.00 0.00 O ATOM 0 H ASP A 59 14.782 1.680 14.714 1.00 0.00 H new ATOM 0 HA ASP A 59 12.670 1.721 16.493 1.00 0.00 H new ATOM 0 HB2 ASP A 59 12.761 2.676 13.608 1.00 0.00 H new ATOM 0 HB3 ASP A 59 11.544 3.139 14.782 1.00 0.00 H new ATOM 948 N LEU A 60 11.943 -0.086 13.790 1.00 0.00 N ATOM 949 CA LEU A 60 11.084 -1.153 13.283 1.00 0.00 C ATOM 950 C LEU A 60 11.009 -2.309 14.287 1.00 0.00 C ATOM 951 O LEU A 60 9.915 -2.690 14.708 1.00 0.00 O ATOM 952 CB LEU A 60 11.567 -1.631 11.895 1.00 0.00 C ATOM 953 CG LEU A 60 10.918 -0.849 10.737 1.00 0.00 C ATOM 954 CD1 LEU A 60 11.812 -0.776 9.497 1.00 0.00 C ATOM 955 CD2 LEU A 60 9.608 -1.516 10.291 1.00 0.00 C ATOM 0 H LEU A 60 12.664 0.203 13.129 1.00 0.00 H new ATOM 0 HA LEU A 60 10.075 -0.759 13.160 1.00 0.00 H new ATOM 0 HB2 LEU A 60 12.650 -1.526 11.836 1.00 0.00 H new ATOM 0 HB3 LEU A 60 11.343 -2.692 11.782 1.00 0.00 H new ATOM 0 HG LEU A 60 10.747 0.154 11.128 1.00 0.00 H new ATOM 0 HD11 LEU A 60 11.303 -0.214 8.714 1.00 0.00 H new ATOM 0 HD12 LEU A 60 12.748 -0.278 9.752 1.00 0.00 H new ATOM 0 HD13 LEU A 60 12.023 -1.784 9.141 1.00 0.00 H new ATOM 0 HD21 LEU A 60 9.169 -0.945 9.473 1.00 0.00 H new ATOM 0 HD22 LEU A 60 9.813 -2.532 9.955 1.00 0.00 H new ATOM 0 HD23 LEU A 60 8.911 -1.544 11.128 1.00 0.00 H new ATOM 967 N ASP A 61 12.155 -2.875 14.672 1.00 0.00 N ATOM 968 CA ASP A 61 12.189 -4.076 15.499 1.00 0.00 C ATOM 969 C ASP A 61 11.815 -3.811 16.954 1.00 0.00 C ATOM 970 O ASP A 61 11.317 -4.716 17.618 1.00 0.00 O ATOM 971 CB ASP A 61 13.511 -4.841 15.342 1.00 0.00 C ATOM 972 CG ASP A 61 14.706 -4.240 16.075 1.00 0.00 C ATOM 973 OD1 ASP A 61 14.658 -4.193 17.322 1.00 0.00 O ATOM 974 OD2 ASP A 61 15.678 -3.892 15.370 1.00 0.00 O ATOM 0 H ASP A 61 13.076 -2.515 14.420 1.00 0.00 H new ATOM 0 HA ASP A 61 11.406 -4.735 15.123 1.00 0.00 H new ATOM 0 HB2 ASP A 61 13.365 -5.861 15.696 1.00 0.00 H new ATOM 0 HB3 ASP A 61 13.751 -4.903 14.281 1.00 0.00 H new ATOM 979 N ARG A 62 12.011 -2.583 17.445 1.00 0.00 N ATOM 980 CA ARG A 62 11.686 -2.197 18.816 1.00 0.00 C ATOM 981 C ARG A 62 10.284 -2.678 19.186 1.00 0.00 C ATOM 982 O ARG A 62 10.071 -3.240 20.261 1.00 0.00 O ATOM 983 CB ARG A 62 11.797 -0.672 18.964 1.00 0.00 C ATOM 984 CG ARG A 62 11.834 -0.236 20.434 1.00 0.00 C ATOM 985 CD ARG A 62 11.818 1.295 20.586 1.00 0.00 C ATOM 986 NE ARG A 62 12.635 2.004 19.585 1.00 0.00 N ATOM 987 CZ ARG A 62 13.968 1.944 19.458 1.00 0.00 C ATOM 988 NH1 ARG A 62 14.702 1.186 20.278 1.00 0.00 N ATOM 989 NH2 ARG A 62 14.573 2.642 18.494 1.00 0.00 N ATOM 0 H ARG A 62 12.405 -1.822 16.892 1.00 0.00 H new ATOM 0 HA ARG A 62 12.394 -2.667 19.498 1.00 0.00 H new ATOM 0 HB2 ARG A 62 12.699 -0.324 18.460 1.00 0.00 H new ATOM 0 HB3 ARG A 62 10.951 -0.197 18.467 1.00 0.00 H new ATOM 0 HG2 ARG A 62 10.978 -0.661 20.959 1.00 0.00 H new ATOM 0 HG3 ARG A 62 12.730 -0.637 20.908 1.00 0.00 H new ATOM 0 HD2 ARG A 62 10.789 1.646 20.515 1.00 0.00 H new ATOM 0 HD3 ARG A 62 12.176 1.555 21.582 1.00 0.00 H new ATOM 0 HE ARG A 62 12.137 2.599 18.923 1.00 0.00 H new ATOM 0 HH11 ARG A 62 14.249 0.643 21.013 1.00 0.00 H new ATOM 0 HH12 ARG A 62 15.716 1.150 20.169 1.00 0.00 H new ATOM 0 HH21 ARG A 62 14.021 3.218 17.858 1.00 0.00 H new ATOM 0 HH22 ARG A 62 15.587 2.600 18.393 1.00 0.00 H new ATOM 1003 N ASN A 63 9.341 -2.485 18.258 1.00 0.00 N ATOM 1004 CA ASN A 63 7.939 -2.860 18.408 1.00 0.00 C ATOM 1005 C ASN A 63 7.748 -4.310 18.861 1.00 0.00 C ATOM 1006 O ASN A 63 6.755 -4.608 19.520 1.00 0.00 O ATOM 1007 CB ASN A 63 7.170 -2.614 17.106 1.00 0.00 C ATOM 1008 CG ASN A 63 7.200 -1.153 16.675 1.00 0.00 C ATOM 1009 OD1 ASN A 63 6.414 -0.341 17.152 1.00 0.00 O ATOM 1010 ND2 ASN A 63 8.111 -0.803 15.775 1.00 0.00 N ATOM 0 H ASN A 63 9.542 -2.051 17.357 1.00 0.00 H new ATOM 0 HA ASN A 63 7.538 -2.224 19.197 1.00 0.00 H new ATOM 0 HB2 ASN A 63 7.596 -3.231 16.315 1.00 0.00 H new ATOM 0 HB3 ASN A 63 6.135 -2.930 17.235 1.00 0.00 H new ATOM 0 HD21 ASN A 63 8.172 0.166 15.461 1.00 0.00 H new ATOM 0 HD22 ASN A 63 8.750 -1.503 15.398 1.00 0.00 H new ATOM 1017 N LYS A 64 8.674 -5.208 18.512 1.00 0.00 N ATOM 1018 CA LYS A 64 8.716 -6.557 19.061 1.00 0.00 C ATOM 1019 C LYS A 64 10.165 -6.921 19.407 1.00 0.00 C ATOM 1020 O LYS A 64 10.657 -7.985 19.031 1.00 0.00 O ATOM 1021 CB LYS A 64 8.024 -7.551 18.113 1.00 0.00 C ATOM 1022 CG LYS A 64 7.683 -8.864 18.834 1.00 0.00 C ATOM 1023 CD LYS A 64 6.985 -9.837 17.877 1.00 0.00 C ATOM 1024 CE LYS A 64 6.730 -11.200 18.530 1.00 0.00 C ATOM 1025 NZ LYS A 64 5.827 -11.097 19.690 1.00 0.00 N ATOM 0 H LYS A 64 9.415 -5.015 17.839 1.00 0.00 H new ATOM 0 HA LYS A 64 8.151 -6.608 19.992 1.00 0.00 H new ATOM 0 HB2 LYS A 64 7.112 -7.104 17.716 1.00 0.00 H new ATOM 0 HB3 LYS A 64 8.674 -7.759 17.263 1.00 0.00 H new ATOM 0 HG2 LYS A 64 8.594 -9.319 19.224 1.00 0.00 H new ATOM 0 HG3 LYS A 64 7.038 -8.660 19.688 1.00 0.00 H new ATOM 0 HD2 LYS A 64 6.037 -9.408 17.551 1.00 0.00 H new ATOM 0 HD3 LYS A 64 7.598 -9.971 16.985 1.00 0.00 H new ATOM 0 HE2 LYS A 64 6.299 -11.879 17.794 1.00 0.00 H new ATOM 0 HE3 LYS A 64 7.679 -11.633 18.847 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 5.614 -12.049 20.050 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 6.285 -10.539 20.438 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 4.943 -10.630 19.402 1.00 0.00 H new ATOM 1039 N ASP A 65 10.827 -6.017 20.144 1.00 0.00 N ATOM 1040 CA ASP A 65 12.121 -6.150 20.819 1.00 0.00 C ATOM 1041 C ASP A 65 13.354 -6.531 19.983 1.00 0.00 C ATOM 1042 O ASP A 65 14.472 -6.247 20.413 1.00 0.00 O ATOM 1043 CB ASP A 65 11.992 -7.031 22.073 1.00 0.00 C ATOM 1044 CG ASP A 65 11.776 -8.510 21.760 1.00 0.00 C ATOM 1045 OD1 ASP A 65 12.774 -9.172 21.400 1.00 0.00 O ATOM 1046 OD2 ASP A 65 10.617 -8.958 21.908 1.00 0.00 O ATOM 0 H ASP A 65 10.431 -5.089 20.295 1.00 0.00 H new ATOM 0 HA ASP A 65 12.354 -5.119 21.086 1.00 0.00 H new ATOM 0 HB2 ASP A 65 12.893 -6.924 22.677 1.00 0.00 H new ATOM 0 HB3 ASP A 65 11.159 -6.670 22.676 1.00 0.00 H new ATOM 1051 N GLN A 66 13.210 -7.207 18.844 1.00 0.00 N ATOM 1052 CA GLN A 66 14.323 -7.790 18.106 1.00 0.00 C ATOM 1053 C GLN A 66 13.869 -8.286 16.733 1.00 0.00 C ATOM 1054 O GLN A 66 14.609 -8.148 15.760 1.00 0.00 O ATOM 1055 CB GLN A 66 14.958 -8.934 18.920 1.00 0.00 C ATOM 1056 CG GLN A 66 16.405 -9.223 18.498 1.00 0.00 C ATOM 1057 CD GLN A 66 17.415 -8.128 18.856 1.00 0.00 C ATOM 1058 OE1 GLN A 66 18.568 -8.209 18.446 1.00 0.00 O ATOM 1059 NE2 GLN A 66 17.035 -7.097 19.605 1.00 0.00 N ATOM 0 H GLN A 66 12.303 -7.366 18.404 1.00 0.00 H new ATOM 0 HA GLN A 66 15.075 -7.017 17.948 1.00 0.00 H new ATOM 0 HB2 GLN A 66 14.936 -8.677 19.979 1.00 0.00 H new ATOM 0 HB3 GLN A 66 14.360 -9.837 18.798 1.00 0.00 H new ATOM 0 HG2 GLN A 66 16.724 -10.156 18.963 1.00 0.00 H new ATOM 0 HG3 GLN A 66 16.429 -9.380 17.420 1.00 0.00 H new ATOM 0 HE21 GLN A 66 16.074 -7.038 19.942 1.00 0.00 H new ATOM 0 HE22 GLN A 66 17.705 -6.365 19.843 1.00 0.00 H new ATOM 1068 N GLU A 67 12.662 -8.856 16.644 1.00 0.00 N ATOM 1069 CA GLU A 67 12.039 -9.150 15.362 1.00 0.00 C ATOM 1070 C GLU A 67 11.109 -7.995 14.987 1.00 0.00 C ATOM 1071 O GLU A 67 10.737 -7.180 15.829 1.00 0.00 O ATOM 1072 CB GLU A 67 11.252 -10.462 15.422 1.00 0.00 C ATOM 1073 CG GLU A 67 12.166 -11.684 15.569 1.00 0.00 C ATOM 1074 CD GLU A 67 11.410 -12.983 15.298 1.00 0.00 C ATOM 1075 OE1 GLU A 67 10.794 -13.067 14.210 1.00 0.00 O ATOM 1076 OE2 GLU A 67 11.462 -13.872 16.174 1.00 0.00 O ATOM 0 H GLU A 67 12.100 -9.122 17.453 1.00 0.00 H new ATOM 0 HA GLU A 67 12.816 -9.262 14.606 1.00 0.00 H new ATOM 0 HB2 GLU A 67 10.557 -10.428 16.261 1.00 0.00 H new ATOM 0 HB3 GLU A 67 10.654 -10.566 14.517 1.00 0.00 H new ATOM 0 HG2 GLU A 67 13.004 -11.598 14.877 1.00 0.00 H new ATOM 0 HG3 GLU A 67 12.584 -11.708 16.575 1.00 0.00 H new ATOM 1083 N VAL A 68 10.727 -7.949 13.714 1.00 0.00 N ATOM 1084 CA VAL A 68 9.824 -6.980 13.123 1.00 0.00 C ATOM 1085 C VAL A 68 8.572 -7.751 12.700 1.00 0.00 C ATOM 1086 O VAL A 68 8.551 -8.372 11.635 1.00 0.00 O ATOM 1087 CB VAL A 68 10.517 -6.318 11.920 1.00 0.00 C ATOM 1088 CG1 VAL A 68 9.636 -5.218 11.323 1.00 0.00 C ATOM 1089 CG2 VAL A 68 11.885 -5.732 12.283 1.00 0.00 C ATOM 0 H VAL A 68 11.062 -8.629 13.032 1.00 0.00 H new ATOM 0 HA VAL A 68 9.551 -6.187 13.819 1.00 0.00 H new ATOM 0 HB VAL A 68 10.673 -7.105 11.182 1.00 0.00 H new ATOM 0 HG11 VAL A 68 10.146 -4.764 10.474 1.00 0.00 H new ATOM 0 HG12 VAL A 68 8.691 -5.649 10.991 1.00 0.00 H new ATOM 0 HG13 VAL A 68 9.442 -4.457 12.079 1.00 0.00 H new ATOM 0 HG21 VAL A 68 12.332 -5.277 11.399 1.00 0.00 H new ATOM 0 HG22 VAL A 68 11.763 -4.976 13.058 1.00 0.00 H new ATOM 0 HG23 VAL A 68 12.535 -6.526 12.650 1.00 0.00 H new ATOM 1099 N ASN A 69 7.532 -7.733 13.538 1.00 0.00 N ATOM 1100 CA ASN A 69 6.307 -8.475 13.262 1.00 0.00 C ATOM 1101 C ASN A 69 5.445 -7.724 12.246 1.00 0.00 C ATOM 1102 O ASN A 69 5.416 -6.495 12.235 1.00 0.00 O ATOM 1103 CB ASN A 69 5.567 -8.782 14.563 1.00 0.00 C ATOM 1104 CG ASN A 69 4.308 -9.603 14.295 1.00 0.00 C ATOM 1105 OD1 ASN A 69 4.375 -10.817 14.148 1.00 0.00 O ATOM 1106 ND2 ASN A 69 3.149 -8.960 14.225 1.00 0.00 N ATOM 0 H ASN A 69 7.518 -7.210 14.414 1.00 0.00 H new ATOM 0 HA ASN A 69 6.557 -9.435 12.810 1.00 0.00 H new ATOM 0 HB2 ASN A 69 6.224 -9.328 15.240 1.00 0.00 H new ATOM 0 HB3 ASN A 69 5.299 -7.851 15.062 1.00 0.00 H new ATOM 0 HD21 ASN A 69 2.289 -9.478 14.045 1.00 0.00 H new ATOM 0 HD22 ASN A 69 3.119 -7.948 14.351 1.00 0.00 H new ATOM 1113 N PHE A 70 4.764 -8.462 11.368 1.00 0.00 N ATOM 1114 CA PHE A 70 4.073 -7.921 10.204 1.00 0.00 C ATOM 1115 C PHE A 70 3.199 -6.694 10.503 1.00 0.00 C ATOM 1116 O PHE A 70 3.357 -5.645 9.879 1.00 0.00 O ATOM 1117 CB PHE A 70 3.274 -9.042 9.536 1.00 0.00 C ATOM 1118 CG PHE A 70 2.399 -8.537 8.418 1.00 0.00 C ATOM 1119 CD1 PHE A 70 2.994 -7.980 7.272 1.00 0.00 C ATOM 1120 CD2 PHE A 70 1.020 -8.385 8.637 1.00 0.00 C ATOM 1121 CE1 PHE A 70 2.200 -7.334 6.312 1.00 0.00 C ATOM 1122 CE2 PHE A 70 0.229 -7.725 7.687 1.00 0.00 C ATOM 1123 CZ PHE A 70 0.818 -7.198 6.525 1.00 0.00 C ATOM 0 H PHE A 70 4.678 -9.475 11.451 1.00 0.00 H new ATOM 0 HA PHE A 70 4.833 -7.546 9.519 1.00 0.00 H new ATOM 0 HB2 PHE A 70 3.962 -9.791 9.145 1.00 0.00 H new ATOM 0 HB3 PHE A 70 2.654 -9.538 10.283 1.00 0.00 H new ATOM 0 HD1 PHE A 70 4.062 -8.049 7.131 1.00 0.00 H new ATOM 0 HD2 PHE A 70 0.569 -8.777 9.537 1.00 0.00 H new ATOM 0 HE1 PHE A 70 2.650 -6.942 5.412 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -0.834 -7.621 7.848 1.00 0.00 H new ATOM 0 HZ PHE A 70 0.207 -6.688 5.795 1.00 0.00 H new ATOM 1133 N GLN A 71 2.277 -6.802 11.463 1.00 0.00 N ATOM 1134 CA GLN A 71 1.415 -5.676 11.807 1.00 0.00 C ATOM 1135 C GLN A 71 2.259 -4.440 12.145 1.00 0.00 C ATOM 1136 O GLN A 71 1.936 -3.321 11.749 1.00 0.00 O ATOM 1137 CB GLN A 71 0.493 -6.071 12.967 1.00 0.00 C ATOM 1138 CG GLN A 71 -0.484 -4.947 13.339 1.00 0.00 C ATOM 1139 CD GLN A 71 -1.327 -5.334 14.548 1.00 0.00 C ATOM 1140 OE1 GLN A 71 -2.514 -5.618 14.421 1.00 0.00 O ATOM 1141 NE2 GLN A 71 -0.721 -5.354 15.731 1.00 0.00 N ATOM 0 H GLN A 71 2.112 -7.648 12.008 1.00 0.00 H new ATOM 0 HA GLN A 71 0.792 -5.418 10.951 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -0.070 -6.964 12.694 1.00 0.00 H new ATOM 0 HB3 GLN A 71 1.097 -6.328 13.837 1.00 0.00 H new ATOM 0 HG2 GLN A 71 0.071 -4.034 13.556 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -1.135 -4.731 12.492 1.00 0.00 H new ATOM 0 HE21 GLN A 71 0.267 -5.112 15.802 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -1.244 -5.611 16.568 1.00 0.00 H new ATOM 1150 N GLU A 72 3.354 -4.645 12.878 1.00 0.00 N ATOM 1151 CA GLU A 72 4.227 -3.584 13.343 1.00 0.00 C ATOM 1152 C GLU A 72 5.016 -3.005 12.164 1.00 0.00 C ATOM 1153 O GLU A 72 5.220 -1.796 12.104 1.00 0.00 O ATOM 1154 CB GLU A 72 5.131 -4.097 14.472 1.00 0.00 C ATOM 1155 CG GLU A 72 4.365 -4.331 15.788 1.00 0.00 C ATOM 1156 CD GLU A 72 3.149 -5.243 15.654 1.00 0.00 C ATOM 1157 OE1 GLU A 72 3.345 -6.381 15.174 1.00 0.00 O ATOM 1158 OE2 GLU A 72 2.034 -4.785 15.991 1.00 0.00 O ATOM 0 H GLU A 72 3.659 -5.574 13.167 1.00 0.00 H new ATOM 0 HA GLU A 72 3.634 -2.771 13.762 1.00 0.00 H new ATOM 0 HB2 GLU A 72 5.602 -5.029 14.160 1.00 0.00 H new ATOM 0 HB3 GLU A 72 5.932 -3.378 14.646 1.00 0.00 H new ATOM 0 HG2 GLU A 72 5.048 -4.761 16.521 1.00 0.00 H new ATOM 0 HG3 GLU A 72 4.040 -3.368 16.182 1.00 0.00 H new ATOM 1165 N TYR A 73 5.424 -3.844 11.207 1.00 0.00 N ATOM 1166 CA TYR A 73 5.980 -3.374 9.941 1.00 0.00 C ATOM 1167 C TYR A 73 5.004 -2.404 9.271 1.00 0.00 C ATOM 1168 O TYR A 73 5.381 -1.278 8.943 1.00 0.00 O ATOM 1169 CB TYR A 73 6.330 -4.567 9.042 1.00 0.00 C ATOM 1170 CG TYR A 73 6.602 -4.253 7.584 1.00 0.00 C ATOM 1171 CD1 TYR A 73 7.919 -3.967 7.173 1.00 0.00 C ATOM 1172 CD2 TYR A 73 5.598 -4.468 6.615 1.00 0.00 C ATOM 1173 CE1 TYR A 73 8.230 -3.874 5.805 1.00 0.00 C ATOM 1174 CE2 TYR A 73 5.907 -4.338 5.250 1.00 0.00 C ATOM 1175 CZ TYR A 73 7.211 -4.001 4.846 1.00 0.00 C ATOM 1176 OH TYR A 73 7.450 -3.712 3.536 1.00 0.00 O ATOM 0 H TYR A 73 5.378 -4.860 11.290 1.00 0.00 H new ATOM 0 HA TYR A 73 6.906 -2.829 10.125 1.00 0.00 H new ATOM 0 HB2 TYR A 73 7.210 -5.060 9.455 1.00 0.00 H new ATOM 0 HB3 TYR A 73 5.510 -5.284 9.090 1.00 0.00 H new ATOM 0 HD1 TYR A 73 8.693 -3.819 7.912 1.00 0.00 H new ATOM 0 HD2 TYR A 73 4.596 -4.731 6.921 1.00 0.00 H new ATOM 0 HE1 TYR A 73 9.250 -3.705 5.492 1.00 0.00 H new ATOM 0 HE2 TYR A 73 5.139 -4.498 4.508 1.00 0.00 H new ATOM 0 HH TYR A 73 8.201 -3.086 3.471 1.00 0.00 H new ATOM 1186 N ILE A 74 3.744 -2.815 9.092 1.00 0.00 N ATOM 1187 CA ILE A 74 2.743 -1.944 8.482 1.00 0.00 C ATOM 1188 C ILE A 74 2.593 -0.649 9.300 1.00 0.00 C ATOM 1189 O ILE A 74 2.639 0.448 8.746 1.00 0.00 O ATOM 1190 CB ILE A 74 1.397 -2.671 8.304 1.00 0.00 C ATOM 1191 CG1 ILE A 74 1.491 -3.963 7.465 1.00 0.00 C ATOM 1192 CG2 ILE A 74 0.374 -1.697 7.697 1.00 0.00 C ATOM 1193 CD1 ILE A 74 1.683 -3.744 5.962 1.00 0.00 C ATOM 0 H ILE A 74 3.399 -3.737 9.359 1.00 0.00 H new ATOM 0 HA ILE A 74 3.086 -1.672 7.484 1.00 0.00 H new ATOM 0 HB ILE A 74 1.073 -2.994 9.293 1.00 0.00 H new ATOM 0 HG12 ILE A 74 2.321 -4.562 7.839 1.00 0.00 H new ATOM 0 HG13 ILE A 74 0.583 -4.546 7.619 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -0.581 -2.206 7.569 1.00 0.00 H new ATOM 0 HG22 ILE A 74 0.244 -0.844 8.363 1.00 0.00 H new ATOM 0 HG23 ILE A 74 0.733 -1.349 6.728 1.00 0.00 H new ATOM 0 HD11 ILE A 74 1.738 -4.709 5.458 1.00 0.00 H new ATOM 0 HD12 ILE A 74 0.841 -3.175 5.567 1.00 0.00 H new ATOM 0 HD13 ILE A 74 2.607 -3.192 5.790 1.00 0.00 H new ATOM 1205 N THR A 75 2.438 -0.769 10.623 1.00 0.00 N ATOM 1206 CA THR A 75 2.341 0.376 11.529 1.00 0.00 C ATOM 1207 C THR A 75 3.497 1.352 11.280 1.00 0.00 C ATOM 1208 O THR A 75 3.293 2.551 11.078 1.00 0.00 O ATOM 1209 CB THR A 75 2.344 -0.108 12.989 1.00 0.00 C ATOM 1210 OG1 THR A 75 1.319 -1.058 13.192 1.00 0.00 O ATOM 1211 CG2 THR A 75 2.136 1.041 13.980 1.00 0.00 C ATOM 0 H THR A 75 2.376 -1.670 11.096 1.00 0.00 H new ATOM 0 HA THR A 75 1.405 0.900 11.338 1.00 0.00 H new ATOM 0 HB THR A 75 3.323 -0.553 13.169 1.00 0.00 H new ATOM 0 HG1 THR A 75 1.574 -1.908 12.776 1.00 0.00 H new ATOM 0 HG21 THR A 75 2.146 0.650 14.997 1.00 0.00 H new ATOM 0 HG22 THR A 75 2.937 1.771 13.864 1.00 0.00 H new ATOM 0 HG23 THR A 75 1.177 1.521 13.785 1.00 0.00 H new ATOM 1219 N PHE A 76 4.722 0.823 11.281 1.00 0.00 N ATOM 1220 CA PHE A 76 5.911 1.613 11.040 1.00 0.00 C ATOM 1221 C PHE A 76 5.843 2.269 9.667 1.00 0.00 C ATOM 1222 O PHE A 76 6.148 3.447 9.549 1.00 0.00 O ATOM 1223 CB PHE A 76 7.172 0.762 11.177 1.00 0.00 C ATOM 1224 CG PHE A 76 8.431 1.588 10.994 1.00 0.00 C ATOM 1225 CD1 PHE A 76 8.957 2.311 12.080 1.00 0.00 C ATOM 1226 CD2 PHE A 76 8.975 1.768 9.707 1.00 0.00 C ATOM 1227 CE1 PHE A 76 10.023 3.206 11.880 1.00 0.00 C ATOM 1228 CE2 PHE A 76 10.074 2.618 9.521 1.00 0.00 C ATOM 1229 CZ PHE A 76 10.578 3.364 10.599 1.00 0.00 C ATOM 0 H PHE A 76 4.908 -0.166 11.450 1.00 0.00 H new ATOM 0 HA PHE A 76 5.958 2.399 11.794 1.00 0.00 H new ATOM 0 HB2 PHE A 76 7.187 0.289 12.159 1.00 0.00 H new ATOM 0 HB3 PHE A 76 7.152 -0.039 10.438 1.00 0.00 H new ATOM 0 HD1 PHE A 76 8.542 2.179 13.068 1.00 0.00 H new ATOM 0 HD2 PHE A 76 8.545 1.250 8.862 1.00 0.00 H new ATOM 0 HE1 PHE A 76 10.415 3.772 12.712 1.00 0.00 H new ATOM 0 HE2 PHE A 76 10.534 2.699 8.547 1.00 0.00 H new ATOM 0 HZ PHE A 76 11.391 4.058 10.443 1.00 0.00 H new ATOM 1239 N LEU A 77 5.434 1.544 8.625 1.00 0.00 N ATOM 1240 CA LEU A 77 5.236 2.159 7.318 1.00 0.00 C ATOM 1241 C LEU A 77 4.220 3.302 7.389 1.00 0.00 C ATOM 1242 O LEU A 77 4.389 4.312 6.708 1.00 0.00 O ATOM 1243 CB LEU A 77 4.871 1.111 6.260 1.00 0.00 C ATOM 1244 CG LEU A 77 6.085 0.249 5.874 1.00 0.00 C ATOM 1245 CD1 LEU A 77 5.628 -0.905 4.987 1.00 0.00 C ATOM 1246 CD2 LEU A 77 7.128 1.057 5.092 1.00 0.00 C ATOM 0 H LEU A 77 5.236 0.544 8.661 1.00 0.00 H new ATOM 0 HA LEU A 77 6.182 2.602 7.006 1.00 0.00 H new ATOM 0 HB2 LEU A 77 4.076 0.470 6.641 1.00 0.00 H new ATOM 0 HB3 LEU A 77 4.481 1.610 5.373 1.00 0.00 H new ATOM 0 HG LEU A 77 6.534 -0.115 6.798 1.00 0.00 H new ATOM 0 HD11 LEU A 77 6.488 -1.516 4.713 1.00 0.00 H new ATOM 0 HD12 LEU A 77 4.906 -1.516 5.529 1.00 0.00 H new ATOM 0 HD13 LEU A 77 5.163 -0.508 4.085 1.00 0.00 H new ATOM 0 HD21 LEU A 77 7.970 0.414 4.837 1.00 0.00 H new ATOM 0 HD22 LEU A 77 6.678 1.444 4.178 1.00 0.00 H new ATOM 0 HD23 LEU A 77 7.478 1.888 5.704 1.00 0.00 H new ATOM 1258 N GLY A 78 3.200 3.193 8.240 1.00 0.00 N ATOM 1259 CA GLY A 78 2.316 4.313 8.538 1.00 0.00 C ATOM 1260 C GLY A 78 3.101 5.510 9.071 1.00 0.00 C ATOM 1261 O GLY A 78 2.970 6.625 8.563 1.00 0.00 O ATOM 0 H GLY A 78 2.967 2.333 8.737 1.00 0.00 H new ATOM 0 HA2 GLY A 78 1.775 4.602 7.637 1.00 0.00 H new ATOM 0 HA3 GLY A 78 1.572 4.007 9.273 1.00 0.00 H new ATOM 1265 N ALA A 79 3.947 5.283 10.078 1.00 0.00 N ATOM 1266 CA ALA A 79 4.836 6.328 10.575 1.00 0.00 C ATOM 1267 C ALA A 79 5.719 6.877 9.446 1.00 0.00 C ATOM 1268 O ALA A 79 5.891 8.085 9.326 1.00 0.00 O ATOM 1269 CB ALA A 79 5.669 5.817 11.754 1.00 0.00 C ATOM 0 H ALA A 79 4.033 4.389 10.561 1.00 0.00 H new ATOM 0 HA ALA A 79 4.227 7.155 10.941 1.00 0.00 H new ATOM 0 HB1 ALA A 79 6.324 6.613 12.108 1.00 0.00 H new ATOM 0 HB2 ALA A 79 5.005 5.507 12.561 1.00 0.00 H new ATOM 0 HB3 ALA A 79 6.271 4.967 11.433 1.00 0.00 H new ATOM 1275 N LEU A 80 6.261 6.005 8.593 1.00 0.00 N ATOM 1276 CA LEU A 80 7.114 6.388 7.478 1.00 0.00 C ATOM 1277 C LEU A 80 6.349 7.301 6.517 1.00 0.00 C ATOM 1278 O LEU A 80 6.871 8.323 6.085 1.00 0.00 O ATOM 1279 CB LEU A 80 7.662 5.138 6.772 1.00 0.00 C ATOM 1280 CG LEU A 80 8.967 5.404 6.004 1.00 0.00 C ATOM 1281 CD1 LEU A 80 10.156 5.614 6.953 1.00 0.00 C ATOM 1282 CD2 LEU A 80 9.289 4.200 5.112 1.00 0.00 C ATOM 0 H LEU A 80 6.114 4.998 8.663 1.00 0.00 H new ATOM 0 HA LEU A 80 7.969 6.950 7.854 1.00 0.00 H new ATOM 0 HB2 LEU A 80 7.835 4.357 7.512 1.00 0.00 H new ATOM 0 HB3 LEU A 80 6.910 4.760 6.079 1.00 0.00 H new ATOM 0 HG LEU A 80 8.818 6.309 5.415 1.00 0.00 H new ATOM 0 HD11 LEU A 80 11.058 5.799 6.370 1.00 0.00 H new ATOM 0 HD12 LEU A 80 9.959 6.470 7.599 1.00 0.00 H new ATOM 0 HD13 LEU A 80 10.295 4.722 7.564 1.00 0.00 H new ATOM 0 HD21 LEU A 80 10.214 4.388 4.567 1.00 0.00 H new ATOM 0 HD22 LEU A 80 9.406 3.310 5.730 1.00 0.00 H new ATOM 0 HD23 LEU A 80 8.476 4.044 4.403 1.00 0.00 H new ATOM 1294 N ALA A 81 5.097 6.962 6.209 1.00 0.00 N ATOM 1295 CA ALA A 81 4.208 7.809 5.429 1.00 0.00 C ATOM 1296 C ALA A 81 4.028 9.171 6.113 1.00 0.00 C ATOM 1297 O ALA A 81 4.161 10.218 5.478 1.00 0.00 O ATOM 1298 CB ALA A 81 2.878 7.087 5.209 1.00 0.00 C ATOM 0 H ALA A 81 4.672 6.082 6.499 1.00 0.00 H new ATOM 0 HA ALA A 81 4.647 8.004 4.450 1.00 0.00 H new ATOM 0 HB1 ALA A 81 2.212 7.722 4.625 1.00 0.00 H new ATOM 0 HB2 ALA A 81 3.054 6.155 4.672 1.00 0.00 H new ATOM 0 HB3 ALA A 81 2.418 6.869 6.173 1.00 0.00 H new ATOM 1304 N MET A 82 3.757 9.172 7.422 1.00 0.00 N ATOM 1305 CA MET A 82 3.667 10.412 8.188 1.00 0.00 C ATOM 1306 C MET A 82 4.965 11.228 8.049 1.00 0.00 C ATOM 1307 O MET A 82 4.912 12.444 7.881 1.00 0.00 O ATOM 1308 CB MET A 82 3.300 10.092 9.648 1.00 0.00 C ATOM 1309 CG MET A 82 2.639 11.266 10.383 1.00 0.00 C ATOM 1310 SD MET A 82 3.695 12.687 10.771 1.00 0.00 S ATOM 1311 CE MET A 82 2.501 13.742 11.619 1.00 0.00 C ATOM 0 H MET A 82 3.597 8.327 7.970 1.00 0.00 H new ATOM 0 HA MET A 82 2.871 11.041 7.789 1.00 0.00 H new ATOM 0 HB2 MET A 82 2.625 9.236 9.666 1.00 0.00 H new ATOM 0 HB3 MET A 82 4.202 9.798 10.185 1.00 0.00 H new ATOM 0 HG2 MET A 82 1.804 11.619 9.778 1.00 0.00 H new ATOM 0 HG3 MET A 82 2.220 10.890 11.316 1.00 0.00 H new ATOM 0 HE1 MET A 82 2.988 14.667 11.928 1.00 0.00 H new ATOM 0 HE2 MET A 82 1.677 13.974 10.944 1.00 0.00 H new ATOM 0 HE3 MET A 82 2.116 13.223 12.497 1.00 0.00 H new ATOM 1321 N ILE A 83 6.121 10.560 8.092 1.00 0.00 N ATOM 1322 CA ILE A 83 7.440 11.172 7.943 1.00 0.00 C ATOM 1323 C ILE A 83 7.659 11.701 6.518 1.00 0.00 C ATOM 1324 O ILE A 83 8.226 12.780 6.369 1.00 0.00 O ATOM 1325 CB ILE A 83 8.540 10.198 8.416 1.00 0.00 C ATOM 1326 CG1 ILE A 83 8.450 10.028 9.946 1.00 0.00 C ATOM 1327 CG2 ILE A 83 9.943 10.698 8.034 1.00 0.00 C ATOM 1328 CD1 ILE A 83 9.195 8.789 10.456 1.00 0.00 C ATOM 0 H ILE A 83 6.164 9.551 8.235 1.00 0.00 H new ATOM 0 HA ILE A 83 7.499 12.048 8.589 1.00 0.00 H new ATOM 0 HB ILE A 83 8.380 9.240 7.921 1.00 0.00 H new ATOM 0 HG12 ILE A 83 8.859 10.915 10.429 1.00 0.00 H new ATOM 0 HG13 ILE A 83 7.402 9.960 10.237 1.00 0.00 H new ATOM 0 HG21 ILE A 83 10.691 9.986 8.384 1.00 0.00 H new ATOM 0 HG22 ILE A 83 10.012 10.794 6.950 1.00 0.00 H new ATOM 0 HG23 ILE A 83 10.122 11.669 8.497 1.00 0.00 H new ATOM 0 HD11 ILE A 83 9.095 8.724 11.539 1.00 0.00 H new ATOM 0 HD12 ILE A 83 8.771 7.895 9.998 1.00 0.00 H new ATOM 0 HD13 ILE A 83 10.250 8.865 10.193 1.00 0.00 H new ATOM 1340 N TYR A 84 7.213 10.985 5.471 1.00 0.00 N ATOM 1341 CA TYR A 84 7.184 11.531 4.109 1.00 0.00 C ATOM 1342 C TYR A 84 6.460 12.876 4.176 1.00 0.00 C ATOM 1343 O TYR A 84 6.943 13.881 3.659 1.00 0.00 O ATOM 1344 CB TYR A 84 6.476 10.598 3.111 1.00 0.00 C ATOM 1345 CG TYR A 84 7.254 9.429 2.532 1.00 0.00 C ATOM 1346 CD1 TYR A 84 8.299 8.795 3.235 1.00 0.00 C ATOM 1347 CD2 TYR A 84 6.878 8.941 1.265 1.00 0.00 C ATOM 1348 CE1 TYR A 84 8.962 7.691 2.666 1.00 0.00 C ATOM 1349 CE2 TYR A 84 7.550 7.849 0.693 1.00 0.00 C ATOM 1350 CZ TYR A 84 8.587 7.215 1.398 1.00 0.00 C ATOM 1351 OH TYR A 84 9.221 6.134 0.862 1.00 0.00 O ATOM 0 H TYR A 84 6.869 10.028 5.545 1.00 0.00 H new ATOM 0 HA TYR A 84 8.206 11.641 3.747 1.00 0.00 H new ATOM 0 HB2 TYR A 84 5.592 10.195 3.604 1.00 0.00 H new ATOM 0 HB3 TYR A 84 6.126 11.208 2.278 1.00 0.00 H new ATOM 0 HD1 TYR A 84 8.591 9.156 4.210 1.00 0.00 H new ATOM 0 HD2 TYR A 84 6.066 9.411 0.729 1.00 0.00 H new ATOM 0 HE1 TYR A 84 9.762 7.208 3.206 1.00 0.00 H new ATOM 0 HE2 TYR A 84 7.270 7.496 -0.289 1.00 0.00 H new ATOM 0 HH TYR A 84 8.788 5.886 0.018 1.00 0.00 H new ATOM 1361 N ASN A 85 5.298 12.871 4.836 1.00 0.00 N ATOM 1362 CA ASN A 85 4.554 14.047 5.266 1.00 0.00 C ATOM 1363 C ASN A 85 3.893 14.806 4.125 1.00 0.00 C ATOM 1364 O ASN A 85 2.674 14.927 4.103 1.00 0.00 O ATOM 1365 CB ASN A 85 5.427 14.970 6.128 1.00 0.00 C ATOM 1366 CG ASN A 85 4.553 15.784 7.073 1.00 0.00 C ATOM 1367 OD1 ASN A 85 4.327 16.970 6.862 1.00 0.00 O ATOM 1368 ND2 ASN A 85 4.053 15.137 8.122 1.00 0.00 N ATOM 0 H ASN A 85 4.832 12.001 5.095 1.00 0.00 H new ATOM 0 HA ASN A 85 3.734 13.675 5.881 1.00 0.00 H new ATOM 0 HB2 ASN A 85 6.141 14.378 6.700 1.00 0.00 H new ATOM 0 HB3 ASN A 85 6.005 15.638 5.489 1.00 0.00 H new ATOM 0 HD21 ASN A 85 3.457 15.629 8.788 1.00 0.00 H new ATOM 0 HD22 ASN A 85 4.266 14.149 8.261 1.00 0.00 H new ATOM 1375 N GLU A 86 4.672 15.285 3.154 1.00 0.00 N ATOM 1376 CA GLU A 86 4.177 15.972 1.967 1.00 0.00 C ATOM 1377 C GLU A 86 3.068 15.152 1.300 1.00 0.00 C ATOM 1378 O GLU A 86 2.037 15.686 0.894 1.00 0.00 O ATOM 1379 CB GLU A 86 5.335 16.223 0.992 1.00 0.00 C ATOM 1380 CG GLU A 86 6.431 17.097 1.618 1.00 0.00 C ATOM 1381 CD GLU A 86 7.509 17.445 0.598 1.00 0.00 C ATOM 1382 OE1 GLU A 86 8.172 16.494 0.128 1.00 0.00 O ATOM 1383 OE2 GLU A 86 7.645 18.651 0.301 1.00 0.00 O ATOM 0 H GLU A 86 5.688 15.202 3.175 1.00 0.00 H new ATOM 0 HA GLU A 86 3.755 16.933 2.260 1.00 0.00 H new ATOM 0 HB2 GLU A 86 5.763 15.269 0.684 1.00 0.00 H new ATOM 0 HB3 GLU A 86 4.954 16.707 0.093 1.00 0.00 H new ATOM 0 HG2 GLU A 86 5.989 18.013 2.011 1.00 0.00 H new ATOM 0 HG3 GLU A 86 6.880 16.573 2.461 1.00 0.00 H new ATOM 1390 N ALA A 87 3.282 13.835 1.240 1.00 0.00 N ATOM 1391 CA ALA A 87 2.315 12.860 0.765 1.00 0.00 C ATOM 1392 C ALA A 87 0.942 13.039 1.427 1.00 0.00 C ATOM 1393 O ALA A 87 -0.082 12.945 0.757 1.00 0.00 O ATOM 1394 CB ALA A 87 2.877 11.457 1.020 1.00 0.00 C ATOM 0 H ALA A 87 4.163 13.411 1.531 1.00 0.00 H new ATOM 0 HA ALA A 87 2.156 13.008 -0.303 1.00 0.00 H new ATOM 0 HB1 ALA A 87 2.164 10.710 0.670 1.00 0.00 H new ATOM 0 HB2 ALA A 87 3.819 11.339 0.484 1.00 0.00 H new ATOM 0 HB3 ALA A 87 3.048 11.322 2.088 1.00 0.00 H new ATOM 1400 N LEU A 88 0.920 13.294 2.739 1.00 0.00 N ATOM 1401 CA LEU A 88 -0.305 13.528 3.496 1.00 0.00 C ATOM 1402 C LEU A 88 -0.752 14.978 3.329 1.00 0.00 C ATOM 1403 O LEU A 88 -1.944 15.250 3.259 1.00 0.00 O ATOM 1404 CB LEU A 88 -0.093 13.222 4.989 1.00 0.00 C ATOM 1405 CG LEU A 88 -0.063 11.736 5.376 1.00 0.00 C ATOM 1406 CD1 LEU A 88 -1.457 11.113 5.255 1.00 0.00 C ATOM 1407 CD2 LEU A 88 0.975 10.927 4.592 1.00 0.00 C ATOM 0 H LEU A 88 1.765 13.343 3.308 1.00 0.00 H new ATOM 0 HA LEU A 88 -1.077 12.862 3.110 1.00 0.00 H new ATOM 0 HB2 LEU A 88 0.846 13.677 5.303 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -0.888 13.708 5.555 1.00 0.00 H new ATOM 0 HG LEU A 88 0.249 11.696 6.420 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -1.411 10.060 5.534 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -2.147 11.634 5.918 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -1.807 11.200 4.226 1.00 0.00 H new ATOM 0 HD21 LEU A 88 0.944 9.886 4.914 1.00 0.00 H new ATOM 0 HD22 LEU A 88 0.752 10.984 3.527 1.00 0.00 H new ATOM 0 HD23 LEU A 88 1.969 11.334 4.777 1.00 0.00 H new ATOM 1419 N LYS A 89 0.196 15.915 3.294 1.00 0.00 N ATOM 1420 CA LYS A 89 -0.071 17.336 3.143 1.00 0.00 C ATOM 1421 C LYS A 89 -0.881 17.596 1.869 1.00 0.00 C ATOM 1422 O LYS A 89 -1.798 18.415 1.877 1.00 0.00 O ATOM 1423 CB LYS A 89 1.260 18.099 3.163 1.00 0.00 C ATOM 1424 CG LYS A 89 1.080 19.557 3.602 1.00 0.00 C ATOM 1425 CD LYS A 89 2.418 20.316 3.660 1.00 0.00 C ATOM 1426 CE LYS A 89 3.488 19.635 4.529 1.00 0.00 C ATOM 1427 NZ LYS A 89 2.985 19.290 5.871 1.00 0.00 N ATOM 0 H LYS A 89 1.189 15.697 3.372 1.00 0.00 H new ATOM 0 HA LYS A 89 -0.678 17.697 3.973 1.00 0.00 H new ATOM 0 HB2 LYS A 89 1.954 17.600 3.839 1.00 0.00 H new ATOM 0 HB3 LYS A 89 1.708 18.072 2.170 1.00 0.00 H new ATOM 0 HG2 LYS A 89 0.407 20.063 2.910 1.00 0.00 H new ATOM 0 HG3 LYS A 89 0.606 19.583 4.583 1.00 0.00 H new ATOM 0 HD2 LYS A 89 2.805 20.427 2.647 1.00 0.00 H new ATOM 0 HD3 LYS A 89 2.238 21.320 4.044 1.00 0.00 H new ATOM 0 HE2 LYS A 89 3.835 18.730 4.030 1.00 0.00 H new ATOM 0 HE3 LYS A 89 4.349 20.296 4.625 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 3.620 18.594 6.311 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 2.949 20.147 6.459 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 2.030 18.886 5.790 1.00 0.00 H new ATOM 1441 N GLY A 90 -0.550 16.889 0.786 1.00 0.00 N ATOM 1442 CA GLY A 90 -1.317 16.914 -0.452 1.00 0.00 C ATOM 1443 C GLY A 90 -2.815 16.684 -0.212 1.00 0.00 C ATOM 1444 O GLY A 90 -3.605 17.498 -0.735 1.00 0.00 O ATOM 1445 OXT GLY A 90 -3.152 15.686 0.467 1.00 0.00 O ATOM 0 H GLY A 90 0.266 16.279 0.748 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -1.174 17.875 -0.947 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -0.937 16.148 -1.128 1.00 0.00 H new TER 1449 GLY A 90 ATOM 1450 N MET B 1 15.245 4.654 -6.647 1.00 0.00 N ATOM 1451 CA MET B 1 14.012 5.336 -6.219 1.00 0.00 C ATOM 1452 C MET B 1 12.980 4.306 -5.753 1.00 0.00 C ATOM 1453 O MET B 1 12.741 3.310 -6.432 1.00 0.00 O ATOM 1454 CB MET B 1 13.470 6.249 -7.328 1.00 0.00 C ATOM 1455 CG MET B 1 12.223 7.035 -6.898 1.00 0.00 C ATOM 1456 SD MET B 1 12.395 8.026 -5.391 1.00 0.00 S ATOM 1457 CE MET B 1 10.747 8.758 -5.315 1.00 0.00 C ATOM 0 H1 MET B 1 16.018 5.346 -6.718 1.00 0.00 H new ATOM 0 H2 MET B 1 15.497 3.924 -5.951 1.00 0.00 H new ATOM 0 H3 MET B 1 15.092 4.210 -7.575 1.00 0.00 H new ATOM 0 HA MET B 1 14.239 5.983 -5.372 1.00 0.00 H new ATOM 0 HB2 MET B 1 14.249 6.949 -7.628 1.00 0.00 H new ATOM 0 HB3 MET B 1 13.229 5.646 -8.203 1.00 0.00 H new ATOM 0 HG2 MET B 1 11.935 7.697 -7.714 1.00 0.00 H new ATOM 0 HG3 MET B 1 11.404 6.330 -6.755 1.00 0.00 H new ATOM 0 HE1 MET B 1 10.670 9.390 -4.430 1.00 0.00 H new ATOM 0 HE2 MET B 1 10.575 9.360 -6.207 1.00 0.00 H new ATOM 0 HE3 MET B 1 9.999 7.967 -5.262 1.00 0.00 H new ATOM 1469 N ALA B 2 12.341 4.554 -4.607 1.00 0.00 N ATOM 1470 CA ALA B 2 11.491 3.583 -3.924 1.00 0.00 C ATOM 1471 C ALA B 2 10.106 3.431 -4.572 1.00 0.00 C ATOM 1472 O ALA B 2 9.137 3.079 -3.896 1.00 0.00 O ATOM 1473 CB ALA B 2 11.377 4.006 -2.456 1.00 0.00 C ATOM 0 H ALA B 2 12.402 5.449 -4.122 1.00 0.00 H new ATOM 0 HA ALA B 2 11.951 2.598 -4.004 1.00 0.00 H new ATOM 0 HB1 ALA B 2 10.746 3.296 -1.921 1.00 0.00 H new ATOM 0 HB2 ALA B 2 12.369 4.022 -2.004 1.00 0.00 H new ATOM 0 HB3 ALA B 2 10.935 5.001 -2.397 1.00 0.00 H new ATOM 1479 N SER B 3 9.998 3.676 -5.882 1.00 0.00 N ATOM 1480 CA SER B 3 8.753 3.731 -6.631 1.00 0.00 C ATOM 1481 C SER B 3 7.797 2.565 -6.343 1.00 0.00 C ATOM 1482 O SER B 3 6.598 2.809 -6.179 1.00 0.00 O ATOM 1483 CB SER B 3 9.062 3.878 -8.127 1.00 0.00 C ATOM 1484 OG SER B 3 10.234 4.658 -8.283 1.00 0.00 O ATOM 0 H SER B 3 10.815 3.848 -6.468 1.00 0.00 H new ATOM 0 HA SER B 3 8.208 4.611 -6.290 1.00 0.00 H new ATOM 0 HB2 SER B 3 9.200 2.897 -8.581 1.00 0.00 H new ATOM 0 HB3 SER B 3 8.224 4.351 -8.639 1.00 0.00 H new ATOM 0 HG SER B 3 10.438 4.754 -9.237 1.00 0.00 H new ATOM 1490 N PRO B 4 8.275 1.305 -6.306 1.00 0.00 N ATOM 1491 CA PRO B 4 7.411 0.153 -6.109 1.00 0.00 C ATOM 1492 C PRO B 4 6.656 0.198 -4.786 1.00 0.00 C ATOM 1493 O PRO B 4 5.480 -0.150 -4.747 1.00 0.00 O ATOM 1494 CB PRO B 4 8.309 -1.085 -6.203 1.00 0.00 C ATOM 1495 CG PRO B 4 9.499 -0.593 -7.023 1.00 0.00 C ATOM 1496 CD PRO B 4 9.640 0.850 -6.548 1.00 0.00 C ATOM 0 HA PRO B 4 6.633 0.137 -6.872 1.00 0.00 H new ATOM 0 HB2 PRO B 4 8.616 -1.435 -5.218 1.00 0.00 H new ATOM 0 HB3 PRO B 4 7.800 -1.916 -6.691 1.00 0.00 H new ATOM 0 HG2 PRO B 4 10.398 -1.176 -6.827 1.00 0.00 H new ATOM 0 HG3 PRO B 4 9.308 -0.653 -8.095 1.00 0.00 H new ATOM 0 HD2 PRO B 4 10.242 0.910 -5.641 1.00 0.00 H new ATOM 0 HD3 PRO B 4 10.134 1.466 -7.300 1.00 0.00 H new ATOM 1504 N LEU B 5 7.311 0.617 -3.699 1.00 0.00 N ATOM 1505 CA LEU B 5 6.610 0.756 -2.434 1.00 0.00 C ATOM 1506 C LEU B 5 5.840 2.073 -2.421 1.00 0.00 C ATOM 1507 O LEU B 5 4.676 2.107 -2.022 1.00 0.00 O ATOM 1508 CB LEU B 5 7.572 0.661 -1.249 1.00 0.00 C ATOM 1509 CG LEU B 5 6.797 0.734 0.077 1.00 0.00 C ATOM 1510 CD1 LEU B 5 5.837 -0.447 0.259 1.00 0.00 C ATOM 1511 CD2 LEU B 5 7.771 0.701 1.245 1.00 0.00 C ATOM 0 H LEU B 5 8.302 0.859 -3.674 1.00 0.00 H new ATOM 0 HA LEU B 5 5.902 -0.067 -2.332 1.00 0.00 H new ATOM 0 HB2 LEU B 5 8.131 -0.273 -1.300 1.00 0.00 H new ATOM 0 HB3 LEU B 5 8.300 1.471 -1.297 1.00 0.00 H new ATOM 0 HG LEU B 5 6.225 1.661 0.050 1.00 0.00 H new ATOM 0 HD11 LEU B 5 5.314 -0.348 1.210 1.00 0.00 H new ATOM 0 HD12 LEU B 5 5.111 -0.455 -0.554 1.00 0.00 H new ATOM 0 HD13 LEU B 5 6.402 -1.379 0.251 1.00 0.00 H new ATOM 0 HD21 LEU B 5 7.217 0.753 2.182 1.00 0.00 H new ATOM 0 HD22 LEU B 5 8.345 -0.225 1.214 1.00 0.00 H new ATOM 0 HD23 LEU B 5 8.450 1.551 1.177 1.00 0.00 H new ATOM 1523 N ASP B 6 6.500 3.158 -2.845 1.00 0.00 N ATOM 1524 CA ASP B 6 5.947 4.506 -2.809 1.00 0.00 C ATOM 1525 C ASP B 6 4.551 4.530 -3.415 1.00 0.00 C ATOM 1526 O ASP B 6 3.650 5.118 -2.825 1.00 0.00 O ATOM 1527 CB ASP B 6 6.841 5.513 -3.542 1.00 0.00 C ATOM 1528 CG ASP B 6 8.181 5.779 -2.864 1.00 0.00 C ATOM 1529 OD1 ASP B 6 8.290 5.517 -1.644 1.00 0.00 O ATOM 1530 OD2 ASP B 6 9.076 6.266 -3.584 1.00 0.00 O ATOM 0 H ASP B 6 7.445 3.117 -3.227 1.00 0.00 H new ATOM 0 HA ASP B 6 5.894 4.800 -1.761 1.00 0.00 H new ATOM 0 HB2 ASP B 6 7.025 5.148 -4.552 1.00 0.00 H new ATOM 0 HB3 ASP B 6 6.303 6.456 -3.637 1.00 0.00 H new ATOM 1535 N GLN B 7 4.354 3.891 -4.574 1.00 0.00 N ATOM 1536 CA GLN B 7 3.026 3.869 -5.176 1.00 0.00 C ATOM 1537 C GLN B 7 1.998 3.206 -4.250 1.00 0.00 C ATOM 1538 O GLN B 7 0.872 3.680 -4.134 1.00 0.00 O ATOM 1539 CB GLN B 7 3.075 3.224 -6.565 1.00 0.00 C ATOM 1540 CG GLN B 7 3.436 1.734 -6.529 1.00 0.00 C ATOM 1541 CD GLN B 7 3.899 1.250 -7.895 1.00 0.00 C ATOM 1542 OE1 GLN B 7 3.206 0.503 -8.575 1.00 0.00 O ATOM 1543 NE2 GLN B 7 5.082 1.693 -8.310 1.00 0.00 N ATOM 0 H GLN B 7 5.077 3.397 -5.097 1.00 0.00 H new ATOM 0 HA GLN B 7 2.691 4.898 -5.311 1.00 0.00 H new ATOM 0 HB2 GLN B 7 2.105 3.344 -7.048 1.00 0.00 H new ATOM 0 HB3 GLN B 7 3.805 3.753 -7.178 1.00 0.00 H new ATOM 0 HG2 GLN B 7 4.223 1.565 -5.794 1.00 0.00 H new ATOM 0 HG3 GLN B 7 2.570 1.154 -6.208 1.00 0.00 H new ATOM 0 HE21 GLN B 7 5.631 2.314 -7.716 1.00 0.00 H new ATOM 0 HE22 GLN B 7 5.440 1.412 -9.223 1.00 0.00 H new ATOM 1552 N ALA B 8 2.379 2.120 -3.573 1.00 0.00 N ATOM 1553 CA ALA B 8 1.473 1.384 -2.708 1.00 0.00 C ATOM 1554 C ALA B 8 1.106 2.212 -1.480 1.00 0.00 C ATOM 1555 O ALA B 8 -0.076 2.441 -1.230 1.00 0.00 O ATOM 1556 CB ALA B 8 2.077 0.039 -2.322 1.00 0.00 C ATOM 0 H ALA B 8 3.322 1.733 -3.613 1.00 0.00 H new ATOM 0 HA ALA B 8 0.551 1.187 -3.255 1.00 0.00 H new ATOM 0 HB1 ALA B 8 1.385 -0.498 -1.674 1.00 0.00 H new ATOM 0 HB2 ALA B 8 2.262 -0.548 -3.221 1.00 0.00 H new ATOM 0 HB3 ALA B 8 3.017 0.200 -1.794 1.00 0.00 H new ATOM 1562 N ILE B 9 2.097 2.689 -0.717 1.00 0.00 N ATOM 1563 CA ILE B 9 1.785 3.551 0.426 1.00 0.00 C ATOM 1564 C ILE B 9 1.019 4.792 -0.060 1.00 0.00 C ATOM 1565 O ILE B 9 0.012 5.180 0.532 1.00 0.00 O ATOM 1566 CB ILE B 9 3.015 3.858 1.305 1.00 0.00 C ATOM 1567 CG1 ILE B 9 4.161 4.550 0.555 1.00 0.00 C ATOM 1568 CG2 ILE B 9 3.495 2.557 1.965 1.00 0.00 C ATOM 1569 CD1 ILE B 9 5.325 4.935 1.477 1.00 0.00 C ATOM 0 H ILE B 9 3.089 2.501 -0.863 1.00 0.00 H new ATOM 0 HA ILE B 9 1.125 3.012 1.105 1.00 0.00 H new ATOM 0 HB ILE B 9 2.699 4.575 2.063 1.00 0.00 H new ATOM 0 HG12 ILE B 9 4.528 3.888 -0.230 1.00 0.00 H new ATOM 0 HG13 ILE B 9 3.780 5.446 0.064 1.00 0.00 H new ATOM 0 HG21 ILE B 9 4.365 2.765 2.589 1.00 0.00 H new ATOM 0 HG22 ILE B 9 2.696 2.146 2.582 1.00 0.00 H new ATOM 0 HG23 ILE B 9 3.766 1.836 1.194 1.00 0.00 H new ATOM 0 HD11 ILE B 9 6.107 5.421 0.893 1.00 0.00 H new ATOM 0 HD12 ILE B 9 4.969 5.620 2.246 1.00 0.00 H new ATOM 0 HD13 ILE B 9 5.728 4.038 1.948 1.00 0.00 H new ATOM 1581 N GLY B 10 1.450 5.356 -1.192 1.00 0.00 N ATOM 1582 CA GLY B 10 0.760 6.410 -1.918 1.00 0.00 C ATOM 1583 C GLY B 10 -0.721 6.094 -2.109 1.00 0.00 C ATOM 1584 O GLY B 10 -1.563 6.960 -1.895 1.00 0.00 O ATOM 0 H GLY B 10 2.323 5.076 -1.639 1.00 0.00 H new ATOM 0 HA2 GLY B 10 0.864 7.351 -1.378 1.00 0.00 H new ATOM 0 HA3 GLY B 10 1.230 6.548 -2.892 1.00 0.00 H new ATOM 1588 N LEU B 11 -1.050 4.861 -2.500 1.00 0.00 N ATOM 1589 CA LEU B 11 -2.421 4.416 -2.696 1.00 0.00 C ATOM 1590 C LEU B 11 -3.234 4.608 -1.411 1.00 0.00 C ATOM 1591 O LEU B 11 -4.218 5.348 -1.400 1.00 0.00 O ATOM 1592 CB LEU B 11 -2.408 2.950 -3.171 1.00 0.00 C ATOM 1593 CG LEU B 11 -3.618 2.504 -4.001 1.00 0.00 C ATOM 1594 CD1 LEU B 11 -4.938 2.725 -3.270 1.00 0.00 C ATOM 1595 CD2 LEU B 11 -3.601 3.149 -5.389 1.00 0.00 C ATOM 0 H LEU B 11 -0.357 4.137 -2.691 1.00 0.00 H new ATOM 0 HA LEU B 11 -2.907 5.017 -3.465 1.00 0.00 H new ATOM 0 HB2 LEU B 11 -1.507 2.788 -3.762 1.00 0.00 H new ATOM 0 HB3 LEU B 11 -2.335 2.305 -2.295 1.00 0.00 H new ATOM 0 HG LEU B 11 -3.536 1.427 -4.144 1.00 0.00 H new ATOM 0 HD11 LEU B 11 -5.763 2.393 -3.900 1.00 0.00 H new ATOM 0 HD12 LEU B 11 -4.939 2.155 -2.341 1.00 0.00 H new ATOM 0 HD13 LEU B 11 -5.057 3.785 -3.046 1.00 0.00 H new ATOM 0 HD21 LEU B 11 -4.470 2.815 -5.956 1.00 0.00 H new ATOM 0 HD22 LEU B 11 -3.629 4.234 -5.286 1.00 0.00 H new ATOM 0 HD23 LEU B 11 -2.691 2.858 -5.914 1.00 0.00 H new ATOM 1607 N LEU B 12 -2.815 3.956 -0.320 1.00 0.00 N ATOM 1608 CA LEU B 12 -3.465 4.061 0.985 1.00 0.00 C ATOM 1609 C LEU B 12 -3.613 5.529 1.385 1.00 0.00 C ATOM 1610 O LEU B 12 -4.679 5.938 1.852 1.00 0.00 O ATOM 1611 CB LEU B 12 -2.639 3.320 2.055 1.00 0.00 C ATOM 1612 CG LEU B 12 -2.804 1.792 2.066 1.00 0.00 C ATOM 1613 CD1 LEU B 12 -2.211 1.104 0.834 1.00 0.00 C ATOM 1614 CD2 LEU B 12 -2.118 1.211 3.308 1.00 0.00 C ATOM 0 H LEU B 12 -2.006 3.335 -0.322 1.00 0.00 H new ATOM 0 HA LEU B 12 -4.453 3.605 0.915 1.00 0.00 H new ATOM 0 HB2 LEU B 12 -1.585 3.555 1.905 1.00 0.00 H new ATOM 0 HB3 LEU B 12 -2.915 3.706 3.036 1.00 0.00 H new ATOM 0 HG LEU B 12 -3.878 1.603 2.068 1.00 0.00 H new ATOM 0 HD11 LEU B 12 -2.364 0.027 0.910 1.00 0.00 H new ATOM 0 HD12 LEU B 12 -2.703 1.478 -0.064 1.00 0.00 H new ATOM 0 HD13 LEU B 12 -1.143 1.316 0.778 1.00 0.00 H new ATOM 0 HD21 LEU B 12 -2.235 0.127 3.315 1.00 0.00 H new ATOM 0 HD22 LEU B 12 -1.057 1.461 3.288 1.00 0.00 H new ATOM 0 HD23 LEU B 12 -2.573 1.631 4.205 1.00 0.00 H new ATOM 1626 N ILE B 13 -2.543 6.308 1.222 1.00 0.00 N ATOM 1627 CA ILE B 13 -2.526 7.721 1.570 1.00 0.00 C ATOM 1628 C ILE B 13 -3.583 8.472 0.764 1.00 0.00 C ATOM 1629 O ILE B 13 -4.396 9.189 1.340 1.00 0.00 O ATOM 1630 CB ILE B 13 -1.111 8.290 1.353 1.00 0.00 C ATOM 1631 CG1 ILE B 13 -0.146 7.717 2.404 1.00 0.00 C ATOM 1632 CG2 ILE B 13 -1.092 9.823 1.409 1.00 0.00 C ATOM 1633 CD1 ILE B 13 1.320 7.846 1.978 1.00 0.00 C ATOM 0 H ILE B 13 -1.659 5.969 0.842 1.00 0.00 H new ATOM 0 HA ILE B 13 -2.775 7.848 2.624 1.00 0.00 H new ATOM 0 HB ILE B 13 -0.788 7.992 0.355 1.00 0.00 H new ATOM 0 HG12 ILE B 13 -0.294 8.236 3.351 1.00 0.00 H new ATOM 0 HG13 ILE B 13 -0.381 6.667 2.576 1.00 0.00 H new ATOM 0 HG21 ILE B 13 -0.074 10.180 1.251 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -1.742 10.224 0.631 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -1.446 10.156 2.385 1.00 0.00 H new ATOM 0 HD11 ILE B 13 1.962 7.427 2.753 1.00 0.00 H new ATOM 0 HD12 ILE B 13 1.477 7.305 1.045 1.00 0.00 H new ATOM 0 HD13 ILE B 13 1.565 8.898 1.833 1.00 0.00 H new ATOM 1645 N GLY B 14 -3.577 8.308 -0.558 1.00 0.00 N ATOM 1646 CA GLY B 14 -4.515 8.954 -1.457 1.00 0.00 C ATOM 1647 C GLY B 14 -5.944 8.607 -1.063 1.00 0.00 C ATOM 1648 O GLY B 14 -6.755 9.503 -0.830 1.00 0.00 O ATOM 0 H GLY B 14 -2.904 7.709 -1.037 1.00 0.00 H new ATOM 0 HA2 GLY B 14 -4.374 10.034 -1.427 1.00 0.00 H new ATOM 0 HA3 GLY B 14 -4.325 8.636 -2.482 1.00 0.00 H new ATOM 1652 N ILE B 15 -6.239 7.304 -0.960 1.00 0.00 N ATOM 1653 CA ILE B 15 -7.541 6.819 -0.527 1.00 0.00 C ATOM 1654 C ILE B 15 -7.946 7.539 0.762 1.00 0.00 C ATOM 1655 O ILE B 15 -9.025 8.117 0.835 1.00 0.00 O ATOM 1656 CB ILE B 15 -7.523 5.276 -0.417 1.00 0.00 C ATOM 1657 CG1 ILE B 15 -7.813 4.672 -1.805 1.00 0.00 C ATOM 1658 CG2 ILE B 15 -8.521 4.754 0.623 1.00 0.00 C ATOM 1659 CD1 ILE B 15 -7.754 3.139 -1.845 1.00 0.00 C ATOM 0 H ILE B 15 -5.575 6.561 -1.177 1.00 0.00 H new ATOM 0 HA ILE B 15 -8.310 7.051 -1.264 1.00 0.00 H new ATOM 0 HB ILE B 15 -6.534 4.968 -0.076 1.00 0.00 H new ATOM 0 HG12 ILE B 15 -8.801 4.996 -2.131 1.00 0.00 H new ATOM 0 HG13 ILE B 15 -7.095 5.072 -2.521 1.00 0.00 H new ATOM 0 HG21 ILE B 15 -8.470 3.666 0.662 1.00 0.00 H new ATOM 0 HG22 ILE B 15 -8.274 5.164 1.602 1.00 0.00 H new ATOM 0 HG23 ILE B 15 -9.530 5.060 0.345 1.00 0.00 H new ATOM 0 HD11 ILE B 15 -7.969 2.793 -2.856 1.00 0.00 H new ATOM 0 HD12 ILE B 15 -6.759 2.805 -1.552 1.00 0.00 H new ATOM 0 HD13 ILE B 15 -8.492 2.728 -1.156 1.00 0.00 H new ATOM 1671 N PHE B 16 -7.074 7.534 1.772 1.00 0.00 N ATOM 1672 CA PHE B 16 -7.380 8.163 3.044 1.00 0.00 C ATOM 1673 C PHE B 16 -7.660 9.658 2.885 1.00 0.00 C ATOM 1674 O PHE B 16 -8.760 10.139 3.170 1.00 0.00 O ATOM 1675 CB PHE B 16 -6.214 7.935 4.008 1.00 0.00 C ATOM 1676 CG PHE B 16 -6.475 8.450 5.404 1.00 0.00 C ATOM 1677 CD1 PHE B 16 -7.194 7.664 6.319 1.00 0.00 C ATOM 1678 CD2 PHE B 16 -6.103 9.762 5.749 1.00 0.00 C ATOM 1679 CE1 PHE B 16 -7.462 8.150 7.610 1.00 0.00 C ATOM 1680 CE2 PHE B 16 -6.436 10.272 7.012 1.00 0.00 C ATOM 1681 CZ PHE B 16 -7.079 9.454 7.955 1.00 0.00 C ATOM 0 H PHE B 16 -6.152 7.100 1.727 1.00 0.00 H new ATOM 0 HA PHE B 16 -8.286 7.710 3.446 1.00 0.00 H new ATOM 0 HB2 PHE B 16 -5.998 6.868 4.058 1.00 0.00 H new ATOM 0 HB3 PHE B 16 -5.324 8.422 3.610 1.00 0.00 H new ATOM 0 HD1 PHE B 16 -7.542 6.683 6.030 1.00 0.00 H new ATOM 0 HD2 PHE B 16 -5.562 10.375 5.043 1.00 0.00 H new ATOM 0 HE1 PHE B 16 -7.961 7.522 8.333 1.00 0.00 H new ATOM 0 HE2 PHE B 16 -6.198 11.296 7.260 1.00 0.00 H new ATOM 0 HZ PHE B 16 -7.279 9.830 8.948 1.00 0.00 H new ATOM 1691 N HIS B 17 -6.648 10.407 2.444 1.00 0.00 N ATOM 1692 CA HIS B 17 -6.696 11.854 2.487 1.00 0.00 C ATOM 1693 C HIS B 17 -7.734 12.425 1.524 1.00 0.00 C ATOM 1694 O HIS B 17 -8.194 13.543 1.736 1.00 0.00 O ATOM 1695 CB HIS B 17 -5.299 12.479 2.352 1.00 0.00 C ATOM 1696 CG HIS B 17 -5.159 13.764 3.139 1.00 0.00 C ATOM 1697 ND1 HIS B 17 -4.752 14.989 2.658 1.00 0.00 N ATOM 1698 CD2 HIS B 17 -5.372 13.906 4.486 1.00 0.00 C ATOM 1699 CE1 HIS B 17 -4.743 15.848 3.695 1.00 0.00 C ATOM 1700 NE2 HIS B 17 -5.104 15.232 4.835 1.00 0.00 N ATOM 0 H HIS B 17 -5.786 10.026 2.053 1.00 0.00 H new ATOM 0 HA HIS B 17 -7.044 12.143 3.479 1.00 0.00 H new ATOM 0 HB2 HIS B 17 -4.550 11.764 2.694 1.00 0.00 H new ATOM 0 HB3 HIS B 17 -5.094 12.677 1.300 1.00 0.00 H new ATOM 0 HD1 HIS B 17 -4.503 15.206 1.693 1.00 0.00 H new ATOM 0 HD2 HIS B 17 -5.692 13.126 5.161 1.00 0.00 H new ATOM 0 HE1 HIS B 17 -4.481 16.893 3.621 1.00 0.00 H new ATOM 1708 N LYS B 18 -8.147 11.670 0.500 1.00 0.00 N ATOM 1709 CA LYS B 18 -9.302 12.037 -0.307 1.00 0.00 C ATOM 1710 C LYS B 18 -10.536 12.156 0.601 1.00 0.00 C ATOM 1711 O LYS B 18 -11.228 13.177 0.601 1.00 0.00 O ATOM 1712 CB LYS B 18 -9.492 10.984 -1.408 1.00 0.00 C ATOM 1713 CG LYS B 18 -10.647 11.310 -2.363 1.00 0.00 C ATOM 1714 CD LYS B 18 -10.670 10.355 -3.568 1.00 0.00 C ATOM 1715 CE LYS B 18 -11.074 8.928 -3.177 1.00 0.00 C ATOM 1716 NZ LYS B 18 -11.077 8.027 -4.343 1.00 0.00 N ATOM 0 H LYS B 18 -7.694 10.802 0.215 1.00 0.00 H new ATOM 0 HA LYS B 18 -9.152 13.004 -0.788 1.00 0.00 H new ATOM 0 HB2 LYS B 18 -8.569 10.896 -1.981 1.00 0.00 H new ATOM 0 HB3 LYS B 18 -9.674 10.014 -0.946 1.00 0.00 H new ATOM 0 HG2 LYS B 18 -11.594 11.243 -1.827 1.00 0.00 H new ATOM 0 HG3 LYS B 18 -10.551 12.338 -2.714 1.00 0.00 H new ATOM 0 HD2 LYS B 18 -11.367 10.735 -4.316 1.00 0.00 H new ATOM 0 HD3 LYS B 18 -9.684 10.336 -4.032 1.00 0.00 H new ATOM 0 HE2 LYS B 18 -10.384 8.547 -2.424 1.00 0.00 H new ATOM 0 HE3 LYS B 18 -12.065 8.941 -2.724 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 -11.238 7.050 -4.026 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 -11.835 8.308 -4.997 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 -10.160 8.086 -4.830 1.00 0.00 H new ATOM 1730 N TYR B 19 -10.808 11.112 1.391 1.00 0.00 N ATOM 1731 CA TYR B 19 -11.950 11.104 2.293 1.00 0.00 C ATOM 1732 C TYR B 19 -11.767 12.108 3.424 1.00 0.00 C ATOM 1733 O TYR B 19 -12.749 12.715 3.844 1.00 0.00 O ATOM 1734 CB TYR B 19 -12.251 9.686 2.780 1.00 0.00 C ATOM 1735 CG TYR B 19 -13.074 8.915 1.776 1.00 0.00 C ATOM 1736 CD1 TYR B 19 -12.433 8.232 0.732 1.00 0.00 C ATOM 1737 CD2 TYR B 19 -14.471 9.072 1.746 1.00 0.00 C ATOM 1738 CE1 TYR B 19 -13.166 7.777 -0.369 1.00 0.00 C ATOM 1739 CE2 TYR B 19 -15.208 8.613 0.644 1.00 0.00 C ATOM 1740 CZ TYR B 19 -14.549 8.006 -0.436 1.00 0.00 C ATOM 1741 OH TYR B 19 -15.245 7.680 -1.558 1.00 0.00 O ATOM 0 H TYR B 19 -10.246 10.261 1.419 1.00 0.00 H new ATOM 0 HA TYR B 19 -12.832 11.431 1.743 1.00 0.00 H new ATOM 0 HB2 TYR B 19 -11.315 9.159 2.966 1.00 0.00 H new ATOM 0 HB3 TYR B 19 -12.785 9.733 3.729 1.00 0.00 H new ATOM 0 HD1 TYR B 19 -11.368 8.057 0.778 1.00 0.00 H new ATOM 0 HD2 TYR B 19 -14.978 9.547 2.573 1.00 0.00 H new ATOM 0 HE1 TYR B 19 -12.667 7.249 -1.168 1.00 0.00 H new ATOM 0 HE2 TYR B 19 -16.282 8.727 0.627 1.00 0.00 H new ATOM 0 HH TYR B 19 -14.718 7.057 -2.101 1.00 0.00 H new ATOM 1751 N SER B 20 -10.535 12.330 3.898 1.00 0.00 N ATOM 1752 CA SER B 20 -10.300 13.459 4.788 1.00 0.00 C ATOM 1753 C SER B 20 -10.757 14.744 4.103 1.00 0.00 C ATOM 1754 O SER B 20 -11.677 15.392 4.583 1.00 0.00 O ATOM 1755 CB SER B 20 -8.832 13.579 5.188 1.00 0.00 C ATOM 1756 OG SER B 20 -8.404 12.401 5.833 1.00 0.00 O ATOM 0 H SER B 20 -9.715 11.761 3.686 1.00 0.00 H new ATOM 0 HA SER B 20 -10.873 13.293 5.700 1.00 0.00 H new ATOM 0 HB2 SER B 20 -8.221 13.761 4.304 1.00 0.00 H new ATOM 0 HB3 SER B 20 -8.697 14.434 5.850 1.00 0.00 H new ATOM 0 HG SER B 20 -8.669 12.430 6.776 1.00 0.00 H new ATOM 1762 N GLY B 21 -10.147 15.089 2.967 1.00 0.00 N ATOM 1763 CA GLY B 21 -10.425 16.288 2.191 1.00 0.00 C ATOM 1764 C GLY B 21 -11.921 16.557 2.048 1.00 0.00 C ATOM 1765 O GLY B 21 -12.354 17.699 2.189 1.00 0.00 O ATOM 0 H GLY B 21 -9.416 14.513 2.550 1.00 0.00 H new ATOM 0 HA2 GLY B 21 -9.949 17.145 2.668 1.00 0.00 H new ATOM 0 HA3 GLY B 21 -9.981 16.187 1.201 1.00 0.00 H new ATOM 1769 N LYS B 22 -12.702 15.504 1.791 1.00 0.00 N ATOM 1770 CA LYS B 22 -14.154 15.587 1.694 1.00 0.00 C ATOM 1771 C LYS B 22 -14.794 16.339 2.876 1.00 0.00 C ATOM 1772 O LYS B 22 -15.735 17.102 2.663 1.00 0.00 O ATOM 1773 CB LYS B 22 -14.732 14.174 1.529 1.00 0.00 C ATOM 1774 CG LYS B 22 -16.168 14.218 0.989 1.00 0.00 C ATOM 1775 CD LYS B 22 -16.758 12.821 0.745 1.00 0.00 C ATOM 1776 CE LYS B 22 -15.950 11.949 -0.226 1.00 0.00 C ATOM 1777 NZ LYS B 22 -15.685 12.633 -1.502 1.00 0.00 N ATOM 0 H LYS B 22 -12.336 14.563 1.644 1.00 0.00 H new ATOM 0 HA LYS B 22 -14.402 16.180 0.813 1.00 0.00 H new ATOM 0 HB2 LYS B 22 -14.103 13.599 0.849 1.00 0.00 H new ATOM 0 HB3 LYS B 22 -14.718 13.659 2.489 1.00 0.00 H new ATOM 0 HG2 LYS B 22 -16.800 14.755 1.696 1.00 0.00 H new ATOM 0 HG3 LYS B 22 -16.183 14.781 0.056 1.00 0.00 H new ATOM 0 HD2 LYS B 22 -16.837 12.302 1.700 1.00 0.00 H new ATOM 0 HD3 LYS B 22 -17.771 12.931 0.358 1.00 0.00 H new ATOM 0 HE2 LYS B 22 -15.004 11.672 0.239 1.00 0.00 H new ATOM 0 HE3 LYS B 22 -16.493 11.024 -0.418 1.00 0.00 H new ATOM 0 HZ1 LYS B 22 -15.212 11.977 -2.156 1.00 0.00 H new ATOM 0 HZ2 LYS B 22 -16.583 12.950 -1.919 1.00 0.00 H new ATOM 0 HZ3 LYS B 22 -15.072 13.456 -1.334 1.00 0.00 H new ATOM 1791 N GLU B 23 -14.302 16.129 4.104 1.00 0.00 N ATOM 1792 CA GLU B 23 -14.761 16.834 5.300 1.00 0.00 C ATOM 1793 C GLU B 23 -13.825 17.999 5.660 1.00 0.00 C ATOM 1794 O GLU B 23 -14.284 19.108 5.920 1.00 0.00 O ATOM 1795 CB GLU B 23 -14.980 15.850 6.464 1.00 0.00 C ATOM 1796 CG GLU B 23 -13.833 14.859 6.713 1.00 0.00 C ATOM 1797 CD GLU B 23 -14.060 14.051 7.987 1.00 0.00 C ATOM 1798 OE1 GLU B 23 -14.692 12.976 7.893 1.00 0.00 O ATOM 1799 OE2 GLU B 23 -13.594 14.514 9.048 1.00 0.00 O ATOM 0 H GLU B 23 -13.562 15.453 4.293 1.00 0.00 H new ATOM 0 HA GLU B 23 -15.730 17.285 5.086 1.00 0.00 H new ATOM 0 HB2 GLU B 23 -15.147 16.423 7.376 1.00 0.00 H new ATOM 0 HB3 GLU B 23 -15.892 15.284 6.272 1.00 0.00 H new ATOM 0 HG2 GLU B 23 -13.744 14.183 5.863 1.00 0.00 H new ATOM 0 HG3 GLU B 23 -12.891 15.402 6.788 1.00 0.00 H new ATOM 1806 N GLY B 24 -12.516 17.749 5.696 1.00 0.00 N ATOM 1807 CA GLY B 24 -11.475 18.718 5.984 1.00 0.00 C ATOM 1808 C GLY B 24 -10.112 18.056 5.769 1.00 0.00 C ATOM 1809 O GLY B 24 -9.888 16.931 6.212 1.00 0.00 O ATOM 0 H GLY B 24 -12.141 16.818 5.515 1.00 0.00 H new ATOM 0 HA2 GLY B 24 -11.579 19.588 5.335 1.00 0.00 H new ATOM 0 HA3 GLY B 24 -11.564 19.074 7.010 1.00 0.00 H new ATOM 1813 N ASP B 25 -9.189 18.747 5.096 1.00 0.00 N ATOM 1814 CA ASP B 25 -7.885 18.227 4.684 1.00 0.00 C ATOM 1815 C ASP B 25 -6.875 18.153 5.839 1.00 0.00 C ATOM 1816 O ASP B 25 -5.746 18.623 5.716 1.00 0.00 O ATOM 1817 CB ASP B 25 -7.348 19.078 3.517 1.00 0.00 C ATOM 1818 CG ASP B 25 -7.015 20.518 3.917 1.00 0.00 C ATOM 1819 OD1 ASP B 25 -7.807 21.095 4.697 1.00 0.00 O ATOM 1820 OD2 ASP B 25 -5.988 21.024 3.417 1.00 0.00 O ATOM 0 H ASP B 25 -9.335 19.716 4.814 1.00 0.00 H new ATOM 0 HA ASP B 25 -8.022 17.198 4.353 1.00 0.00 H new ATOM 0 HB2 ASP B 25 -6.453 18.605 3.114 1.00 0.00 H new ATOM 0 HB3 ASP B 25 -8.088 19.093 2.717 1.00 0.00 H new ATOM 1825 N LYS B 26 -7.276 17.551 6.959 1.00 0.00 N ATOM 1826 CA LYS B 26 -6.407 17.198 8.074 1.00 0.00 C ATOM 1827 C LYS B 26 -6.229 15.680 8.017 1.00 0.00 C ATOM 1828 O LYS B 26 -7.036 14.994 7.398 1.00 0.00 O ATOM 1829 CB LYS B 26 -7.046 17.642 9.401 1.00 0.00 C ATOM 1830 CG LYS B 26 -6.732 19.098 9.790 1.00 0.00 C ATOM 1831 CD LYS B 26 -7.113 20.171 8.759 1.00 0.00 C ATOM 1832 CE LYS B 26 -8.621 20.219 8.481 1.00 0.00 C ATOM 1833 NZ LYS B 26 -8.939 21.228 7.454 1.00 0.00 N ATOM 0 H LYS B 26 -8.249 17.288 7.117 1.00 0.00 H new ATOM 0 HA LYS B 26 -5.440 17.697 8.009 1.00 0.00 H new ATOM 0 HB2 LYS B 26 -8.127 17.520 9.331 1.00 0.00 H new ATOM 0 HB3 LYS B 26 -6.702 16.982 10.197 1.00 0.00 H new ATOM 0 HG2 LYS B 26 -7.247 19.322 10.724 1.00 0.00 H new ATOM 0 HG3 LYS B 26 -5.663 19.177 9.988 1.00 0.00 H new ATOM 0 HD2 LYS B 26 -6.783 21.146 9.117 1.00 0.00 H new ATOM 0 HD3 LYS B 26 -6.582 19.978 7.827 1.00 0.00 H new ATOM 0 HE2 LYS B 26 -8.965 19.239 8.151 1.00 0.00 H new ATOM 0 HE3 LYS B 26 -9.157 20.451 9.402 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 -9.965 21.240 7.285 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 -8.631 22.166 7.782 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 -8.445 20.991 6.570 1.00 0.00 H new ATOM 1847 N HIS B 27 -5.182 15.135 8.642 1.00 0.00 N ATOM 1848 CA HIS B 27 -4.815 13.726 8.485 1.00 0.00 C ATOM 1849 C HIS B 27 -5.666 12.833 9.401 1.00 0.00 C ATOM 1850 O HIS B 27 -5.165 12.023 10.185 1.00 0.00 O ATOM 1851 CB HIS B 27 -3.302 13.574 8.685 1.00 0.00 C ATOM 1852 CG HIS B 27 -2.497 14.537 7.839 1.00 0.00 C ATOM 1853 ND1 HIS B 27 -2.938 15.213 6.718 1.00 0.00 N ATOM 1854 CD2 HIS B 27 -1.255 15.026 8.148 1.00 0.00 C ATOM 1855 CE1 HIS B 27 -1.988 16.099 6.380 1.00 0.00 C ATOM 1856 NE2 HIS B 27 -0.938 16.017 7.214 1.00 0.00 N ATOM 0 H HIS B 27 -4.568 15.656 9.268 1.00 0.00 H new ATOM 0 HA HIS B 27 -5.036 13.384 7.474 1.00 0.00 H new ATOM 0 HB2 HIS B 27 -3.062 13.733 9.736 1.00 0.00 H new ATOM 0 HB3 HIS B 27 -3.009 12.553 8.442 1.00 0.00 H new ATOM 0 HD1 HIS B 27 -3.824 15.066 6.235 1.00 0.00 H new ATOM 0 HD2 HIS B 27 -0.631 14.703 8.968 1.00 0.00 H new ATOM 0 HE1 HIS B 27 -2.058 16.786 5.549 1.00 0.00 H new ATOM 1864 N THR B 28 -6.980 12.986 9.265 1.00 0.00 N ATOM 1865 CA THR B 28 -8.022 12.448 10.110 1.00 0.00 C ATOM 1866 C THR B 28 -9.267 12.320 9.241 1.00 0.00 C ATOM 1867 O THR B 28 -9.432 13.116 8.317 1.00 0.00 O ATOM 1868 CB THR B 28 -8.300 13.432 11.257 1.00 0.00 C ATOM 1869 OG1 THR B 28 -8.313 14.760 10.759 1.00 0.00 O ATOM 1870 CG2 THR B 28 -7.255 13.349 12.372 1.00 0.00 C ATOM 0 H THR B 28 -7.366 13.535 8.497 1.00 0.00 H new ATOM 0 HA THR B 28 -7.735 11.486 10.533 1.00 0.00 H new ATOM 0 HB THR B 28 -9.269 13.158 11.675 1.00 0.00 H new ATOM 0 HG1 THR B 28 -8.492 15.383 11.494 1.00 0.00 H new ATOM 0 HG21 THR B 28 -7.501 14.066 13.155 1.00 0.00 H new ATOM 0 HG22 THR B 28 -7.248 12.342 12.790 1.00 0.00 H new ATOM 0 HG23 THR B 28 -6.270 13.580 11.966 1.00 0.00 H new ATOM 1878 N LEU B 29 -10.139 11.357 9.528 1.00 0.00 N ATOM 1879 CA LEU B 29 -11.465 11.321 8.909 1.00 0.00 C ATOM 1880 C LEU B 29 -12.475 10.676 9.851 1.00 0.00 C ATOM 1881 O LEU B 29 -12.099 9.865 10.695 1.00 0.00 O ATOM 1882 CB LEU B 29 -11.426 10.726 7.491 1.00 0.00 C ATOM 1883 CG LEU B 29 -10.892 9.290 7.370 1.00 0.00 C ATOM 1884 CD1 LEU B 29 -12.011 8.262 7.535 1.00 0.00 C ATOM 1885 CD2 LEU B 29 -10.293 9.102 5.970 1.00 0.00 C ATOM 0 H LEU B 29 -9.955 10.595 10.181 1.00 0.00 H new ATOM 0 HA LEU B 29 -11.814 12.342 8.754 1.00 0.00 H new ATOM 0 HB2 LEU B 29 -12.436 10.751 7.081 1.00 0.00 H new ATOM 0 HB3 LEU B 29 -10.812 11.373 6.865 1.00 0.00 H new ATOM 0 HG LEU B 29 -10.149 9.140 8.153 1.00 0.00 H new ATOM 0 HD11 LEU B 29 -11.598 7.257 7.444 1.00 0.00 H new ATOM 0 HD12 LEU B 29 -12.470 8.378 8.517 1.00 0.00 H new ATOM 0 HD13 LEU B 29 -12.764 8.417 6.762 1.00 0.00 H new ATOM 0 HD21 LEU B 29 -9.910 8.086 5.871 1.00 0.00 H new ATOM 0 HD22 LEU B 29 -11.064 9.274 5.218 1.00 0.00 H new ATOM 0 HD23 LEU B 29 -9.479 9.812 5.824 1.00 0.00 H new ATOM 1897 N SER B 30 -13.747 11.077 9.763 1.00 0.00 N ATOM 1898 CA SER B 30 -14.748 10.704 10.753 1.00 0.00 C ATOM 1899 C SER B 30 -15.234 9.270 10.526 1.00 0.00 C ATOM 1900 O SER B 30 -15.068 8.707 9.448 1.00 0.00 O ATOM 1901 CB SER B 30 -15.907 11.707 10.745 1.00 0.00 C ATOM 1902 OG SER B 30 -16.552 11.724 9.488 1.00 0.00 O ATOM 0 H SER B 30 -14.104 11.664 9.009 1.00 0.00 H new ATOM 0 HA SER B 30 -14.290 10.735 11.741 1.00 0.00 H new ATOM 0 HB2 SER B 30 -16.625 11.445 11.523 1.00 0.00 H new ATOM 0 HB3 SER B 30 -15.532 12.703 10.979 1.00 0.00 H new ATOM 0 HG SER B 30 -16.007 12.227 8.847 1.00 0.00 H new ATOM 1908 N LYS B 31 -15.836 8.665 11.548 1.00 0.00 N ATOM 1909 CA LYS B 31 -16.203 7.258 11.533 1.00 0.00 C ATOM 1910 C LYS B 31 -17.166 6.903 10.389 1.00 0.00 C ATOM 1911 O LYS B 31 -16.978 5.916 9.677 1.00 0.00 O ATOM 1912 CB LYS B 31 -16.719 6.876 12.925 1.00 0.00 C ATOM 1913 CG LYS B 31 -18.002 7.583 13.379 1.00 0.00 C ATOM 1914 CD LYS B 31 -18.332 7.139 14.810 1.00 0.00 C ATOM 1915 CE LYS B 31 -19.497 7.937 15.406 1.00 0.00 C ATOM 1916 NZ LYS B 31 -20.747 7.735 14.652 1.00 0.00 N ATOM 0 H LYS B 31 -16.083 9.144 12.414 1.00 0.00 H new ATOM 0 HA LYS B 31 -15.322 6.654 11.317 1.00 0.00 H new ATOM 0 HB2 LYS B 31 -16.893 5.800 12.944 1.00 0.00 H new ATOM 0 HB3 LYS B 31 -15.935 7.085 13.652 1.00 0.00 H new ATOM 0 HG2 LYS B 31 -17.871 8.664 13.340 1.00 0.00 H new ATOM 0 HG3 LYS B 31 -18.826 7.338 12.708 1.00 0.00 H new ATOM 0 HD2 LYS B 31 -18.581 6.078 14.812 1.00 0.00 H new ATOM 0 HD3 LYS B 31 -17.450 7.260 15.439 1.00 0.00 H new ATOM 0 HE2 LYS B 31 -19.647 7.639 16.444 1.00 0.00 H new ATOM 0 HE3 LYS B 31 -19.245 8.997 15.412 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 -21.517 8.265 15.108 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 -20.623 8.074 13.677 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 -20.985 6.723 14.639 1.00 0.00 H new ATOM 1930 N LYS B 32 -18.197 7.720 10.170 1.00 0.00 N ATOM 1931 CA LYS B 32 -19.103 7.494 9.051 1.00 0.00 C ATOM 1932 C LYS B 32 -18.401 7.807 7.725 1.00 0.00 C ATOM 1933 O LYS B 32 -18.661 7.137 6.728 1.00 0.00 O ATOM 1934 CB LYS B 32 -20.414 8.259 9.266 1.00 0.00 C ATOM 1935 CG LYS B 32 -21.368 8.124 8.071 1.00 0.00 C ATOM 1936 CD LYS B 32 -22.704 8.814 8.373 1.00 0.00 C ATOM 1937 CE LYS B 32 -23.704 8.642 7.222 1.00 0.00 C ATOM 1938 NZ LYS B 32 -23.229 9.269 5.975 1.00 0.00 N ATOM 0 H LYS B 32 -18.421 8.532 10.745 1.00 0.00 H new ATOM 0 HA LYS B 32 -19.379 6.441 8.998 1.00 0.00 H new ATOM 0 HB2 LYS B 32 -20.906 7.888 10.165 1.00 0.00 H new ATOM 0 HB3 LYS B 32 -20.194 9.313 9.435 1.00 0.00 H new ATOM 0 HG2 LYS B 32 -20.915 8.567 7.184 1.00 0.00 H new ATOM 0 HG3 LYS B 32 -21.537 7.070 7.850 1.00 0.00 H new ATOM 0 HD2 LYS B 32 -23.128 8.401 9.288 1.00 0.00 H new ATOM 0 HD3 LYS B 32 -22.533 9.876 8.551 1.00 0.00 H new ATOM 0 HE2 LYS B 32 -23.878 7.580 7.050 1.00 0.00 H new ATOM 0 HE3 LYS B 32 -24.661 9.080 7.506 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 -23.988 9.248 5.265 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 -22.958 10.255 6.164 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 -22.405 8.746 5.616 1.00 0.00 H new ATOM 1952 N GLU B 33 -17.490 8.787 7.697 1.00 0.00 N ATOM 1953 CA GLU B 33 -16.697 9.055 6.505 1.00 0.00 C ATOM 1954 C GLU B 33 -15.833 7.834 6.167 1.00 0.00 C ATOM 1955 O GLU B 33 -15.693 7.481 5.000 1.00 0.00 O ATOM 1956 CB GLU B 33 -15.866 10.332 6.694 1.00 0.00 C ATOM 1957 CG GLU B 33 -15.225 10.840 5.398 1.00 0.00 C ATOM 1958 CD GLU B 33 -16.248 11.501 4.479 1.00 0.00 C ATOM 1959 OE1 GLU B 33 -16.899 10.750 3.722 1.00 0.00 O ATOM 1960 OE2 GLU B 33 -16.374 12.742 4.565 1.00 0.00 O ATOM 0 H GLU B 33 -17.289 9.402 8.486 1.00 0.00 H new ATOM 0 HA GLU B 33 -17.357 9.230 5.655 1.00 0.00 H new ATOM 0 HB2 GLU B 33 -16.504 11.114 7.105 1.00 0.00 H new ATOM 0 HB3 GLU B 33 -15.082 10.141 7.427 1.00 0.00 H new ATOM 0 HG2 GLU B 33 -14.438 11.554 5.638 1.00 0.00 H new ATOM 0 HG3 GLU B 33 -14.752 10.008 4.876 1.00 0.00 H new ATOM 1967 N LEU B 34 -15.285 7.153 7.179 1.00 0.00 N ATOM 1968 CA LEU B 34 -14.617 5.875 6.987 1.00 0.00 C ATOM 1969 C LEU B 34 -15.593 4.886 6.354 1.00 0.00 C ATOM 1970 O LEU B 34 -15.272 4.261 5.344 1.00 0.00 O ATOM 1971 CB LEU B 34 -14.017 5.365 8.310 1.00 0.00 C ATOM 1972 CG LEU B 34 -13.401 3.955 8.275 1.00 0.00 C ATOM 1973 CD1 LEU B 34 -14.460 2.838 8.278 1.00 0.00 C ATOM 1974 CD2 LEU B 34 -12.397 3.803 7.122 1.00 0.00 C ATOM 0 H LEU B 34 -15.295 7.476 8.147 1.00 0.00 H new ATOM 0 HA LEU B 34 -13.777 5.994 6.303 1.00 0.00 H new ATOM 0 HB2 LEU B 34 -13.248 6.067 8.631 1.00 0.00 H new ATOM 0 HB3 LEU B 34 -14.799 5.379 9.069 1.00 0.00 H new ATOM 0 HG LEU B 34 -12.844 3.838 9.205 1.00 0.00 H new ATOM 0 HD11 LEU B 34 -13.965 1.867 8.252 1.00 0.00 H new ATOM 0 HD12 LEU B 34 -15.065 2.913 9.181 1.00 0.00 H new ATOM 0 HD13 LEU B 34 -15.101 2.942 7.402 1.00 0.00 H new ATOM 0 HD21 LEU B 34 -11.983 2.795 7.130 1.00 0.00 H new ATOM 0 HD22 LEU B 34 -12.903 3.980 6.173 1.00 0.00 H new ATOM 0 HD23 LEU B 34 -11.591 4.527 7.244 1.00 0.00 H new ATOM 1986 N LYS B 35 -16.795 4.728 6.916 1.00 0.00 N ATOM 1987 CA LYS B 35 -17.756 3.822 6.299 1.00 0.00 C ATOM 1988 C LYS B 35 -17.984 4.194 4.827 1.00 0.00 C ATOM 1989 O LYS B 35 -18.022 3.313 3.971 1.00 0.00 O ATOM 1990 CB LYS B 35 -19.073 3.757 7.082 1.00 0.00 C ATOM 1991 CG LYS B 35 -19.831 2.509 6.613 1.00 0.00 C ATOM 1992 CD LYS B 35 -21.182 2.324 7.299 1.00 0.00 C ATOM 1993 CE LYS B 35 -21.715 0.935 6.922 1.00 0.00 C ATOM 1994 NZ LYS B 35 -23.110 0.754 7.360 1.00 0.00 N ATOM 0 H LYS B 35 -17.114 5.197 7.764 1.00 0.00 H new ATOM 0 HA LYS B 35 -17.331 2.819 6.329 1.00 0.00 H new ATOM 0 HB2 LYS B 35 -18.879 3.707 8.153 1.00 0.00 H new ATOM 0 HB3 LYS B 35 -19.667 4.654 6.907 1.00 0.00 H new ATOM 0 HG2 LYS B 35 -19.985 2.570 5.536 1.00 0.00 H new ATOM 0 HG3 LYS B 35 -19.215 1.629 6.797 1.00 0.00 H new ATOM 0 HD2 LYS B 35 -21.076 2.412 8.380 1.00 0.00 H new ATOM 0 HD3 LYS B 35 -21.880 3.099 6.983 1.00 0.00 H new ATOM 0 HE2 LYS B 35 -21.651 0.801 5.842 1.00 0.00 H new ATOM 0 HE3 LYS B 35 -21.088 0.168 7.376 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 -23.357 -0.256 7.324 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 -23.216 1.102 8.334 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 -23.743 1.288 6.731 1.00 0.00 H new ATOM 2008 N GLU B 36 -18.105 5.491 4.528 1.00 0.00 N ATOM 2009 CA GLU B 36 -18.235 5.985 3.165 1.00 0.00 C ATOM 2010 C GLU B 36 -17.035 5.549 2.315 1.00 0.00 C ATOM 2011 O GLU B 36 -17.221 5.010 1.227 1.00 0.00 O ATOM 2012 CB GLU B 36 -18.422 7.510 3.173 1.00 0.00 C ATOM 2013 CG GLU B 36 -19.060 7.997 1.867 1.00 0.00 C ATOM 2014 CD GLU B 36 -19.239 9.512 1.865 1.00 0.00 C ATOM 2015 OE1 GLU B 36 -20.004 9.992 2.730 1.00 0.00 O ATOM 2016 OE2 GLU B 36 -18.619 10.160 0.993 1.00 0.00 O ATOM 0 H GLU B 36 -18.115 6.228 5.233 1.00 0.00 H new ATOM 0 HA GLU B 36 -19.122 5.549 2.707 1.00 0.00 H new ATOM 0 HB2 GLU B 36 -19.049 7.798 4.017 1.00 0.00 H new ATOM 0 HB3 GLU B 36 -17.457 7.997 3.313 1.00 0.00 H new ATOM 0 HG2 GLU B 36 -18.436 7.702 1.023 1.00 0.00 H new ATOM 0 HG3 GLU B 36 -20.028 7.515 1.731 1.00 0.00 H new ATOM 2023 N LEU B 37 -15.811 5.752 2.817 1.00 0.00 N ATOM 2024 CA LEU B 37 -14.585 5.284 2.175 1.00 0.00 C ATOM 2025 C LEU B 37 -14.727 3.815 1.827 1.00 0.00 C ATOM 2026 O LEU B 37 -14.498 3.429 0.686 1.00 0.00 O ATOM 2027 CB LEU B 37 -13.357 5.575 3.071 1.00 0.00 C ATOM 2028 CG LEU B 37 -11.981 5.054 2.595 1.00 0.00 C ATOM 2029 CD1 LEU B 37 -10.868 5.790 3.357 1.00 0.00 C ATOM 2030 CD2 LEU B 37 -11.763 3.556 2.872 1.00 0.00 C ATOM 0 H LEU B 37 -15.646 6.252 3.691 1.00 0.00 H new ATOM 0 HA LEU B 37 -14.421 5.827 1.244 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -13.282 6.655 3.196 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -13.553 5.153 4.056 1.00 0.00 H new ATOM 0 HG LEU B 37 -11.955 5.226 1.519 1.00 0.00 H new ATOM 0 HD11 LEU B 37 -9.896 5.425 3.024 1.00 0.00 H new ATOM 0 HD12 LEU B 37 -10.940 6.860 3.162 1.00 0.00 H new ATOM 0 HD13 LEU B 37 -10.977 5.608 4.426 1.00 0.00 H new ATOM 0 HD21 LEU B 37 -10.778 3.259 2.512 1.00 0.00 H new ATOM 0 HD22 LEU B 37 -11.829 3.371 3.944 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -12.528 2.976 2.356 1.00 0.00 H new ATOM 2042 N ILE B 38 -15.110 2.982 2.788 1.00 0.00 N ATOM 2043 CA ILE B 38 -15.221 1.560 2.519 1.00 0.00 C ATOM 2044 C ILE B 38 -16.288 1.309 1.461 1.00 0.00 C ATOM 2045 O ILE B 38 -15.981 0.762 0.408 1.00 0.00 O ATOM 2046 CB ILE B 38 -15.443 0.784 3.822 1.00 0.00 C ATOM 2047 CG1 ILE B 38 -14.174 0.962 4.670 1.00 0.00 C ATOM 2048 CG2 ILE B 38 -15.720 -0.705 3.567 1.00 0.00 C ATOM 2049 CD1 ILE B 38 -14.250 0.222 5.993 1.00 0.00 C ATOM 0 H ILE B 38 -15.344 3.262 3.741 1.00 0.00 H new ATOM 0 HA ILE B 38 -14.286 1.184 2.104 1.00 0.00 H new ATOM 0 HB ILE B 38 -16.322 1.170 4.338 1.00 0.00 H new ATOM 0 HG12 ILE B 38 -13.312 0.605 4.107 1.00 0.00 H new ATOM 0 HG13 ILE B 38 -14.014 2.023 4.860 1.00 0.00 H new ATOM 0 HG21 ILE B 38 -15.871 -1.215 4.518 1.00 0.00 H new ATOM 0 HG22 ILE B 38 -16.615 -0.809 2.954 1.00 0.00 H new ATOM 0 HG23 ILE B 38 -14.871 -1.149 3.048 1.00 0.00 H new ATOM 0 HD11 ILE B 38 -13.328 0.381 6.552 1.00 0.00 H new ATOM 0 HD12 ILE B 38 -15.095 0.596 6.571 1.00 0.00 H new ATOM 0 HD13 ILE B 38 -14.382 -0.844 5.807 1.00 0.00 H new ATOM 2061 N GLN B 39 -17.531 1.710 1.714 1.00 0.00 N ATOM 2062 CA GLN B 39 -18.624 1.420 0.800 1.00 0.00 C ATOM 2063 C GLN B 39 -18.345 1.935 -0.613 1.00 0.00 C ATOM 2064 O GLN B 39 -18.733 1.275 -1.577 1.00 0.00 O ATOM 2065 CB GLN B 39 -19.943 1.973 1.356 1.00 0.00 C ATOM 2066 CG GLN B 39 -20.384 1.254 2.640 1.00 0.00 C ATOM 2067 CD GLN B 39 -20.651 -0.228 2.400 1.00 0.00 C ATOM 2068 OE1 GLN B 39 -21.705 -0.601 1.897 1.00 0.00 O ATOM 2069 NE2 GLN B 39 -19.699 -1.092 2.742 1.00 0.00 N ATOM 0 H GLN B 39 -17.803 2.236 2.544 1.00 0.00 H new ATOM 0 HA GLN B 39 -18.714 0.337 0.719 1.00 0.00 H new ATOM 0 HB2 GLN B 39 -19.830 3.038 1.559 1.00 0.00 H new ATOM 0 HB3 GLN B 39 -20.723 1.873 0.601 1.00 0.00 H new ATOM 0 HG2 GLN B 39 -19.612 1.365 3.401 1.00 0.00 H new ATOM 0 HG3 GLN B 39 -21.286 1.727 3.029 1.00 0.00 H new ATOM 0 HE21 GLN B 39 -18.831 -0.756 3.159 1.00 0.00 H new ATOM 0 HE22 GLN B 39 -19.837 -2.091 2.587 1.00 0.00 H new ATOM 2078 N LYS B 40 -17.687 3.090 -0.756 1.00 0.00 N ATOM 2079 CA LYS B 40 -17.405 3.622 -2.076 1.00 0.00 C ATOM 2080 C LYS B 40 -16.186 2.931 -2.685 1.00 0.00 C ATOM 2081 O LYS B 40 -16.258 2.431 -3.805 1.00 0.00 O ATOM 2082 CB LYS B 40 -17.249 5.145 -2.001 1.00 0.00 C ATOM 2083 CG LYS B 40 -17.196 5.834 -3.376 1.00 0.00 C ATOM 2084 CD LYS B 40 -18.495 5.706 -4.188 1.00 0.00 C ATOM 2085 CE LYS B 40 -18.384 4.673 -5.319 1.00 0.00 C ATOM 2086 NZ LYS B 40 -19.633 4.594 -6.096 1.00 0.00 N ATOM 0 H LYS B 40 -17.348 3.661 0.018 1.00 0.00 H new ATOM 0 HA LYS B 40 -18.243 3.414 -2.742 1.00 0.00 H new ATOM 0 HB2 LYS B 40 -18.081 5.558 -1.430 1.00 0.00 H new ATOM 0 HB3 LYS B 40 -16.337 5.381 -1.452 1.00 0.00 H new ATOM 0 HG2 LYS B 40 -16.971 6.891 -3.233 1.00 0.00 H new ATOM 0 HG3 LYS B 40 -16.375 5.409 -3.953 1.00 0.00 H new ATOM 0 HD2 LYS B 40 -19.310 5.423 -3.521 1.00 0.00 H new ATOM 0 HD3 LYS B 40 -18.752 6.677 -4.611 1.00 0.00 H new ATOM 0 HE2 LYS B 40 -17.559 4.941 -5.979 1.00 0.00 H new ATOM 0 HE3 LYS B 40 -18.152 3.694 -4.899 1.00 0.00 H new ATOM 0 HZ1 LYS B 40 -19.527 3.888 -6.852 1.00 0.00 H new ATOM 0 HZ2 LYS B 40 -20.415 4.315 -5.469 1.00 0.00 H new ATOM 0 HZ3 LYS B 40 -19.840 5.523 -6.516 1.00 0.00 H new ATOM 2100 N GLU B 41 -15.056 2.917 -1.975 1.00 0.00 N ATOM 2101 CA GLU B 41 -13.799 2.450 -2.536 1.00 0.00 C ATOM 2102 C GLU B 41 -13.758 0.923 -2.537 1.00 0.00 C ATOM 2103 O GLU B 41 -13.514 0.308 -3.571 1.00 0.00 O ATOM 2104 CB GLU B 41 -12.605 3.038 -1.767 1.00 0.00 C ATOM 2105 CG GLU B 41 -12.639 4.569 -1.656 1.00 0.00 C ATOM 2106 CD GLU B 41 -12.823 5.275 -2.994 1.00 0.00 C ATOM 2107 OE1 GLU B 41 -11.900 5.170 -3.827 1.00 0.00 O ATOM 2108 OE2 GLU B 41 -13.868 5.944 -3.146 1.00 0.00 O ATOM 0 H GLU B 41 -14.992 3.227 -1.005 1.00 0.00 H new ATOM 0 HA GLU B 41 -13.728 2.795 -3.568 1.00 0.00 H new ATOM 0 HB2 GLU B 41 -12.583 2.610 -0.765 1.00 0.00 H new ATOM 0 HB3 GLU B 41 -11.681 2.738 -2.262 1.00 0.00 H new ATOM 0 HG2 GLU B 41 -13.450 4.858 -0.988 1.00 0.00 H new ATOM 0 HG3 GLU B 41 -11.711 4.912 -1.198 1.00 0.00 H new ATOM 2115 N LEU B 42 -14.002 0.310 -1.379 1.00 0.00 N ATOM 2116 CA LEU B 42 -14.046 -1.137 -1.224 1.00 0.00 C ATOM 2117 C LEU B 42 -15.474 -1.556 -1.578 1.00 0.00 C ATOM 2118 O LEU B 42 -16.239 -1.973 -0.710 1.00 0.00 O ATOM 2119 CB LEU B 42 -13.650 -1.560 0.204 1.00 0.00 C ATOM 2120 CG LEU B 42 -12.152 -1.439 0.549 1.00 0.00 C ATOM 2121 CD1 LEU B 42 -11.633 0.000 0.442 1.00 0.00 C ATOM 2122 CD2 LEU B 42 -11.920 -1.952 1.976 1.00 0.00 C ATOM 0 H LEU B 42 -14.177 0.816 -0.511 1.00 0.00 H new ATOM 0 HA LEU B 42 -13.328 -1.632 -1.878 1.00 0.00 H new ATOM 0 HB2 LEU B 42 -14.216 -0.955 0.912 1.00 0.00 H new ATOM 0 HB3 LEU B 42 -13.955 -2.596 0.354 1.00 0.00 H new ATOM 0 HG LEU B 42 -11.603 -2.038 -0.177 1.00 0.00 H new ATOM 0 HD11 LEU B 42 -10.573 0.024 0.696 1.00 0.00 H new ATOM 0 HD12 LEU B 42 -11.770 0.361 -0.577 1.00 0.00 H new ATOM 0 HD13 LEU B 42 -12.186 0.638 1.131 1.00 0.00 H new ATOM 0 HD21 LEU B 42 -10.862 -1.869 2.225 1.00 0.00 H new ATOM 0 HD22 LEU B 42 -12.506 -1.357 2.676 1.00 0.00 H new ATOM 0 HD23 LEU B 42 -12.227 -2.996 2.042 1.00 0.00 H new ATOM 2134 N THR B 43 -15.834 -1.409 -2.857 1.00 0.00 N ATOM 2135 CA THR B 43 -17.191 -1.519 -3.380 1.00 0.00 C ATOM 2136 C THR B 43 -17.764 -2.948 -3.328 1.00 0.00 C ATOM 2137 O THR B 43 -18.106 -3.529 -4.357 1.00 0.00 O ATOM 2138 CB THR B 43 -17.187 -0.946 -4.813 1.00 0.00 C ATOM 2139 OG1 THR B 43 -16.112 -0.042 -4.992 1.00 0.00 O ATOM 2140 CG2 THR B 43 -18.505 -0.236 -5.137 1.00 0.00 C ATOM 0 H THR B 43 -15.152 -1.200 -3.586 1.00 0.00 H new ATOM 0 HA THR B 43 -17.861 -0.945 -2.740 1.00 0.00 H new ATOM 0 HB THR B 43 -17.067 -1.789 -5.494 1.00 0.00 H new ATOM 0 HG1 THR B 43 -16.311 0.799 -4.529 1.00 0.00 H new ATOM 0 HG21 THR B 43 -18.467 0.155 -6.154 1.00 0.00 H new ATOM 0 HG22 THR B 43 -19.330 -0.943 -5.051 1.00 0.00 H new ATOM 0 HG23 THR B 43 -18.657 0.586 -4.437 1.00 0.00 H new ATOM 2148 N ILE B 44 -17.901 -3.525 -2.134 1.00 0.00 N ATOM 2149 CA ILE B 44 -18.483 -4.847 -1.962 1.00 0.00 C ATOM 2150 C ILE B 44 -19.970 -4.810 -2.327 1.00 0.00 C ATOM 2151 O ILE B 44 -20.716 -3.967 -1.834 1.00 0.00 O ATOM 2152 CB ILE B 44 -18.226 -5.388 -0.540 1.00 0.00 C ATOM 2153 CG1 ILE B 44 -18.849 -4.515 0.569 1.00 0.00 C ATOM 2154 CG2 ILE B 44 -16.716 -5.570 -0.326 1.00 0.00 C ATOM 2155 CD1 ILE B 44 -18.585 -5.072 1.969 1.00 0.00 C ATOM 0 H ILE B 44 -17.610 -3.085 -1.261 1.00 0.00 H new ATOM 0 HA ILE B 44 -17.997 -5.547 -2.641 1.00 0.00 H new ATOM 0 HB ILE B 44 -18.726 -6.354 -0.463 1.00 0.00 H new ATOM 0 HG12 ILE B 44 -18.446 -3.505 0.501 1.00 0.00 H new ATOM 0 HG13 ILE B 44 -19.924 -4.441 0.408 1.00 0.00 H new ATOM 0 HG21 ILE B 44 -16.534 -5.952 0.679 1.00 0.00 H new ATOM 0 HG22 ILE B 44 -16.327 -6.277 -1.059 1.00 0.00 H new ATOM 0 HG23 ILE B 44 -16.213 -4.610 -0.445 1.00 0.00 H new ATOM 0 HD11 ILE B 44 -19.045 -4.421 2.712 1.00 0.00 H new ATOM 0 HD12 ILE B 44 -19.012 -6.072 2.049 1.00 0.00 H new ATOM 0 HD13 ILE B 44 -17.510 -5.121 2.144 1.00 0.00 H new ATOM 2167 N GLY B 45 -20.406 -5.727 -3.194 1.00 0.00 N ATOM 2168 CA GLY B 45 -21.817 -5.888 -3.526 1.00 0.00 C ATOM 2169 C GLY B 45 -22.581 -6.536 -2.371 1.00 0.00 C ATOM 2170 O GLY B 45 -23.779 -6.314 -2.202 1.00 0.00 O ATOM 0 H GLY B 45 -19.789 -6.376 -3.683 1.00 0.00 H new ATOM 0 HA2 GLY B 45 -22.253 -4.916 -3.755 1.00 0.00 H new ATOM 0 HA3 GLY B 45 -21.916 -6.501 -4.422 1.00 0.00 H new ATOM 2174 N SER B 46 -21.894 -7.354 -1.573 1.00 0.00 N ATOM 2175 CA SER B 46 -22.432 -8.120 -0.466 1.00 0.00 C ATOM 2176 C SER B 46 -22.742 -7.214 0.734 1.00 0.00 C ATOM 2177 O SER B 46 -22.168 -7.365 1.813 1.00 0.00 O ATOM 2178 CB SER B 46 -21.396 -9.209 -0.149 1.00 0.00 C ATOM 2179 OG SER B 46 -20.092 -8.712 -0.414 1.00 0.00 O ATOM 0 H SER B 46 -20.892 -7.503 -1.695 1.00 0.00 H new ATOM 0 HA SER B 46 -23.386 -8.583 -0.720 1.00 0.00 H new ATOM 0 HB2 SER B 46 -21.477 -9.510 0.895 1.00 0.00 H new ATOM 0 HB3 SER B 46 -21.589 -10.096 -0.752 1.00 0.00 H new ATOM 0 HG SER B 46 -19.514 -8.881 0.359 1.00 0.00 H new ATOM 2185 N LYS B 47 -23.705 -6.303 0.568 1.00 0.00 N ATOM 2186 CA LYS B 47 -24.117 -5.354 1.600 1.00 0.00 C ATOM 2187 C LYS B 47 -24.597 -6.034 2.887 1.00 0.00 C ATOM 2188 O LYS B 47 -24.625 -5.400 3.937 1.00 0.00 O ATOM 2189 CB LYS B 47 -25.181 -4.391 1.052 1.00 0.00 C ATOM 2190 CG LYS B 47 -24.733 -3.590 -0.182 1.00 0.00 C ATOM 2191 CD LYS B 47 -23.370 -2.920 0.029 1.00 0.00 C ATOM 2192 CE LYS B 47 -23.056 -1.916 -1.083 1.00 0.00 C ATOM 2193 NZ LYS B 47 -21.682 -1.402 -0.941 1.00 0.00 N ATOM 0 H LYS B 47 -24.227 -6.205 -0.303 1.00 0.00 H new ATOM 0 HA LYS B 47 -23.230 -4.783 1.874 1.00 0.00 H new ATOM 0 HB2 LYS B 47 -26.074 -4.962 0.796 1.00 0.00 H new ATOM 0 HB3 LYS B 47 -25.464 -3.694 1.840 1.00 0.00 H new ATOM 0 HG2 LYS B 47 -24.680 -4.254 -1.045 1.00 0.00 H new ATOM 0 HG3 LYS B 47 -25.479 -2.829 -0.410 1.00 0.00 H new ATOM 0 HD2 LYS B 47 -23.360 -2.411 0.993 1.00 0.00 H new ATOM 0 HD3 LYS B 47 -22.591 -3.682 0.063 1.00 0.00 H new ATOM 0 HE2 LYS B 47 -23.173 -2.393 -2.056 1.00 0.00 H new ATOM 0 HE3 LYS B 47 -23.766 -1.089 -1.046 1.00 0.00 H new ATOM 0 HZ1 LYS B 47 -21.546 -0.593 -1.581 1.00 0.00 H new ATOM 0 HZ2 LYS B 47 -21.525 -1.097 0.041 1.00 0.00 H new ATOM 0 HZ3 LYS B 47 -21.004 -2.152 -1.183 1.00 0.00 H new ATOM 2207 N LEU B 48 -24.920 -7.330 2.841 1.00 0.00 N ATOM 2208 CA LEU B 48 -25.183 -8.135 4.030 1.00 0.00 C ATOM 2209 C LEU B 48 -24.035 -8.024 5.046 1.00 0.00 C ATOM 2210 O LEU B 48 -24.253 -8.157 6.247 1.00 0.00 O ATOM 2211 CB LEU B 48 -25.403 -9.605 3.640 1.00 0.00 C ATOM 2212 CG LEU B 48 -26.684 -9.930 2.845 1.00 0.00 C ATOM 2213 CD1 LEU B 48 -27.953 -9.496 3.586 1.00 0.00 C ATOM 2214 CD2 LEU B 48 -26.692 -9.372 1.417 1.00 0.00 C ATOM 0 H LEU B 48 -25.006 -7.851 1.968 1.00 0.00 H new ATOM 0 HA LEU B 48 -26.088 -7.751 4.500 1.00 0.00 H new ATOM 0 HB2 LEU B 48 -24.546 -9.932 3.051 1.00 0.00 H new ATOM 0 HB3 LEU B 48 -25.409 -10.201 4.553 1.00 0.00 H new ATOM 0 HG LEU B 48 -26.680 -11.017 2.759 1.00 0.00 H new ATOM 0 HD11 LEU B 48 -28.828 -9.746 2.986 1.00 0.00 H new ATOM 0 HD12 LEU B 48 -28.010 -10.013 4.544 1.00 0.00 H new ATOM 0 HD13 LEU B 48 -27.925 -8.420 3.756 1.00 0.00 H new ATOM 0 HD21 LEU B 48 -27.626 -9.644 0.925 1.00 0.00 H new ATOM 0 HD22 LEU B 48 -26.602 -8.286 1.450 1.00 0.00 H new ATOM 0 HD23 LEU B 48 -25.854 -9.789 0.859 1.00 0.00 H new ATOM 2226 N GLN B 49 -22.810 -7.765 4.578 1.00 0.00 N ATOM 2227 CA GLN B 49 -21.655 -7.562 5.442 1.00 0.00 C ATOM 2228 C GLN B 49 -21.725 -6.251 6.238 1.00 0.00 C ATOM 2229 O GLN B 49 -20.854 -6.024 7.074 1.00 0.00 O ATOM 2230 CB GLN B 49 -20.369 -7.601 4.606 1.00 0.00 C ATOM 2231 CG GLN B 49 -20.121 -8.992 4.007 1.00 0.00 C ATOM 2232 CD GLN B 49 -18.879 -9.018 3.119 1.00 0.00 C ATOM 2233 OE1 GLN B 49 -18.943 -9.421 1.963 1.00 0.00 O ATOM 2234 NE2 GLN B 49 -17.733 -8.597 3.646 1.00 0.00 N ATOM 0 H GLN B 49 -22.596 -7.691 3.583 1.00 0.00 H new ATOM 0 HA GLN B 49 -21.655 -8.373 6.171 1.00 0.00 H new ATOM 0 HB2 GLN B 49 -20.435 -6.866 3.804 1.00 0.00 H new ATOM 0 HB3 GLN B 49 -19.521 -7.317 5.230 1.00 0.00 H new ATOM 0 HG2 GLN B 49 -20.007 -9.718 4.812 1.00 0.00 H new ATOM 0 HG3 GLN B 49 -20.990 -9.296 3.424 1.00 0.00 H new ATOM 0 HE21 GLN B 49 -17.706 -8.266 4.611 1.00 0.00 H new ATOM 0 HE22 GLN B 49 -16.881 -8.605 3.086 1.00 0.00 H new ATOM 2243 N ASP B 50 -22.711 -5.377 5.999 1.00 0.00 N ATOM 2244 CA ASP B 50 -22.815 -4.063 6.631 1.00 0.00 C ATOM 2245 C ASP B 50 -22.561 -4.103 8.136 1.00 0.00 C ATOM 2246 O ASP B 50 -21.807 -3.284 8.649 1.00 0.00 O ATOM 2247 CB ASP B 50 -24.158 -3.384 6.318 1.00 0.00 C ATOM 2248 CG ASP B 50 -25.385 -4.070 6.921 1.00 0.00 C ATOM 2249 OD1 ASP B 50 -25.339 -5.307 7.106 1.00 0.00 O ATOM 2250 OD2 ASP B 50 -26.353 -3.332 7.204 1.00 0.00 O ATOM 0 H ASP B 50 -23.472 -5.571 5.348 1.00 0.00 H new ATOM 0 HA ASP B 50 -22.020 -3.459 6.194 1.00 0.00 H new ATOM 0 HB2 ASP B 50 -24.121 -2.356 6.679 1.00 0.00 H new ATOM 0 HB3 ASP B 50 -24.281 -3.338 5.236 1.00 0.00 H new ATOM 2255 N ALA B 51 -23.163 -5.066 8.835 1.00 0.00 N ATOM 2256 CA ALA B 51 -22.938 -5.295 10.258 1.00 0.00 C ATOM 2257 C ALA B 51 -21.439 -5.417 10.571 1.00 0.00 C ATOM 2258 O ALA B 51 -20.919 -4.779 11.488 1.00 0.00 O ATOM 2259 CB ALA B 51 -23.690 -6.557 10.681 1.00 0.00 C ATOM 0 H ALA B 51 -23.830 -5.717 8.420 1.00 0.00 H new ATOM 0 HA ALA B 51 -23.314 -4.442 10.823 1.00 0.00 H new ATOM 0 HB1 ALA B 51 -23.529 -6.738 11.744 1.00 0.00 H new ATOM 0 HB2 ALA B 51 -24.756 -6.426 10.493 1.00 0.00 H new ATOM 0 HB3 ALA B 51 -23.323 -7.409 10.108 1.00 0.00 H new ATOM 2265 N GLU B 52 -20.736 -6.223 9.776 1.00 0.00 N ATOM 2266 CA GLU B 52 -19.308 -6.431 9.930 1.00 0.00 C ATOM 2267 C GLU B 52 -18.576 -5.129 9.614 1.00 0.00 C ATOM 2268 O GLU B 52 -17.650 -4.754 10.328 1.00 0.00 O ATOM 2269 CB GLU B 52 -18.827 -7.583 9.034 1.00 0.00 C ATOM 2270 CG GLU B 52 -19.705 -8.840 9.151 1.00 0.00 C ATOM 2271 CD GLU B 52 -19.894 -9.281 10.599 1.00 0.00 C ATOM 2272 OE1 GLU B 52 -18.881 -9.694 11.202 1.00 0.00 O ATOM 2273 OE2 GLU B 52 -21.046 -9.185 11.078 1.00 0.00 O ATOM 0 H GLU B 52 -21.148 -6.749 9.006 1.00 0.00 H new ATOM 0 HA GLU B 52 -19.088 -6.714 10.959 1.00 0.00 H new ATOM 0 HB2 GLU B 52 -18.816 -7.249 7.996 1.00 0.00 H new ATOM 0 HB3 GLU B 52 -17.800 -7.837 9.298 1.00 0.00 H new ATOM 0 HG2 GLU B 52 -20.679 -8.643 8.703 1.00 0.00 H new ATOM 0 HG3 GLU B 52 -19.251 -9.652 8.583 1.00 0.00 H new ATOM 2280 N ILE B 53 -19.006 -4.425 8.563 1.00 0.00 N ATOM 2281 CA ILE B 53 -18.442 -3.123 8.237 1.00 0.00 C ATOM 2282 C ILE B 53 -18.586 -2.161 9.418 1.00 0.00 C ATOM 2283 O ILE B 53 -17.613 -1.490 9.748 1.00 0.00 O ATOM 2284 CB ILE B 53 -19.012 -2.546 6.927 1.00 0.00 C ATOM 2285 CG1 ILE B 53 -18.832 -3.491 5.725 1.00 0.00 C ATOM 2286 CG2 ILE B 53 -18.363 -1.188 6.620 1.00 0.00 C ATOM 2287 CD1 ILE B 53 -17.396 -3.985 5.523 1.00 0.00 C ATOM 0 H ILE B 53 -19.741 -4.738 7.928 1.00 0.00 H new ATOM 0 HA ILE B 53 -17.376 -3.259 8.055 1.00 0.00 H new ATOM 0 HB ILE B 53 -20.084 -2.423 7.081 1.00 0.00 H new ATOM 0 HG12 ILE B 53 -19.486 -4.353 5.854 1.00 0.00 H new ATOM 0 HG13 ILE B 53 -19.158 -2.977 4.821 1.00 0.00 H new ATOM 0 HG21 ILE B 53 -18.774 -0.790 5.692 1.00 0.00 H new ATOM 0 HG22 ILE B 53 -18.569 -0.494 7.435 1.00 0.00 H new ATOM 0 HG23 ILE B 53 -17.286 -1.315 6.515 1.00 0.00 H new ATOM 0 HD11 ILE B 53 -17.357 -4.645 4.656 1.00 0.00 H new ATOM 0 HD12 ILE B 53 -16.737 -3.132 5.360 1.00 0.00 H new ATOM 0 HD13 ILE B 53 -17.071 -4.530 6.409 1.00 0.00 H new ATOM 2299 N VAL B 54 -19.750 -2.067 10.072 1.00 0.00 N ATOM 2300 CA VAL B 54 -19.874 -1.159 11.209 1.00 0.00 C ATOM 2301 C VAL B 54 -19.044 -1.618 12.411 1.00 0.00 C ATOM 2302 O VAL B 54 -18.459 -0.778 13.089 1.00 0.00 O ATOM 2303 CB VAL B 54 -21.312 -0.750 11.565 1.00 0.00 C ATOM 2304 CG1 VAL B 54 -21.852 0.192 10.480 1.00 0.00 C ATOM 2305 CG2 VAL B 54 -22.264 -1.919 11.805 1.00 0.00 C ATOM 0 H VAL B 54 -20.593 -2.592 9.840 1.00 0.00 H new ATOM 0 HA VAL B 54 -19.433 -0.222 10.869 1.00 0.00 H new ATOM 0 HB VAL B 54 -21.263 -0.236 12.525 1.00 0.00 H new ATOM 0 HG11 VAL B 54 -22.872 0.485 10.728 1.00 0.00 H new ATOM 0 HG12 VAL B 54 -21.223 1.080 10.423 1.00 0.00 H new ATOM 0 HG13 VAL B 54 -21.845 -0.320 9.518 1.00 0.00 H new ATOM 0 HG21 VAL B 54 -23.255 -1.537 12.050 1.00 0.00 H new ATOM 0 HG22 VAL B 54 -22.323 -2.531 10.905 1.00 0.00 H new ATOM 0 HG23 VAL B 54 -21.894 -2.525 12.632 1.00 0.00 H new ATOM 2315 N LYS B 55 -18.937 -2.926 12.667 1.00 0.00 N ATOM 2316 CA LYS B 55 -18.007 -3.416 13.684 1.00 0.00 C ATOM 2317 C LYS B 55 -16.581 -2.945 13.364 1.00 0.00 C ATOM 2318 O LYS B 55 -15.912 -2.332 14.193 1.00 0.00 O ATOM 2319 CB LYS B 55 -18.109 -4.945 13.793 1.00 0.00 C ATOM 2320 CG LYS B 55 -17.100 -5.571 14.770 1.00 0.00 C ATOM 2321 CD LYS B 55 -17.138 -4.991 16.193 1.00 0.00 C ATOM 2322 CE LYS B 55 -18.519 -5.077 16.859 1.00 0.00 C ATOM 2323 NZ LYS B 55 -19.020 -6.462 16.911 1.00 0.00 N ATOM 0 H LYS B 55 -19.474 -3.652 12.192 1.00 0.00 H new ATOM 0 HA LYS B 55 -18.272 -3.003 14.657 1.00 0.00 H new ATOM 0 HB2 LYS B 55 -19.118 -5.210 14.109 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -17.960 -5.380 12.805 1.00 0.00 H new ATOM 0 HG2 LYS B 55 -17.286 -6.644 14.825 1.00 0.00 H new ATOM 0 HG3 LYS B 55 -16.096 -5.441 14.366 1.00 0.00 H new ATOM 0 HD2 LYS B 55 -16.413 -5.521 16.811 1.00 0.00 H new ATOM 0 HD3 LYS B 55 -16.826 -3.947 16.159 1.00 0.00 H new ATOM 0 HE2 LYS B 55 -18.460 -4.674 17.870 1.00 0.00 H new ATOM 0 HE3 LYS B 55 -19.226 -4.456 16.309 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 -19.905 -6.491 17.457 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 -19.198 -6.803 15.945 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 -18.311 -7.071 17.368 1.00 0.00 H new ATOM 2337 N LEU B 56 -16.127 -3.211 12.140 1.00 0.00 N ATOM 2338 CA LEU B 56 -14.832 -2.781 11.631 1.00 0.00 C ATOM 2339 C LEU B 56 -14.657 -1.262 11.771 1.00 0.00 C ATOM 2340 O LEU B 56 -13.612 -0.788 12.212 1.00 0.00 O ATOM 2341 CB LEU B 56 -14.702 -3.308 10.195 1.00 0.00 C ATOM 2342 CG LEU B 56 -13.572 -2.678 9.374 1.00 0.00 C ATOM 2343 CD1 LEU B 56 -12.996 -3.707 8.393 1.00 0.00 C ATOM 2344 CD2 LEU B 56 -14.105 -1.511 8.542 1.00 0.00 C ATOM 0 H LEU B 56 -16.667 -3.746 11.459 1.00 0.00 H new ATOM 0 HA LEU B 56 -14.013 -3.197 12.218 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -14.546 -4.386 10.232 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -15.645 -3.140 9.676 1.00 0.00 H new ATOM 0 HG LEU B 56 -12.807 -2.335 10.071 1.00 0.00 H new ATOM 0 HD11 LEU B 56 -12.194 -3.249 7.815 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -12.603 -4.558 8.948 1.00 0.00 H new ATOM 0 HD13 LEU B 56 -13.782 -4.046 7.718 1.00 0.00 H new ATOM 0 HD21 LEU B 56 -13.290 -1.074 7.964 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -14.878 -1.871 7.864 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -14.527 -0.755 9.204 1.00 0.00 H new ATOM 2356 N MET B 57 -15.683 -0.489 11.414 1.00 0.00 N ATOM 2357 CA MET B 57 -15.681 0.962 11.521 1.00 0.00 C ATOM 2358 C MET B 57 -15.525 1.370 12.983 1.00 0.00 C ATOM 2359 O MET B 57 -14.758 2.283 13.276 1.00 0.00 O ATOM 2360 CB MET B 57 -16.951 1.518 10.868 1.00 0.00 C ATOM 2361 CG MET B 57 -17.189 3.015 11.105 1.00 0.00 C ATOM 2362 SD MET B 57 -18.095 3.443 12.617 1.00 0.00 S ATOM 2363 CE MET B 57 -19.736 2.769 12.290 1.00 0.00 C ATOM 0 H MET B 57 -16.553 -0.865 11.036 1.00 0.00 H new ATOM 0 HA MET B 57 -14.833 1.390 10.987 1.00 0.00 H new ATOM 0 HB2 MET B 57 -16.901 1.337 9.794 1.00 0.00 H new ATOM 0 HB3 MET B 57 -17.810 0.963 11.245 1.00 0.00 H new ATOM 0 HG2 MET B 57 -16.222 3.518 11.129 1.00 0.00 H new ATOM 0 HG3 MET B 57 -17.735 3.416 10.251 1.00 0.00 H new ATOM 0 HE1 MET B 57 -20.449 3.186 13.001 1.00 0.00 H new ATOM 0 HE2 MET B 57 -20.041 3.029 11.276 1.00 0.00 H new ATOM 0 HE3 MET B 57 -19.711 1.684 12.394 1.00 0.00 H new ATOM 2373 N ASP B 58 -16.211 0.683 13.900 1.00 0.00 N ATOM 2374 CA ASP B 58 -16.026 0.904 15.324 1.00 0.00 C ATOM 2375 C ASP B 58 -14.573 0.631 15.710 1.00 0.00 C ATOM 2376 O ASP B 58 -13.943 1.462 16.355 1.00 0.00 O ATOM 2377 CB ASP B 58 -17.015 0.073 16.148 1.00 0.00 C ATOM 2378 CG ASP B 58 -16.948 0.461 17.621 1.00 0.00 C ATOM 2379 OD1 ASP B 58 -17.618 1.454 17.977 1.00 0.00 O ATOM 2380 OD2 ASP B 58 -16.238 -0.247 18.368 1.00 0.00 O ATOM 0 H ASP B 58 -16.901 -0.033 13.673 1.00 0.00 H new ATOM 0 HA ASP B 58 -16.239 1.949 15.551 1.00 0.00 H new ATOM 0 HB2 ASP B 58 -18.027 0.225 15.772 1.00 0.00 H new ATOM 0 HB3 ASP B 58 -16.789 -0.987 16.035 1.00 0.00 H new ATOM 2385 N ASP B 59 -14.021 -0.512 15.285 1.00 0.00 N ATOM 2386 CA ASP B 59 -12.626 -0.857 15.557 1.00 0.00 C ATOM 2387 C ASP B 59 -11.679 0.253 15.087 1.00 0.00 C ATOM 2388 O ASP B 59 -10.829 0.700 15.854 1.00 0.00 O ATOM 2389 CB ASP B 59 -12.239 -2.209 14.936 1.00 0.00 C ATOM 2390 CG ASP B 59 -13.037 -3.388 15.490 1.00 0.00 C ATOM 2391 OD1 ASP B 59 -13.079 -3.521 16.734 1.00 0.00 O ATOM 2392 OD2 ASP B 59 -13.570 -4.157 14.662 1.00 0.00 O ATOM 0 H ASP B 59 -14.526 -1.216 14.748 1.00 0.00 H new ATOM 0 HA ASP B 59 -12.524 -0.954 16.638 1.00 0.00 H new ATOM 0 HB2 ASP B 59 -12.384 -2.158 13.857 1.00 0.00 H new ATOM 0 HB3 ASP B 59 -11.177 -2.387 15.107 1.00 0.00 H new ATOM 2397 N LEU B 60 -11.826 0.706 13.838 1.00 0.00 N ATOM 2398 CA LEU B 60 -11.066 1.834 13.307 1.00 0.00 C ATOM 2399 C LEU B 60 -11.271 3.078 14.194 1.00 0.00 C ATOM 2400 O LEU B 60 -10.309 3.642 14.718 1.00 0.00 O ATOM 2401 CB LEU B 60 -11.466 2.082 11.836 1.00 0.00 C ATOM 2402 CG LEU B 60 -10.716 1.173 10.838 1.00 0.00 C ATOM 2403 CD1 LEU B 60 -11.531 0.897 9.573 1.00 0.00 C ATOM 2404 CD2 LEU B 60 -9.416 1.825 10.351 1.00 0.00 C ATOM 0 H LEU B 60 -12.478 0.298 13.168 1.00 0.00 H new ATOM 0 HA LEU B 60 -10.000 1.606 13.323 1.00 0.00 H new ATOM 0 HB2 LEU B 60 -12.539 1.923 11.727 1.00 0.00 H new ATOM 0 HB3 LEU B 60 -11.271 3.125 11.584 1.00 0.00 H new ATOM 0 HG LEU B 60 -10.527 0.252 11.389 1.00 0.00 H new ATOM 0 HD11 LEU B 60 -10.959 0.254 8.905 1.00 0.00 H new ATOM 0 HD12 LEU B 60 -12.464 0.402 9.842 1.00 0.00 H new ATOM 0 HD13 LEU B 60 -11.752 1.838 9.070 1.00 0.00 H new ATOM 0 HD21 LEU B 60 -8.914 1.157 9.650 1.00 0.00 H new ATOM 0 HD22 LEU B 60 -9.646 2.767 9.853 1.00 0.00 H new ATOM 0 HD23 LEU B 60 -8.763 2.014 11.203 1.00 0.00 H new ATOM 2416 N ASP B 61 -12.519 3.522 14.371 1.00 0.00 N ATOM 2417 CA ASP B 61 -12.821 4.776 15.058 1.00 0.00 C ATOM 2418 C ASP B 61 -12.426 4.772 16.531 1.00 0.00 C ATOM 2419 O ASP B 61 -12.157 5.837 17.080 1.00 0.00 O ATOM 2420 CB ASP B 61 -14.264 5.247 14.823 1.00 0.00 C ATOM 2421 CG ASP B 61 -15.364 4.564 15.644 1.00 0.00 C ATOM 2422 OD1 ASP B 61 -15.123 4.212 16.817 1.00 0.00 O ATOM 2423 OD2 ASP B 61 -16.472 4.440 15.083 1.00 0.00 O ATOM 0 H ASP B 61 -13.345 3.022 14.042 1.00 0.00 H new ATOM 0 HA ASP B 61 -12.180 5.526 14.594 1.00 0.00 H new ATOM 0 HB2 ASP B 61 -14.307 6.317 15.024 1.00 0.00 H new ATOM 0 HB3 ASP B 61 -14.496 5.111 13.767 1.00 0.00 H new ATOM 2428 N ARG B 62 -12.349 3.593 17.159 1.00 0.00 N ATOM 2429 CA ARG B 62 -11.921 3.430 18.544 1.00 0.00 C ATOM 2430 C ARG B 62 -10.645 4.229 18.815 1.00 0.00 C ATOM 2431 O ARG B 62 -10.468 4.749 19.913 1.00 0.00 O ATOM 2432 CB ARG B 62 -11.742 1.939 18.852 1.00 0.00 C ATOM 2433 CG ARG B 62 -11.616 1.663 20.357 1.00 0.00 C ATOM 2434 CD ARG B 62 -11.565 0.153 20.619 1.00 0.00 C ATOM 2435 NE ARG B 62 -12.795 -0.500 20.143 1.00 0.00 N ATOM 2436 CZ ARG B 62 -12.867 -1.549 19.310 1.00 0.00 C ATOM 2437 NH1 ARG B 62 -11.793 -2.286 19.009 1.00 0.00 N ATOM 2438 NH2 ARG B 62 -14.034 -1.860 18.741 1.00 0.00 N ATOM 0 H ARG B 62 -12.588 2.711 16.706 1.00 0.00 H new ATOM 0 HA ARG B 62 -12.688 3.825 19.210 1.00 0.00 H new ATOM 0 HB2 ARG B 62 -12.591 1.384 18.454 1.00 0.00 H new ATOM 0 HB3 ARG B 62 -10.852 1.570 18.342 1.00 0.00 H new ATOM 0 HG2 ARG B 62 -10.715 2.137 20.746 1.00 0.00 H new ATOM 0 HG3 ARG B 62 -12.462 2.102 20.886 1.00 0.00 H new ATOM 0 HD2 ARG B 62 -10.700 -0.279 20.116 1.00 0.00 H new ATOM 0 HD3 ARG B 62 -11.439 -0.032 21.686 1.00 0.00 H new ATOM 0 HE ARG B 62 -13.679 -0.118 20.479 1.00 0.00 H new ATOM 0 HH11 ARG B 62 -10.887 -2.056 19.416 1.00 0.00 H new ATOM 0 HH12 ARG B 62 -11.880 -3.078 18.372 1.00 0.00 H new ATOM 0 HH21 ARG B 62 -14.864 -1.301 18.941 1.00 0.00 H new ATOM 0 HH22 ARG B 62 -14.096 -2.656 18.107 1.00 0.00 H new ATOM 2452 N ASN B 63 -9.790 4.356 17.791 1.00 0.00 N ATOM 2453 CA ASN B 63 -8.644 5.255 17.764 1.00 0.00 C ATOM 2454 C ASN B 63 -8.906 6.576 18.481 1.00 0.00 C ATOM 2455 O ASN B 63 -8.093 6.995 19.304 1.00 0.00 O ATOM 2456 CB ASN B 63 -8.292 5.549 16.302 1.00 0.00 C ATOM 2457 CG ASN B 63 -7.139 6.535 16.108 1.00 0.00 C ATOM 2458 OD1 ASN B 63 -6.953 7.027 15.002 1.00 0.00 O ATOM 2459 ND2 ASN B 63 -6.341 6.852 17.125 1.00 0.00 N ATOM 0 H ASN B 63 -9.887 3.814 16.932 1.00 0.00 H new ATOM 0 HA ASN B 63 -7.826 4.760 18.287 1.00 0.00 H new ATOM 0 HB2 ASN B 63 -8.037 4.611 15.808 1.00 0.00 H new ATOM 0 HB3 ASN B 63 -9.177 5.943 15.802 1.00 0.00 H new ATOM 0 HD21 ASN B 63 -5.572 7.507 16.985 1.00 0.00 H new ATOM 0 HD22 ASN B 63 -6.499 6.440 18.045 1.00 0.00 H new ATOM 2466 N LYS B 64 -9.983 7.256 18.092 1.00 0.00 N ATOM 2467 CA LYS B 64 -10.325 8.587 18.562 1.00 0.00 C ATOM 2468 C LYS B 64 -11.841 8.766 18.422 1.00 0.00 C ATOM 2469 O LYS B 64 -12.319 9.724 17.815 1.00 0.00 O ATOM 2470 CB LYS B 64 -9.489 9.632 17.796 1.00 0.00 C ATOM 2471 CG LYS B 64 -9.180 10.906 18.598 1.00 0.00 C ATOM 2472 CD LYS B 64 -10.430 11.718 18.957 1.00 0.00 C ATOM 2473 CE LYS B 64 -10.049 13.047 19.612 1.00 0.00 C ATOM 2474 NZ LYS B 64 -11.250 13.822 19.969 1.00 0.00 N ATOM 0 H LYS B 64 -10.656 6.882 17.423 1.00 0.00 H new ATOM 0 HA LYS B 64 -10.081 8.728 19.615 1.00 0.00 H new ATOM 0 HB2 LYS B 64 -8.549 9.174 17.488 1.00 0.00 H new ATOM 0 HB3 LYS B 64 -10.021 9.910 16.886 1.00 0.00 H new ATOM 0 HG2 LYS B 64 -8.658 10.632 19.515 1.00 0.00 H new ATOM 0 HG3 LYS B 64 -8.501 11.534 18.021 1.00 0.00 H new ATOM 0 HD2 LYS B 64 -11.017 11.906 18.058 1.00 0.00 H new ATOM 0 HD3 LYS B 64 -11.061 11.142 19.634 1.00 0.00 H new ATOM 0 HE2 LYS B 64 -9.454 12.859 20.506 1.00 0.00 H new ATOM 0 HE3 LYS B 64 -9.426 13.627 18.931 1.00 0.00 H new ATOM 0 HZ1 LYS B 64 -10.965 14.719 20.412 1.00 0.00 H new ATOM 0 HZ2 LYS B 64 -11.803 14.020 19.111 1.00 0.00 H new ATOM 0 HZ3 LYS B 64 -11.830 13.275 20.637 1.00 0.00 H new ATOM 2488 N ASP B 65 -12.590 7.837 19.027 1.00 0.00 N ATOM 2489 CA ASP B 65 -14.047 7.808 19.159 1.00 0.00 C ATOM 2490 C ASP B 65 -14.823 8.152 17.878 1.00 0.00 C ATOM 2491 O ASP B 65 -15.368 7.276 17.213 1.00 0.00 O ATOM 2492 CB ASP B 65 -14.506 8.613 20.394 1.00 0.00 C ATOM 2493 CG ASP B 65 -13.907 10.016 20.505 1.00 0.00 C ATOM 2494 OD1 ASP B 65 -14.440 10.930 19.837 1.00 0.00 O ATOM 2495 OD2 ASP B 65 -12.915 10.154 21.253 1.00 0.00 O ATOM 0 H ASP B 65 -12.159 7.026 19.470 1.00 0.00 H new ATOM 0 HA ASP B 65 -14.311 6.764 19.328 1.00 0.00 H new ATOM 0 HB2 ASP B 65 -15.592 8.698 20.371 1.00 0.00 H new ATOM 0 HB3 ASP B 65 -14.249 8.051 21.292 1.00 0.00 H new ATOM 2500 N GLN B 66 -14.928 9.437 17.564 1.00 0.00 N ATOM 2501 CA GLN B 66 -15.666 9.970 16.433 1.00 0.00 C ATOM 2502 C GLN B 66 -14.890 9.812 15.124 1.00 0.00 C ATOM 2503 O GLN B 66 -15.500 9.898 14.056 1.00 0.00 O ATOM 2504 CB GLN B 66 -15.965 11.448 16.706 1.00 0.00 C ATOM 2505 CG GLN B 66 -16.987 11.609 17.839 1.00 0.00 C ATOM 2506 CD GLN B 66 -16.919 13.005 18.445 1.00 0.00 C ATOM 2507 OE1 GLN B 66 -17.741 13.865 18.145 1.00 0.00 O ATOM 2508 NE2 GLN B 66 -15.935 13.240 19.307 1.00 0.00 N ATOM 0 H GLN B 66 -14.479 10.167 18.118 1.00 0.00 H new ATOM 0 HA GLN B 66 -16.595 9.411 16.318 1.00 0.00 H new ATOM 0 HB2 GLN B 66 -15.042 11.965 16.969 1.00 0.00 H new ATOM 0 HB3 GLN B 66 -16.347 11.918 15.799 1.00 0.00 H new ATOM 0 HG2 GLN B 66 -17.991 11.424 17.456 1.00 0.00 H new ATOM 0 HG3 GLN B 66 -16.798 10.864 18.612 1.00 0.00 H new ATOM 0 HE21 GLN B 66 -15.269 12.502 19.534 1.00 0.00 H new ATOM 0 HE22 GLN B 66 -15.846 14.158 19.742 1.00 0.00 H new ATOM 2517 N GLU B 67 -13.562 9.640 15.180 1.00 0.00 N ATOM 2518 CA GLU B 67 -12.720 9.688 13.992 1.00 0.00 C ATOM 2519 C GLU B 67 -11.556 8.702 14.036 1.00 0.00 C ATOM 2520 O GLU B 67 -11.183 8.194 15.093 1.00 0.00 O ATOM 2521 CB GLU B 67 -12.241 11.133 13.764 1.00 0.00 C ATOM 2522 CG GLU B 67 -11.353 11.644 14.908 1.00 0.00 C ATOM 2523 CD GLU B 67 -10.965 13.111 14.749 1.00 0.00 C ATOM 2524 OE1 GLU B 67 -10.983 13.591 13.595 1.00 0.00 O ATOM 2525 OE2 GLU B 67 -10.644 13.724 15.791 1.00 0.00 O ATOM 0 H GLU B 67 -13.051 9.466 16.046 1.00 0.00 H new ATOM 0 HA GLU B 67 -13.325 9.371 13.143 1.00 0.00 H new ATOM 0 HB2 GLU B 67 -11.687 11.185 12.827 1.00 0.00 H new ATOM 0 HB3 GLU B 67 -13.106 11.787 13.660 1.00 0.00 H new ATOM 0 HG2 GLU B 67 -11.877 11.513 15.855 1.00 0.00 H new ATOM 0 HG3 GLU B 67 -10.449 11.038 14.958 1.00 0.00 H new ATOM 2532 N VAL B 68 -10.988 8.466 12.853 1.00 0.00 N ATOM 2533 CA VAL B 68 -9.807 7.665 12.595 1.00 0.00 C ATOM 2534 C VAL B 68 -8.711 8.634 12.153 1.00 0.00 C ATOM 2535 O VAL B 68 -8.943 9.447 11.256 1.00 0.00 O ATOM 2536 CB VAL B 68 -10.089 6.666 11.455 1.00 0.00 C ATOM 2537 CG1 VAL B 68 -8.991 5.597 11.421 1.00 0.00 C ATOM 2538 CG2 VAL B 68 -11.454 5.979 11.564 1.00 0.00 C ATOM 0 H VAL B 68 -11.373 8.860 11.995 1.00 0.00 H new ATOM 0 HA VAL B 68 -9.515 7.103 13.482 1.00 0.00 H new ATOM 0 HB VAL B 68 -10.099 7.248 10.533 1.00 0.00 H new ATOM 0 HG11 VAL B 68 -9.194 4.893 10.614 1.00 0.00 H new ATOM 0 HG12 VAL B 68 -8.025 6.073 11.253 1.00 0.00 H new ATOM 0 HG13 VAL B 68 -8.973 5.064 12.372 1.00 0.00 H new ATOM 0 HG21 VAL B 68 -11.583 5.291 10.729 1.00 0.00 H new ATOM 0 HG22 VAL B 68 -11.509 5.426 12.502 1.00 0.00 H new ATOM 0 HG23 VAL B 68 -12.243 6.731 11.539 1.00 0.00 H new ATOM 2548 N ASN B 69 -7.524 8.555 12.756 1.00 0.00 N ATOM 2549 CA ASN B 69 -6.342 9.257 12.281 1.00 0.00 C ATOM 2550 C ASN B 69 -5.594 8.362 11.300 1.00 0.00 C ATOM 2551 O ASN B 69 -5.575 7.140 11.447 1.00 0.00 O ATOM 2552 CB ASN B 69 -5.417 9.640 13.446 1.00 0.00 C ATOM 2553 CG ASN B 69 -3.984 9.915 12.981 1.00 0.00 C ATOM 2554 OD1 ASN B 69 -3.093 9.095 13.183 1.00 0.00 O ATOM 2555 ND2 ASN B 69 -3.740 11.021 12.288 1.00 0.00 N ATOM 0 H ASN B 69 -7.360 7.997 13.594 1.00 0.00 H new ATOM 0 HA ASN B 69 -6.656 10.176 11.787 1.00 0.00 H new ATOM 0 HB2 ASN B 69 -5.811 10.525 13.945 1.00 0.00 H new ATOM 0 HB3 ASN B 69 -5.410 8.836 14.182 1.00 0.00 H new ATOM 0 HD21 ASN B 69 -2.806 11.195 11.918 1.00 0.00 H new ATOM 0 HD22 ASN B 69 -4.487 11.696 12.126 1.00 0.00 H new ATOM 2562 N PHE B 70 -4.937 8.996 10.329 1.00 0.00 N ATOM 2563 CA PHE B 70 -4.134 8.342 9.312 1.00 0.00 C ATOM 2564 C PHE B 70 -3.277 7.182 9.839 1.00 0.00 C ATOM 2565 O PHE B 70 -3.335 6.073 9.307 1.00 0.00 O ATOM 2566 CB PHE B 70 -3.259 9.397 8.634 1.00 0.00 C ATOM 2567 CG PHE B 70 -2.312 8.787 7.633 1.00 0.00 C ATOM 2568 CD1 PHE B 70 -2.839 8.091 6.533 1.00 0.00 C ATOM 2569 CD2 PHE B 70 -0.936 8.716 7.921 1.00 0.00 C ATOM 2570 CE1 PHE B 70 -1.985 7.364 5.688 1.00 0.00 C ATOM 2571 CE2 PHE B 70 -0.086 7.975 7.088 1.00 0.00 C ATOM 2572 CZ PHE B 70 -0.608 7.303 5.970 1.00 0.00 C ATOM 0 H PHE B 70 -4.954 10.011 10.231 1.00 0.00 H new ATOM 0 HA PHE B 70 -4.820 7.885 8.599 1.00 0.00 H new ATOM 0 HB2 PHE B 70 -3.894 10.128 8.133 1.00 0.00 H new ATOM 0 HB3 PHE B 70 -2.689 9.936 9.391 1.00 0.00 H new ATOM 0 HD1 PHE B 70 -3.901 8.115 6.337 1.00 0.00 H new ATOM 0 HD2 PHE B 70 -0.536 9.231 8.782 1.00 0.00 H new ATOM 0 HE1 PHE B 70 -2.384 6.853 4.824 1.00 0.00 H new ATOM 0 HE2 PHE B 70 0.970 7.921 7.306 1.00 0.00 H new ATOM 0 HZ PHE B 70 0.049 6.738 5.326 1.00 0.00 H new ATOM 2582 N GLN B 71 -2.459 7.417 10.869 1.00 0.00 N ATOM 2583 CA GLN B 71 -1.513 6.401 11.307 1.00 0.00 C ATOM 2584 C GLN B 71 -2.262 5.164 11.810 1.00 0.00 C ATOM 2585 O GLN B 71 -1.866 4.030 11.529 1.00 0.00 O ATOM 2586 CB GLN B 71 -0.567 6.982 12.365 1.00 0.00 C ATOM 2587 CG GLN B 71 0.599 6.027 12.649 1.00 0.00 C ATOM 2588 CD GLN B 71 1.616 6.650 13.599 1.00 0.00 C ATOM 2589 OE1 GLN B 71 2.752 6.911 13.221 1.00 0.00 O ATOM 2590 NE2 GLN B 71 1.219 6.900 14.843 1.00 0.00 N ATOM 0 H GLN B 71 -2.436 8.286 11.403 1.00 0.00 H new ATOM 0 HA GLN B 71 -0.899 6.085 10.464 1.00 0.00 H new ATOM 0 HB2 GLN B 71 -0.180 7.942 12.023 1.00 0.00 H new ATOM 0 HB3 GLN B 71 -1.119 7.171 13.286 1.00 0.00 H new ATOM 0 HG2 GLN B 71 0.216 5.102 13.081 1.00 0.00 H new ATOM 0 HG3 GLN B 71 1.090 5.762 11.712 1.00 0.00 H new ATOM 0 HE21 GLN B 71 0.267 6.672 15.130 1.00 0.00 H new ATOM 0 HE22 GLN B 71 1.866 7.320 15.510 1.00 0.00 H new ATOM 2599 N GLU B 72 -3.360 5.374 12.542 1.00 0.00 N ATOM 2600 CA GLU B 72 -4.149 4.261 13.037 1.00 0.00 C ATOM 2601 C GLU B 72 -4.865 3.583 11.870 1.00 0.00 C ATOM 2602 O GLU B 72 -4.926 2.362 11.829 1.00 0.00 O ATOM 2603 CB GLU B 72 -5.102 4.696 14.153 1.00 0.00 C ATOM 2604 CG GLU B 72 -5.446 3.516 15.083 1.00 0.00 C ATOM 2605 CD GLU B 72 -6.341 2.461 14.429 1.00 0.00 C ATOM 2606 OE1 GLU B 72 -7.321 2.870 13.769 1.00 0.00 O ATOM 2607 OE2 GLU B 72 -6.017 1.264 14.591 1.00 0.00 O ATOM 0 H GLU B 72 -3.713 6.296 12.798 1.00 0.00 H new ATOM 0 HA GLU B 72 -3.486 3.525 13.492 1.00 0.00 H new ATOM 0 HB2 GLU B 72 -4.645 5.498 14.733 1.00 0.00 H new ATOM 0 HB3 GLU B 72 -6.017 5.098 13.718 1.00 0.00 H new ATOM 0 HG2 GLU B 72 -4.521 3.042 15.412 1.00 0.00 H new ATOM 0 HG3 GLU B 72 -5.943 3.900 15.974 1.00 0.00 H new ATOM 2614 N TYR B 73 -5.369 4.348 10.899 1.00 0.00 N ATOM 2615 CA TYR B 73 -5.889 3.776 9.664 1.00 0.00 C ATOM 2616 C TYR B 73 -4.869 2.809 9.045 1.00 0.00 C ATOM 2617 O TYR B 73 -5.213 1.662 8.761 1.00 0.00 O ATOM 2618 CB TYR B 73 -6.337 4.895 8.712 1.00 0.00 C ATOM 2619 CG TYR B 73 -6.301 4.550 7.238 1.00 0.00 C ATOM 2620 CD1 TYR B 73 -7.431 3.991 6.612 1.00 0.00 C ATOM 2621 CD2 TYR B 73 -5.175 4.897 6.470 1.00 0.00 C ATOM 2622 CE1 TYR B 73 -7.455 3.844 5.214 1.00 0.00 C ATOM 2623 CE2 TYR B 73 -5.178 4.695 5.082 1.00 0.00 C ATOM 2624 CZ TYR B 73 -6.331 4.203 4.449 1.00 0.00 C ATOM 2625 OH TYR B 73 -6.388 4.134 3.091 1.00 0.00 O ATOM 0 H TYR B 73 -5.426 5.365 10.948 1.00 0.00 H new ATOM 0 HA TYR B 73 -6.776 3.179 9.877 1.00 0.00 H new ATOM 0 HB2 TYR B 73 -7.354 5.186 8.974 1.00 0.00 H new ATOM 0 HB3 TYR B 73 -5.703 5.766 8.879 1.00 0.00 H new ATOM 0 HD1 TYR B 73 -8.277 3.676 7.204 1.00 0.00 H new ATOM 0 HD2 TYR B 73 -4.305 5.320 6.951 1.00 0.00 H new ATOM 0 HE1 TYR B 73 -8.337 3.455 4.727 1.00 0.00 H new ATOM 0 HE2 TYR B 73 -4.295 4.917 4.501 1.00 0.00 H new ATOM 0 HH TYR B 73 -5.758 4.777 2.704 1.00 0.00 H new ATOM 2635 N ILE B 74 -3.611 3.234 8.867 1.00 0.00 N ATOM 2636 CA ILE B 74 -2.575 2.342 8.349 1.00 0.00 C ATOM 2637 C ILE B 74 -2.427 1.112 9.258 1.00 0.00 C ATOM 2638 O ILE B 74 -2.470 -0.021 8.778 1.00 0.00 O ATOM 2639 CB ILE B 74 -1.226 3.065 8.168 1.00 0.00 C ATOM 2640 CG1 ILE B 74 -1.276 4.238 7.170 1.00 0.00 C ATOM 2641 CG2 ILE B 74 -0.155 2.047 7.743 1.00 0.00 C ATOM 2642 CD1 ILE B 74 -1.414 3.827 5.701 1.00 0.00 C ATOM 0 H ILE B 74 -3.292 4.181 9.073 1.00 0.00 H new ATOM 0 HA ILE B 74 -2.889 2.009 7.360 1.00 0.00 H new ATOM 0 HB ILE B 74 -0.974 3.507 9.132 1.00 0.00 H new ATOM 0 HG12 ILE B 74 -2.114 4.884 7.432 1.00 0.00 H new ATOM 0 HG13 ILE B 74 -0.369 4.831 7.283 1.00 0.00 H new ATOM 0 HG21 ILE B 74 0.800 2.556 7.614 1.00 0.00 H new ATOM 0 HG22 ILE B 74 -0.057 1.280 8.511 1.00 0.00 H new ATOM 0 HG23 ILE B 74 -0.448 1.582 6.802 1.00 0.00 H new ATOM 0 HD11 ILE B 74 -1.441 4.719 5.075 1.00 0.00 H new ATOM 0 HD12 ILE B 74 -0.564 3.208 5.415 1.00 0.00 H new ATOM 0 HD13 ILE B 74 -2.336 3.261 5.566 1.00 0.00 H new ATOM 2654 N THR B 75 -2.253 1.329 10.567 1.00 0.00 N ATOM 2655 CA THR B 75 -2.127 0.253 11.553 1.00 0.00 C ATOM 2656 C THR B 75 -3.237 -0.786 11.356 1.00 0.00 C ATOM 2657 O THR B 75 -2.988 -1.989 11.235 1.00 0.00 O ATOM 2658 CB THR B 75 -2.181 0.846 12.973 1.00 0.00 C ATOM 2659 OG1 THR B 75 -1.202 1.856 13.119 1.00 0.00 O ATOM 2660 CG2 THR B 75 -1.961 -0.212 14.057 1.00 0.00 C ATOM 0 H THR B 75 -2.195 2.263 10.973 1.00 0.00 H new ATOM 0 HA THR B 75 -1.169 -0.248 11.416 1.00 0.00 H new ATOM 0 HB THR B 75 -3.181 1.262 13.100 1.00 0.00 H new ATOM 0 HG1 THR B 75 -1.513 2.678 12.686 1.00 0.00 H new ATOM 0 HG21 THR B 75 -2.009 0.258 15.039 1.00 0.00 H new ATOM 0 HG22 THR B 75 -2.735 -0.976 13.982 1.00 0.00 H new ATOM 0 HG23 THR B 75 -0.982 -0.673 13.922 1.00 0.00 H new ATOM 2668 N PHE B 76 -4.477 -0.304 11.298 1.00 0.00 N ATOM 2669 CA PHE B 76 -5.648 -1.129 11.118 1.00 0.00 C ATOM 2670 C PHE B 76 -5.597 -1.834 9.770 1.00 0.00 C ATOM 2671 O PHE B 76 -5.898 -3.016 9.715 1.00 0.00 O ATOM 2672 CB PHE B 76 -6.927 -0.307 11.259 1.00 0.00 C ATOM 2673 CG PHE B 76 -8.163 -1.171 11.105 1.00 0.00 C ATOM 2674 CD1 PHE B 76 -8.669 -1.874 12.215 1.00 0.00 C ATOM 2675 CD2 PHE B 76 -8.677 -1.434 9.820 1.00 0.00 C ATOM 2676 CE1 PHE B 76 -9.673 -2.842 12.036 1.00 0.00 C ATOM 2677 CE2 PHE B 76 -9.712 -2.363 9.652 1.00 0.00 C ATOM 2678 CZ PHE B 76 -10.180 -3.101 10.750 1.00 0.00 C ATOM 0 H PHE B 76 -4.689 0.691 11.377 1.00 0.00 H new ATOM 0 HA PHE B 76 -5.656 -1.887 11.902 1.00 0.00 H new ATOM 0 HB2 PHE B 76 -6.942 0.180 12.234 1.00 0.00 H new ATOM 0 HB3 PHE B 76 -6.938 0.483 10.508 1.00 0.00 H new ATOM 0 HD1 PHE B 76 -8.286 -1.670 13.204 1.00 0.00 H new ATOM 0 HD2 PHE B 76 -8.272 -0.918 8.962 1.00 0.00 H new ATOM 0 HE1 PHE B 76 -10.055 -3.387 12.887 1.00 0.00 H new ATOM 0 HE2 PHE B 76 -10.150 -2.511 8.676 1.00 0.00 H new ATOM 0 HZ PHE B 76 -10.928 -3.867 10.608 1.00 0.00 H new ATOM 2688 N LEU B 77 -5.223 -1.161 8.680 1.00 0.00 N ATOM 2689 CA LEU B 77 -5.040 -1.855 7.408 1.00 0.00 C ATOM 2690 C LEU B 77 -4.004 -2.977 7.546 1.00 0.00 C ATOM 2691 O LEU B 77 -4.165 -4.043 6.956 1.00 0.00 O ATOM 2692 CB LEU B 77 -4.713 -0.877 6.270 1.00 0.00 C ATOM 2693 CG LEU B 77 -5.939 -0.060 5.820 1.00 0.00 C ATOM 2694 CD1 LEU B 77 -5.523 0.987 4.787 1.00 0.00 C ATOM 2695 CD2 LEU B 77 -7.013 -0.935 5.166 1.00 0.00 C ATOM 0 H LEU B 77 -5.045 -0.157 8.653 1.00 0.00 H new ATOM 0 HA LEU B 77 -5.985 -2.326 7.136 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -3.927 -0.196 6.596 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -4.320 -1.434 5.419 1.00 0.00 H new ATOM 0 HG LEU B 77 -6.346 0.402 6.719 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -6.397 1.559 4.476 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -4.787 1.660 5.227 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -5.087 0.490 3.920 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -7.856 -0.313 4.866 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -6.596 -1.428 4.288 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -7.352 -1.688 5.878 1.00 0.00 H new ATOM 2707 N GLY B 78 -2.974 -2.781 8.371 1.00 0.00 N ATOM 2708 CA GLY B 78 -2.067 -3.857 8.743 1.00 0.00 C ATOM 2709 C GLY B 78 -2.819 -5.018 9.391 1.00 0.00 C ATOM 2710 O GLY B 78 -2.671 -6.170 8.980 1.00 0.00 O ATOM 0 H GLY B 78 -2.750 -1.880 8.794 1.00 0.00 H new ATOM 0 HA2 GLY B 78 -1.538 -4.212 7.858 1.00 0.00 H new ATOM 0 HA3 GLY B 78 -1.314 -3.478 9.434 1.00 0.00 H new ATOM 2714 N ALA B 79 -3.651 -4.722 10.390 1.00 0.00 N ATOM 2715 CA ALA B 79 -4.503 -5.739 10.994 1.00 0.00 C ATOM 2716 C ALA B 79 -5.382 -6.422 9.938 1.00 0.00 C ATOM 2717 O ALA B 79 -5.463 -7.643 9.910 1.00 0.00 O ATOM 2718 CB ALA B 79 -5.332 -5.148 12.138 1.00 0.00 C ATOM 0 H ALA B 79 -3.751 -3.791 10.794 1.00 0.00 H new ATOM 0 HA ALA B 79 -3.863 -6.510 11.423 1.00 0.00 H new ATOM 0 HB1 ALA B 79 -5.959 -5.926 12.572 1.00 0.00 H new ATOM 0 HB2 ALA B 79 -4.665 -4.750 12.903 1.00 0.00 H new ATOM 0 HB3 ALA B 79 -5.962 -4.346 11.754 1.00 0.00 H new ATOM 2724 N LEU B 80 -6.015 -5.652 9.052 1.00 0.00 N ATOM 2725 CA LEU B 80 -6.872 -6.136 7.977 1.00 0.00 C ATOM 2726 C LEU B 80 -6.099 -7.132 7.114 1.00 0.00 C ATOM 2727 O LEU B 80 -6.582 -8.228 6.846 1.00 0.00 O ATOM 2728 CB LEU B 80 -7.380 -4.943 7.146 1.00 0.00 C ATOM 2729 CG LEU B 80 -8.601 -5.265 6.270 1.00 0.00 C ATOM 2730 CD1 LEU B 80 -9.880 -5.415 7.102 1.00 0.00 C ATOM 2731 CD2 LEU B 80 -8.840 -4.115 5.287 1.00 0.00 C ATOM 0 H LEU B 80 -5.940 -4.635 9.067 1.00 0.00 H new ATOM 0 HA LEU B 80 -7.738 -6.651 8.393 1.00 0.00 H new ATOM 0 HB2 LEU B 80 -7.635 -4.126 7.821 1.00 0.00 H new ATOM 0 HB3 LEU B 80 -6.571 -4.588 6.507 1.00 0.00 H new ATOM 0 HG LEU B 80 -8.388 -6.203 5.758 1.00 0.00 H new ATOM 0 HD11 LEU B 80 -10.718 -5.642 6.443 1.00 0.00 H new ATOM 0 HD12 LEU B 80 -9.754 -6.225 7.821 1.00 0.00 H new ATOM 0 HD13 LEU B 80 -10.079 -4.485 7.634 1.00 0.00 H new ATOM 0 HD21 LEU B 80 -9.706 -4.342 4.665 1.00 0.00 H new ATOM 0 HD22 LEU B 80 -9.023 -3.195 5.841 1.00 0.00 H new ATOM 0 HD23 LEU B 80 -7.962 -3.989 4.654 1.00 0.00 H new ATOM 2743 N ALA B 81 -4.878 -6.764 6.712 1.00 0.00 N ATOM 2744 CA ALA B 81 -3.977 -7.647 5.989 1.00 0.00 C ATOM 2745 C ALA B 81 -3.772 -8.944 6.781 1.00 0.00 C ATOM 2746 O ALA B 81 -3.994 -10.043 6.270 1.00 0.00 O ATOM 2747 CB ALA B 81 -2.657 -6.918 5.702 1.00 0.00 C ATOM 0 H ALA B 81 -4.491 -5.836 6.884 1.00 0.00 H new ATOM 0 HA ALA B 81 -4.412 -7.922 5.028 1.00 0.00 H new ATOM 0 HB1 ALA B 81 -1.984 -7.583 5.160 1.00 0.00 H new ATOM 0 HB2 ALA B 81 -2.854 -6.032 5.099 1.00 0.00 H new ATOM 0 HB3 ALA B 81 -2.193 -6.621 6.643 1.00 0.00 H new ATOM 2753 N MET B 82 -3.370 -8.820 8.047 1.00 0.00 N ATOM 2754 CA MET B 82 -3.090 -9.971 8.893 1.00 0.00 C ATOM 2755 C MET B 82 -4.328 -10.864 9.080 1.00 0.00 C ATOM 2756 O MET B 82 -4.197 -12.084 9.175 1.00 0.00 O ATOM 2757 CB MET B 82 -2.490 -9.489 10.223 1.00 0.00 C ATOM 2758 CG MET B 82 -1.676 -10.589 10.911 1.00 0.00 C ATOM 2759 SD MET B 82 -0.698 -10.017 12.325 1.00 0.00 S ATOM 2760 CE MET B 82 0.149 -11.551 12.760 1.00 0.00 C ATOM 0 H MET B 82 -3.231 -7.921 8.509 1.00 0.00 H new ATOM 0 HA MET B 82 -2.354 -10.606 8.401 1.00 0.00 H new ATOM 0 HB2 MET B 82 -1.852 -8.624 10.042 1.00 0.00 H new ATOM 0 HB3 MET B 82 -3.291 -9.161 10.886 1.00 0.00 H new ATOM 0 HG2 MET B 82 -2.356 -11.372 11.247 1.00 0.00 H new ATOM 0 HG3 MET B 82 -1.006 -11.041 10.179 1.00 0.00 H new ATOM 0 HE1 MET B 82 0.798 -11.377 13.618 1.00 0.00 H new ATOM 0 HE2 MET B 82 -0.587 -12.315 13.010 1.00 0.00 H new ATOM 0 HE3 MET B 82 0.748 -11.888 11.914 1.00 0.00 H new ATOM 2770 N ILE B 83 -5.519 -10.258 9.124 1.00 0.00 N ATOM 2771 CA ILE B 83 -6.808 -10.931 9.245 1.00 0.00 C ATOM 2772 C ILE B 83 -7.165 -11.638 7.934 1.00 0.00 C ATOM 2773 O ILE B 83 -7.633 -12.774 7.976 1.00 0.00 O ATOM 2774 CB ILE B 83 -7.888 -9.928 9.701 1.00 0.00 C ATOM 2775 CG1 ILE B 83 -7.649 -9.552 11.177 1.00 0.00 C ATOM 2776 CG2 ILE B 83 -9.304 -10.505 9.541 1.00 0.00 C ATOM 2777 CD1 ILE B 83 -8.382 -8.271 11.590 1.00 0.00 C ATOM 0 H ILE B 83 -5.610 -9.243 9.074 1.00 0.00 H new ATOM 0 HA ILE B 83 -6.749 -11.704 10.011 1.00 0.00 H new ATOM 0 HB ILE B 83 -7.813 -9.043 9.069 1.00 0.00 H new ATOM 0 HG12 ILE B 83 -7.976 -10.374 11.814 1.00 0.00 H new ATOM 0 HG13 ILE B 83 -6.580 -9.424 11.346 1.00 0.00 H new ATOM 0 HG21 ILE B 83 -10.036 -9.769 9.873 1.00 0.00 H new ATOM 0 HG22 ILE B 83 -9.482 -10.747 8.493 1.00 0.00 H new ATOM 0 HG23 ILE B 83 -9.399 -11.408 10.144 1.00 0.00 H new ATOM 0 HD11 ILE B 83 -8.177 -8.056 12.639 1.00 0.00 H new ATOM 0 HD12 ILE B 83 -8.037 -7.440 10.975 1.00 0.00 H new ATOM 0 HD13 ILE B 83 -9.455 -8.405 11.450 1.00 0.00 H new ATOM 2789 N TYR B 84 -6.945 -10.999 6.776 1.00 0.00 N ATOM 2790 CA TYR B 84 -7.070 -11.676 5.484 1.00 0.00 C ATOM 2791 C TYR B 84 -6.211 -12.939 5.532 1.00 0.00 C ATOM 2792 O TYR B 84 -6.671 -14.022 5.179 1.00 0.00 O ATOM 2793 CB TYR B 84 -6.656 -10.766 4.316 1.00 0.00 C ATOM 2794 CG TYR B 84 -7.533 -9.566 3.989 1.00 0.00 C ATOM 2795 CD1 TYR B 84 -8.727 -9.291 4.688 1.00 0.00 C ATOM 2796 CD2 TYR B 84 -7.183 -8.768 2.883 1.00 0.00 C ATOM 2797 CE1 TYR B 84 -9.563 -8.241 4.271 1.00 0.00 C ATOM 2798 CE2 TYR B 84 -8.025 -7.725 2.462 1.00 0.00 C ATOM 2799 CZ TYR B 84 -9.215 -7.460 3.158 1.00 0.00 C ATOM 2800 OH TYR B 84 -10.039 -6.453 2.750 1.00 0.00 O ATOM 0 H TYR B 84 -6.680 -10.016 6.711 1.00 0.00 H new ATOM 0 HA TYR B 84 -8.114 -11.935 5.308 1.00 0.00 H new ATOM 0 HB2 TYR B 84 -5.651 -10.397 4.522 1.00 0.00 H new ATOM 0 HB3 TYR B 84 -6.591 -11.384 3.420 1.00 0.00 H new ATOM 0 HD1 TYR B 84 -8.999 -9.889 5.545 1.00 0.00 H new ATOM 0 HD2 TYR B 84 -6.261 -8.959 2.354 1.00 0.00 H new ATOM 0 HE1 TYR B 84 -10.476 -8.034 4.809 1.00 0.00 H new ATOM 0 HE2 TYR B 84 -7.757 -7.127 1.603 1.00 0.00 H new ATOM 0 HH TYR B 84 -9.651 -6.010 1.967 1.00 0.00 H new ATOM 2810 N ASN B 85 -4.967 -12.785 5.998 1.00 0.00 N ATOM 2811 CA ASN B 85 -4.060 -13.859 6.387 1.00 0.00 C ATOM 2812 C ASN B 85 -3.518 -14.663 5.210 1.00 0.00 C ATOM 2813 O ASN B 85 -2.310 -14.700 4.996 1.00 0.00 O ATOM 2814 CB ASN B 85 -4.710 -14.768 7.439 1.00 0.00 C ATOM 2815 CG ASN B 85 -3.642 -15.427 8.300 1.00 0.00 C ATOM 2816 OD1 ASN B 85 -3.248 -16.564 8.067 1.00 0.00 O ATOM 2817 ND2 ASN B 85 -3.162 -14.705 9.309 1.00 0.00 N ATOM 0 H ASN B 85 -4.550 -11.862 6.118 1.00 0.00 H new ATOM 0 HA ASN B 85 -3.190 -13.376 6.832 1.00 0.00 H new ATOM 0 HB2 ASN B 85 -5.384 -14.185 8.067 1.00 0.00 H new ATOM 0 HB3 ASN B 85 -5.313 -15.532 6.947 1.00 0.00 H new ATOM 0 HD21 ASN B 85 -2.443 -15.095 9.918 1.00 0.00 H new ATOM 0 HD22 ASN B 85 -3.513 -13.762 9.473 1.00 0.00 H new ATOM 2824 N GLU B 86 -4.398 -15.285 4.422 1.00 0.00 N ATOM 2825 CA GLU B 86 -4.040 -16.034 3.224 1.00 0.00 C ATOM 2826 C GLU B 86 -3.100 -15.195 2.356 1.00 0.00 C ATOM 2827 O GLU B 86 -2.045 -15.672 1.946 1.00 0.00 O ATOM 2828 CB GLU B 86 -5.318 -16.434 2.473 1.00 0.00 C ATOM 2829 CG GLU B 86 -5.012 -17.326 1.263 1.00 0.00 C ATOM 2830 CD GLU B 86 -6.296 -17.764 0.567 1.00 0.00 C ATOM 2831 OE1 GLU B 86 -6.791 -16.968 -0.261 1.00 0.00 O ATOM 2832 OE2 GLU B 86 -6.765 -18.877 0.885 1.00 0.00 O ATOM 0 H GLU B 86 -5.401 -15.279 4.607 1.00 0.00 H new ATOM 0 HA GLU B 86 -3.511 -16.949 3.492 1.00 0.00 H new ATOM 0 HB2 GLU B 86 -5.989 -16.960 3.152 1.00 0.00 H new ATOM 0 HB3 GLU B 86 -5.840 -15.537 2.140 1.00 0.00 H new ATOM 0 HG2 GLU B 86 -4.379 -16.785 0.559 1.00 0.00 H new ATOM 0 HG3 GLU B 86 -4.452 -18.204 1.586 1.00 0.00 H new ATOM 2839 N ALA B 87 -3.469 -13.926 2.156 1.00 0.00 N ATOM 2840 CA ALA B 87 -2.677 -12.897 1.488 1.00 0.00 C ATOM 2841 C ALA B 87 -1.189 -12.951 1.852 1.00 0.00 C ATOM 2842 O ALA B 87 -0.332 -12.758 0.994 1.00 0.00 O ATOM 2843 CB ALA B 87 -3.266 -11.529 1.847 1.00 0.00 C ATOM 0 H ALA B 87 -4.373 -13.575 2.472 1.00 0.00 H new ATOM 0 HA ALA B 87 -2.728 -13.074 0.414 1.00 0.00 H new ATOM 0 HB1 ALA B 87 -2.689 -10.745 1.358 1.00 0.00 H new ATOM 0 HB2 ALA B 87 -4.302 -11.480 1.512 1.00 0.00 H new ATOM 0 HB3 ALA B 87 -3.227 -11.388 2.927 1.00 0.00 H new ATOM 2849 N LEU B 88 -0.878 -13.184 3.130 1.00 0.00 N ATOM 2850 CA LEU B 88 0.485 -13.189 3.637 1.00 0.00 C ATOM 2851 C LEU B 88 1.222 -14.453 3.193 1.00 0.00 C ATOM 2852 O LEU B 88 2.434 -14.418 2.995 1.00 0.00 O ATOM 2853 CB LEU B 88 0.484 -13.042 5.166 1.00 0.00 C ATOM 2854 CG LEU B 88 0.117 -11.634 5.673 1.00 0.00 C ATOM 2855 CD1 LEU B 88 -1.252 -11.118 5.233 1.00 0.00 C ATOM 2856 CD2 LEU B 88 0.173 -11.635 7.202 1.00 0.00 C ATOM 0 H LEU B 88 -1.579 -13.376 3.846 1.00 0.00 H new ATOM 0 HA LEU B 88 1.020 -12.336 3.219 1.00 0.00 H new ATOM 0 HB2 LEU B 88 -0.219 -13.761 5.587 1.00 0.00 H new ATOM 0 HB3 LEU B 88 1.472 -13.304 5.544 1.00 0.00 H new ATOM 0 HG LEU B 88 0.845 -10.958 5.225 1.00 0.00 H new ATOM 0 HD11 LEU B 88 -1.414 -10.121 5.642 1.00 0.00 H new ATOM 0 HD12 LEU B 88 -1.292 -11.075 4.145 1.00 0.00 H new ATOM 0 HD13 LEU B 88 -2.029 -11.790 5.598 1.00 0.00 H new ATOM 0 HD21 LEU B 88 -0.085 -10.644 7.576 1.00 0.00 H new ATOM 0 HD22 LEU B 88 -0.536 -12.366 7.592 1.00 0.00 H new ATOM 0 HD23 LEU B 88 1.180 -11.896 7.529 1.00 0.00 H new ATOM 2868 N LYS B 89 0.507 -15.567 3.020 1.00 0.00 N ATOM 2869 CA LYS B 89 1.090 -16.785 2.479 1.00 0.00 C ATOM 2870 C LYS B 89 1.234 -16.658 0.960 1.00 0.00 C ATOM 2871 O LYS B 89 2.270 -17.013 0.403 1.00 0.00 O ATOM 2872 CB LYS B 89 0.244 -18.005 2.871 1.00 0.00 C ATOM 2873 CG LYS B 89 -0.010 -18.118 4.382 1.00 0.00 C ATOM 2874 CD LYS B 89 1.282 -18.022 5.205 1.00 0.00 C ATOM 2875 CE LYS B 89 1.041 -18.483 6.645 1.00 0.00 C ATOM 2876 NZ LYS B 89 2.168 -18.114 7.520 1.00 0.00 N ATOM 0 H LYS B 89 -0.484 -15.645 3.250 1.00 0.00 H new ATOM 0 HA LYS B 89 2.084 -16.931 2.902 1.00 0.00 H new ATOM 0 HB2 LYS B 89 -0.714 -17.954 2.353 1.00 0.00 H new ATOM 0 HB3 LYS B 89 0.745 -18.910 2.527 1.00 0.00 H new ATOM 0 HG2 LYS B 89 -0.694 -17.328 4.692 1.00 0.00 H new ATOM 0 HG3 LYS B 89 -0.502 -19.067 4.594 1.00 0.00 H new ATOM 0 HD2 LYS B 89 2.058 -18.635 4.746 1.00 0.00 H new ATOM 0 HD3 LYS B 89 1.645 -16.994 5.203 1.00 0.00 H new ATOM 0 HE2 LYS B 89 0.122 -18.036 7.024 1.00 0.00 H new ATOM 0 HE3 LYS B 89 0.901 -19.564 6.665 1.00 0.00 H new ATOM 0 HZ1 LYS B 89 2.124 -18.671 8.397 1.00 0.00 H new ATOM 0 HZ2 LYS B 89 3.065 -18.308 7.031 1.00 0.00 H new ATOM 0 HZ3 LYS B 89 2.112 -17.101 7.750 1.00 0.00 H new ATOM 2890 N GLY B 90 0.198 -16.151 0.287 1.00 0.00 N ATOM 2891 CA GLY B 90 0.214 -15.922 -1.149 1.00 0.00 C ATOM 2892 C GLY B 90 -1.194 -15.667 -1.683 1.00 0.00 C ATOM 2893 O GLY B 90 -1.411 -15.978 -2.874 1.00 0.00 O ATOM 2894 OXT GLY B 90 -2.030 -15.168 -0.899 1.00 0.00 O ATOM 0 H GLY B 90 -0.681 -15.888 0.733 1.00 0.00 H new ATOM 0 HA2 GLY B 90 0.852 -15.068 -1.377 1.00 0.00 H new ATOM 0 HA3 GLY B 90 0.646 -16.787 -1.653 1.00 0.00 H new TER 2898 GLY B 90