USER MOD reduce.3.24.130724 H: found=0, std=0, add=1298, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1298 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 74 ASN : amide:sc= -1.35 K(o=-0.21,f=-0.88!) USER MOD Set 1.2: B 77 HIS : no HE2:sc= 1.15 K(o=-0.21,f=-4.8!) USER MOD Set 2.1: A 67 MET CE :methyl -172:sc= 0 (180deg=-0.175) USER MOD Set 2.2: B 67 MET CE :methyl -157:sc= -0.0498 (180deg=-1.29) USER MOD Set 3.1: B 40 LYS NZ :NH3+ 164:sc= 0.185 (180deg=-0.124) USER MOD Set 3.2: B 61 ASN : amide:sc= 0.659 K(o=0.84,f=-0.92) USER MOD Set 4.1: B 19 SER OG : rot 112:sc= 0.183 USER MOD Set 4.2: B 27 LYS NZ :NH3+ -147:sc= 1.83 (180deg=-1.29) USER MOD Set 5.1: B 14 HIS : no HD1:sc= 0.634 K(o=1.4,f=-8.9!) USER MOD Set 5.2: B 17 THR OG1 : rot 80:sc= 0.801 USER MOD Set 6.1: A 50 HIS : no HD1:sc= 0.0212 X(o=-0.082,f=-0.14) USER MOD Set 6.2: A 51 THR OG1 : rot 84:sc= -0.103 USER MOD Set 7.1: A 40 LYS NZ :NH3+ 168:sc= 0.142 (180deg=0) USER MOD Set 7.2: A 60 SER OG : rot 91:sc= 0.141 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 146:sc= 0.971 (180deg=-1.1) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ 146:sc= -1.68! (180deg=-3.55!) USER MOD Single : A 4 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 8 THR OG1 : rot -86:sc= 1.23 USER MOD Single : A 14 HIS : no HD1:sc= -0.477 X(o=-0.48,f=-0.86) USER MOD Single : A 17 THR OG1 : rot -50:sc= 1.3 USER MOD Single : A 19 SER OG : rot 180:sc= -0.0543 USER MOD Single : A 21 ASN : amide:sc= -0.23 X(o=-0.23,f=-0.29) USER MOD Single : A 23 LYS NZ :NH3+ -173:sc= -0.0123 (180deg=-0.1) USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ -147:sc= -1.64 (180deg=-4.19!) USER MOD Single : A 30 ASN : amide:sc= -0.817! C(o=-0.82!,f=-8.5!) USER MOD Single : A 33 SER OG : rot -106:sc= -1.73! USER MOD Single : A 35 ASN : amide:sc= -2.44! C(o=-2.4!,f=-9.2!) USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 MET CE :methyl -139:sc= -0.166 (180deg=-0.86) USER MOD Single : A 55 LYS NZ :NH3+ 167:sc= -0.0485 (180deg=-0.268) USER MOD Single : A 58 THR OG1 : rot -52:sc= 1.23 USER MOD Single : A 61 ASN : amide:sc= -0.332 K(o=-0.33,f=-4.6!) USER MOD Single : A 65 GLN : amide:sc= -3.88! C(o=-3.9!,f=-4.4!) USER MOD Single : A 66 THR OG1 : rot 92:sc= 1.25 USER MOD Single : A 72 LYS NZ :NH3+ 138:sc= 0.433 (180deg=-1.2!) USER MOD Single : A 74 ASN : amide:sc= -1.32 K(o=-1.3,f=-5.2!) USER MOD Single : A 77 HIS : no HD1:sc= -0.304 X(o=-0.3,f=-0.073) USER MOD Single : A 78 HIS : no HE2:sc= -0.28 K(o=-0.28,f=-2.4) USER MOD Single : A 79 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 80 HIS : no HD1:sc= -0.0043 X(o=-0.0043,f=-0.00055) USER MOD Single : A 81 HIS : no HD1:sc= -0.119 X(o=-0.12,f=0) USER MOD Single : A 82 HIS : no HD1:sc= -0.0124 X(o=-0.012,f=0) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ -172:sc= 0 (180deg=-0.0559) USER MOD Single : B 2 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0534) USER MOD Single : B 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 4 MET CE :methyl -158:sc= -0.221 (180deg=-0.882) USER MOD Single : B 8 THR OG1 : rot 180:sc= 0 USER MOD Single : B 21 ASN : amide:sc= -1.8! C(o=-1.8!,f=-3!) USER MOD Single : B 23 LYS NZ :NH3+ 167:sc= -0.03 (180deg=-0.2) USER MOD Single : B 26 THR OG1 : rot 117:sc= 0.605 USER MOD Single : B 30 ASN :FLIP amide:sc= -1.83 F(o=-2.7!,f=-1.8) USER MOD Single : B 33 SER OG : rot -152:sc= 1.28 USER MOD Single : B 35 ASN : amide:sc= -0.811 K(o=-0.81,f=-3.8!) USER MOD Single : B 47 SER OG : rot 114:sc= 1.28 USER MOD Single : B 50 HIS : no HD1:sc=-0.00597 X(o=-0.006,f=0) USER MOD Single : B 51 THR OG1 : rot -96:sc= 1.23 USER MOD Single : B 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 53 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 58 THR OG1 : rot 180:sc= 0 USER MOD Single : B 60 SER OG : rot 95:sc= 1.25 USER MOD Single : B 65 GLN : amide:sc= -0.487 K(o=-0.49,f=-2.8!) USER MOD Single : B 66 THR OG1 : rot 75:sc= 1.25 USER MOD Single : B 72 LYS NZ :NH3+ -137:sc= 1.17 (180deg=0.436) USER MOD Single : B 78 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 79 HIS : no HD1:sc= -0.524 X(o=-0.52,f=-0.035) USER MOD Single : B 80 HIS : no HE2:sc= 1.02 K(o=1,f=-3.1!) USER MOD Single : B 81 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 82 HIS :FLIP no HD1:sc= -0.0774 F(o=-0.58,f=-0.077) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 14.524 6.398 -28.637 1.00 0.00 N ATOM 2 CA MET A 1 15.713 6.636 -27.788 1.00 0.00 C ATOM 3 C MET A 1 15.885 8.129 -27.499 1.00 0.00 C ATOM 4 O MET A 1 15.439 8.624 -26.462 1.00 0.00 O ATOM 5 CB MET A 1 16.970 6.083 -28.470 1.00 0.00 C ATOM 6 CG MET A 1 18.242 6.232 -27.646 1.00 0.00 C ATOM 7 SD MET A 1 19.706 5.648 -28.523 1.00 0.00 S ATOM 8 CE MET A 1 20.979 5.969 -27.302 1.00 0.00 C ATOM 0 H1 MET A 1 14.706 5.595 -29.272 1.00 0.00 H new ATOM 0 H2 MET A 1 13.704 6.184 -28.034 1.00 0.00 H new ATOM 0 H3 MET A 1 14.325 7.248 -29.202 1.00 0.00 H new ATOM 0 HA MET A 1 15.566 6.117 -26.841 1.00 0.00 H new ATOM 0 HB2 MET A 1 16.815 5.027 -28.692 1.00 0.00 H new ATOM 0 HB3 MET A 1 17.106 6.592 -29.424 1.00 0.00 H new ATOM 0 HG2 MET A 1 18.377 7.280 -27.378 1.00 0.00 H new ATOM 0 HG3 MET A 1 18.135 5.676 -26.714 1.00 0.00 H new ATOM 0 HE1 MET A 1 21.947 5.660 -27.696 1.00 0.00 H new ATOM 0 HE2 MET A 1 21.003 7.034 -27.073 1.00 0.00 H new ATOM 0 HE3 MET A 1 20.762 5.408 -26.393 1.00 0.00 H new ATOM 20 N LYS A 2 16.481 8.848 -28.445 1.00 0.00 N ATOM 21 CA LYS A 2 16.837 10.248 -28.241 1.00 0.00 C ATOM 22 C LYS A 2 15.600 11.129 -28.138 1.00 0.00 C ATOM 23 O LYS A 2 14.830 11.245 -29.094 1.00 0.00 O ATOM 24 CB LYS A 2 17.726 10.739 -29.381 1.00 0.00 C ATOM 25 CG LYS A 2 19.042 9.990 -29.490 1.00 0.00 C ATOM 26 CD LYS A 2 19.914 10.569 -30.594 1.00 0.00 C ATOM 27 CE LYS A 2 21.258 9.870 -30.667 1.00 0.00 C ATOM 28 NZ LYS A 2 22.141 10.484 -31.694 1.00 0.00 N ATOM 0 H LYS A 2 16.729 8.482 -29.364 1.00 0.00 H new ATOM 0 HA LYS A 2 17.382 10.316 -27.300 1.00 0.00 H new ATOM 0 HB2 LYS A 2 17.183 10.642 -30.321 1.00 0.00 H new ATOM 0 HB3 LYS A 2 17.932 11.800 -29.239 1.00 0.00 H new ATOM 0 HG2 LYS A 2 19.573 10.041 -28.539 1.00 0.00 H new ATOM 0 HG3 LYS A 2 18.848 8.936 -29.691 1.00 0.00 H new ATOM 0 HD2 LYS A 2 19.401 10.474 -31.551 1.00 0.00 H new ATOM 0 HD3 LYS A 2 20.066 11.634 -30.418 1.00 0.00 H new ATOM 0 HE2 LYS A 2 21.746 9.916 -29.693 1.00 0.00 H new ATOM 0 HE3 LYS A 2 21.108 8.816 -30.899 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 23.051 9.980 -31.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 21.686 10.418 -32.627 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 22.304 11.484 -31.459 1.00 0.00 H new ATOM 42 N LYS A 3 15.420 11.739 -26.960 1.00 0.00 N ATOM 43 CA LYS A 3 14.294 12.638 -26.690 1.00 0.00 C ATOM 44 C LYS A 3 12.974 11.870 -26.615 1.00 0.00 C ATOM 45 O LYS A 3 11.900 12.464 -26.510 1.00 0.00 O ATOM 46 CB LYS A 3 14.222 13.737 -27.756 1.00 0.00 C ATOM 47 CG LYS A 3 15.413 14.682 -27.740 1.00 0.00 C ATOM 48 CD LYS A 3 15.458 15.578 -28.973 1.00 0.00 C ATOM 49 CE LYS A 3 15.989 14.843 -30.203 1.00 0.00 C ATOM 50 NZ LYS A 3 15.035 13.832 -30.733 1.00 0.00 N ATOM 0 H LYS A 3 16.052 11.622 -26.168 1.00 0.00 H new ATOM 0 HA LYS A 3 14.460 13.104 -25.719 1.00 0.00 H new ATOM 0 HB2 LYS A 3 14.151 13.273 -28.740 1.00 0.00 H new ATOM 0 HB3 LYS A 3 13.309 14.314 -27.609 1.00 0.00 H new ATOM 0 HG2 LYS A 3 15.370 15.302 -26.845 1.00 0.00 H new ATOM 0 HG3 LYS A 3 16.334 14.102 -27.682 1.00 0.00 H new ATOM 0 HD2 LYS A 3 14.457 15.956 -29.182 1.00 0.00 H new ATOM 0 HD3 LYS A 3 16.089 16.443 -28.768 1.00 0.00 H new ATOM 0 HE2 LYS A 3 16.212 15.569 -30.985 1.00 0.00 H new ATOM 0 HE3 LYS A 3 16.927 14.350 -29.948 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 15.117 13.787 -31.769 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 15.256 12.900 -30.327 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 14.064 14.101 -30.474 1.00 0.00 H new ATOM 64 N MET A 4 13.067 10.547 -26.649 1.00 0.00 N ATOM 65 CA MET A 4 11.895 9.689 -26.586 1.00 0.00 C ATOM 66 C MET A 4 11.528 9.408 -25.137 1.00 0.00 C ATOM 67 O MET A 4 10.389 9.606 -24.719 1.00 0.00 O ATOM 68 CB MET A 4 12.161 8.376 -27.322 1.00 0.00 C ATOM 69 CG MET A 4 11.022 7.374 -27.237 1.00 0.00 C ATOM 70 SD MET A 4 11.447 5.798 -28.001 1.00 0.00 S ATOM 71 CE MET A 4 9.944 4.863 -27.719 1.00 0.00 C ATOM 0 H MET A 4 13.951 10.043 -26.721 1.00 0.00 H new ATOM 0 HA MET A 4 11.062 10.200 -27.068 1.00 0.00 H new ATOM 0 HB2 MET A 4 12.361 8.594 -28.371 1.00 0.00 H new ATOM 0 HB3 MET A 4 13.063 7.920 -26.914 1.00 0.00 H new ATOM 0 HG2 MET A 4 10.761 7.211 -26.191 1.00 0.00 H new ATOM 0 HG3 MET A 4 10.139 7.787 -27.725 1.00 0.00 H new ATOM 0 HE1 MET A 4 10.054 3.862 -28.137 1.00 0.00 H new ATOM 0 HE2 MET A 4 9.756 4.790 -26.648 1.00 0.00 H new ATOM 0 HE3 MET A 4 9.106 5.367 -28.200 1.00 0.00 H new ATOM 81 N ALA A 5 12.502 8.932 -24.378 1.00 0.00 N ATOM 82 CA ALA A 5 12.306 8.682 -22.966 1.00 0.00 C ATOM 83 C ALA A 5 13.376 9.398 -22.158 1.00 0.00 C ATOM 84 O ALA A 5 14.448 8.854 -21.908 1.00 0.00 O ATOM 85 CB ALA A 5 12.317 7.188 -22.670 1.00 0.00 C ATOM 0 H ALA A 5 13.437 8.712 -24.721 1.00 0.00 H new ATOM 0 HA ALA A 5 11.329 9.071 -22.678 1.00 0.00 H new ATOM 0 HB1 ALA A 5 12.168 7.028 -21.602 1.00 0.00 H new ATOM 0 HB2 ALA A 5 11.516 6.701 -23.226 1.00 0.00 H new ATOM 0 HB3 ALA A 5 13.276 6.765 -22.970 1.00 0.00 H new ATOM 91 N GLU A 6 13.096 10.641 -21.798 1.00 0.00 N ATOM 92 CA GLU A 6 14.024 11.426 -20.998 1.00 0.00 C ATOM 93 C GLU A 6 13.638 11.360 -19.528 1.00 0.00 C ATOM 94 O GLU A 6 14.346 11.870 -18.662 1.00 0.00 O ATOM 95 CB GLU A 6 14.057 12.881 -21.477 1.00 0.00 C ATOM 96 CG GLU A 6 12.684 13.524 -21.571 1.00 0.00 C ATOM 97 CD GLU A 6 12.749 15.016 -21.822 1.00 0.00 C ATOM 98 OE1 GLU A 6 13.384 15.435 -22.815 1.00 0.00 O ATOM 99 OE2 GLU A 6 12.156 15.780 -21.033 1.00 0.00 O ATOM 0 H GLU A 6 12.235 11.128 -22.047 1.00 0.00 H new ATOM 0 HA GLU A 6 15.022 11.005 -21.117 1.00 0.00 H new ATOM 0 HB2 GLU A 6 14.676 13.465 -20.796 1.00 0.00 H new ATOM 0 HB3 GLU A 6 14.535 12.921 -22.456 1.00 0.00 H new ATOM 0 HG2 GLU A 6 12.120 13.050 -22.374 1.00 0.00 H new ATOM 0 HG3 GLU A 6 12.138 13.340 -20.646 1.00 0.00 H new ATOM 106 N PHE A 7 12.509 10.726 -19.254 1.00 0.00 N ATOM 107 CA PHE A 7 12.055 10.564 -17.888 1.00 0.00 C ATOM 108 C PHE A 7 12.752 9.375 -17.246 1.00 0.00 C ATOM 109 O PHE A 7 12.816 8.287 -17.825 1.00 0.00 O ATOM 110 CB PHE A 7 10.527 10.411 -17.815 1.00 0.00 C ATOM 111 CG PHE A 7 9.973 9.231 -18.571 1.00 0.00 C ATOM 112 CD1 PHE A 7 9.755 9.308 -19.937 1.00 0.00 C ATOM 113 CD2 PHE A 7 9.661 8.052 -17.911 1.00 0.00 C ATOM 114 CE1 PHE A 7 9.238 8.231 -20.630 1.00 0.00 C ATOM 115 CE2 PHE A 7 9.145 6.973 -18.601 1.00 0.00 C ATOM 116 CZ PHE A 7 8.932 7.063 -19.962 1.00 0.00 C ATOM 0 H PHE A 7 11.894 10.318 -19.958 1.00 0.00 H new ATOM 0 HA PHE A 7 12.315 11.466 -17.334 1.00 0.00 H new ATOM 0 HB2 PHE A 7 10.234 10.324 -16.769 1.00 0.00 H new ATOM 0 HB3 PHE A 7 10.066 11.320 -18.200 1.00 0.00 H new ATOM 0 HD1 PHE A 7 9.992 10.220 -20.465 1.00 0.00 H new ATOM 0 HD2 PHE A 7 9.823 7.977 -16.846 1.00 0.00 H new ATOM 0 HE1 PHE A 7 9.073 8.303 -21.695 1.00 0.00 H new ATOM 0 HE2 PHE A 7 8.908 6.059 -18.076 1.00 0.00 H new ATOM 0 HZ PHE A 7 8.527 6.221 -20.503 1.00 0.00 H new ATOM 126 N THR A 8 13.294 9.589 -16.065 1.00 0.00 N ATOM 127 CA THR A 8 13.993 8.542 -15.355 1.00 0.00 C ATOM 128 C THR A 8 13.305 8.258 -14.030 1.00 0.00 C ATOM 129 O THR A 8 12.974 9.176 -13.276 1.00 0.00 O ATOM 130 CB THR A 8 15.484 8.902 -15.122 1.00 0.00 C ATOM 131 OG1 THR A 8 16.146 7.854 -14.396 1.00 0.00 O ATOM 132 CG2 THR A 8 15.628 10.218 -14.366 1.00 0.00 C ATOM 0 H THR A 8 13.263 10.484 -15.576 1.00 0.00 H new ATOM 0 HA THR A 8 13.964 7.645 -15.974 1.00 0.00 H new ATOM 0 HB THR A 8 15.951 9.015 -16.101 1.00 0.00 H new ATOM 0 HG1 THR A 8 16.017 7.991 -13.434 1.00 0.00 H new ATOM 0 HG21 THR A 8 16.685 10.440 -14.220 1.00 0.00 H new ATOM 0 HG22 THR A 8 15.165 11.020 -14.941 1.00 0.00 H new ATOM 0 HG23 THR A 8 15.137 10.136 -13.396 1.00 0.00 H new ATOM 140 N PHE A 9 13.050 6.988 -13.782 1.00 0.00 N ATOM 141 CA PHE A 9 12.483 6.552 -12.523 1.00 0.00 C ATOM 142 C PHE A 9 13.445 5.583 -11.854 1.00 0.00 C ATOM 143 O PHE A 9 13.793 4.545 -12.422 1.00 0.00 O ATOM 144 CB PHE A 9 11.100 5.911 -12.731 1.00 0.00 C ATOM 145 CG PHE A 9 11.065 4.794 -13.742 1.00 0.00 C ATOM 146 CD1 PHE A 9 11.002 5.071 -15.099 1.00 0.00 C ATOM 147 CD2 PHE A 9 11.082 3.468 -13.334 1.00 0.00 C ATOM 148 CE1 PHE A 9 10.963 4.049 -16.027 1.00 0.00 C ATOM 149 CE2 PHE A 9 11.041 2.444 -14.259 1.00 0.00 C ATOM 150 CZ PHE A 9 10.981 2.734 -15.607 1.00 0.00 C ATOM 0 H PHE A 9 13.229 6.234 -14.445 1.00 0.00 H new ATOM 0 HA PHE A 9 12.339 7.416 -11.875 1.00 0.00 H new ATOM 0 HB2 PHE A 9 10.746 5.527 -11.774 1.00 0.00 H new ATOM 0 HB3 PHE A 9 10.399 6.686 -13.043 1.00 0.00 H new ATOM 0 HD1 PHE A 9 10.983 6.098 -15.434 1.00 0.00 H new ATOM 0 HD2 PHE A 9 11.128 3.234 -12.281 1.00 0.00 H new ATOM 0 HE1 PHE A 9 10.918 4.278 -17.081 1.00 0.00 H new ATOM 0 HE2 PHE A 9 11.056 1.416 -13.928 1.00 0.00 H new ATOM 0 HZ PHE A 9 10.948 1.934 -16.332 1.00 0.00 H new ATOM 160 N GLU A 10 13.897 5.939 -10.669 1.00 0.00 N ATOM 161 CA GLU A 10 14.883 5.140 -9.968 1.00 0.00 C ATOM 162 C GLU A 10 14.450 4.851 -8.541 1.00 0.00 C ATOM 163 O GLU A 10 13.685 5.609 -7.942 1.00 0.00 O ATOM 164 CB GLU A 10 16.254 5.829 -9.971 1.00 0.00 C ATOM 165 CG GLU A 10 16.232 7.291 -9.546 1.00 0.00 C ATOM 166 CD GLU A 10 15.983 8.247 -10.700 1.00 0.00 C ATOM 167 OE1 GLU A 10 16.572 8.040 -11.786 1.00 0.00 O ATOM 168 OE2 GLU A 10 15.222 9.216 -10.522 1.00 0.00 O ATOM 0 H GLU A 10 13.598 6.777 -10.170 1.00 0.00 H new ATOM 0 HA GLU A 10 14.967 4.192 -10.499 1.00 0.00 H new ATOM 0 HB2 GLU A 10 16.922 5.281 -9.306 1.00 0.00 H new ATOM 0 HB3 GLU A 10 16.677 5.762 -10.973 1.00 0.00 H new ATOM 0 HG2 GLU A 10 15.457 7.432 -8.793 1.00 0.00 H new ATOM 0 HG3 GLU A 10 17.183 7.540 -9.075 1.00 0.00 H new ATOM 175 N ILE A 11 14.942 3.743 -8.008 1.00 0.00 N ATOM 176 CA ILE A 11 14.649 3.357 -6.640 1.00 0.00 C ATOM 177 C ILE A 11 15.782 3.817 -5.736 1.00 0.00 C ATOM 178 O ILE A 11 16.780 3.110 -5.559 1.00 0.00 O ATOM 179 CB ILE A 11 14.477 1.830 -6.501 1.00 0.00 C ATOM 180 CG1 ILE A 11 13.511 1.300 -7.562 1.00 0.00 C ATOM 181 CG2 ILE A 11 13.982 1.475 -5.103 1.00 0.00 C ATOM 182 CD1 ILE A 11 13.474 -0.210 -7.651 1.00 0.00 C ATOM 0 H ILE A 11 15.549 3.093 -8.507 1.00 0.00 H new ATOM 0 HA ILE A 11 13.711 3.830 -6.350 1.00 0.00 H new ATOM 0 HB ILE A 11 15.448 1.358 -6.654 1.00 0.00 H new ATOM 0 HG12 ILE A 11 12.508 1.667 -7.343 1.00 0.00 H new ATOM 0 HG13 ILE A 11 13.794 1.706 -8.533 1.00 0.00 H new ATOM 0 HG21 ILE A 11 13.866 0.394 -5.022 1.00 0.00 H new ATOM 0 HG22 ILE A 11 14.704 1.819 -4.363 1.00 0.00 H new ATOM 0 HG23 ILE A 11 13.021 1.958 -4.924 1.00 0.00 H new ATOM 0 HD11 ILE A 11 12.767 -0.512 -8.424 1.00 0.00 H new ATOM 0 HD12 ILE A 11 14.467 -0.584 -7.901 1.00 0.00 H new ATOM 0 HD13 ILE A 11 13.161 -0.623 -6.692 1.00 0.00 H new ATOM 194 N GLU A 12 15.643 5.017 -5.197 1.00 0.00 N ATOM 195 CA GLU A 12 16.677 5.602 -4.361 1.00 0.00 C ATOM 196 C GLU A 12 16.666 5.009 -2.960 1.00 0.00 C ATOM 197 O GLU A 12 17.714 4.657 -2.421 1.00 0.00 O ATOM 198 CB GLU A 12 16.506 7.120 -4.285 1.00 0.00 C ATOM 199 CG GLU A 12 16.941 7.847 -5.545 1.00 0.00 C ATOM 200 CD GLU A 12 18.437 7.764 -5.774 1.00 0.00 C ATOM 201 OE1 GLU A 12 19.194 8.406 -5.014 1.00 0.00 O ATOM 202 OE2 GLU A 12 18.865 7.058 -6.712 1.00 0.00 O ATOM 0 H GLU A 12 14.821 5.607 -5.325 1.00 0.00 H new ATOM 0 HA GLU A 12 17.639 5.370 -4.818 1.00 0.00 H new ATOM 0 HB2 GLU A 12 15.459 7.349 -4.087 1.00 0.00 H new ATOM 0 HB3 GLU A 12 17.081 7.500 -3.440 1.00 0.00 H new ATOM 0 HG2 GLU A 12 16.421 7.423 -6.404 1.00 0.00 H new ATOM 0 HG3 GLU A 12 16.644 8.894 -5.478 1.00 0.00 H new ATOM 209 N GLU A 13 15.483 4.880 -2.380 1.00 0.00 N ATOM 210 CA GLU A 13 15.378 4.465 -0.994 1.00 0.00 C ATOM 211 C GLU A 13 14.235 3.481 -0.780 1.00 0.00 C ATOM 212 O GLU A 13 13.153 3.623 -1.349 1.00 0.00 O ATOM 213 CB GLU A 13 15.194 5.697 -0.107 1.00 0.00 C ATOM 214 CG GLU A 13 15.052 5.377 1.369 1.00 0.00 C ATOM 215 CD GLU A 13 15.047 6.621 2.223 1.00 0.00 C ATOM 216 OE1 GLU A 13 13.982 7.256 2.354 1.00 0.00 O ATOM 217 OE2 GLU A 13 16.119 6.981 2.757 1.00 0.00 O ATOM 0 H GLU A 13 14.591 5.055 -2.844 1.00 0.00 H new ATOM 0 HA GLU A 13 16.300 3.950 -0.723 1.00 0.00 H new ATOM 0 HB2 GLU A 13 16.047 6.362 -0.244 1.00 0.00 H new ATOM 0 HB3 GLU A 13 14.309 6.241 -0.437 1.00 0.00 H new ATOM 0 HG2 GLU A 13 14.128 4.823 1.532 1.00 0.00 H new ATOM 0 HG3 GLU A 13 15.871 4.729 1.679 1.00 0.00 H new ATOM 224 N HIS A 14 14.498 2.463 0.024 1.00 0.00 N ATOM 225 CA HIS A 14 13.464 1.547 0.474 1.00 0.00 C ATOM 226 C HIS A 14 12.931 2.002 1.823 1.00 0.00 C ATOM 227 O HIS A 14 13.690 2.492 2.659 1.00 0.00 O ATOM 228 CB HIS A 14 14.013 0.126 0.617 1.00 0.00 C ATOM 229 CG HIS A 14 14.322 -0.563 -0.676 1.00 0.00 C ATOM 230 ND1 HIS A 14 15.556 -1.089 -0.970 1.00 0.00 N ATOM 231 CD2 HIS A 14 13.529 -0.857 -1.728 1.00 0.00 C ATOM 232 CE1 HIS A 14 15.507 -1.686 -2.147 1.00 0.00 C ATOM 233 NE2 HIS A 14 14.283 -1.568 -2.632 1.00 0.00 N ATOM 0 H HIS A 14 15.429 2.250 0.381 1.00 0.00 H new ATOM 0 HA HIS A 14 12.667 1.546 -0.269 1.00 0.00 H new ATOM 0 HB2 HIS A 14 14.921 0.162 1.219 1.00 0.00 H new ATOM 0 HB3 HIS A 14 13.289 -0.474 1.168 1.00 0.00 H new ATOM 0 HD2 HIS A 14 12.490 -0.583 -1.840 1.00 0.00 H new ATOM 0 HE1 HIS A 14 16.331 -2.188 -2.633 1.00 0.00 H new ATOM 0 HE2 HIS A 14 13.954 -1.940 -3.523 1.00 0.00 H new ATOM 242 N LEU A 15 11.635 1.856 2.036 1.00 0.00 N ATOM 243 CA LEU A 15 11.063 2.121 3.345 1.00 0.00 C ATOM 244 C LEU A 15 11.152 0.861 4.185 1.00 0.00 C ATOM 245 O LEU A 15 11.707 0.868 5.284 1.00 0.00 O ATOM 246 CB LEU A 15 9.612 2.584 3.223 1.00 0.00 C ATOM 247 CG LEU A 15 9.421 3.924 2.515 1.00 0.00 C ATOM 248 CD1 LEU A 15 7.943 4.239 2.371 1.00 0.00 C ATOM 249 CD2 LEU A 15 10.135 5.035 3.275 1.00 0.00 C ATOM 0 H LEU A 15 10.964 1.558 1.328 1.00 0.00 H new ATOM 0 HA LEU A 15 11.624 2.922 3.827 1.00 0.00 H new ATOM 0 HB2 LEU A 15 9.047 1.822 2.686 1.00 0.00 H new ATOM 0 HB3 LEU A 15 9.183 2.654 4.223 1.00 0.00 H new ATOM 0 HG LEU A 15 9.858 3.856 1.519 1.00 0.00 H new ATOM 0 HD11 LEU A 15 7.823 5.197 1.865 1.00 0.00 H new ATOM 0 HD12 LEU A 15 7.459 3.456 1.786 1.00 0.00 H new ATOM 0 HD13 LEU A 15 7.484 4.290 3.358 1.00 0.00 H new ATOM 0 HD21 LEU A 15 9.989 5.983 2.757 1.00 0.00 H new ATOM 0 HD22 LEU A 15 9.727 5.106 4.283 1.00 0.00 H new ATOM 0 HD23 LEU A 15 11.201 4.812 3.329 1.00 0.00 H new ATOM 261 N LEU A 16 10.617 -0.223 3.644 1.00 0.00 N ATOM 262 CA LEU A 16 10.751 -1.536 4.252 1.00 0.00 C ATOM 263 C LEU A 16 10.341 -2.613 3.259 1.00 0.00 C ATOM 264 O LEU A 16 9.339 -2.471 2.552 1.00 0.00 O ATOM 265 CB LEU A 16 9.915 -1.669 5.535 1.00 0.00 C ATOM 266 CG LEU A 16 8.394 -1.576 5.361 1.00 0.00 C ATOM 267 CD1 LEU A 16 7.699 -2.447 6.392 1.00 0.00 C ATOM 268 CD2 LEU A 16 7.925 -0.134 5.502 1.00 0.00 C ATOM 0 H LEU A 16 10.081 -0.217 2.776 1.00 0.00 H new ATOM 0 HA LEU A 16 11.799 -1.662 4.526 1.00 0.00 H new ATOM 0 HB2 LEU A 16 10.149 -2.627 6.000 1.00 0.00 H new ATOM 0 HB3 LEU A 16 10.229 -0.892 6.231 1.00 0.00 H new ATOM 0 HG LEU A 16 8.139 -1.929 4.362 1.00 0.00 H new ATOM 0 HD11 LEU A 16 6.619 -2.375 6.261 1.00 0.00 H new ATOM 0 HD12 LEU A 16 8.012 -3.483 6.263 1.00 0.00 H new ATOM 0 HD13 LEU A 16 7.966 -2.109 7.393 1.00 0.00 H new ATOM 0 HD21 LEU A 16 6.843 -0.089 5.375 1.00 0.00 H new ATOM 0 HD22 LEU A 16 8.190 0.240 6.491 1.00 0.00 H new ATOM 0 HD23 LEU A 16 8.405 0.481 4.741 1.00 0.00 H new ATOM 280 N THR A 17 11.136 -3.664 3.180 1.00 0.00 N ATOM 281 CA THR A 17 10.794 -4.820 2.375 1.00 0.00 C ATOM 282 C THR A 17 9.878 -5.741 3.173 1.00 0.00 C ATOM 283 O THR A 17 10.246 -6.217 4.246 1.00 0.00 O ATOM 284 CB THR A 17 12.062 -5.577 1.932 1.00 0.00 C ATOM 285 OG1 THR A 17 12.958 -4.673 1.267 1.00 0.00 O ATOM 286 CG2 THR A 17 11.715 -6.725 0.997 1.00 0.00 C ATOM 0 H THR A 17 12.029 -3.740 3.667 1.00 0.00 H new ATOM 0 HA THR A 17 10.275 -4.483 1.478 1.00 0.00 H new ATOM 0 HB THR A 17 12.541 -5.988 2.820 1.00 0.00 H new ATOM 0 HG1 THR A 17 12.470 -4.178 0.576 1.00 0.00 H new ATOM 0 HG21 THR A 17 12.628 -7.241 0.700 1.00 0.00 H new ATOM 0 HG22 THR A 17 11.053 -7.424 1.509 1.00 0.00 H new ATOM 0 HG23 THR A 17 11.215 -6.334 0.111 1.00 0.00 H new ATOM 294 N LEU A 18 8.677 -5.969 2.657 1.00 0.00 N ATOM 295 CA LEU A 18 7.682 -6.757 3.367 1.00 0.00 C ATOM 296 C LEU A 18 8.069 -8.228 3.376 1.00 0.00 C ATOM 297 O LEU A 18 8.572 -8.740 4.378 1.00 0.00 O ATOM 298 CB LEU A 18 6.302 -6.580 2.734 1.00 0.00 C ATOM 299 CG LEU A 18 5.773 -5.146 2.706 1.00 0.00 C ATOM 300 CD1 LEU A 18 4.416 -5.100 2.027 1.00 0.00 C ATOM 301 CD2 LEU A 18 5.680 -4.586 4.116 1.00 0.00 C ATOM 0 H LEU A 18 8.370 -5.619 1.750 1.00 0.00 H new ATOM 0 HA LEU A 18 7.641 -6.402 4.397 1.00 0.00 H new ATOM 0 HB2 LEU A 18 6.339 -6.956 1.711 1.00 0.00 H new ATOM 0 HB3 LEU A 18 5.590 -7.202 3.276 1.00 0.00 H new ATOM 0 HG LEU A 18 6.469 -4.530 2.136 1.00 0.00 H new ATOM 0 HD11 LEU A 18 4.050 -4.073 2.014 1.00 0.00 H new ATOM 0 HD12 LEU A 18 4.508 -5.466 1.004 1.00 0.00 H new ATOM 0 HD13 LEU A 18 3.714 -5.728 2.575 1.00 0.00 H new ATOM 0 HD21 LEU A 18 5.302 -3.564 4.078 1.00 0.00 H new ATOM 0 HD22 LEU A 18 5.003 -5.202 4.708 1.00 0.00 H new ATOM 0 HD23 LEU A 18 6.669 -4.590 4.575 1.00 0.00 H new ATOM 313 N SER A 19 7.858 -8.898 2.252 1.00 0.00 N ATOM 314 CA SER A 19 8.177 -10.308 2.141 1.00 0.00 C ATOM 315 C SER A 19 8.191 -10.734 0.678 1.00 0.00 C ATOM 316 O SER A 19 7.740 -9.996 -0.208 1.00 0.00 O ATOM 317 CB SER A 19 7.161 -11.148 2.933 1.00 0.00 C ATOM 318 OG SER A 19 7.531 -12.518 2.973 1.00 0.00 O ATOM 0 H SER A 19 7.467 -8.485 1.405 1.00 0.00 H new ATOM 0 HA SER A 19 9.169 -10.475 2.561 1.00 0.00 H new ATOM 0 HB2 SER A 19 7.083 -10.762 3.949 1.00 0.00 H new ATOM 0 HB3 SER A 19 6.175 -11.050 2.479 1.00 0.00 H new ATOM 0 HG SER A 19 6.865 -13.022 3.485 1.00 0.00 H new ATOM 324 N GLU A 20 8.727 -11.917 0.429 1.00 0.00 N ATOM 325 CA GLU A 20 8.760 -12.479 -0.907 1.00 0.00 C ATOM 326 C GLU A 20 7.524 -13.346 -1.120 1.00 0.00 C ATOM 327 O GLU A 20 7.018 -13.966 -0.180 1.00 0.00 O ATOM 328 CB GLU A 20 10.035 -13.300 -1.088 1.00 0.00 C ATOM 329 CG GLU A 20 10.294 -13.736 -2.517 1.00 0.00 C ATOM 330 CD GLU A 20 11.594 -14.491 -2.652 1.00 0.00 C ATOM 331 OE1 GLU A 20 12.661 -13.840 -2.717 1.00 0.00 O ATOM 332 OE2 GLU A 20 11.563 -15.737 -2.686 1.00 0.00 O ATOM 0 H GLU A 20 9.149 -12.510 1.144 1.00 0.00 H new ATOM 0 HA GLU A 20 8.758 -11.678 -1.646 1.00 0.00 H new ATOM 0 HB2 GLU A 20 10.885 -12.713 -0.739 1.00 0.00 H new ATOM 0 HB3 GLU A 20 9.977 -14.185 -0.454 1.00 0.00 H new ATOM 0 HG2 GLU A 20 9.472 -14.366 -2.858 1.00 0.00 H new ATOM 0 HG3 GLU A 20 10.315 -12.860 -3.165 1.00 0.00 H new ATOM 339 N ASN A 21 7.025 -13.366 -2.341 1.00 0.00 N ATOM 340 CA ASN A 21 5.840 -14.140 -2.672 1.00 0.00 C ATOM 341 C ASN A 21 6.215 -15.288 -3.604 1.00 0.00 C ATOM 342 O ASN A 21 7.259 -15.242 -4.263 1.00 0.00 O ATOM 343 CB ASN A 21 4.783 -13.234 -3.316 1.00 0.00 C ATOM 344 CG ASN A 21 3.432 -13.913 -3.455 1.00 0.00 C ATOM 345 OD1 ASN A 21 3.120 -14.497 -4.490 1.00 0.00 O ATOM 346 ND2 ASN A 21 2.625 -13.850 -2.405 1.00 0.00 N ATOM 0 H ASN A 21 7.424 -12.852 -3.126 1.00 0.00 H new ATOM 0 HA ASN A 21 5.417 -14.561 -1.760 1.00 0.00 H new ATOM 0 HB2 ASN A 21 4.671 -12.331 -2.716 1.00 0.00 H new ATOM 0 HB3 ASN A 21 5.130 -12.921 -4.301 1.00 0.00 H new ATOM 0 HD21 ASN A 21 1.708 -14.296 -2.439 1.00 0.00 H new ATOM 0 HD22 ASN A 21 2.921 -13.355 -1.563 1.00 0.00 H new ATOM 353 N GLU A 22 5.370 -16.307 -3.635 1.00 0.00 N ATOM 354 CA GLU A 22 5.612 -17.521 -4.404 1.00 0.00 C ATOM 355 C GLU A 22 5.954 -17.226 -5.868 1.00 0.00 C ATOM 356 O GLU A 22 5.522 -16.219 -6.433 1.00 0.00 O ATOM 357 CB GLU A 22 4.386 -18.440 -4.336 1.00 0.00 C ATOM 358 CG GLU A 22 4.017 -18.893 -2.926 1.00 0.00 C ATOM 359 CD GLU A 22 3.256 -17.843 -2.126 1.00 0.00 C ATOM 360 OE1 GLU A 22 3.903 -16.992 -1.473 1.00 0.00 O ATOM 361 OE2 GLU A 22 2.008 -17.877 -2.129 1.00 0.00 O ATOM 0 H GLU A 22 4.488 -16.316 -3.123 1.00 0.00 H new ATOM 0 HA GLU A 22 6.475 -18.017 -3.958 1.00 0.00 H new ATOM 0 HB2 GLU A 22 3.533 -17.921 -4.773 1.00 0.00 H new ATOM 0 HB3 GLU A 22 4.572 -19.321 -4.951 1.00 0.00 H new ATOM 0 HG2 GLU A 22 3.412 -19.797 -2.991 1.00 0.00 H new ATOM 0 HG3 GLU A 22 4.928 -19.157 -2.389 1.00 0.00 H new ATOM 368 N LYS A 23 6.749 -18.124 -6.459 1.00 0.00 N ATOM 369 CA LYS A 23 7.173 -18.034 -7.863 1.00 0.00 C ATOM 370 C LYS A 23 8.231 -16.953 -8.081 1.00 0.00 C ATOM 371 O LYS A 23 8.632 -16.691 -9.215 1.00 0.00 O ATOM 372 CB LYS A 23 5.983 -17.823 -8.815 1.00 0.00 C ATOM 373 CG LYS A 23 5.322 -19.117 -9.272 1.00 0.00 C ATOM 374 CD LYS A 23 4.620 -19.839 -8.133 1.00 0.00 C ATOM 375 CE LYS A 23 4.117 -21.208 -8.565 1.00 0.00 C ATOM 376 NZ LYS A 23 3.190 -21.131 -9.725 1.00 0.00 N ATOM 0 H LYS A 23 7.120 -18.941 -5.974 1.00 0.00 H new ATOM 0 HA LYS A 23 7.627 -18.996 -8.101 1.00 0.00 H new ATOM 0 HB2 LYS A 23 5.238 -17.202 -8.318 1.00 0.00 H new ATOM 0 HB3 LYS A 23 6.324 -17.272 -9.691 1.00 0.00 H new ATOM 0 HG2 LYS A 23 4.601 -18.896 -10.059 1.00 0.00 H new ATOM 0 HG3 LYS A 23 6.076 -19.774 -9.706 1.00 0.00 H new ATOM 0 HD2 LYS A 23 5.307 -19.951 -7.294 1.00 0.00 H new ATOM 0 HD3 LYS A 23 3.782 -19.237 -7.781 1.00 0.00 H new ATOM 0 HE2 LYS A 23 4.967 -21.839 -8.824 1.00 0.00 H new ATOM 0 HE3 LYS A 23 3.608 -21.686 -7.728 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 2.783 -22.071 -9.907 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 2.426 -20.457 -9.515 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 3.712 -20.811 -10.566 1.00 0.00 H new ATOM 390 N GLY A 24 8.696 -16.346 -6.999 1.00 0.00 N ATOM 391 CA GLY A 24 9.793 -15.406 -7.100 1.00 0.00 C ATOM 392 C GLY A 24 9.338 -13.995 -7.407 1.00 0.00 C ATOM 393 O GLY A 24 9.698 -13.432 -8.437 1.00 0.00 O ATOM 0 H GLY A 24 8.335 -16.487 -6.056 1.00 0.00 H new ATOM 0 HA2 GLY A 24 10.351 -15.406 -6.164 1.00 0.00 H new ATOM 0 HA3 GLY A 24 10.478 -15.738 -7.880 1.00 0.00 H new ATOM 397 N TRP A 25 8.533 -13.434 -6.518 1.00 0.00 N ATOM 398 CA TRP A 25 8.120 -12.041 -6.620 1.00 0.00 C ATOM 399 C TRP A 25 8.236 -11.365 -5.264 1.00 0.00 C ATOM 400 O TRP A 25 7.464 -11.652 -4.354 1.00 0.00 O ATOM 401 CB TRP A 25 6.680 -11.927 -7.137 1.00 0.00 C ATOM 402 CG TRP A 25 6.560 -12.084 -8.621 1.00 0.00 C ATOM 403 CD1 TRP A 25 6.423 -13.249 -9.318 1.00 0.00 C ATOM 404 CD2 TRP A 25 6.566 -11.033 -9.592 1.00 0.00 C ATOM 405 NE1 TRP A 25 6.343 -12.987 -10.663 1.00 0.00 N ATOM 406 CE2 TRP A 25 6.426 -11.634 -10.857 1.00 0.00 C ATOM 407 CE3 TRP A 25 6.673 -9.642 -9.517 1.00 0.00 C ATOM 408 CZ2 TRP A 25 6.387 -10.893 -12.032 1.00 0.00 C ATOM 409 CZ3 TRP A 25 6.636 -8.907 -10.686 1.00 0.00 C ATOM 410 CH2 TRP A 25 6.494 -9.533 -11.929 1.00 0.00 C ATOM 0 H TRP A 25 8.149 -13.926 -5.711 1.00 0.00 H new ATOM 0 HA TRP A 25 8.779 -11.543 -7.332 1.00 0.00 H new ATOM 0 HB2 TRP A 25 6.067 -12.685 -6.649 1.00 0.00 H new ATOM 0 HB3 TRP A 25 6.276 -10.957 -6.849 1.00 0.00 H new ATOM 0 HD1 TRP A 25 6.383 -14.234 -8.876 1.00 0.00 H new ATOM 0 HE1 TRP A 25 6.239 -13.686 -11.398 1.00 0.00 H new ATOM 0 HE3 TRP A 25 6.783 -9.150 -8.562 1.00 0.00 H new ATOM 0 HZ2 TRP A 25 6.276 -11.374 -12.993 1.00 0.00 H new ATOM 0 HZ3 TRP A 25 6.718 -7.831 -10.640 1.00 0.00 H new ATOM 0 HH2 TRP A 25 6.468 -8.931 -12.825 1.00 0.00 H new ATOM 421 N THR A 26 9.201 -10.476 -5.121 1.00 0.00 N ATOM 422 CA THR A 26 9.402 -9.790 -3.858 1.00 0.00 C ATOM 423 C THR A 26 8.495 -8.572 -3.787 1.00 0.00 C ATOM 424 O THR A 26 8.340 -7.853 -4.772 1.00 0.00 O ATOM 425 CB THR A 26 10.870 -9.351 -3.696 1.00 0.00 C ATOM 426 OG1 THR A 26 11.739 -10.415 -4.109 1.00 0.00 O ATOM 427 CG2 THR A 26 11.173 -8.973 -2.250 1.00 0.00 C ATOM 0 H THR A 26 9.854 -10.213 -5.859 1.00 0.00 H new ATOM 0 HA THR A 26 9.157 -10.480 -3.050 1.00 0.00 H new ATOM 0 HB THR A 26 11.037 -8.474 -4.321 1.00 0.00 H new ATOM 0 HG1 THR A 26 12.672 -10.134 -4.007 1.00 0.00 H new ATOM 0 HG21 THR A 26 12.216 -8.667 -2.165 1.00 0.00 H new ATOM 0 HG22 THR A 26 10.527 -8.149 -1.946 1.00 0.00 H new ATOM 0 HG23 THR A 26 10.993 -9.832 -1.604 1.00 0.00 H new ATOM 435 N LYS A 27 7.892 -8.342 -2.634 1.00 0.00 N ATOM 436 CA LYS A 27 6.967 -7.239 -2.476 1.00 0.00 C ATOM 437 C LYS A 27 7.395 -6.364 -1.315 1.00 0.00 C ATOM 438 O LYS A 27 7.594 -6.846 -0.197 1.00 0.00 O ATOM 439 CB LYS A 27 5.549 -7.773 -2.272 1.00 0.00 C ATOM 440 CG LYS A 27 4.478 -6.696 -2.223 1.00 0.00 C ATOM 441 CD LYS A 27 3.075 -7.280 -2.371 1.00 0.00 C ATOM 442 CE LYS A 27 2.664 -8.137 -1.178 1.00 0.00 C ATOM 443 NZ LYS A 27 3.392 -9.435 -1.124 1.00 0.00 N ATOM 0 H LYS A 27 8.028 -8.906 -1.795 1.00 0.00 H new ATOM 0 HA LYS A 27 6.974 -6.629 -3.379 1.00 0.00 H new ATOM 0 HB2 LYS A 27 5.314 -8.466 -3.080 1.00 0.00 H new ATOM 0 HB3 LYS A 27 5.518 -8.343 -1.343 1.00 0.00 H new ATOM 0 HG2 LYS A 27 4.549 -6.157 -1.278 1.00 0.00 H new ATOM 0 HG3 LYS A 27 4.655 -5.972 -3.018 1.00 0.00 H new ATOM 0 HD2 LYS A 27 2.359 -6.467 -2.493 1.00 0.00 H new ATOM 0 HD3 LYS A 27 3.031 -7.883 -3.278 1.00 0.00 H new ATOM 0 HE2 LYS A 27 2.849 -7.583 -0.257 1.00 0.00 H new ATOM 0 HE3 LYS A 27 1.592 -8.328 -1.226 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 2.770 -10.165 -0.722 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 3.677 -9.714 -2.085 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 4.238 -9.334 -0.528 1.00 0.00 H new ATOM 457 N GLU A 28 7.548 -5.081 -1.586 1.00 0.00 N ATOM 458 CA GLU A 28 8.054 -4.149 -0.599 1.00 0.00 C ATOM 459 C GLU A 28 7.460 -2.766 -0.803 1.00 0.00 C ATOM 460 O GLU A 28 6.768 -2.514 -1.793 1.00 0.00 O ATOM 461 CB GLU A 28 9.575 -4.072 -0.694 1.00 0.00 C ATOM 462 CG GLU A 28 10.076 -3.651 -2.068 1.00 0.00 C ATOM 463 CD GLU A 28 11.580 -3.527 -2.128 1.00 0.00 C ATOM 464 OE1 GLU A 28 12.231 -3.660 -1.070 1.00 0.00 O ATOM 465 OE2 GLU A 28 12.115 -3.282 -3.229 1.00 0.00 O ATOM 0 H GLU A 28 7.327 -4.660 -2.488 1.00 0.00 H new ATOM 0 HA GLU A 28 7.765 -4.507 0.389 1.00 0.00 H new ATOM 0 HB2 GLU A 28 9.942 -3.366 0.050 1.00 0.00 H new ATOM 0 HB3 GLU A 28 9.997 -5.046 -0.445 1.00 0.00 H new ATOM 0 HG2 GLU A 28 9.746 -4.379 -2.809 1.00 0.00 H new ATOM 0 HG3 GLU A 28 9.626 -2.695 -2.337 1.00 0.00 H new ATOM 472 N ILE A 29 7.736 -1.878 0.135 1.00 0.00 N ATOM 473 CA ILE A 29 7.329 -0.491 0.018 1.00 0.00 C ATOM 474 C ILE A 29 8.570 0.380 -0.131 1.00 0.00 C ATOM 475 O ILE A 29 9.474 0.349 0.713 1.00 0.00 O ATOM 476 CB ILE A 29 6.500 -0.040 1.239 1.00 0.00 C ATOM 477 CG1 ILE A 29 5.338 -1.013 1.461 1.00 0.00 C ATOM 478 CG2 ILE A 29 5.984 1.377 1.031 1.00 0.00 C ATOM 479 CD1 ILE A 29 4.502 -0.699 2.679 1.00 0.00 C ATOM 0 H ILE A 29 8.244 -2.096 0.992 1.00 0.00 H new ATOM 0 HA ILE A 29 6.695 -0.386 -0.862 1.00 0.00 H new ATOM 0 HB ILE A 29 7.134 -0.044 2.125 1.00 0.00 H new ATOM 0 HG12 ILE A 29 4.696 -1.005 0.580 1.00 0.00 H new ATOM 0 HG13 ILE A 29 5.736 -2.023 1.556 1.00 0.00 H new ATOM 0 HG21 ILE A 29 5.401 1.683 1.900 1.00 0.00 H new ATOM 0 HG22 ILE A 29 6.827 2.056 0.902 1.00 0.00 H new ATOM 0 HG23 ILE A 29 5.354 1.408 0.142 1.00 0.00 H new ATOM 0 HD11 ILE A 29 3.700 -1.432 2.769 1.00 0.00 H new ATOM 0 HD12 ILE A 29 5.129 -0.736 3.570 1.00 0.00 H new ATOM 0 HD13 ILE A 29 4.073 0.298 2.579 1.00 0.00 H new ATOM 491 N ASN A 30 8.619 1.150 -1.205 1.00 0.00 N ATOM 492 CA ASN A 30 9.827 1.884 -1.558 1.00 0.00 C ATOM 493 C ASN A 30 9.503 3.307 -1.981 1.00 0.00 C ATOM 494 O ASN A 30 8.339 3.692 -2.057 1.00 0.00 O ATOM 495 CB ASN A 30 10.598 1.158 -2.678 1.00 0.00 C ATOM 496 CG ASN A 30 9.935 1.202 -4.058 1.00 0.00 C ATOM 497 OD1 ASN A 30 10.626 1.200 -5.078 1.00 0.00 O ATOM 498 ND2 ASN A 30 8.612 1.220 -4.115 1.00 0.00 N ATOM 0 H ASN A 30 7.839 1.284 -1.848 1.00 0.00 H new ATOM 0 HA ASN A 30 10.458 1.929 -0.670 1.00 0.00 H new ATOM 0 HB2 ASN A 30 11.593 1.597 -2.756 1.00 0.00 H new ATOM 0 HB3 ASN A 30 10.731 0.115 -2.389 1.00 0.00 H new ATOM 0 HD21 ASN A 30 8.141 1.233 -5.019 1.00 0.00 H new ATOM 0 HD22 ASN A 30 8.064 1.221 -3.254 1.00 0.00 H new ATOM 505 N ARG A 31 10.543 4.085 -2.224 1.00 0.00 N ATOM 506 CA ARG A 31 10.389 5.443 -2.711 1.00 0.00 C ATOM 507 C ARG A 31 10.969 5.551 -4.110 1.00 0.00 C ATOM 508 O ARG A 31 12.133 5.211 -4.337 1.00 0.00 O ATOM 509 CB ARG A 31 11.093 6.433 -1.783 1.00 0.00 C ATOM 510 CG ARG A 31 10.574 6.412 -0.357 1.00 0.00 C ATOM 511 CD ARG A 31 11.332 7.385 0.528 1.00 0.00 C ATOM 512 NE ARG A 31 11.124 8.776 0.129 1.00 0.00 N ATOM 513 CZ ARG A 31 11.762 9.807 0.679 1.00 0.00 C ATOM 514 NH1 ARG A 31 12.710 9.600 1.582 1.00 0.00 N ATOM 515 NH2 ARG A 31 11.471 11.044 0.301 1.00 0.00 N ATOM 0 H ARG A 31 11.512 3.795 -2.090 1.00 0.00 H new ATOM 0 HA ARG A 31 9.327 5.686 -2.735 1.00 0.00 H new ATOM 0 HB2 ARG A 31 12.160 6.212 -1.774 1.00 0.00 H new ATOM 0 HB3 ARG A 31 10.979 7.439 -2.186 1.00 0.00 H new ATOM 0 HG2 ARG A 31 9.514 6.664 -0.351 1.00 0.00 H new ATOM 0 HG3 ARG A 31 10.664 5.404 0.049 1.00 0.00 H new ATOM 0 HD2 ARG A 31 11.014 7.255 1.563 1.00 0.00 H new ATOM 0 HD3 ARG A 31 12.397 7.154 0.490 1.00 0.00 H new ATOM 0 HE ARG A 31 10.451 8.968 -0.613 1.00 0.00 H new ATOM 0 HH11 ARG A 31 12.953 8.648 1.858 1.00 0.00 H new ATOM 0 HH12 ARG A 31 13.197 10.392 2.001 1.00 0.00 H new ATOM 0 HH21 ARG A 31 10.759 11.205 -0.411 1.00 0.00 H new ATOM 0 HH22 ARG A 31 11.960 11.834 0.722 1.00 0.00 H new ATOM 529 N VAL A 32 10.155 6.014 -5.044 1.00 0.00 N ATOM 530 CA VAL A 32 10.583 6.139 -6.427 1.00 0.00 C ATOM 531 C VAL A 32 10.774 7.606 -6.795 1.00 0.00 C ATOM 532 O VAL A 32 9.907 8.445 -6.524 1.00 0.00 O ATOM 533 CB VAL A 32 9.573 5.488 -7.398 1.00 0.00 C ATOM 534 CG1 VAL A 32 10.073 5.559 -8.834 1.00 0.00 C ATOM 535 CG2 VAL A 32 9.305 4.045 -7.004 1.00 0.00 C ATOM 0 H VAL A 32 9.194 6.309 -4.870 1.00 0.00 H new ATOM 0 HA VAL A 32 11.533 5.614 -6.522 1.00 0.00 H new ATOM 0 HB VAL A 32 8.639 6.046 -7.334 1.00 0.00 H new ATOM 0 HG11 VAL A 32 9.343 5.094 -9.497 1.00 0.00 H new ATOM 0 HG12 VAL A 32 10.210 6.602 -9.120 1.00 0.00 H new ATOM 0 HG13 VAL A 32 11.024 5.032 -8.915 1.00 0.00 H new ATOM 0 HG21 VAL A 32 8.591 3.604 -7.700 1.00 0.00 H new ATOM 0 HG22 VAL A 32 10.237 3.481 -7.034 1.00 0.00 H new ATOM 0 HG23 VAL A 32 8.894 4.014 -5.995 1.00 0.00 H new ATOM 545 N SER A 33 11.923 7.908 -7.380 1.00 0.00 N ATOM 546 CA SER A 33 12.231 9.256 -7.823 1.00 0.00 C ATOM 547 C SER A 33 11.882 9.417 -9.298 1.00 0.00 C ATOM 548 O SER A 33 12.017 8.474 -10.080 1.00 0.00 O ATOM 549 CB SER A 33 13.714 9.549 -7.600 1.00 0.00 C ATOM 550 OG SER A 33 14.069 9.388 -6.236 1.00 0.00 O ATOM 0 H SER A 33 12.663 7.229 -7.559 1.00 0.00 H new ATOM 0 HA SER A 33 11.637 9.963 -7.244 1.00 0.00 H new ATOM 0 HB2 SER A 33 14.316 8.881 -8.216 1.00 0.00 H new ATOM 0 HB3 SER A 33 13.938 10.567 -7.919 1.00 0.00 H new ATOM 0 HG SER A 33 14.200 10.268 -5.826 1.00 0.00 H new ATOM 556 N PHE A 34 11.411 10.603 -9.669 1.00 0.00 N ATOM 557 CA PHE A 34 11.060 10.883 -11.055 1.00 0.00 C ATOM 558 C PHE A 34 11.800 12.118 -11.556 1.00 0.00 C ATOM 559 O PHE A 34 11.391 13.250 -11.284 1.00 0.00 O ATOM 560 CB PHE A 34 9.549 11.085 -11.200 1.00 0.00 C ATOM 561 CG PHE A 34 8.734 9.884 -10.804 1.00 0.00 C ATOM 562 CD1 PHE A 34 8.571 8.823 -11.679 1.00 0.00 C ATOM 563 CD2 PHE A 34 8.134 9.817 -9.555 1.00 0.00 C ATOM 564 CE1 PHE A 34 7.824 7.718 -11.319 1.00 0.00 C ATOM 565 CE2 PHE A 34 7.385 8.712 -9.190 1.00 0.00 C ATOM 566 CZ PHE A 34 7.230 7.662 -10.073 1.00 0.00 C ATOM 0 H PHE A 34 11.264 11.384 -9.030 1.00 0.00 H new ATOM 0 HA PHE A 34 11.358 10.026 -11.659 1.00 0.00 H new ATOM 0 HB2 PHE A 34 9.246 11.935 -10.589 1.00 0.00 H new ATOM 0 HB3 PHE A 34 9.324 11.340 -12.236 1.00 0.00 H new ATOM 0 HD1 PHE A 34 9.033 8.860 -12.654 1.00 0.00 H new ATOM 0 HD2 PHE A 34 8.253 10.635 -8.860 1.00 0.00 H new ATOM 0 HE1 PHE A 34 7.704 6.898 -12.012 1.00 0.00 H new ATOM 0 HE2 PHE A 34 6.922 8.671 -8.215 1.00 0.00 H new ATOM 0 HZ PHE A 34 6.646 6.799 -9.790 1.00 0.00 H new ATOM 576 N ASN A 35 12.903 11.883 -12.265 1.00 0.00 N ATOM 577 CA ASN A 35 13.739 12.957 -12.824 1.00 0.00 C ATOM 578 C ASN A 35 14.190 13.954 -11.760 1.00 0.00 C ATOM 579 O ASN A 35 14.499 15.107 -12.068 1.00 0.00 O ATOM 580 CB ASN A 35 12.999 13.699 -13.940 1.00 0.00 C ATOM 581 CG ASN A 35 12.860 12.875 -15.203 1.00 0.00 C ATOM 582 OD1 ASN A 35 11.875 12.164 -15.390 1.00 0.00 O ATOM 583 ND2 ASN A 35 13.860 12.947 -16.066 1.00 0.00 N ATOM 0 H ASN A 35 13.247 10.945 -12.471 1.00 0.00 H new ATOM 0 HA ASN A 35 14.628 12.477 -13.233 1.00 0.00 H new ATOM 0 HB2 ASN A 35 12.008 13.982 -13.586 1.00 0.00 H new ATOM 0 HB3 ASN A 35 13.531 14.622 -14.171 1.00 0.00 H new ATOM 0 HD21 ASN A 35 13.832 12.399 -16.926 1.00 0.00 H new ATOM 0 HD22 ASN A 35 14.659 13.550 -15.871 1.00 0.00 H new ATOM 590 N GLY A 36 14.257 13.512 -10.518 1.00 0.00 N ATOM 591 CA GLY A 36 14.652 14.397 -9.444 1.00 0.00 C ATOM 592 C GLY A 36 14.887 13.646 -8.158 1.00 0.00 C ATOM 593 O GLY A 36 14.641 12.446 -8.088 1.00 0.00 O ATOM 0 H GLY A 36 14.045 12.556 -10.232 1.00 0.00 H new ATOM 0 HA2 GLY A 36 15.561 14.928 -9.726 1.00 0.00 H new ATOM 0 HA3 GLY A 36 13.878 15.149 -9.290 1.00 0.00 H new ATOM 597 N ALA A 37 15.359 14.350 -7.142 1.00 0.00 N ATOM 598 CA ALA A 37 15.640 13.734 -5.852 1.00 0.00 C ATOM 599 C ALA A 37 14.366 13.322 -5.102 1.00 0.00 C ATOM 600 O ALA A 37 14.301 12.204 -4.591 1.00 0.00 O ATOM 601 CB ALA A 37 16.493 14.654 -4.996 1.00 0.00 C ATOM 0 H ALA A 37 15.556 15.350 -7.184 1.00 0.00 H new ATOM 0 HA ALA A 37 16.196 12.818 -6.053 1.00 0.00 H new ATOM 0 HB1 ALA A 37 16.693 14.177 -4.036 1.00 0.00 H new ATOM 0 HB2 ALA A 37 17.436 14.854 -5.505 1.00 0.00 H new ATOM 0 HB3 ALA A 37 15.964 15.592 -4.831 1.00 0.00 H new ATOM 607 N PRO A 38 13.347 14.212 -5.008 1.00 0.00 N ATOM 608 CA PRO A 38 12.081 13.909 -4.324 1.00 0.00 C ATOM 609 C PRO A 38 11.480 12.574 -4.749 1.00 0.00 C ATOM 610 O PRO A 38 10.931 12.440 -5.847 1.00 0.00 O ATOM 611 CB PRO A 38 11.166 15.062 -4.738 1.00 0.00 C ATOM 612 CG PRO A 38 12.091 16.196 -4.999 1.00 0.00 C ATOM 613 CD PRO A 38 13.351 15.585 -5.543 1.00 0.00 C ATOM 0 HA PRO A 38 12.221 13.819 -3.247 1.00 0.00 H new ATOM 0 HB2 PRO A 38 10.587 14.810 -5.626 1.00 0.00 H new ATOM 0 HB3 PRO A 38 10.453 15.305 -3.951 1.00 0.00 H new ATOM 0 HG2 PRO A 38 11.658 16.897 -5.712 1.00 0.00 H new ATOM 0 HG3 PRO A 38 12.291 16.755 -4.085 1.00 0.00 H new ATOM 0 HD2 PRO A 38 13.357 15.588 -6.633 1.00 0.00 H new ATOM 0 HD3 PRO A 38 14.233 16.136 -5.218 1.00 0.00 H new ATOM 621 N ALA A 39 11.615 11.588 -3.879 1.00 0.00 N ATOM 622 CA ALA A 39 11.076 10.267 -4.124 1.00 0.00 C ATOM 623 C ALA A 39 9.828 10.059 -3.289 1.00 0.00 C ATOM 624 O ALA A 39 9.872 10.156 -2.058 1.00 0.00 O ATOM 625 CB ALA A 39 12.114 9.206 -3.794 1.00 0.00 C ATOM 0 H ALA A 39 12.100 11.683 -2.987 1.00 0.00 H new ATOM 0 HA ALA A 39 10.815 10.180 -5.179 1.00 0.00 H new ATOM 0 HB1 ALA A 39 11.696 8.217 -3.983 1.00 0.00 H new ATOM 0 HB2 ALA A 39 12.995 9.353 -4.418 1.00 0.00 H new ATOM 0 HB3 ALA A 39 12.396 9.287 -2.744 1.00 0.00 H new ATOM 631 N LYS A 40 8.715 9.779 -3.943 1.00 0.00 N ATOM 632 CA LYS A 40 7.465 9.600 -3.227 1.00 0.00 C ATOM 633 C LYS A 40 7.192 8.122 -2.993 1.00 0.00 C ATOM 634 O LYS A 40 7.931 7.261 -3.472 1.00 0.00 O ATOM 635 CB LYS A 40 6.303 10.292 -3.947 1.00 0.00 C ATOM 636 CG LYS A 40 6.047 9.820 -5.370 1.00 0.00 C ATOM 637 CD LYS A 40 5.128 10.790 -6.102 1.00 0.00 C ATOM 638 CE LYS A 40 3.780 10.947 -5.403 1.00 0.00 C ATOM 639 NZ LYS A 40 3.018 12.115 -5.922 1.00 0.00 N ATOM 0 H LYS A 40 8.650 9.672 -4.955 1.00 0.00 H new ATOM 0 HA LYS A 40 7.558 10.078 -2.252 1.00 0.00 H new ATOM 0 HB2 LYS A 40 5.395 10.143 -3.363 1.00 0.00 H new ATOM 0 HB3 LYS A 40 6.496 11.365 -3.967 1.00 0.00 H new ATOM 0 HG2 LYS A 40 6.993 9.733 -5.905 1.00 0.00 H new ATOM 0 HG3 LYS A 40 5.597 8.827 -5.354 1.00 0.00 H new ATOM 0 HD2 LYS A 40 5.613 11.763 -6.174 1.00 0.00 H new ATOM 0 HD3 LYS A 40 4.968 10.437 -7.121 1.00 0.00 H new ATOM 0 HE2 LYS A 40 3.192 10.040 -5.541 1.00 0.00 H new ATOM 0 HE3 LYS A 40 3.939 11.064 -4.331 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 2.038 12.072 -5.576 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 3.463 12.995 -5.592 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 3.019 12.096 -6.962 1.00 0.00 H new ATOM 653 N PHE A 41 6.136 7.841 -2.252 1.00 0.00 N ATOM 654 CA PHE A 41 5.905 6.506 -1.722 1.00 0.00 C ATOM 655 C PHE A 41 5.267 5.597 -2.764 1.00 0.00 C ATOM 656 O PHE A 41 4.344 5.997 -3.463 1.00 0.00 O ATOM 657 CB PHE A 41 5.015 6.611 -0.486 1.00 0.00 C ATOM 658 CG PHE A 41 5.442 7.701 0.463 1.00 0.00 C ATOM 659 CD1 PHE A 41 6.567 7.548 1.255 1.00 0.00 C ATOM 660 CD2 PHE A 41 4.723 8.881 0.551 1.00 0.00 C ATOM 661 CE1 PHE A 41 6.967 8.549 2.120 1.00 0.00 C ATOM 662 CE2 PHE A 41 5.118 9.888 1.414 1.00 0.00 C ATOM 663 CZ PHE A 41 6.241 9.720 2.201 1.00 0.00 C ATOM 0 H PHE A 41 5.420 8.523 -2.001 1.00 0.00 H new ATOM 0 HA PHE A 41 6.863 6.063 -1.450 1.00 0.00 H new ATOM 0 HB2 PHE A 41 3.988 6.794 -0.801 1.00 0.00 H new ATOM 0 HB3 PHE A 41 5.022 5.657 0.041 1.00 0.00 H new ATOM 0 HD1 PHE A 41 7.140 6.634 1.196 1.00 0.00 H new ATOM 0 HD2 PHE A 41 3.844 9.017 -0.061 1.00 0.00 H new ATOM 0 HE1 PHE A 41 7.847 8.415 2.732 1.00 0.00 H new ATOM 0 HE2 PHE A 41 4.549 10.804 1.472 1.00 0.00 H new ATOM 0 HZ PHE A 41 6.550 10.503 2.878 1.00 0.00 H new ATOM 673 N ASP A 42 5.773 4.378 -2.864 1.00 0.00 N ATOM 674 CA ASP A 42 5.287 3.418 -3.849 1.00 0.00 C ATOM 675 C ASP A 42 5.309 2.000 -3.283 1.00 0.00 C ATOM 676 O ASP A 42 6.281 1.590 -2.644 1.00 0.00 O ATOM 677 CB ASP A 42 6.153 3.498 -5.111 1.00 0.00 C ATOM 678 CG ASP A 42 5.822 2.435 -6.141 1.00 0.00 C ATOM 679 OD1 ASP A 42 4.824 2.596 -6.875 1.00 0.00 O ATOM 680 OD2 ASP A 42 6.579 1.444 -6.240 1.00 0.00 O ATOM 0 H ASP A 42 6.525 4.026 -2.272 1.00 0.00 H new ATOM 0 HA ASP A 42 4.256 3.665 -4.100 1.00 0.00 H new ATOM 0 HB2 ASP A 42 6.031 4.482 -5.564 1.00 0.00 H new ATOM 0 HB3 ASP A 42 7.202 3.405 -4.829 1.00 0.00 H new ATOM 685 N ILE A 43 4.226 1.265 -3.502 1.00 0.00 N ATOM 686 CA ILE A 43 4.135 -0.126 -3.077 1.00 0.00 C ATOM 687 C ILE A 43 4.118 -1.025 -4.309 1.00 0.00 C ATOM 688 O ILE A 43 3.204 -0.937 -5.132 1.00 0.00 O ATOM 689 CB ILE A 43 2.870 -0.389 -2.228 1.00 0.00 C ATOM 690 CG1 ILE A 43 2.803 0.586 -1.048 1.00 0.00 C ATOM 691 CG2 ILE A 43 2.860 -1.827 -1.726 1.00 0.00 C ATOM 692 CD1 ILE A 43 1.553 0.444 -0.205 1.00 0.00 C ATOM 0 H ILE A 43 3.392 1.613 -3.975 1.00 0.00 H new ATOM 0 HA ILE A 43 5.002 -0.346 -2.455 1.00 0.00 H new ATOM 0 HB ILE A 43 1.993 -0.232 -2.856 1.00 0.00 H new ATOM 0 HG12 ILE A 43 3.676 0.434 -0.414 1.00 0.00 H new ATOM 0 HG13 ILE A 43 2.859 1.606 -1.428 1.00 0.00 H new ATOM 0 HG21 ILE A 43 1.964 -1.998 -1.130 1.00 0.00 H new ATOM 0 HG22 ILE A 43 2.866 -2.509 -2.576 1.00 0.00 H new ATOM 0 HG23 ILE A 43 3.743 -2.004 -1.112 1.00 0.00 H new ATOM 0 HD11 ILE A 43 1.579 1.168 0.610 1.00 0.00 H new ATOM 0 HD12 ILE A 43 0.674 0.626 -0.824 1.00 0.00 H new ATOM 0 HD13 ILE A 43 1.504 -0.564 0.207 1.00 0.00 H new ATOM 704 N ARG A 44 5.119 -1.887 -4.440 1.00 0.00 N ATOM 705 CA ARG A 44 5.298 -2.650 -5.667 1.00 0.00 C ATOM 706 C ARG A 44 5.895 -4.028 -5.394 1.00 0.00 C ATOM 707 O ARG A 44 6.638 -4.223 -4.430 1.00 0.00 O ATOM 708 CB ARG A 44 6.214 -1.872 -6.612 1.00 0.00 C ATOM 709 CG ARG A 44 6.440 -2.536 -7.959 1.00 0.00 C ATOM 710 CD ARG A 44 7.598 -1.887 -8.697 1.00 0.00 C ATOM 711 NE ARG A 44 8.859 -2.043 -7.964 1.00 0.00 N ATOM 712 CZ ARG A 44 9.466 -1.064 -7.294 1.00 0.00 C ATOM 713 NH1 ARG A 44 8.959 0.162 -7.289 1.00 0.00 N ATOM 714 NH2 ARG A 44 10.586 -1.311 -6.627 1.00 0.00 N ATOM 0 H ARG A 44 5.814 -2.074 -3.717 1.00 0.00 H new ATOM 0 HA ARG A 44 4.319 -2.797 -6.123 1.00 0.00 H new ATOM 0 HB2 ARG A 44 5.789 -0.882 -6.776 1.00 0.00 H new ATOM 0 HB3 ARG A 44 7.179 -1.728 -6.126 1.00 0.00 H new ATOM 0 HG2 ARG A 44 6.644 -3.597 -7.816 1.00 0.00 H new ATOM 0 HG3 ARG A 44 5.534 -2.464 -8.561 1.00 0.00 H new ATOM 0 HD2 ARG A 44 7.694 -2.332 -9.687 1.00 0.00 H new ATOM 0 HD3 ARG A 44 7.390 -0.827 -8.843 1.00 0.00 H new ATOM 0 HE ARG A 44 9.301 -2.962 -7.967 1.00 0.00 H new ATOM 0 HH11 ARG A 44 8.099 0.360 -7.800 1.00 0.00 H new ATOM 0 HH12 ARG A 44 9.429 0.906 -6.774 1.00 0.00 H new ATOM 0 HH21 ARG A 44 10.983 -2.251 -6.627 1.00 0.00 H new ATOM 0 HH22 ARG A 44 11.050 -0.561 -6.114 1.00 0.00 H new ATOM 728 N ALA A 45 5.546 -4.981 -6.249 1.00 0.00 N ATOM 729 CA ALA A 45 6.158 -6.299 -6.239 1.00 0.00 C ATOM 730 C ALA A 45 6.992 -6.478 -7.503 1.00 0.00 C ATOM 731 O ALA A 45 6.534 -6.156 -8.600 1.00 0.00 O ATOM 732 CB ALA A 45 5.094 -7.382 -6.138 1.00 0.00 C ATOM 0 H ALA A 45 4.832 -4.860 -6.967 1.00 0.00 H new ATOM 0 HA ALA A 45 6.807 -6.387 -5.368 1.00 0.00 H new ATOM 0 HB1 ALA A 45 5.572 -8.362 -6.132 1.00 0.00 H new ATOM 0 HB2 ALA A 45 4.526 -7.249 -5.217 1.00 0.00 H new ATOM 0 HB3 ALA A 45 4.421 -7.312 -6.993 1.00 0.00 H new ATOM 738 N TRP A 46 8.215 -6.967 -7.347 1.00 0.00 N ATOM 739 CA TRP A 46 9.136 -7.088 -8.470 1.00 0.00 C ATOM 740 C TRP A 46 10.200 -8.149 -8.198 1.00 0.00 C ATOM 741 O TRP A 46 10.511 -8.444 -7.041 1.00 0.00 O ATOM 742 CB TRP A 46 9.803 -5.732 -8.751 1.00 0.00 C ATOM 743 CG TRP A 46 10.677 -5.238 -7.629 1.00 0.00 C ATOM 744 CD1 TRP A 46 10.271 -4.709 -6.433 1.00 0.00 C ATOM 745 CD2 TRP A 46 12.110 -5.226 -7.603 1.00 0.00 C ATOM 746 NE1 TRP A 46 11.364 -4.372 -5.672 1.00 0.00 N ATOM 747 CE2 TRP A 46 12.502 -4.683 -6.366 1.00 0.00 C ATOM 748 CE3 TRP A 46 13.101 -5.628 -8.506 1.00 0.00 C ATOM 749 CZ2 TRP A 46 13.838 -4.530 -6.010 1.00 0.00 C ATOM 750 CZ3 TRP A 46 14.425 -5.473 -8.152 1.00 0.00 C ATOM 751 CH2 TRP A 46 14.785 -4.931 -6.913 1.00 0.00 C ATOM 0 H TRP A 46 8.592 -7.286 -6.455 1.00 0.00 H new ATOM 0 HA TRP A 46 8.566 -7.397 -9.346 1.00 0.00 H new ATOM 0 HB2 TRP A 46 10.403 -5.814 -9.657 1.00 0.00 H new ATOM 0 HB3 TRP A 46 9.028 -4.991 -8.948 1.00 0.00 H new ATOM 0 HD1 TRP A 46 9.242 -4.576 -6.132 1.00 0.00 H new ATOM 0 HE1 TRP A 46 11.333 -3.957 -4.741 1.00 0.00 H new ATOM 0 HE3 TRP A 46 12.834 -6.052 -9.463 1.00 0.00 H new ATOM 0 HZ2 TRP A 46 14.118 -4.110 -5.055 1.00 0.00 H new ATOM 0 HZ3 TRP A 46 15.198 -5.775 -8.843 1.00 0.00 H new ATOM 0 HH2 TRP A 46 15.831 -4.827 -6.664 1.00 0.00 H new ATOM 762 N SER A 47 10.744 -8.720 -9.271 1.00 0.00 N ATOM 763 CA SER A 47 11.846 -9.674 -9.184 1.00 0.00 C ATOM 764 C SER A 47 12.315 -10.071 -10.594 1.00 0.00 C ATOM 765 O SER A 47 13.482 -9.861 -10.931 1.00 0.00 O ATOM 766 CB SER A 47 11.458 -10.905 -8.350 1.00 0.00 C ATOM 767 OG SER A 47 12.578 -11.736 -8.094 1.00 0.00 O ATOM 0 H SER A 47 10.433 -8.534 -10.224 1.00 0.00 H new ATOM 0 HA SER A 47 12.678 -9.193 -8.670 1.00 0.00 H new ATOM 0 HB2 SER A 47 11.020 -10.582 -7.405 1.00 0.00 H new ATOM 0 HB3 SER A 47 10.693 -11.476 -8.877 1.00 0.00 H new ATOM 0 HG SER A 47 12.297 -12.509 -7.560 1.00 0.00 H new ATOM 773 N PRO A 48 11.431 -10.641 -11.451 1.00 0.00 N ATOM 774 CA PRO A 48 11.770 -10.911 -12.857 1.00 0.00 C ATOM 775 C PRO A 48 11.858 -9.622 -13.675 1.00 0.00 C ATOM 776 O PRO A 48 11.268 -8.602 -13.306 1.00 0.00 O ATOM 777 CB PRO A 48 10.612 -11.786 -13.358 1.00 0.00 C ATOM 778 CG PRO A 48 9.885 -12.220 -12.130 1.00 0.00 C ATOM 779 CD PRO A 48 10.072 -11.112 -11.138 1.00 0.00 C ATOM 0 HA PRO A 48 12.744 -11.391 -12.956 1.00 0.00 H new ATOM 0 HB2 PRO A 48 9.957 -11.226 -14.026 1.00 0.00 H new ATOM 0 HB3 PRO A 48 10.982 -12.644 -13.920 1.00 0.00 H new ATOM 0 HG2 PRO A 48 8.828 -12.385 -12.338 1.00 0.00 H new ATOM 0 HG3 PRO A 48 10.286 -13.159 -11.749 1.00 0.00 H new ATOM 0 HD2 PRO A 48 9.329 -10.324 -11.263 1.00 0.00 H new ATOM 0 HD3 PRO A 48 9.991 -11.467 -10.111 1.00 0.00 H new ATOM 787 N ASP A 49 12.586 -9.672 -14.790 1.00 0.00 N ATOM 788 CA ASP A 49 12.839 -8.470 -15.589 1.00 0.00 C ATOM 789 C ASP A 49 12.396 -8.659 -17.038 1.00 0.00 C ATOM 790 O ASP A 49 12.014 -7.695 -17.699 1.00 0.00 O ATOM 791 CB ASP A 49 14.333 -8.110 -15.595 1.00 0.00 C ATOM 792 CG ASP A 49 15.020 -8.306 -14.260 1.00 0.00 C ATOM 793 OD1 ASP A 49 14.915 -7.421 -13.385 1.00 0.00 O ATOM 794 OD2 ASP A 49 15.705 -9.342 -14.096 1.00 0.00 O ATOM 0 H ASP A 49 13.009 -10.524 -15.160 1.00 0.00 H new ATOM 0 HA ASP A 49 12.263 -7.667 -15.128 1.00 0.00 H new ATOM 0 HB2 ASP A 49 14.839 -8.718 -16.345 1.00 0.00 H new ATOM 0 HB3 ASP A 49 14.444 -7.069 -15.900 1.00 0.00 H new ATOM 799 N HIS A 50 12.442 -9.912 -17.508 1.00 0.00 N ATOM 800 CA HIS A 50 12.278 -10.238 -18.934 1.00 0.00 C ATOM 801 C HIS A 50 11.046 -9.574 -19.547 1.00 0.00 C ATOM 802 O HIS A 50 11.155 -8.568 -20.247 1.00 0.00 O ATOM 803 CB HIS A 50 12.204 -11.758 -19.126 1.00 0.00 C ATOM 804 CG HIS A 50 12.276 -12.191 -20.562 1.00 0.00 C ATOM 805 ND1 HIS A 50 11.208 -12.733 -21.250 1.00 0.00 N ATOM 806 CD2 HIS A 50 13.306 -12.164 -21.440 1.00 0.00 C ATOM 807 CE1 HIS A 50 11.582 -13.017 -22.483 1.00 0.00 C ATOM 808 NE2 HIS A 50 12.848 -12.681 -22.624 1.00 0.00 N ATOM 0 H HIS A 50 12.593 -10.727 -16.914 1.00 0.00 H new ATOM 0 HA HIS A 50 13.151 -9.844 -19.454 1.00 0.00 H new ATOM 0 HB2 HIS A 50 13.020 -12.225 -18.574 1.00 0.00 H new ATOM 0 HB3 HIS A 50 11.274 -12.125 -18.692 1.00 0.00 H new ATOM 0 HD2 HIS A 50 14.304 -11.802 -21.244 1.00 0.00 H new ATOM 0 HE1 HIS A 50 10.956 -13.452 -23.248 1.00 0.00 H new ATOM 0 HE2 HIS A 50 13.398 -12.788 -23.476 1.00 0.00 H new ATOM 817 N THR A 51 9.875 -10.142 -19.302 1.00 0.00 N ATOM 818 CA THR A 51 8.641 -9.582 -19.828 1.00 0.00 C ATOM 819 C THR A 51 7.469 -9.940 -18.925 1.00 0.00 C ATOM 820 O THR A 51 6.731 -10.891 -19.185 1.00 0.00 O ATOM 821 CB THR A 51 8.355 -10.066 -21.266 1.00 0.00 C ATOM 822 OG1 THR A 51 9.513 -9.876 -22.091 1.00 0.00 O ATOM 823 CG2 THR A 51 7.177 -9.313 -21.870 1.00 0.00 C ATOM 0 H THR A 51 9.754 -10.987 -18.744 1.00 0.00 H new ATOM 0 HA THR A 51 8.764 -8.499 -19.855 1.00 0.00 H new ATOM 0 HB THR A 51 8.108 -11.127 -21.220 1.00 0.00 H new ATOM 0 HG1 THR A 51 10.121 -10.637 -21.981 1.00 0.00 H new ATOM 0 HG21 THR A 51 6.996 -9.673 -22.883 1.00 0.00 H new ATOM 0 HG22 THR A 51 6.288 -9.480 -21.262 1.00 0.00 H new ATOM 0 HG23 THR A 51 7.403 -8.247 -21.898 1.00 0.00 H new ATOM 831 N LYS A 52 7.351 -9.200 -17.836 1.00 0.00 N ATOM 832 CA LYS A 52 6.255 -9.355 -16.894 1.00 0.00 C ATOM 833 C LYS A 52 6.324 -8.250 -15.849 1.00 0.00 C ATOM 834 O LYS A 52 7.169 -8.265 -14.955 1.00 0.00 O ATOM 835 CB LYS A 52 6.262 -10.746 -16.238 1.00 0.00 C ATOM 836 CG LYS A 52 7.591 -11.150 -15.620 1.00 0.00 C ATOM 837 CD LYS A 52 7.553 -12.583 -15.112 1.00 0.00 C ATOM 838 CE LYS A 52 7.402 -13.574 -16.256 1.00 0.00 C ATOM 839 NZ LYS A 52 7.309 -14.976 -15.770 1.00 0.00 N ATOM 0 H LYS A 52 8.016 -8.471 -17.579 1.00 0.00 H new ATOM 0 HA LYS A 52 5.314 -9.271 -17.438 1.00 0.00 H new ATOM 0 HB2 LYS A 52 5.494 -10.772 -15.465 1.00 0.00 H new ATOM 0 HB3 LYS A 52 5.985 -11.488 -16.987 1.00 0.00 H new ATOM 0 HG2 LYS A 52 8.385 -11.045 -16.360 1.00 0.00 H new ATOM 0 HG3 LYS A 52 7.831 -10.477 -14.797 1.00 0.00 H new ATOM 0 HD2 LYS A 52 8.468 -12.799 -14.560 1.00 0.00 H new ATOM 0 HD3 LYS A 52 6.724 -12.701 -14.414 1.00 0.00 H new ATOM 0 HE2 LYS A 52 6.509 -13.330 -16.832 1.00 0.00 H new ATOM 0 HE3 LYS A 52 8.252 -13.480 -16.932 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 7.207 -15.619 -16.581 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 8.172 -15.219 -15.242 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 6.483 -15.073 -15.146 1.00 0.00 H new ATOM 853 N MET A 53 5.448 -7.274 -15.991 1.00 0.00 N ATOM 854 CA MET A 53 5.447 -6.117 -15.115 1.00 0.00 C ATOM 855 C MET A 53 4.388 -6.267 -14.038 1.00 0.00 C ATOM 856 O MET A 53 3.188 -6.175 -14.314 1.00 0.00 O ATOM 857 CB MET A 53 5.213 -4.839 -15.922 1.00 0.00 C ATOM 858 CG MET A 53 6.320 -4.550 -16.924 1.00 0.00 C ATOM 859 SD MET A 53 5.995 -3.089 -17.926 1.00 0.00 S ATOM 860 CE MET A 53 4.481 -3.582 -18.752 1.00 0.00 C ATOM 0 H MET A 53 4.724 -7.259 -16.709 1.00 0.00 H new ATOM 0 HA MET A 53 6.421 -6.048 -14.632 1.00 0.00 H new ATOM 0 HB2 MET A 53 4.264 -4.921 -16.453 1.00 0.00 H new ATOM 0 HB3 MET A 53 5.123 -3.996 -15.237 1.00 0.00 H new ATOM 0 HG2 MET A 53 7.261 -4.416 -16.390 1.00 0.00 H new ATOM 0 HG3 MET A 53 6.445 -5.413 -17.578 1.00 0.00 H new ATOM 0 HE1 MET A 53 4.516 -3.267 -19.795 1.00 0.00 H new ATOM 0 HE2 MET A 53 4.377 -4.666 -18.704 1.00 0.00 H new ATOM 0 HE3 MET A 53 3.629 -3.113 -18.260 1.00 0.00 H new ATOM 870 N GLY A 54 4.844 -6.510 -12.819 1.00 0.00 N ATOM 871 CA GLY A 54 3.939 -6.691 -11.704 1.00 0.00 C ATOM 872 C GLY A 54 3.217 -5.415 -11.335 1.00 0.00 C ATOM 873 O GLY A 54 3.703 -4.315 -11.611 1.00 0.00 O ATOM 0 H GLY A 54 5.833 -6.586 -12.581 1.00 0.00 H new ATOM 0 HA2 GLY A 54 3.208 -7.460 -11.954 1.00 0.00 H new ATOM 0 HA3 GLY A 54 4.498 -7.052 -10.841 1.00 0.00 H new ATOM 877 N LYS A 55 2.056 -5.560 -10.716 1.00 0.00 N ATOM 878 CA LYS A 55 1.259 -4.411 -10.322 1.00 0.00 C ATOM 879 C LYS A 55 1.893 -3.682 -9.145 1.00 0.00 C ATOM 880 O LYS A 55 2.294 -4.298 -8.153 1.00 0.00 O ATOM 881 CB LYS A 55 -0.162 -4.834 -9.960 1.00 0.00 C ATOM 882 CG LYS A 55 -0.994 -5.288 -11.147 1.00 0.00 C ATOM 883 CD LYS A 55 -2.411 -5.633 -10.724 1.00 0.00 C ATOM 884 CE LYS A 55 -3.260 -6.064 -11.908 1.00 0.00 C ATOM 885 NZ LYS A 55 -2.673 -7.229 -12.622 1.00 0.00 N ATOM 0 H LYS A 55 1.645 -6.462 -10.476 1.00 0.00 H new ATOM 0 HA LYS A 55 1.220 -3.732 -11.174 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -0.114 -5.644 -9.232 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -0.666 -3.998 -9.475 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -1.018 -4.500 -11.900 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -0.528 -6.158 -11.610 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -2.386 -6.433 -9.984 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -2.868 -4.768 -10.243 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -4.262 -6.319 -11.562 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -3.365 -5.230 -12.601 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -3.378 -7.627 -13.275 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -1.837 -6.922 -13.160 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -2.393 -7.954 -11.931 1.00 0.00 H new ATOM 899 N GLY A 56 1.993 -2.373 -9.282 1.00 0.00 N ATOM 900 CA GLY A 56 2.480 -1.532 -8.217 1.00 0.00 C ATOM 901 C GLY A 56 1.689 -0.247 -8.163 1.00 0.00 C ATOM 902 O GLY A 56 1.187 0.212 -9.192 1.00 0.00 O ATOM 0 H GLY A 56 1.739 -1.870 -10.132 1.00 0.00 H new ATOM 0 HA2 GLY A 56 2.401 -2.056 -7.265 1.00 0.00 H new ATOM 0 HA3 GLY A 56 3.536 -1.311 -8.372 1.00 0.00 H new ATOM 906 N ILE A 57 1.560 0.332 -6.985 1.00 0.00 N ATOM 907 CA ILE A 57 0.771 1.539 -6.828 1.00 0.00 C ATOM 908 C ILE A 57 1.561 2.611 -6.083 1.00 0.00 C ATOM 909 O ILE A 57 2.125 2.366 -5.012 1.00 0.00 O ATOM 910 CB ILE A 57 -0.572 1.250 -6.112 1.00 0.00 C ATOM 911 CG1 ILE A 57 -1.419 2.523 -6.020 1.00 0.00 C ATOM 912 CG2 ILE A 57 -0.338 0.660 -4.728 1.00 0.00 C ATOM 913 CD1 ILE A 57 -2.814 2.286 -5.483 1.00 0.00 C ATOM 0 H ILE A 57 1.989 -0.012 -6.126 1.00 0.00 H new ATOM 0 HA ILE A 57 0.540 1.913 -7.825 1.00 0.00 H new ATOM 0 HB ILE A 57 -1.118 0.515 -6.703 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -0.910 3.243 -5.379 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -1.492 2.973 -7.010 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -1.297 0.467 -4.248 1.00 0.00 H new ATOM 0 HG22 ILE A 57 0.216 -0.274 -4.820 1.00 0.00 H new ATOM 0 HG23 ILE A 57 0.235 1.364 -4.124 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -3.355 3.231 -5.446 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -3.342 1.591 -6.136 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -2.751 1.865 -4.480 1.00 0.00 H new ATOM 925 N THR A 58 1.621 3.789 -6.676 1.00 0.00 N ATOM 926 CA THR A 58 2.343 4.903 -6.096 1.00 0.00 C ATOM 927 C THR A 58 1.385 5.818 -5.333 1.00 0.00 C ATOM 928 O THR A 58 0.312 6.171 -5.828 1.00 0.00 O ATOM 929 CB THR A 58 3.070 5.696 -7.200 1.00 0.00 C ATOM 930 OG1 THR A 58 3.817 4.789 -8.027 1.00 0.00 O ATOM 931 CG2 THR A 58 4.014 6.732 -6.608 1.00 0.00 C ATOM 0 H THR A 58 1.173 3.999 -7.568 1.00 0.00 H new ATOM 0 HA THR A 58 3.083 4.513 -5.397 1.00 0.00 H new ATOM 0 HB THR A 58 2.320 6.217 -7.794 1.00 0.00 H new ATOM 0 HG1 THR A 58 4.386 4.224 -7.463 1.00 0.00 H new ATOM 0 HG21 THR A 58 4.511 7.274 -7.413 1.00 0.00 H new ATOM 0 HG22 THR A 58 3.447 7.433 -5.995 1.00 0.00 H new ATOM 0 HG23 THR A 58 4.761 6.233 -5.991 1.00 0.00 H new ATOM 939 N LEU A 59 1.770 6.182 -4.121 1.00 0.00 N ATOM 940 CA LEU A 59 0.944 7.021 -3.272 1.00 0.00 C ATOM 941 C LEU A 59 1.612 8.370 -3.068 1.00 0.00 C ATOM 942 O LEU A 59 2.841 8.469 -3.027 1.00 0.00 O ATOM 943 CB LEU A 59 0.691 6.359 -1.908 1.00 0.00 C ATOM 944 CG LEU A 59 -0.067 5.024 -1.935 1.00 0.00 C ATOM 945 CD1 LEU A 59 0.869 3.868 -2.256 1.00 0.00 C ATOM 946 CD2 LEU A 59 -0.770 4.794 -0.606 1.00 0.00 C ATOM 0 H LEU A 59 2.658 5.906 -3.701 1.00 0.00 H new ATOM 0 HA LEU A 59 -0.016 7.158 -3.769 1.00 0.00 H new ATOM 0 HB2 LEU A 59 1.653 6.198 -1.421 1.00 0.00 H new ATOM 0 HB3 LEU A 59 0.132 7.058 -1.286 1.00 0.00 H new ATOM 0 HG LEU A 59 -0.817 5.072 -2.724 1.00 0.00 H new ATOM 0 HD11 LEU A 59 0.305 2.936 -2.268 1.00 0.00 H new ATOM 0 HD12 LEU A 59 1.325 4.029 -3.233 1.00 0.00 H new ATOM 0 HD13 LEU A 59 1.649 3.810 -1.497 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -1.304 3.844 -0.637 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -0.033 4.770 0.196 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -1.478 5.603 -0.424 1.00 0.00 H new ATOM 958 N SER A 60 0.814 9.411 -2.953 1.00 0.00 N ATOM 959 CA SER A 60 1.351 10.729 -2.691 1.00 0.00 C ATOM 960 C SER A 60 1.529 10.924 -1.190 1.00 0.00 C ATOM 961 O SER A 60 1.057 10.109 -0.389 1.00 0.00 O ATOM 962 CB SER A 60 0.435 11.802 -3.278 1.00 0.00 C ATOM 963 OG SER A 60 0.134 11.519 -4.636 1.00 0.00 O ATOM 0 H SER A 60 -0.202 9.371 -3.036 1.00 0.00 H new ATOM 0 HA SER A 60 2.326 10.821 -3.170 1.00 0.00 H new ATOM 0 HB2 SER A 60 -0.487 11.855 -2.700 1.00 0.00 H new ATOM 0 HB3 SER A 60 0.915 12.778 -3.203 1.00 0.00 H new ATOM 0 HG SER A 60 -0.682 10.978 -4.684 1.00 0.00 H new ATOM 969 N ASN A 61 2.219 11.991 -0.817 1.00 0.00 N ATOM 970 CA ASN A 61 2.529 12.269 0.586 1.00 0.00 C ATOM 971 C ASN A 61 1.270 12.313 1.456 1.00 0.00 C ATOM 972 O ASN A 61 1.264 11.776 2.566 1.00 0.00 O ATOM 973 CB ASN A 61 3.321 13.580 0.719 1.00 0.00 C ATOM 974 CG ASN A 61 2.575 14.800 0.199 1.00 0.00 C ATOM 975 OD1 ASN A 61 1.770 14.716 -0.734 1.00 0.00 O ATOM 976 ND2 ASN A 61 2.842 15.950 0.797 1.00 0.00 N ATOM 0 H ASN A 61 2.580 12.687 -1.469 1.00 0.00 H new ATOM 0 HA ASN A 61 3.146 11.447 0.947 1.00 0.00 H new ATOM 0 HB2 ASN A 61 3.572 13.738 1.768 1.00 0.00 H new ATOM 0 HB3 ASN A 61 4.262 13.482 0.178 1.00 0.00 H new ATOM 0 HD21 ASN A 61 2.377 16.804 0.490 1.00 0.00 H new ATOM 0 HD22 ASN A 61 3.513 15.982 1.565 1.00 0.00 H new ATOM 983 N GLU A 62 0.205 12.928 0.947 1.00 0.00 N ATOM 984 CA GLU A 62 -1.034 13.065 1.704 1.00 0.00 C ATOM 985 C GLU A 62 -1.636 11.702 2.041 1.00 0.00 C ATOM 986 O GLU A 62 -1.825 11.378 3.214 1.00 0.00 O ATOM 987 CB GLU A 62 -2.058 13.907 0.933 1.00 0.00 C ATOM 988 CG GLU A 62 -3.411 13.991 1.624 1.00 0.00 C ATOM 989 CD GLU A 62 -4.383 14.916 0.921 1.00 0.00 C ATOM 990 OE1 GLU A 62 -5.045 14.480 -0.046 1.00 0.00 O ATOM 991 OE2 GLU A 62 -4.499 16.084 1.339 1.00 0.00 O ATOM 0 H GLU A 62 0.176 13.339 0.014 1.00 0.00 H new ATOM 0 HA GLU A 62 -0.787 13.573 2.636 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -1.663 14.914 0.799 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -2.192 13.482 -0.062 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -3.845 12.993 1.681 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -3.268 14.335 2.648 1.00 0.00 H new ATOM 998 N GLU A 63 -1.929 10.907 1.016 1.00 0.00 N ATOM 999 CA GLU A 63 -2.598 9.621 1.203 1.00 0.00 C ATOM 1000 C GLU A 63 -1.785 8.688 2.085 1.00 0.00 C ATOM 1001 O GLU A 63 -2.330 8.035 2.975 1.00 0.00 O ATOM 1002 CB GLU A 63 -2.851 8.932 -0.135 1.00 0.00 C ATOM 1003 CG GLU A 63 -3.535 9.813 -1.157 1.00 0.00 C ATOM 1004 CD GLU A 63 -2.552 10.556 -2.031 1.00 0.00 C ATOM 1005 OE1 GLU A 63 -2.137 11.667 -1.661 1.00 0.00 O ATOM 1006 OE2 GLU A 63 -2.195 10.021 -3.106 1.00 0.00 O ATOM 0 H GLU A 63 -1.713 11.131 0.044 1.00 0.00 H new ATOM 0 HA GLU A 63 -3.549 9.834 1.691 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -1.900 8.590 -0.543 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -3.462 8.045 0.034 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -4.183 9.201 -1.784 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -4.174 10.531 -0.643 1.00 0.00 H new ATOM 1013 N PHE A 64 -0.486 8.634 1.837 1.00 0.00 N ATOM 1014 CA PHE A 64 0.387 7.718 2.554 1.00 0.00 C ATOM 1015 C PHE A 64 0.437 8.081 4.037 1.00 0.00 C ATOM 1016 O PHE A 64 0.334 7.214 4.902 1.00 0.00 O ATOM 1017 CB PHE A 64 1.787 7.746 1.951 1.00 0.00 C ATOM 1018 CG PHE A 64 2.619 6.551 2.302 1.00 0.00 C ATOM 1019 CD1 PHE A 64 2.529 5.389 1.550 1.00 0.00 C ATOM 1020 CD2 PHE A 64 3.499 6.587 3.370 1.00 0.00 C ATOM 1021 CE1 PHE A 64 3.302 4.288 1.857 1.00 0.00 C ATOM 1022 CE2 PHE A 64 4.273 5.487 3.681 1.00 0.00 C ATOM 1023 CZ PHE A 64 4.176 4.337 2.922 1.00 0.00 C ATOM 0 H PHE A 64 -0.013 9.214 1.144 1.00 0.00 H new ATOM 0 HA PHE A 64 -0.013 6.708 2.460 1.00 0.00 H new ATOM 0 HB2 PHE A 64 1.704 7.814 0.866 1.00 0.00 H new ATOM 0 HB3 PHE A 64 2.300 8.646 2.288 1.00 0.00 H new ATOM 0 HD1 PHE A 64 1.846 5.345 0.715 1.00 0.00 H new ATOM 0 HD2 PHE A 64 3.581 7.484 3.966 1.00 0.00 H new ATOM 0 HE1 PHE A 64 3.222 3.389 1.264 1.00 0.00 H new ATOM 0 HE2 PHE A 64 4.955 5.526 4.518 1.00 0.00 H new ATOM 0 HZ PHE A 64 4.784 3.477 3.163 1.00 0.00 H new ATOM 1033 N GLN A 65 0.583 9.367 4.321 1.00 0.00 N ATOM 1034 CA GLN A 65 0.558 9.851 5.693 1.00 0.00 C ATOM 1035 C GLN A 65 -0.808 9.572 6.329 1.00 0.00 C ATOM 1036 O GLN A 65 -0.894 9.084 7.458 1.00 0.00 O ATOM 1037 CB GLN A 65 0.862 11.353 5.731 1.00 0.00 C ATOM 1038 CG GLN A 65 0.641 11.991 7.094 1.00 0.00 C ATOM 1039 CD GLN A 65 1.450 11.333 8.196 1.00 0.00 C ATOM 1040 OE1 GLN A 65 1.019 11.283 9.345 1.00 0.00 O ATOM 1041 NE2 GLN A 65 2.631 10.836 7.858 1.00 0.00 N ATOM 0 H GLN A 65 0.720 10.094 3.619 1.00 0.00 H new ATOM 0 HA GLN A 65 1.323 9.324 6.263 1.00 0.00 H new ATOM 0 HB2 GLN A 65 1.897 11.512 5.430 1.00 0.00 H new ATOM 0 HB3 GLN A 65 0.235 11.860 4.997 1.00 0.00 H new ATOM 0 HG2 GLN A 65 0.902 13.048 7.041 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -0.418 11.937 7.347 1.00 0.00 H new ATOM 0 HE21 GLN A 65 2.953 10.898 6.892 1.00 0.00 H new ATOM 0 HE22 GLN A 65 3.218 10.392 8.564 1.00 0.00 H new ATOM 1050 N THR A 66 -1.862 9.863 5.575 1.00 0.00 N ATOM 1051 CA THR A 66 -3.231 9.680 6.044 1.00 0.00 C ATOM 1052 C THR A 66 -3.501 8.229 6.436 1.00 0.00 C ATOM 1053 O THR A 66 -4.044 7.961 7.513 1.00 0.00 O ATOM 1054 CB THR A 66 -4.246 10.121 4.963 1.00 0.00 C ATOM 1055 OG1 THR A 66 -4.066 11.516 4.669 1.00 0.00 O ATOM 1056 CG2 THR A 66 -5.679 9.868 5.410 1.00 0.00 C ATOM 0 H THR A 66 -1.793 10.231 4.626 1.00 0.00 H new ATOM 0 HA THR A 66 -3.353 10.305 6.929 1.00 0.00 H new ATOM 0 HB THR A 66 -4.064 9.529 4.066 1.00 0.00 H new ATOM 0 HG1 THR A 66 -3.439 11.615 3.922 1.00 0.00 H new ATOM 0 HG21 THR A 66 -6.366 10.189 4.627 1.00 0.00 H new ATOM 0 HG22 THR A 66 -5.818 8.804 5.601 1.00 0.00 H new ATOM 0 HG23 THR A 66 -5.880 10.430 6.322 1.00 0.00 H new ATOM 1064 N MET A 67 -3.109 7.294 5.573 1.00 0.00 N ATOM 1065 CA MET A 67 -3.337 5.880 5.840 1.00 0.00 C ATOM 1066 C MET A 67 -2.596 5.457 7.106 1.00 0.00 C ATOM 1067 O MET A 67 -3.107 4.676 7.901 1.00 0.00 O ATOM 1068 CB MET A 67 -2.904 5.000 4.654 1.00 0.00 C ATOM 1069 CG MET A 67 -1.411 4.718 4.606 1.00 0.00 C ATOM 1070 SD MET A 67 -0.977 3.416 3.443 1.00 0.00 S ATOM 1071 CE MET A 67 0.727 3.122 3.918 1.00 0.00 C ATOM 0 H MET A 67 -2.636 7.490 4.691 1.00 0.00 H new ATOM 0 HA MET A 67 -4.408 5.739 5.985 1.00 0.00 H new ATOM 0 HB2 MET A 67 -3.441 4.053 4.703 1.00 0.00 H new ATOM 0 HB3 MET A 67 -3.201 5.487 3.726 1.00 0.00 H new ATOM 0 HG2 MET A 67 -0.883 5.632 4.333 1.00 0.00 H new ATOM 0 HG3 MET A 67 -1.068 4.437 5.602 1.00 0.00 H new ATOM 0 HE1 MET A 67 1.192 2.443 3.203 1.00 0.00 H new ATOM 0 HE2 MET A 67 1.270 4.067 3.927 1.00 0.00 H new ATOM 0 HE3 MET A 67 0.756 2.677 4.913 1.00 0.00 H new ATOM 1081 N VAL A 68 -1.403 6.008 7.301 1.00 0.00 N ATOM 1082 CA VAL A 68 -0.564 5.643 8.431 1.00 0.00 C ATOM 1083 C VAL A 68 -1.197 6.046 9.757 1.00 0.00 C ATOM 1084 O VAL A 68 -1.139 5.290 10.724 1.00 0.00 O ATOM 1085 CB VAL A 68 0.844 6.252 8.295 1.00 0.00 C ATOM 1086 CG1 VAL A 68 1.614 6.204 9.610 1.00 0.00 C ATOM 1087 CG2 VAL A 68 1.608 5.519 7.209 1.00 0.00 C ATOM 0 H VAL A 68 -0.996 6.713 6.686 1.00 0.00 H new ATOM 0 HA VAL A 68 -0.471 4.557 8.425 1.00 0.00 H new ATOM 0 HB VAL A 68 0.735 7.302 8.024 1.00 0.00 H new ATOM 0 HG11 VAL A 68 2.602 6.643 9.470 1.00 0.00 H new ATOM 0 HG12 VAL A 68 1.071 6.766 10.370 1.00 0.00 H new ATOM 0 HG13 VAL A 68 1.720 5.168 9.932 1.00 0.00 H new ATOM 0 HG21 VAL A 68 2.605 5.949 7.112 1.00 0.00 H new ATOM 0 HG22 VAL A 68 1.692 4.464 7.472 1.00 0.00 H new ATOM 0 HG23 VAL A 68 1.077 5.616 6.262 1.00 0.00 H new ATOM 1097 N ASP A 69 -1.802 7.227 9.806 1.00 0.00 N ATOM 1098 CA ASP A 69 -2.502 7.661 11.012 1.00 0.00 C ATOM 1099 C ASP A 69 -3.603 6.666 11.354 1.00 0.00 C ATOM 1100 O ASP A 69 -3.685 6.159 12.480 1.00 0.00 O ATOM 1101 CB ASP A 69 -3.102 9.057 10.829 1.00 0.00 C ATOM 1102 CG ASP A 69 -3.779 9.566 12.090 1.00 0.00 C ATOM 1103 OD1 ASP A 69 -4.924 9.154 12.370 1.00 0.00 O ATOM 1104 OD2 ASP A 69 -3.164 10.379 12.812 1.00 0.00 O ATOM 0 H ASP A 69 -1.823 7.895 9.036 1.00 0.00 H new ATOM 0 HA ASP A 69 -1.782 7.705 11.829 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -2.315 9.752 10.536 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -3.826 9.034 10.015 1.00 0.00 H new ATOM 1109 N ALA A 70 -4.423 6.362 10.366 1.00 0.00 N ATOM 1110 CA ALA A 70 -5.519 5.432 10.547 1.00 0.00 C ATOM 1111 C ALA A 70 -5.015 4.045 10.934 1.00 0.00 C ATOM 1112 O ALA A 70 -5.596 3.389 11.797 1.00 0.00 O ATOM 1113 CB ALA A 70 -6.357 5.363 9.286 1.00 0.00 C ATOM 0 H ALA A 70 -4.349 6.749 9.425 1.00 0.00 H new ATOM 0 HA ALA A 70 -6.140 5.796 11.365 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -7.178 4.661 9.433 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -6.760 6.351 9.062 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -5.737 5.027 8.455 1.00 0.00 H new ATOM 1119 N PHE A 71 -3.923 3.613 10.308 1.00 0.00 N ATOM 1120 CA PHE A 71 -3.365 2.288 10.568 1.00 0.00 C ATOM 1121 C PHE A 71 -2.664 2.216 11.919 1.00 0.00 C ATOM 1122 O PHE A 71 -2.567 1.148 12.507 1.00 0.00 O ATOM 1123 CB PHE A 71 -2.413 1.854 9.447 1.00 0.00 C ATOM 1124 CG PHE A 71 -3.119 1.534 8.163 1.00 0.00 C ATOM 1125 CD1 PHE A 71 -4.393 0.987 8.184 1.00 0.00 C ATOM 1126 CD2 PHE A 71 -2.515 1.777 6.940 1.00 0.00 C ATOM 1127 CE1 PHE A 71 -5.051 0.691 7.008 1.00 0.00 C ATOM 1128 CE2 PHE A 71 -3.170 1.483 5.762 1.00 0.00 C ATOM 1129 CZ PHE A 71 -4.439 0.938 5.796 1.00 0.00 C ATOM 0 H PHE A 71 -3.408 4.160 9.618 1.00 0.00 H new ATOM 0 HA PHE A 71 -4.206 1.595 10.595 1.00 0.00 H new ATOM 0 HB2 PHE A 71 -1.688 2.648 9.267 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -1.852 0.978 9.774 1.00 0.00 H new ATOM 0 HD1 PHE A 71 -4.875 0.791 9.130 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -1.522 2.201 6.909 1.00 0.00 H new ATOM 0 HE1 PHE A 71 -6.044 0.267 7.036 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -2.691 1.679 4.814 1.00 0.00 H new ATOM 0 HZ PHE A 71 -4.952 0.705 4.874 1.00 0.00 H new ATOM 1139 N LYS A 72 -2.172 3.339 12.424 1.00 0.00 N ATOM 1140 CA LYS A 72 -1.622 3.343 13.772 1.00 0.00 C ATOM 1141 C LYS A 72 -2.742 3.565 14.782 1.00 0.00 C ATOM 1142 O LYS A 72 -2.527 3.522 15.997 1.00 0.00 O ATOM 1143 CB LYS A 72 -0.488 4.370 13.948 1.00 0.00 C ATOM 1144 CG LYS A 72 -0.872 5.831 13.758 1.00 0.00 C ATOM 1145 CD LYS A 72 0.273 6.744 14.183 1.00 0.00 C ATOM 1146 CE LYS A 72 -0.057 8.216 13.980 1.00 0.00 C ATOM 1147 NZ LYS A 72 0.302 8.696 12.616 1.00 0.00 N ATOM 0 H LYS A 72 -2.142 4.235 11.937 1.00 0.00 H new ATOM 0 HA LYS A 72 -1.169 2.368 13.951 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -0.071 4.252 14.948 1.00 0.00 H new ATOM 0 HB3 LYS A 72 0.306 4.129 13.241 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -1.122 6.014 12.713 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -1.763 6.058 14.344 1.00 0.00 H new ATOM 0 HD2 LYS A 72 0.505 6.567 15.233 1.00 0.00 H new ATOM 0 HD3 LYS A 72 1.167 6.492 13.612 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -1.122 8.373 14.149 1.00 0.00 H new ATOM 0 HE3 LYS A 72 0.475 8.811 14.723 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -0.455 9.310 12.253 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 1.191 9.233 12.660 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 0.421 7.881 11.981 1.00 0.00 H new ATOM 1161 N GLY A 73 -3.940 3.809 14.263 1.00 0.00 N ATOM 1162 CA GLY A 73 -5.116 3.893 15.102 1.00 0.00 C ATOM 1163 C GLY A 73 -5.879 2.576 15.192 1.00 0.00 C ATOM 1164 O GLY A 73 -6.756 2.427 16.043 1.00 0.00 O ATOM 0 H GLY A 73 -4.116 3.951 13.268 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -4.819 4.204 16.104 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -5.779 4.665 14.712 1.00 0.00 H new ATOM 1168 N ASN A 74 -5.556 1.616 14.326 1.00 0.00 N ATOM 1169 CA ASN A 74 -6.239 0.320 14.340 1.00 0.00 C ATOM 1170 C ASN A 74 -5.272 -0.809 13.993 1.00 0.00 C ATOM 1171 O ASN A 74 -4.065 -0.593 13.932 1.00 0.00 O ATOM 1172 CB ASN A 74 -7.429 0.305 13.363 1.00 0.00 C ATOM 1173 CG ASN A 74 -7.018 0.173 11.903 1.00 0.00 C ATOM 1174 OD1 ASN A 74 -5.965 0.646 11.486 1.00 0.00 O ATOM 1175 ND2 ASN A 74 -7.854 -0.482 11.109 1.00 0.00 N ATOM 0 H ASN A 74 -4.833 1.708 13.612 1.00 0.00 H new ATOM 0 HA ASN A 74 -6.618 0.163 15.350 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -8.090 -0.522 13.622 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -8.003 1.223 13.489 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -7.629 -0.604 10.122 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -8.722 -0.864 11.486 1.00 0.00 H new ATOM 1182 N LEU A 75 -5.821 -2.013 13.798 1.00 0.00 N ATOM 1183 CA LEU A 75 -5.061 -3.195 13.374 1.00 0.00 C ATOM 1184 C LEU A 75 -4.122 -3.696 14.472 1.00 0.00 C ATOM 1185 O LEU A 75 -4.286 -4.812 14.973 1.00 0.00 O ATOM 1186 CB LEU A 75 -4.281 -2.929 12.080 1.00 0.00 C ATOM 1187 CG LEU A 75 -3.633 -4.168 11.463 1.00 0.00 C ATOM 1188 CD1 LEU A 75 -4.690 -5.161 11.013 1.00 0.00 C ATOM 1189 CD2 LEU A 75 -2.749 -3.787 10.296 1.00 0.00 C ATOM 0 H LEU A 75 -6.815 -2.196 13.931 1.00 0.00 H new ATOM 0 HA LEU A 75 -5.791 -3.980 13.177 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -4.957 -2.486 11.348 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -3.504 -2.192 12.284 1.00 0.00 H new ATOM 0 HG LEU A 75 -3.016 -4.639 12.228 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -4.206 -6.035 10.577 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -5.289 -5.468 11.870 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -5.334 -4.694 10.268 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -2.298 -4.685 9.873 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -3.347 -3.287 9.534 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -1.963 -3.114 10.639 1.00 0.00 H new ATOM 1201 N GLU A 76 -3.142 -2.881 14.844 1.00 0.00 N ATOM 1202 CA GLU A 76 -2.223 -3.241 15.907 1.00 0.00 C ATOM 1203 C GLU A 76 -2.921 -3.085 17.254 1.00 0.00 C ATOM 1204 O GLU A 76 -2.791 -2.071 17.942 1.00 0.00 O ATOM 1205 CB GLU A 76 -0.936 -2.404 15.836 1.00 0.00 C ATOM 1206 CG GLU A 76 0.085 -2.749 16.916 1.00 0.00 C ATOM 1207 CD GLU A 76 0.300 -4.241 17.072 1.00 0.00 C ATOM 1208 OE1 GLU A 76 1.172 -4.807 16.375 1.00 0.00 O ATOM 1209 OE2 GLU A 76 -0.405 -4.857 17.901 1.00 0.00 O ATOM 0 H GLU A 76 -2.967 -1.968 14.423 1.00 0.00 H new ATOM 0 HA GLU A 76 -1.927 -4.283 15.786 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -0.477 -2.544 14.857 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -1.195 -1.349 15.919 1.00 0.00 H new ATOM 0 HG2 GLU A 76 1.036 -2.274 16.675 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -0.246 -2.334 17.868 1.00 0.00 H new ATOM 1216 N HIS A 77 -3.715 -4.091 17.579 1.00 0.00 N ATOM 1217 CA HIS A 77 -4.480 -4.115 18.810 1.00 0.00 C ATOM 1218 C HIS A 77 -4.474 -5.538 19.367 1.00 0.00 C ATOM 1219 O HIS A 77 -5.280 -5.895 20.224 1.00 0.00 O ATOM 1220 CB HIS A 77 -5.915 -3.637 18.527 1.00 0.00 C ATOM 1221 CG HIS A 77 -6.729 -3.304 19.746 1.00 0.00 C ATOM 1222 ND1 HIS A 77 -6.745 -2.051 20.317 1.00 0.00 N ATOM 1223 CD2 HIS A 77 -7.575 -4.061 20.485 1.00 0.00 C ATOM 1224 CE1 HIS A 77 -7.564 -2.052 21.353 1.00 0.00 C ATOM 1225 NE2 HIS A 77 -8.084 -3.259 21.480 1.00 0.00 N ATOM 0 H HIS A 77 -3.846 -4.916 16.993 1.00 0.00 H new ATOM 0 HA HIS A 77 -4.037 -3.447 19.549 1.00 0.00 H new ATOM 0 HB2 HIS A 77 -5.868 -2.755 17.889 1.00 0.00 H new ATOM 0 HB3 HIS A 77 -6.435 -4.411 17.963 1.00 0.00 H new ATOM 0 HD2 HIS A 77 -7.807 -5.103 20.323 1.00 0.00 H new ATOM 0 HE1 HIS A 77 -7.774 -1.206 21.991 1.00 0.00 H new ATOM 0 HE2 HIS A 77 -8.751 -3.548 22.196 1.00 0.00 H new ATOM 1234 N HIS A 78 -3.521 -6.345 18.897 1.00 0.00 N ATOM 1235 CA HIS A 78 -3.444 -7.751 19.297 1.00 0.00 C ATOM 1236 C HIS A 78 -2.791 -7.891 20.671 1.00 0.00 C ATOM 1237 O HIS A 78 -2.286 -8.955 21.028 1.00 0.00 O ATOM 1238 CB HIS A 78 -2.697 -8.599 18.251 1.00 0.00 C ATOM 1239 CG HIS A 78 -1.258 -8.222 18.032 1.00 0.00 C ATOM 1240 ND1 HIS A 78 -0.276 -8.392 18.984 1.00 0.00 N ATOM 1241 CD2 HIS A 78 -0.643 -7.680 16.956 1.00 0.00 C ATOM 1242 CE1 HIS A 78 0.877 -7.968 18.502 1.00 0.00 C ATOM 1243 NE2 HIS A 78 0.686 -7.529 17.272 1.00 0.00 N ATOM 0 H HIS A 78 -2.796 -6.051 18.243 1.00 0.00 H new ATOM 0 HA HIS A 78 -4.465 -8.129 19.360 1.00 0.00 H new ATOM 0 HB2 HIS A 78 -2.740 -9.644 18.556 1.00 0.00 H new ATOM 0 HB3 HIS A 78 -3.225 -8.523 17.300 1.00 0.00 H new ATOM 0 HD1 HIS A 78 -0.418 -8.784 19.915 1.00 0.00 H new ATOM 0 HD2 HIS A 78 -1.111 -7.414 16.020 1.00 0.00 H new ATOM 0 HE1 HIS A 78 1.821 -7.978 19.027 1.00 0.00 H new ATOM 1252 N HIS A 79 -2.800 -6.799 21.427 1.00 0.00 N ATOM 1253 CA HIS A 79 -2.348 -6.801 22.810 1.00 0.00 C ATOM 1254 C HIS A 79 -3.268 -7.689 23.638 1.00 0.00 C ATOM 1255 O HIS A 79 -2.878 -8.218 24.676 1.00 0.00 O ATOM 1256 CB HIS A 79 -2.356 -5.370 23.361 1.00 0.00 C ATOM 1257 CG HIS A 79 -1.618 -5.199 24.652 1.00 0.00 C ATOM 1258 ND1 HIS A 79 -0.281 -4.882 24.709 1.00 0.00 N ATOM 1259 CD2 HIS A 79 -2.043 -5.267 25.938 1.00 0.00 C ATOM 1260 CE1 HIS A 79 0.087 -4.760 25.970 1.00 0.00 C ATOM 1261 NE2 HIS A 79 -0.962 -4.985 26.734 1.00 0.00 N ATOM 0 H HIS A 79 -3.121 -5.889 21.097 1.00 0.00 H new ATOM 0 HA HIS A 79 -1.331 -7.190 22.863 1.00 0.00 H new ATOM 0 HB2 HIS A 79 -1.919 -4.705 22.616 1.00 0.00 H new ATOM 0 HB3 HIS A 79 -3.390 -5.054 23.503 1.00 0.00 H new ATOM 0 HD2 HIS A 79 -3.043 -5.499 26.272 1.00 0.00 H new ATOM 0 HE1 HIS A 79 1.080 -4.517 26.317 1.00 0.00 H new ATOM 0 HE2 HIS A 79 -0.969 -4.954 27.754 1.00 0.00 H new ATOM 1270 N HIS A 80 -4.500 -7.832 23.163 1.00 0.00 N ATOM 1271 CA HIS A 80 -5.461 -8.735 23.775 1.00 0.00 C ATOM 1272 C HIS A 80 -5.616 -9.974 22.911 1.00 0.00 C ATOM 1273 O HIS A 80 -6.369 -9.966 21.937 1.00 0.00 O ATOM 1274 CB HIS A 80 -6.831 -8.065 23.935 1.00 0.00 C ATOM 1275 CG HIS A 80 -6.872 -6.963 24.942 1.00 0.00 C ATOM 1276 ND1 HIS A 80 -7.712 -6.979 26.028 1.00 0.00 N ATOM 1277 CD2 HIS A 80 -6.197 -5.794 25.008 1.00 0.00 C ATOM 1278 CE1 HIS A 80 -7.554 -5.870 26.721 1.00 0.00 C ATOM 1279 NE2 HIS A 80 -6.638 -5.131 26.125 1.00 0.00 N ATOM 0 H HIS A 80 -4.856 -7.329 22.350 1.00 0.00 H new ATOM 0 HA HIS A 80 -5.088 -9.005 24.763 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -7.141 -7.668 22.969 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -7.561 -8.824 24.217 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -5.449 -5.446 24.311 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -8.085 -5.610 27.625 1.00 0.00 H new ATOM 0 HE2 HIS A 80 -6.312 -4.218 26.442 1.00 0.00 H new ATOM 1288 N HIS A 81 -4.891 -11.026 23.245 1.00 0.00 N ATOM 1289 CA HIS A 81 -5.000 -12.266 22.498 1.00 0.00 C ATOM 1290 C HIS A 81 -6.135 -13.099 23.068 1.00 0.00 C ATOM 1291 O HIS A 81 -6.133 -13.440 24.246 1.00 0.00 O ATOM 1292 CB HIS A 81 -3.688 -13.059 22.524 1.00 0.00 C ATOM 1293 CG HIS A 81 -3.734 -14.308 21.689 1.00 0.00 C ATOM 1294 ND1 HIS A 81 -3.222 -14.385 20.413 1.00 0.00 N ATOM 1295 CD2 HIS A 81 -4.256 -15.530 21.953 1.00 0.00 C ATOM 1296 CE1 HIS A 81 -3.430 -15.597 19.929 1.00 0.00 C ATOM 1297 NE2 HIS A 81 -4.055 -16.311 20.844 1.00 0.00 N ATOM 0 H HIS A 81 -4.228 -11.048 24.019 1.00 0.00 H new ATOM 0 HA HIS A 81 -5.211 -12.023 21.457 1.00 0.00 H new ATOM 0 HB2 HIS A 81 -2.879 -12.421 22.168 1.00 0.00 H new ATOM 0 HB3 HIS A 81 -3.453 -13.327 23.554 1.00 0.00 H new ATOM 0 HD2 HIS A 81 -4.741 -15.833 22.869 1.00 0.00 H new ATOM 0 HE1 HIS A 81 -3.137 -15.944 18.949 1.00 0.00 H new ATOM 0 HE2 HIS A 81 -4.342 -17.285 20.744 1.00 0.00 H new ATOM 1306 N HIS A 82 -7.096 -13.415 22.227 1.00 0.00 N ATOM 1307 CA HIS A 82 -8.277 -14.141 22.659 1.00 0.00 C ATOM 1308 C HIS A 82 -8.082 -15.629 22.429 1.00 0.00 C ATOM 1309 O HIS A 82 -7.898 -16.362 23.418 1.00 0.00 O ATOM 1310 CB HIS A 82 -9.520 -13.650 21.915 1.00 0.00 C ATOM 1311 CG HIS A 82 -9.756 -12.173 22.039 1.00 0.00 C ATOM 1312 ND1 HIS A 82 -10.675 -11.625 22.905 1.00 0.00 N ATOM 1313 CD2 HIS A 82 -9.177 -11.131 21.398 1.00 0.00 C ATOM 1314 CE1 HIS A 82 -10.650 -10.310 22.792 1.00 0.00 C ATOM 1315 NE2 HIS A 82 -9.750 -9.984 21.886 1.00 0.00 N ATOM 1316 OXT HIS A 82 -8.080 -16.050 21.256 1.00 0.00 O ATOM 0 H HIS A 82 -7.085 -13.180 21.234 1.00 0.00 H new ATOM 0 HA HIS A 82 -8.424 -13.960 23.724 1.00 0.00 H new ATOM 0 HB2 HIS A 82 -9.425 -13.906 20.860 1.00 0.00 H new ATOM 0 HB3 HIS A 82 -10.393 -14.181 22.295 1.00 0.00 H new ATOM 0 HD2 HIS A 82 -8.407 -11.191 20.643 1.00 0.00 H new ATOM 0 HE1 HIS A 82 -11.264 -9.617 23.349 1.00 0.00 H new ATOM 0 HE2 HIS A 82 -9.518 -9.034 21.595 1.00 0.00 H new TER 1325 HIS A 82 ATOM 1326 N MET B 1 -2.340 -27.205 -15.203 1.00 0.00 N ATOM 1327 CA MET B 1 -3.351 -27.990 -14.456 1.00 0.00 C ATOM 1328 C MET B 1 -3.835 -27.228 -13.224 1.00 0.00 C ATOM 1329 O MET B 1 -5.013 -27.289 -12.876 1.00 0.00 O ATOM 1330 CB MET B 1 -2.781 -29.346 -14.031 1.00 0.00 C ATOM 1331 CG MET B 1 -3.808 -30.264 -13.394 1.00 0.00 C ATOM 1332 SD MET B 1 -5.189 -30.625 -14.495 1.00 0.00 S ATOM 1333 CE MET B 1 -6.218 -31.629 -13.425 1.00 0.00 C ATOM 0 H1 MET B 1 -2.127 -27.680 -16.103 1.00 0.00 H new ATOM 0 H2 MET B 1 -2.712 -26.253 -15.394 1.00 0.00 H new ATOM 0 H3 MET B 1 -1.471 -27.131 -14.637 1.00 0.00 H new ATOM 0 HA MET B 1 -4.198 -28.154 -15.122 1.00 0.00 H new ATOM 0 HB2 MET B 1 -2.355 -29.841 -14.904 1.00 0.00 H new ATOM 0 HB3 MET B 1 -1.965 -29.183 -13.327 1.00 0.00 H new ATOM 0 HG2 MET B 1 -3.326 -31.197 -13.104 1.00 0.00 H new ATOM 0 HG3 MET B 1 -4.186 -29.803 -12.481 1.00 0.00 H new ATOM 0 HE1 MET B 1 -7.116 -31.932 -13.964 1.00 0.00 H new ATOM 0 HE2 MET B 1 -5.664 -32.515 -13.114 1.00 0.00 H new ATOM 0 HE3 MET B 1 -6.501 -31.051 -12.545 1.00 0.00 H new ATOM 1345 N LYS B 2 -2.928 -26.519 -12.556 1.00 0.00 N ATOM 1346 CA LYS B 2 -3.305 -25.736 -11.388 1.00 0.00 C ATOM 1347 C LYS B 2 -4.111 -24.516 -11.818 1.00 0.00 C ATOM 1348 O LYS B 2 -3.620 -23.663 -12.557 1.00 0.00 O ATOM 1349 CB LYS B 2 -2.068 -25.304 -10.596 1.00 0.00 C ATOM 1350 CG LYS B 2 -1.268 -26.464 -10.022 1.00 0.00 C ATOM 1351 CD LYS B 2 -0.155 -25.971 -9.113 1.00 0.00 C ATOM 1352 CE LYS B 2 0.697 -27.116 -8.588 1.00 0.00 C ATOM 1353 NZ LYS B 2 1.519 -27.741 -9.656 1.00 0.00 N ATOM 0 H LYS B 2 -1.939 -26.472 -12.802 1.00 0.00 H new ATOM 0 HA LYS B 2 -3.921 -26.359 -10.739 1.00 0.00 H new ATOM 0 HB2 LYS B 2 -1.420 -24.715 -11.245 1.00 0.00 H new ATOM 0 HB3 LYS B 2 -2.380 -24.652 -9.780 1.00 0.00 H new ATOM 0 HG2 LYS B 2 -1.931 -27.124 -9.463 1.00 0.00 H new ATOM 0 HG3 LYS B 2 -0.843 -27.053 -10.835 1.00 0.00 H new ATOM 0 HD2 LYS B 2 0.476 -25.270 -9.659 1.00 0.00 H new ATOM 0 HD3 LYS B 2 -0.586 -25.425 -8.274 1.00 0.00 H new ATOM 0 HE2 LYS B 2 1.351 -26.747 -7.798 1.00 0.00 H new ATOM 0 HE3 LYS B 2 0.051 -27.871 -8.140 1.00 0.00 H new ATOM 0 HZ1 LYS B 2 2.192 -28.410 -9.230 1.00 0.00 H new ATOM 0 HZ2 LYS B 2 0.899 -28.249 -10.319 1.00 0.00 H new ATOM 0 HZ3 LYS B 2 2.042 -27.003 -10.168 1.00 0.00 H new ATOM 1367 N LYS B 3 -5.354 -24.454 -11.369 1.00 0.00 N ATOM 1368 CA LYS B 3 -6.252 -23.377 -11.755 1.00 0.00 C ATOM 1369 C LYS B 3 -6.241 -22.278 -10.703 1.00 0.00 C ATOM 1370 O LYS B 3 -6.062 -22.546 -9.515 1.00 0.00 O ATOM 1371 CB LYS B 3 -7.676 -23.906 -11.945 1.00 0.00 C ATOM 1372 CG LYS B 3 -7.771 -25.066 -12.925 1.00 0.00 C ATOM 1373 CD LYS B 3 -9.213 -25.486 -13.156 1.00 0.00 C ATOM 1374 CE LYS B 3 -9.299 -26.693 -14.076 1.00 0.00 C ATOM 1375 NZ LYS B 3 -10.702 -27.000 -14.460 1.00 0.00 N ATOM 0 H LYS B 3 -5.765 -25.139 -10.735 1.00 0.00 H new ATOM 0 HA LYS B 3 -5.905 -22.964 -12.702 1.00 0.00 H new ATOM 0 HB2 LYS B 3 -8.068 -24.225 -10.979 1.00 0.00 H new ATOM 0 HB3 LYS B 3 -8.313 -23.093 -12.295 1.00 0.00 H new ATOM 0 HG2 LYS B 3 -7.318 -24.779 -13.874 1.00 0.00 H new ATOM 0 HG3 LYS B 3 -7.201 -25.913 -12.543 1.00 0.00 H new ATOM 0 HD2 LYS B 3 -9.683 -25.721 -12.201 1.00 0.00 H new ATOM 0 HD3 LYS B 3 -9.770 -24.656 -13.590 1.00 0.00 H new ATOM 0 HE2 LYS B 3 -8.709 -26.508 -14.974 1.00 0.00 H new ATOM 0 HE3 LYS B 3 -8.861 -27.559 -13.580 1.00 0.00 H new ATOM 0 HZ1 LYS B 3 -10.717 -27.829 -15.087 1.00 0.00 H new ATOM 0 HZ2 LYS B 3 -11.259 -27.202 -13.606 1.00 0.00 H new ATOM 0 HZ3 LYS B 3 -11.113 -26.183 -14.956 1.00 0.00 H new ATOM 1389 N MET B 4 -6.424 -21.042 -11.141 1.00 0.00 N ATOM 1390 CA MET B 4 -6.449 -19.911 -10.230 1.00 0.00 C ATOM 1391 C MET B 4 -7.858 -19.709 -9.684 1.00 0.00 C ATOM 1392 O MET B 4 -8.810 -19.533 -10.449 1.00 0.00 O ATOM 1393 CB MET B 4 -5.960 -18.641 -10.935 1.00 0.00 C ATOM 1394 CG MET B 4 -5.881 -17.422 -10.025 1.00 0.00 C ATOM 1395 SD MET B 4 -5.184 -15.977 -10.851 1.00 0.00 S ATOM 1396 CE MET B 4 -3.547 -16.578 -11.264 1.00 0.00 C ATOM 0 H MET B 4 -6.557 -20.798 -12.122 1.00 0.00 H new ATOM 0 HA MET B 4 -5.777 -20.119 -9.397 1.00 0.00 H new ATOM 0 HB2 MET B 4 -4.974 -18.830 -11.360 1.00 0.00 H new ATOM 0 HB3 MET B 4 -6.628 -18.419 -11.767 1.00 0.00 H new ATOM 0 HG2 MET B 4 -6.880 -17.180 -9.661 1.00 0.00 H new ATOM 0 HG3 MET B 4 -5.274 -17.664 -9.153 1.00 0.00 H new ATOM 0 HE1 MET B 4 -2.876 -15.732 -11.412 1.00 0.00 H new ATOM 0 HE2 MET B 4 -3.172 -17.201 -10.452 1.00 0.00 H new ATOM 0 HE3 MET B 4 -3.596 -17.167 -12.180 1.00 0.00 H new ATOM 1406 N ALA B 5 -7.986 -19.734 -8.364 1.00 0.00 N ATOM 1407 CA ALA B 5 -9.285 -19.613 -7.712 1.00 0.00 C ATOM 1408 C ALA B 5 -9.689 -18.151 -7.552 1.00 0.00 C ATOM 1409 O ALA B 5 -10.071 -17.710 -6.467 1.00 0.00 O ATOM 1410 CB ALA B 5 -9.261 -20.306 -6.363 1.00 0.00 C ATOM 0 H ALA B 5 -7.202 -19.838 -7.720 1.00 0.00 H new ATOM 0 HA ALA B 5 -10.028 -20.098 -8.346 1.00 0.00 H new ATOM 0 HB1 ALA B 5 -10.236 -20.208 -5.886 1.00 0.00 H new ATOM 0 HB2 ALA B 5 -9.028 -21.362 -6.500 1.00 0.00 H new ATOM 0 HB3 ALA B 5 -8.501 -19.846 -5.731 1.00 0.00 H new ATOM 1416 N GLU B 6 -9.607 -17.409 -8.638 1.00 0.00 N ATOM 1417 CA GLU B 6 -10.030 -16.021 -8.648 1.00 0.00 C ATOM 1418 C GLU B 6 -11.187 -15.877 -9.632 1.00 0.00 C ATOM 1419 O GLU B 6 -11.016 -16.064 -10.839 1.00 0.00 O ATOM 1420 CB GLU B 6 -8.859 -15.109 -9.036 1.00 0.00 C ATOM 1421 CG GLU B 6 -9.018 -13.658 -8.592 1.00 0.00 C ATOM 1422 CD GLU B 6 -10.168 -12.941 -9.274 1.00 0.00 C ATOM 1423 OE1 GLU B 6 -10.010 -12.540 -10.445 1.00 0.00 O ATOM 1424 OE2 GLU B 6 -11.235 -12.779 -8.645 1.00 0.00 O ATOM 0 H GLU B 6 -9.249 -17.746 -9.532 1.00 0.00 H new ATOM 0 HA GLU B 6 -10.361 -15.722 -7.653 1.00 0.00 H new ATOM 0 HB2 GLU B 6 -7.943 -15.510 -8.603 1.00 0.00 H new ATOM 0 HB3 GLU B 6 -8.738 -15.134 -10.119 1.00 0.00 H new ATOM 0 HG2 GLU B 6 -9.171 -13.631 -7.513 1.00 0.00 H new ATOM 0 HG3 GLU B 6 -8.092 -13.120 -8.796 1.00 0.00 H new ATOM 1431 N PHE B 7 -12.363 -15.567 -9.104 1.00 0.00 N ATOM 1432 CA PHE B 7 -13.574 -15.483 -9.912 1.00 0.00 C ATOM 1433 C PHE B 7 -14.402 -14.283 -9.483 1.00 0.00 C ATOM 1434 O PHE B 7 -14.630 -13.354 -10.258 1.00 0.00 O ATOM 1435 CB PHE B 7 -14.409 -16.762 -9.779 1.00 0.00 C ATOM 1436 CG PHE B 7 -13.747 -17.993 -10.334 1.00 0.00 C ATOM 1437 CD1 PHE B 7 -13.837 -18.294 -11.684 1.00 0.00 C ATOM 1438 CD2 PHE B 7 -13.040 -18.848 -9.507 1.00 0.00 C ATOM 1439 CE1 PHE B 7 -13.233 -19.426 -12.197 1.00 0.00 C ATOM 1440 CE2 PHE B 7 -12.435 -19.982 -10.013 1.00 0.00 C ATOM 1441 CZ PHE B 7 -12.532 -20.271 -11.358 1.00 0.00 C ATOM 0 H PHE B 7 -12.505 -15.368 -8.114 1.00 0.00 H new ATOM 0 HA PHE B 7 -13.281 -15.367 -10.956 1.00 0.00 H new ATOM 0 HB2 PHE B 7 -14.633 -16.928 -8.725 1.00 0.00 H new ATOM 0 HB3 PHE B 7 -15.361 -16.615 -10.288 1.00 0.00 H new ATOM 0 HD1 PHE B 7 -14.385 -17.636 -12.342 1.00 0.00 H new ATOM 0 HD2 PHE B 7 -12.960 -18.626 -8.453 1.00 0.00 H new ATOM 0 HE1 PHE B 7 -13.309 -19.650 -13.251 1.00 0.00 H new ATOM 0 HE2 PHE B 7 -11.887 -20.641 -9.356 1.00 0.00 H new ATOM 0 HZ PHE B 7 -12.060 -21.157 -11.755 1.00 0.00 H new ATOM 1451 N THR B 8 -14.841 -14.306 -8.237 1.00 0.00 N ATOM 1452 CA THR B 8 -15.612 -13.216 -7.683 1.00 0.00 C ATOM 1453 C THR B 8 -14.979 -12.746 -6.376 1.00 0.00 C ATOM 1454 O THR B 8 -14.485 -13.556 -5.586 1.00 0.00 O ATOM 1455 CB THR B 8 -17.090 -13.627 -7.461 1.00 0.00 C ATOM 1456 OG1 THR B 8 -17.851 -12.524 -6.954 1.00 0.00 O ATOM 1457 CG2 THR B 8 -17.202 -14.806 -6.501 1.00 0.00 C ATOM 0 H THR B 8 -14.673 -15.075 -7.589 1.00 0.00 H new ATOM 0 HA THR B 8 -15.606 -12.392 -8.397 1.00 0.00 H new ATOM 0 HB THR B 8 -17.492 -13.928 -8.428 1.00 0.00 H new ATOM 0 HG1 THR B 8 -18.781 -12.802 -6.822 1.00 0.00 H new ATOM 0 HG21 THR B 8 -18.252 -15.068 -6.368 1.00 0.00 H new ATOM 0 HG22 THR B 8 -16.664 -15.661 -6.910 1.00 0.00 H new ATOM 0 HG23 THR B 8 -16.771 -14.533 -5.538 1.00 0.00 H new ATOM 1465 N PHE B 9 -14.968 -11.439 -6.170 1.00 0.00 N ATOM 1466 CA PHE B 9 -14.369 -10.858 -4.982 1.00 0.00 C ATOM 1467 C PHE B 9 -15.384 -9.975 -4.272 1.00 0.00 C ATOM 1468 O PHE B 9 -16.224 -9.341 -4.915 1.00 0.00 O ATOM 1469 CB PHE B 9 -13.119 -10.045 -5.347 1.00 0.00 C ATOM 1470 CG PHE B 9 -13.400 -8.768 -6.098 1.00 0.00 C ATOM 1471 CD1 PHE B 9 -13.585 -8.776 -7.469 1.00 0.00 C ATOM 1472 CD2 PHE B 9 -13.472 -7.557 -5.426 1.00 0.00 C ATOM 1473 CE1 PHE B 9 -13.840 -7.605 -8.158 1.00 0.00 C ATOM 1474 CE2 PHE B 9 -13.728 -6.383 -6.109 1.00 0.00 C ATOM 1475 CZ PHE B 9 -13.910 -6.407 -7.476 1.00 0.00 C ATOM 0 H PHE B 9 -15.370 -10.758 -6.815 1.00 0.00 H new ATOM 0 HA PHE B 9 -14.067 -11.664 -4.313 1.00 0.00 H new ATOM 0 HB2 PHE B 9 -12.579 -9.802 -4.432 1.00 0.00 H new ATOM 0 HB3 PHE B 9 -12.459 -10.668 -5.950 1.00 0.00 H new ATOM 0 HD1 PHE B 9 -13.529 -9.710 -8.008 1.00 0.00 H new ATOM 0 HD2 PHE B 9 -13.326 -7.531 -4.356 1.00 0.00 H new ATOM 0 HE1 PHE B 9 -13.984 -7.627 -9.228 1.00 0.00 H new ATOM 0 HE2 PHE B 9 -13.785 -5.447 -5.573 1.00 0.00 H new ATOM 0 HZ PHE B 9 -14.107 -5.490 -8.012 1.00 0.00 H new ATOM 1485 N GLU B 10 -15.324 -9.940 -2.955 1.00 0.00 N ATOM 1486 CA GLU B 10 -16.240 -9.120 -2.186 1.00 0.00 C ATOM 1487 C GLU B 10 -15.481 -8.282 -1.167 1.00 0.00 C ATOM 1488 O GLU B 10 -14.475 -8.723 -0.608 1.00 0.00 O ATOM 1489 CB GLU B 10 -17.284 -9.997 -1.495 1.00 0.00 C ATOM 1490 CG GLU B 10 -18.353 -9.204 -0.772 1.00 0.00 C ATOM 1491 CD GLU B 10 -19.531 -10.055 -0.362 1.00 0.00 C ATOM 1492 OE1 GLU B 10 -20.443 -10.247 -1.192 1.00 0.00 O ATOM 1493 OE2 GLU B 10 -19.560 -10.527 0.788 1.00 0.00 O ATOM 0 H GLU B 10 -14.653 -10.468 -2.397 1.00 0.00 H new ATOM 0 HA GLU B 10 -16.755 -8.442 -2.867 1.00 0.00 H new ATOM 0 HB2 GLU B 10 -17.758 -10.638 -2.238 1.00 0.00 H new ATOM 0 HB3 GLU B 10 -16.783 -10.652 -0.782 1.00 0.00 H new ATOM 0 HG2 GLU B 10 -17.919 -8.740 0.114 1.00 0.00 H new ATOM 0 HG3 GLU B 10 -18.700 -8.397 -1.417 1.00 0.00 H new ATOM 1500 N ILE B 11 -15.957 -7.067 -0.950 1.00 0.00 N ATOM 1501 CA ILE B 11 -15.349 -6.172 0.015 1.00 0.00 C ATOM 1502 C ILE B 11 -15.796 -6.539 1.425 1.00 0.00 C ATOM 1503 O ILE B 11 -16.933 -6.268 1.825 1.00 0.00 O ATOM 1504 CB ILE B 11 -15.702 -4.698 -0.281 1.00 0.00 C ATOM 1505 CG1 ILE B 11 -15.304 -4.340 -1.719 1.00 0.00 C ATOM 1506 CG2 ILE B 11 -15.011 -3.771 0.715 1.00 0.00 C ATOM 1507 CD1 ILE B 11 -15.688 -2.932 -2.129 1.00 0.00 C ATOM 0 H ILE B 11 -16.767 -6.678 -1.433 1.00 0.00 H new ATOM 0 HA ILE B 11 -14.267 -6.283 -0.063 1.00 0.00 H new ATOM 0 HB ILE B 11 -16.779 -4.568 -0.175 1.00 0.00 H new ATOM 0 HG12 ILE B 11 -14.226 -4.458 -1.828 1.00 0.00 H new ATOM 0 HG13 ILE B 11 -15.773 -5.048 -2.403 1.00 0.00 H new ATOM 0 HG21 ILE B 11 -15.272 -2.737 0.491 1.00 0.00 H new ATOM 0 HG22 ILE B 11 -15.336 -4.016 1.726 1.00 0.00 H new ATOM 0 HG23 ILE B 11 -13.931 -3.897 0.641 1.00 0.00 H new ATOM 0 HD11 ILE B 11 -15.374 -2.754 -3.157 1.00 0.00 H new ATOM 0 HD12 ILE B 11 -16.769 -2.813 -2.054 1.00 0.00 H new ATOM 0 HD13 ILE B 11 -15.198 -2.215 -1.471 1.00 0.00 H new ATOM 1519 N GLU B 12 -14.905 -7.183 2.162 1.00 0.00 N ATOM 1520 CA GLU B 12 -15.177 -7.587 3.532 1.00 0.00 C ATOM 1521 C GLU B 12 -15.192 -6.377 4.449 1.00 0.00 C ATOM 1522 O GLU B 12 -16.065 -6.238 5.309 1.00 0.00 O ATOM 1523 CB GLU B 12 -14.107 -8.563 4.014 1.00 0.00 C ATOM 1524 CG GLU B 12 -14.119 -9.898 3.298 1.00 0.00 C ATOM 1525 CD GLU B 12 -15.291 -10.764 3.699 1.00 0.00 C ATOM 1526 OE1 GLU B 12 -15.500 -10.955 4.918 1.00 0.00 O ATOM 1527 OE2 GLU B 12 -15.989 -11.281 2.805 1.00 0.00 O ATOM 0 H GLU B 12 -13.976 -7.440 1.829 1.00 0.00 H new ATOM 0 HA GLU B 12 -16.153 -8.071 3.557 1.00 0.00 H new ATOM 0 HB2 GLU B 12 -13.127 -8.103 3.886 1.00 0.00 H new ATOM 0 HB3 GLU B 12 -14.242 -8.735 5.082 1.00 0.00 H new ATOM 0 HG2 GLU B 12 -14.149 -9.728 2.222 1.00 0.00 H new ATOM 0 HG3 GLU B 12 -13.191 -10.428 3.511 1.00 0.00 H new ATOM 1534 N GLU B 13 -14.220 -5.501 4.254 1.00 0.00 N ATOM 1535 CA GLU B 13 -14.032 -4.371 5.142 1.00 0.00 C ATOM 1536 C GLU B 13 -13.501 -3.172 4.371 1.00 0.00 C ATOM 1537 O GLU B 13 -12.386 -3.210 3.847 1.00 0.00 O ATOM 1538 CB GLU B 13 -13.033 -4.746 6.237 1.00 0.00 C ATOM 1539 CG GLU B 13 -13.102 -3.863 7.469 1.00 0.00 C ATOM 1540 CD GLU B 13 -14.316 -4.165 8.319 1.00 0.00 C ATOM 1541 OE1 GLU B 13 -14.338 -5.240 8.953 1.00 0.00 O ATOM 1542 OE2 GLU B 13 -15.251 -3.340 8.347 1.00 0.00 O ATOM 0 H GLU B 13 -13.549 -5.553 3.487 1.00 0.00 H new ATOM 0 HA GLU B 13 -14.993 -4.110 5.586 1.00 0.00 H new ATOM 0 HB2 GLU B 13 -13.208 -5.780 6.534 1.00 0.00 H new ATOM 0 HB3 GLU B 13 -12.025 -4.699 5.825 1.00 0.00 H new ATOM 0 HG2 GLU B 13 -12.200 -4.001 8.065 1.00 0.00 H new ATOM 0 HG3 GLU B 13 -13.125 -2.817 7.164 1.00 0.00 H new ATOM 1549 N HIS B 14 -14.300 -2.123 4.289 1.00 0.00 N ATOM 1550 CA HIS B 14 -13.847 -0.866 3.721 1.00 0.00 C ATOM 1551 C HIS B 14 -12.906 -0.198 4.716 1.00 0.00 C ATOM 1552 O HIS B 14 -13.348 0.406 5.691 1.00 0.00 O ATOM 1553 CB HIS B 14 -15.044 0.044 3.402 1.00 0.00 C ATOM 1554 CG HIS B 14 -14.693 1.299 2.655 1.00 0.00 C ATOM 1555 ND1 HIS B 14 -15.061 1.527 1.343 1.00 0.00 N ATOM 1556 CD2 HIS B 14 -14.010 2.405 3.044 1.00 0.00 C ATOM 1557 CE1 HIS B 14 -14.618 2.710 0.961 1.00 0.00 C ATOM 1558 NE2 HIS B 14 -13.979 3.262 1.974 1.00 0.00 N ATOM 0 H HIS B 14 -15.268 -2.117 4.610 1.00 0.00 H new ATOM 0 HA HIS B 14 -13.318 -1.050 2.786 1.00 0.00 H new ATOM 0 HB2 HIS B 14 -15.768 -0.522 2.816 1.00 0.00 H new ATOM 0 HB3 HIS B 14 -15.535 0.318 4.336 1.00 0.00 H new ATOM 0 HD2 HIS B 14 -13.572 2.578 4.016 1.00 0.00 H new ATOM 0 HE1 HIS B 14 -14.755 3.151 -0.015 1.00 0.00 H new ATOM 0 HE2 HIS B 14 -13.533 4.179 1.963 1.00 0.00 H new ATOM 1567 N LEU B 15 -11.609 -0.334 4.480 1.00 0.00 N ATOM 1568 CA LEU B 15 -10.612 0.160 5.416 1.00 0.00 C ATOM 1569 C LEU B 15 -10.486 1.678 5.347 1.00 0.00 C ATOM 1570 O LEU B 15 -10.779 2.368 6.318 1.00 0.00 O ATOM 1571 CB LEU B 15 -9.252 -0.496 5.156 1.00 0.00 C ATOM 1572 CG LEU B 15 -9.188 -2.002 5.430 1.00 0.00 C ATOM 1573 CD1 LEU B 15 -7.838 -2.562 5.012 1.00 0.00 C ATOM 1574 CD2 LEU B 15 -9.443 -2.291 6.903 1.00 0.00 C ATOM 0 H LEU B 15 -11.224 -0.782 3.649 1.00 0.00 H new ATOM 0 HA LEU B 15 -10.945 -0.106 6.419 1.00 0.00 H new ATOM 0 HB2 LEU B 15 -8.975 -0.321 4.116 1.00 0.00 H new ATOM 0 HB3 LEU B 15 -8.504 0.001 5.773 1.00 0.00 H new ATOM 0 HG LEU B 15 -9.966 -2.489 4.842 1.00 0.00 H new ATOM 0 HD11 LEU B 15 -7.810 -3.633 5.214 1.00 0.00 H new ATOM 0 HD12 LEU B 15 -7.687 -2.389 3.946 1.00 0.00 H new ATOM 0 HD13 LEU B 15 -7.048 -2.066 5.576 1.00 0.00 H new ATOM 0 HD21 LEU B 15 -9.393 -3.366 7.077 1.00 0.00 H new ATOM 0 HD22 LEU B 15 -8.687 -1.790 7.508 1.00 0.00 H new ATOM 0 HD23 LEU B 15 -10.431 -1.924 7.180 1.00 0.00 H new ATOM 1586 N LEU B 16 -10.067 2.198 4.199 1.00 0.00 N ATOM 1587 CA LEU B 16 -9.798 3.624 4.070 1.00 0.00 C ATOM 1588 C LEU B 16 -10.185 4.160 2.699 1.00 0.00 C ATOM 1589 O LEU B 16 -10.052 3.470 1.689 1.00 0.00 O ATOM 1590 CB LEU B 16 -8.310 3.909 4.309 1.00 0.00 C ATOM 1591 CG LEU B 16 -7.826 3.722 5.745 1.00 0.00 C ATOM 1592 CD1 LEU B 16 -6.337 3.995 5.839 1.00 0.00 C ATOM 1593 CD2 LEU B 16 -8.594 4.641 6.674 1.00 0.00 C ATOM 0 H LEU B 16 -9.907 1.657 3.349 1.00 0.00 H new ATOM 0 HA LEU B 16 -10.406 4.128 4.821 1.00 0.00 H new ATOM 0 HB2 LEU B 16 -7.725 3.258 3.659 1.00 0.00 H new ATOM 0 HB3 LEU B 16 -8.101 4.935 4.005 1.00 0.00 H new ATOM 0 HG LEU B 16 -8.005 2.690 6.047 1.00 0.00 H new ATOM 0 HD11 LEU B 16 -6.006 3.858 6.868 1.00 0.00 H new ATOM 0 HD12 LEU B 16 -5.799 3.304 5.190 1.00 0.00 H new ATOM 0 HD13 LEU B 16 -6.134 5.019 5.526 1.00 0.00 H new ATOM 0 HD21 LEU B 16 -8.243 4.501 7.696 1.00 0.00 H new ATOM 0 HD22 LEU B 16 -8.435 5.677 6.374 1.00 0.00 H new ATOM 0 HD23 LEU B 16 -9.657 4.407 6.621 1.00 0.00 H new ATOM 1605 N THR B 17 -10.684 5.382 2.684 1.00 0.00 N ATOM 1606 CA THR B 17 -10.835 6.142 1.459 1.00 0.00 C ATOM 1607 C THR B 17 -9.763 7.226 1.439 1.00 0.00 C ATOM 1608 O THR B 17 -9.875 8.232 2.145 1.00 0.00 O ATOM 1609 CB THR B 17 -12.229 6.786 1.365 1.00 0.00 C ATOM 1610 OG1 THR B 17 -13.239 5.806 1.655 1.00 0.00 O ATOM 1611 CG2 THR B 17 -12.467 7.371 -0.018 1.00 0.00 C ATOM 0 H THR B 17 -10.996 5.875 3.521 1.00 0.00 H new ATOM 0 HA THR B 17 -10.726 5.472 0.606 1.00 0.00 H new ATOM 0 HB THR B 17 -12.282 7.594 2.095 1.00 0.00 H new ATOM 0 HG1 THR B 17 -13.313 5.690 2.625 1.00 0.00 H new ATOM 0 HG21 THR B 17 -13.459 7.820 -0.057 1.00 0.00 H new ATOM 0 HG22 THR B 17 -11.716 8.133 -0.225 1.00 0.00 H new ATOM 0 HG23 THR B 17 -12.397 6.580 -0.765 1.00 0.00 H new ATOM 1619 N LEU B 18 -8.709 7.008 0.666 1.00 0.00 N ATOM 1620 CA LEU B 18 -7.533 7.861 0.749 1.00 0.00 C ATOM 1621 C LEU B 18 -7.695 9.150 -0.039 1.00 0.00 C ATOM 1622 O LEU B 18 -7.595 10.238 0.524 1.00 0.00 O ATOM 1623 CB LEU B 18 -6.281 7.119 0.275 1.00 0.00 C ATOM 1624 CG LEU B 18 -5.856 5.929 1.136 1.00 0.00 C ATOM 1625 CD1 LEU B 18 -4.563 5.333 0.607 1.00 0.00 C ATOM 1626 CD2 LEU B 18 -5.695 6.346 2.592 1.00 0.00 C ATOM 0 H LEU B 18 -8.644 6.255 -0.019 1.00 0.00 H new ATOM 0 HA LEU B 18 -7.418 8.125 1.800 1.00 0.00 H new ATOM 0 HB2 LEU B 18 -6.452 6.767 -0.742 1.00 0.00 H new ATOM 0 HB3 LEU B 18 -5.454 7.828 0.232 1.00 0.00 H new ATOM 0 HG LEU B 18 -6.637 5.170 1.085 1.00 0.00 H new ATOM 0 HD11 LEU B 18 -4.271 4.487 1.229 1.00 0.00 H new ATOM 0 HD12 LEU B 18 -4.711 4.996 -0.419 1.00 0.00 H new ATOM 0 HD13 LEU B 18 -3.778 6.088 0.631 1.00 0.00 H new ATOM 0 HD21 LEU B 18 -5.392 5.484 3.186 1.00 0.00 H new ATOM 0 HD22 LEU B 18 -4.934 7.123 2.666 1.00 0.00 H new ATOM 0 HD23 LEU B 18 -6.643 6.730 2.967 1.00 0.00 H new ATOM 1638 N SER B 19 -7.945 9.042 -1.333 1.00 0.00 N ATOM 1639 CA SER B 19 -7.882 10.222 -2.181 1.00 0.00 C ATOM 1640 C SER B 19 -8.682 10.074 -3.460 1.00 0.00 C ATOM 1641 O SER B 19 -9.059 8.972 -3.845 1.00 0.00 O ATOM 1642 CB SER B 19 -6.428 10.474 -2.558 1.00 0.00 C ATOM 1643 OG SER B 19 -5.902 9.344 -3.247 1.00 0.00 O ATOM 0 H SER B 19 -8.187 8.174 -1.811 1.00 0.00 H new ATOM 0 HA SER B 19 -8.309 11.050 -1.615 1.00 0.00 H new ATOM 0 HB2 SER B 19 -6.355 11.361 -3.188 1.00 0.00 H new ATOM 0 HB3 SER B 19 -5.840 10.670 -1.662 1.00 0.00 H new ATOM 0 HG SER B 19 -5.730 9.582 -4.182 1.00 0.00 H new ATOM 1649 N GLU B 20 -8.912 11.201 -4.112 1.00 0.00 N ATOM 1650 CA GLU B 20 -9.360 11.218 -5.488 1.00 0.00 C ATOM 1651 C GLU B 20 -8.511 12.225 -6.258 1.00 0.00 C ATOM 1652 O GLU B 20 -8.310 13.357 -5.817 1.00 0.00 O ATOM 1653 CB GLU B 20 -10.856 11.548 -5.614 1.00 0.00 C ATOM 1654 CG GLU B 20 -11.222 12.980 -5.277 1.00 0.00 C ATOM 1655 CD GLU B 20 -11.240 13.256 -3.788 1.00 0.00 C ATOM 1656 OE1 GLU B 20 -12.206 12.829 -3.116 1.00 0.00 O ATOM 1657 OE2 GLU B 20 -10.297 13.902 -3.281 1.00 0.00 O ATOM 0 H GLU B 20 -8.793 12.127 -3.701 1.00 0.00 H new ATOM 0 HA GLU B 20 -9.236 10.220 -5.909 1.00 0.00 H new ATOM 0 HB2 GLU B 20 -11.176 11.337 -6.634 1.00 0.00 H new ATOM 0 HB3 GLU B 20 -11.417 10.881 -4.960 1.00 0.00 H new ATOM 0 HG2 GLU B 20 -10.511 13.653 -5.756 1.00 0.00 H new ATOM 0 HG3 GLU B 20 -12.204 13.205 -5.694 1.00 0.00 H new ATOM 1664 N ASN B 21 -7.981 11.791 -7.381 1.00 0.00 N ATOM 1665 CA ASN B 21 -7.100 12.618 -8.187 1.00 0.00 C ATOM 1666 C ASN B 21 -7.895 13.311 -9.277 1.00 0.00 C ATOM 1667 O ASN B 21 -8.595 12.653 -10.053 1.00 0.00 O ATOM 1668 CB ASN B 21 -5.987 11.757 -8.798 1.00 0.00 C ATOM 1669 CG ASN B 21 -5.007 12.565 -9.627 1.00 0.00 C ATOM 1670 OD1 ASN B 21 -5.157 12.693 -10.839 1.00 0.00 O ATOM 1671 ND2 ASN B 21 -3.995 13.111 -8.972 1.00 0.00 N ATOM 0 H ASN B 21 -8.146 10.859 -7.763 1.00 0.00 H new ATOM 0 HA ASN B 21 -6.643 13.378 -7.553 1.00 0.00 H new ATOM 0 HB2 ASN B 21 -5.447 11.249 -7.999 1.00 0.00 H new ATOM 0 HB3 ASN B 21 -6.434 10.984 -9.423 1.00 0.00 H new ATOM 0 HD21 ASN B 21 -3.301 13.664 -9.475 1.00 0.00 H new ATOM 0 HD22 ASN B 21 -3.909 12.979 -7.964 1.00 0.00 H new ATOM 1678 N GLU B 22 -7.792 14.641 -9.310 1.00 0.00 N ATOM 1679 CA GLU B 22 -8.540 15.470 -10.257 1.00 0.00 C ATOM 1680 C GLU B 22 -10.036 15.163 -10.154 1.00 0.00 C ATOM 1681 O GLU B 22 -10.763 15.225 -11.151 1.00 0.00 O ATOM 1682 CB GLU B 22 -8.044 15.238 -11.690 1.00 0.00 C ATOM 1683 CG GLU B 22 -6.534 15.365 -11.849 1.00 0.00 C ATOM 1684 CD GLU B 22 -5.994 16.679 -11.324 1.00 0.00 C ATOM 1685 OE1 GLU B 22 -6.080 17.692 -12.045 1.00 0.00 O ATOM 1686 OE2 GLU B 22 -5.468 16.708 -10.190 1.00 0.00 O ATOM 0 H GLU B 22 -7.189 15.173 -8.682 1.00 0.00 H new ATOM 0 HA GLU B 22 -8.377 16.518 -10.006 1.00 0.00 H new ATOM 0 HB2 GLU B 22 -8.351 14.244 -12.014 1.00 0.00 H new ATOM 0 HB3 GLU B 22 -8.531 15.954 -12.353 1.00 0.00 H new ATOM 0 HG2 GLU B 22 -6.048 14.543 -11.324 1.00 0.00 H new ATOM 0 HG3 GLU B 22 -6.275 15.267 -12.903 1.00 0.00 H new ATOM 1693 N LYS B 23 -10.474 14.870 -8.926 1.00 0.00 N ATOM 1694 CA LYS B 23 -11.824 14.383 -8.646 1.00 0.00 C ATOM 1695 C LYS B 23 -12.260 13.340 -9.673 1.00 0.00 C ATOM 1696 O LYS B 23 -13.067 13.614 -10.560 1.00 0.00 O ATOM 1697 CB LYS B 23 -12.843 15.525 -8.580 1.00 0.00 C ATOM 1698 CG LYS B 23 -14.206 15.068 -8.083 1.00 0.00 C ATOM 1699 CD LYS B 23 -15.229 16.187 -8.111 1.00 0.00 C ATOM 1700 CE LYS B 23 -16.580 15.707 -7.605 1.00 0.00 C ATOM 1701 NZ LYS B 23 -16.529 15.294 -6.175 1.00 0.00 N ATOM 0 H LYS B 23 -9.895 14.966 -8.092 1.00 0.00 H new ATOM 0 HA LYS B 23 -11.791 13.910 -7.665 1.00 0.00 H new ATOM 0 HB2 LYS B 23 -12.464 16.307 -7.922 1.00 0.00 H new ATOM 0 HB3 LYS B 23 -12.952 15.967 -9.570 1.00 0.00 H new ATOM 0 HG2 LYS B 23 -14.557 14.241 -8.700 1.00 0.00 H new ATOM 0 HG3 LYS B 23 -14.112 14.689 -7.065 1.00 0.00 H new ATOM 0 HD2 LYS B 23 -14.881 17.017 -7.496 1.00 0.00 H new ATOM 0 HD3 LYS B 23 -15.332 16.565 -9.128 1.00 0.00 H new ATOM 0 HE2 LYS B 23 -17.315 16.503 -7.726 1.00 0.00 H new ATOM 0 HE3 LYS B 23 -16.916 14.867 -8.213 1.00 0.00 H new ATOM 0 HZ1 LYS B 23 -17.497 15.186 -5.810 1.00 0.00 H new ATOM 0 HZ2 LYS B 23 -16.025 14.388 -6.093 1.00 0.00 H new ATOM 0 HZ3 LYS B 23 -16.030 16.019 -5.622 1.00 0.00 H new ATOM 1715 N GLY B 24 -11.694 12.154 -9.568 1.00 0.00 N ATOM 1716 CA GLY B 24 -12.044 11.094 -10.482 1.00 0.00 C ATOM 1717 C GLY B 24 -11.294 9.816 -10.188 1.00 0.00 C ATOM 1718 O GLY B 24 -11.901 8.791 -9.887 1.00 0.00 O ATOM 0 H GLY B 24 -10.997 11.905 -8.866 1.00 0.00 H new ATOM 0 HA2 GLY B 24 -13.116 10.906 -10.424 1.00 0.00 H new ATOM 0 HA3 GLY B 24 -11.831 11.412 -11.503 1.00 0.00 H new ATOM 1722 N TRP B 25 -9.972 9.879 -10.264 1.00 0.00 N ATOM 1723 CA TRP B 25 -9.145 8.708 -10.008 1.00 0.00 C ATOM 1724 C TRP B 25 -8.935 8.540 -8.516 1.00 0.00 C ATOM 1725 O TRP B 25 -8.063 9.174 -7.924 1.00 0.00 O ATOM 1726 CB TRP B 25 -7.795 8.819 -10.717 1.00 0.00 C ATOM 1727 CG TRP B 25 -7.892 8.714 -12.205 1.00 0.00 C ATOM 1728 CD1 TRP B 25 -8.191 9.716 -13.078 1.00 0.00 C ATOM 1729 CD2 TRP B 25 -7.688 7.537 -12.996 1.00 0.00 C ATOM 1730 NE1 TRP B 25 -8.181 9.238 -14.366 1.00 0.00 N ATOM 1731 CE2 TRP B 25 -7.875 7.902 -14.342 1.00 0.00 C ATOM 1732 CE3 TRP B 25 -7.360 6.211 -12.699 1.00 0.00 C ATOM 1733 CZ2 TRP B 25 -7.748 6.990 -15.386 1.00 0.00 C ATOM 1734 CZ3 TRP B 25 -7.234 5.307 -13.735 1.00 0.00 C ATOM 1735 CH2 TRP B 25 -7.427 5.699 -15.064 1.00 0.00 C ATOM 0 H TRP B 25 -9.451 10.724 -10.500 1.00 0.00 H new ATOM 0 HA TRP B 25 -9.663 7.833 -10.402 1.00 0.00 H new ATOM 0 HB2 TRP B 25 -7.335 9.772 -10.457 1.00 0.00 H new ATOM 0 HB3 TRP B 25 -7.134 8.035 -10.348 1.00 0.00 H new ATOM 0 HD1 TRP B 25 -8.405 10.737 -12.798 1.00 0.00 H new ATOM 0 HE1 TRP B 25 -8.370 9.788 -15.204 1.00 0.00 H new ATOM 0 HE3 TRP B 25 -7.208 5.899 -11.676 1.00 0.00 H new ATOM 0 HZ2 TRP B 25 -7.897 7.290 -16.413 1.00 0.00 H new ATOM 0 HZ3 TRP B 25 -6.982 4.280 -13.516 1.00 0.00 H new ATOM 0 HH2 TRP B 25 -7.321 4.968 -15.852 1.00 0.00 H new ATOM 1746 N THR B 26 -9.739 7.697 -7.911 1.00 0.00 N ATOM 1747 CA THR B 26 -9.704 7.527 -6.477 1.00 0.00 C ATOM 1748 C THR B 26 -8.661 6.494 -6.090 1.00 0.00 C ATOM 1749 O THR B 26 -8.117 5.796 -6.944 1.00 0.00 O ATOM 1750 CB THR B 26 -11.080 7.103 -5.926 1.00 0.00 C ATOM 1751 OG1 THR B 26 -11.466 5.840 -6.483 1.00 0.00 O ATOM 1752 CG2 THR B 26 -12.140 8.149 -6.243 1.00 0.00 C ATOM 0 H THR B 26 -10.427 7.117 -8.391 1.00 0.00 H new ATOM 0 HA THR B 26 -9.440 8.490 -6.040 1.00 0.00 H new ATOM 0 HB THR B 26 -10.997 7.011 -4.843 1.00 0.00 H new ATOM 0 HG1 THR B 26 -11.536 5.174 -5.767 1.00 0.00 H new ATOM 0 HG21 THR B 26 -13.101 7.826 -5.843 1.00 0.00 H new ATOM 0 HG22 THR B 26 -11.860 9.100 -5.790 1.00 0.00 H new ATOM 0 HG23 THR B 26 -12.219 8.271 -7.323 1.00 0.00 H new ATOM 1760 N LYS B 27 -8.375 6.419 -4.809 1.00 0.00 N ATOM 1761 CA LYS B 27 -7.455 5.436 -4.286 1.00 0.00 C ATOM 1762 C LYS B 27 -7.915 5.037 -2.898 1.00 0.00 C ATOM 1763 O LYS B 27 -7.906 5.853 -1.970 1.00 0.00 O ATOM 1764 CB LYS B 27 -6.026 5.997 -4.257 1.00 0.00 C ATOM 1765 CG LYS B 27 -5.003 5.026 -3.690 1.00 0.00 C ATOM 1766 CD LYS B 27 -3.566 5.457 -3.973 1.00 0.00 C ATOM 1767 CE LYS B 27 -3.177 6.746 -3.258 1.00 0.00 C ATOM 1768 NZ LYS B 27 -3.615 7.969 -3.988 1.00 0.00 N ATOM 0 H LYS B 27 -8.773 7.037 -4.102 1.00 0.00 H new ATOM 0 HA LYS B 27 -7.444 4.556 -4.930 1.00 0.00 H new ATOM 0 HB2 LYS B 27 -5.732 6.272 -5.270 1.00 0.00 H new ATOM 0 HB3 LYS B 27 -6.015 6.911 -3.663 1.00 0.00 H new ATOM 0 HG2 LYS B 27 -5.147 4.940 -2.613 1.00 0.00 H new ATOM 0 HG3 LYS B 27 -5.172 4.036 -4.115 1.00 0.00 H new ATOM 0 HD2 LYS B 27 -2.887 4.660 -3.668 1.00 0.00 H new ATOM 0 HD3 LYS B 27 -3.438 5.591 -5.047 1.00 0.00 H new ATOM 0 HE2 LYS B 27 -3.615 6.748 -2.260 1.00 0.00 H new ATOM 0 HE3 LYS B 27 -2.095 6.773 -3.131 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 -2.924 8.731 -3.835 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 -3.682 7.761 -5.005 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 -4.546 8.270 -3.635 1.00 0.00 H new ATOM 1782 N GLU B 28 -8.326 3.786 -2.767 1.00 0.00 N ATOM 1783 CA GLU B 28 -8.926 3.307 -1.537 1.00 0.00 C ATOM 1784 C GLU B 28 -8.178 2.098 -0.996 1.00 0.00 C ATOM 1785 O GLU B 28 -7.357 1.490 -1.687 1.00 0.00 O ATOM 1786 CB GLU B 28 -10.403 2.936 -1.748 1.00 0.00 C ATOM 1787 CG GLU B 28 -11.360 4.122 -1.839 1.00 0.00 C ATOM 1788 CD GLU B 28 -11.204 4.931 -3.111 1.00 0.00 C ATOM 1789 OE1 GLU B 28 -11.525 4.402 -4.200 1.00 0.00 O ATOM 1790 OE2 GLU B 28 -10.769 6.097 -3.026 1.00 0.00 O ATOM 0 H GLU B 28 -8.254 3.083 -3.502 1.00 0.00 H new ATOM 0 HA GLU B 28 -8.863 4.119 -0.812 1.00 0.00 H new ATOM 0 HB2 GLU B 28 -10.487 2.349 -2.663 1.00 0.00 H new ATOM 0 HB3 GLU B 28 -10.721 2.294 -0.927 1.00 0.00 H new ATOM 0 HG2 GLU B 28 -12.385 3.757 -1.774 1.00 0.00 H new ATOM 0 HG3 GLU B 28 -11.199 4.775 -0.981 1.00 0.00 H new ATOM 1797 N ILE B 29 -8.473 1.767 0.249 1.00 0.00 N ATOM 1798 CA ILE B 29 -7.914 0.595 0.896 1.00 0.00 C ATOM 1799 C ILE B 29 -9.046 -0.241 1.475 1.00 0.00 C ATOM 1800 O ILE B 29 -9.946 0.296 2.126 1.00 0.00 O ATOM 1801 CB ILE B 29 -6.933 0.982 2.025 1.00 0.00 C ATOM 1802 CG1 ILE B 29 -5.802 1.862 1.481 1.00 0.00 C ATOM 1803 CG2 ILE B 29 -6.364 -0.270 2.677 1.00 0.00 C ATOM 1804 CD1 ILE B 29 -4.812 2.305 2.538 1.00 0.00 C ATOM 0 H ILE B 29 -9.108 2.304 0.840 1.00 0.00 H new ATOM 0 HA ILE B 29 -7.360 0.025 0.150 1.00 0.00 H new ATOM 0 HB ILE B 29 -7.478 1.553 2.777 1.00 0.00 H new ATOM 0 HG12 ILE B 29 -5.269 1.314 0.704 1.00 0.00 H new ATOM 0 HG13 ILE B 29 -6.235 2.744 1.009 1.00 0.00 H new ATOM 0 HG21 ILE B 29 -5.674 0.015 3.471 1.00 0.00 H new ATOM 0 HG22 ILE B 29 -7.176 -0.863 3.098 1.00 0.00 H new ATOM 0 HG23 ILE B 29 -5.833 -0.860 1.930 1.00 0.00 H new ATOM 0 HD11 ILE B 29 -4.041 2.924 2.078 1.00 0.00 H new ATOM 0 HD12 ILE B 29 -5.331 2.881 3.304 1.00 0.00 H new ATOM 0 HD13 ILE B 29 -4.350 1.429 2.994 1.00 0.00 H new ATOM 1816 N ASN B 30 -9.011 -1.542 1.242 1.00 0.00 N ATOM 1817 CA ASN B 30 -10.088 -2.417 1.695 1.00 0.00 C ATOM 1818 C ASN B 30 -9.617 -3.858 1.824 1.00 0.00 C ATOM 1819 O ASN B 30 -8.576 -4.231 1.284 1.00 0.00 O ATOM 1820 CB ASN B 30 -11.298 -2.340 0.745 1.00 0.00 C ATOM 1821 CG ASN B 30 -11.047 -2.908 -0.651 1.00 0.00 C ATOM 1822 OD1 ASN B 30 -9.850 -2.719 -1.189 1.00 0.00 O flip ATOM 1823 ND2 ASN B 30 -11.949 -3.488 -1.252 1.00 0.00 N flip ATOM 0 H ASN B 30 -8.256 -2.016 0.746 1.00 0.00 H new ATOM 0 HA ASN B 30 -10.395 -2.068 2.681 1.00 0.00 H new ATOM 0 HB2 ASN B 30 -12.133 -2.876 1.197 1.00 0.00 H new ATOM 0 HB3 ASN B 30 -11.603 -1.298 0.650 1.00 0.00 H new ATOM 0 HD21 ASN B 30 -12.858 -3.616 -0.807 1.00 0.00 H new ATOM 0 HD22 ASN B 30 -11.788 -3.841 -2.195 1.00 0.00 H new ATOM 1830 N ARG B 31 -10.371 -4.650 2.580 1.00 0.00 N ATOM 1831 CA ARG B 31 -10.109 -6.078 2.694 1.00 0.00 C ATOM 1832 C ARG B 31 -11.030 -6.838 1.753 1.00 0.00 C ATOM 1833 O ARG B 31 -12.246 -6.668 1.800 1.00 0.00 O ATOM 1834 CB ARG B 31 -10.298 -6.574 4.133 1.00 0.00 C ATOM 1835 CG ARG B 31 -9.302 -5.986 5.118 1.00 0.00 C ATOM 1836 CD ARG B 31 -9.292 -6.738 6.439 1.00 0.00 C ATOM 1837 NE ARG B 31 -10.545 -6.599 7.181 1.00 0.00 N ATOM 1838 CZ ARG B 31 -10.995 -7.511 8.044 1.00 0.00 C ATOM 1839 NH1 ARG B 31 -10.323 -8.640 8.225 1.00 0.00 N ATOM 1840 NH2 ARG B 31 -12.119 -7.303 8.720 1.00 0.00 N ATOM 0 H ARG B 31 -11.170 -4.324 3.124 1.00 0.00 H new ATOM 0 HA ARG B 31 -9.070 -6.258 2.418 1.00 0.00 H new ATOM 0 HB2 ARG B 31 -11.308 -6.330 4.462 1.00 0.00 H new ATOM 0 HB3 ARG B 31 -10.212 -7.660 4.148 1.00 0.00 H new ATOM 0 HG2 ARG B 31 -8.304 -6.009 4.681 1.00 0.00 H new ATOM 0 HG3 ARG B 31 -9.547 -4.939 5.299 1.00 0.00 H new ATOM 0 HD2 ARG B 31 -9.103 -7.795 6.249 1.00 0.00 H new ATOM 0 HD3 ARG B 31 -8.469 -6.373 7.053 1.00 0.00 H new ATOM 0 HE ARG B 31 -11.105 -5.760 7.030 1.00 0.00 H new ATOM 0 HH11 ARG B 31 -9.463 -8.810 7.704 1.00 0.00 H new ATOM 0 HH12 ARG B 31 -10.667 -9.338 8.885 1.00 0.00 H new ATOM 0 HH21 ARG B 31 -12.645 -6.440 8.581 1.00 0.00 H new ATOM 0 HH22 ARG B 31 -12.456 -8.006 9.378 1.00 0.00 H new ATOM 1854 N VAL B 32 -10.447 -7.667 0.903 1.00 0.00 N ATOM 1855 CA VAL B 32 -11.204 -8.353 -0.130 1.00 0.00 C ATOM 1856 C VAL B 32 -11.148 -9.867 0.056 1.00 0.00 C ATOM 1857 O VAL B 32 -10.087 -10.429 0.340 1.00 0.00 O ATOM 1858 CB VAL B 32 -10.667 -7.996 -1.533 1.00 0.00 C ATOM 1859 CG1 VAL B 32 -11.504 -8.649 -2.618 1.00 0.00 C ATOM 1860 CG2 VAL B 32 -10.626 -6.489 -1.728 1.00 0.00 C ATOM 0 H VAL B 32 -9.450 -7.881 0.908 1.00 0.00 H new ATOM 0 HA VAL B 32 -12.239 -8.023 -0.043 1.00 0.00 H new ATOM 0 HB VAL B 32 -9.650 -8.381 -1.609 1.00 0.00 H new ATOM 0 HG11 VAL B 32 -11.105 -8.381 -3.596 1.00 0.00 H new ATOM 0 HG12 VAL B 32 -11.475 -9.732 -2.498 1.00 0.00 H new ATOM 0 HG13 VAL B 32 -12.535 -8.303 -2.540 1.00 0.00 H new ATOM 0 HG21 VAL B 32 -10.244 -6.261 -2.723 1.00 0.00 H new ATOM 0 HG22 VAL B 32 -11.631 -6.081 -1.623 1.00 0.00 H new ATOM 0 HG23 VAL B 32 -9.973 -6.043 -0.978 1.00 0.00 H new ATOM 1870 N SER B 33 -12.296 -10.511 -0.088 1.00 0.00 N ATOM 1871 CA SER B 33 -12.379 -11.959 -0.059 1.00 0.00 C ATOM 1872 C SER B 33 -12.536 -12.497 -1.480 1.00 0.00 C ATOM 1873 O SER B 33 -13.250 -11.910 -2.295 1.00 0.00 O ATOM 1874 CB SER B 33 -13.555 -12.394 0.815 1.00 0.00 C ATOM 1875 OG SER B 33 -14.733 -11.681 0.472 1.00 0.00 O ATOM 0 H SER B 33 -13.192 -10.044 -0.228 1.00 0.00 H new ATOM 0 HA SER B 33 -11.462 -12.366 0.367 1.00 0.00 H new ATOM 0 HB2 SER B 33 -13.725 -13.464 0.696 1.00 0.00 H new ATOM 0 HB3 SER B 33 -13.315 -12.224 1.865 1.00 0.00 H new ATOM 0 HG SER B 33 -15.319 -11.622 1.255 1.00 0.00 H new ATOM 1881 N PHE B 34 -11.853 -13.592 -1.781 1.00 0.00 N ATOM 1882 CA PHE B 34 -11.904 -14.180 -3.113 1.00 0.00 C ATOM 1883 C PHE B 34 -12.621 -15.520 -3.073 1.00 0.00 C ATOM 1884 O PHE B 34 -12.071 -16.506 -2.581 1.00 0.00 O ATOM 1885 CB PHE B 34 -10.491 -14.354 -3.675 1.00 0.00 C ATOM 1886 CG PHE B 34 -9.715 -13.068 -3.752 1.00 0.00 C ATOM 1887 CD1 PHE B 34 -9.893 -12.199 -4.813 1.00 0.00 C ATOM 1888 CD2 PHE B 34 -8.807 -12.732 -2.760 1.00 0.00 C ATOM 1889 CE1 PHE B 34 -9.183 -11.015 -4.887 1.00 0.00 C ATOM 1890 CE2 PHE B 34 -8.093 -11.551 -2.827 1.00 0.00 C ATOM 1891 CZ PHE B 34 -8.281 -10.691 -3.890 1.00 0.00 C ATOM 0 H PHE B 34 -11.257 -14.092 -1.121 1.00 0.00 H new ATOM 0 HA PHE B 34 -12.458 -13.506 -3.766 1.00 0.00 H new ATOM 0 HB2 PHE B 34 -9.945 -15.062 -3.052 1.00 0.00 H new ATOM 0 HB3 PHE B 34 -10.556 -14.791 -4.672 1.00 0.00 H new ATOM 0 HD1 PHE B 34 -10.596 -12.449 -5.594 1.00 0.00 H new ATOM 0 HD2 PHE B 34 -8.656 -13.401 -1.926 1.00 0.00 H new ATOM 0 HE1 PHE B 34 -9.332 -10.345 -5.721 1.00 0.00 H new ATOM 0 HE2 PHE B 34 -7.388 -11.301 -2.048 1.00 0.00 H new ATOM 0 HZ PHE B 34 -7.725 -9.767 -3.943 1.00 0.00 H new ATOM 1901 N ASN B 35 -13.846 -15.540 -3.605 1.00 0.00 N ATOM 1902 CA ASN B 35 -14.715 -16.724 -3.583 1.00 0.00 C ATOM 1903 C ASN B 35 -15.058 -17.140 -2.154 1.00 0.00 C ATOM 1904 O ASN B 35 -16.147 -16.851 -1.658 1.00 0.00 O ATOM 1905 CB ASN B 35 -14.091 -17.907 -4.340 1.00 0.00 C ATOM 1906 CG ASN B 35 -13.987 -17.666 -5.835 1.00 0.00 C ATOM 1907 OD1 ASN B 35 -14.931 -17.913 -6.583 1.00 0.00 O ATOM 1908 ND2 ASN B 35 -12.831 -17.213 -6.289 1.00 0.00 N ATOM 0 H ASN B 35 -14.266 -14.733 -4.066 1.00 0.00 H new ATOM 0 HA ASN B 35 -15.636 -16.443 -4.093 1.00 0.00 H new ATOM 0 HB2 ASN B 35 -13.097 -18.104 -3.939 1.00 0.00 H new ATOM 0 HB3 ASN B 35 -14.689 -18.801 -4.162 1.00 0.00 H new ATOM 0 HD21 ASN B 35 -12.701 -17.058 -7.289 1.00 0.00 H new ATOM 0 HD22 ASN B 35 -12.069 -17.019 -5.640 1.00 0.00 H new ATOM 1915 N GLY B 36 -14.126 -17.813 -1.499 1.00 0.00 N ATOM 1916 CA GLY B 36 -14.339 -18.262 -0.139 1.00 0.00 C ATOM 1917 C GLY B 36 -13.047 -18.284 0.649 1.00 0.00 C ATOM 1918 O GLY B 36 -12.826 -19.165 1.480 1.00 0.00 O ATOM 0 H GLY B 36 -13.216 -18.059 -1.889 1.00 0.00 H new ATOM 0 HA2 GLY B 36 -15.055 -17.605 0.354 1.00 0.00 H new ATOM 0 HA3 GLY B 36 -14.777 -19.260 -0.149 1.00 0.00 H new ATOM 1922 N ALA B 37 -12.188 -17.316 0.374 1.00 0.00 N ATOM 1923 CA ALA B 37 -10.894 -17.223 1.032 1.00 0.00 C ATOM 1924 C ALA B 37 -10.886 -16.067 2.030 1.00 0.00 C ATOM 1925 O ALA B 37 -11.633 -15.103 1.865 1.00 0.00 O ATOM 1926 CB ALA B 37 -9.793 -17.040 -0.005 1.00 0.00 C ATOM 0 H ALA B 37 -12.366 -16.577 -0.307 1.00 0.00 H new ATOM 0 HA ALA B 37 -10.710 -18.148 1.578 1.00 0.00 H new ATOM 0 HB1 ALA B 37 -8.828 -16.971 0.497 1.00 0.00 H new ATOM 0 HB2 ALA B 37 -9.788 -17.892 -0.685 1.00 0.00 H new ATOM 0 HB3 ALA B 37 -9.974 -16.126 -0.570 1.00 0.00 H new ATOM 1932 N PRO B 38 -10.044 -16.157 3.078 1.00 0.00 N ATOM 1933 CA PRO B 38 -9.929 -15.113 4.105 1.00 0.00 C ATOM 1934 C PRO B 38 -9.610 -13.747 3.509 1.00 0.00 C ATOM 1935 O PRO B 38 -8.913 -13.644 2.496 1.00 0.00 O ATOM 1936 CB PRO B 38 -8.774 -15.590 4.994 1.00 0.00 C ATOM 1937 CG PRO B 38 -8.080 -16.647 4.204 1.00 0.00 C ATOM 1938 CD PRO B 38 -9.135 -17.276 3.345 1.00 0.00 C ATOM 0 HA PRO B 38 -10.866 -14.980 4.646 1.00 0.00 H new ATOM 0 HB2 PRO B 38 -8.097 -14.770 5.233 1.00 0.00 H new ATOM 0 HB3 PRO B 38 -9.143 -15.985 5.940 1.00 0.00 H new ATOM 0 HG2 PRO B 38 -7.284 -16.220 3.595 1.00 0.00 H new ATOM 0 HG3 PRO B 38 -7.619 -17.385 4.860 1.00 0.00 H new ATOM 0 HD2 PRO B 38 -8.717 -17.686 2.426 1.00 0.00 H new ATOM 0 HD3 PRO B 38 -9.640 -18.094 3.858 1.00 0.00 H new ATOM 1946 N ALA B 39 -10.114 -12.706 4.152 1.00 0.00 N ATOM 1947 CA ALA B 39 -9.959 -11.345 3.665 1.00 0.00 C ATOM 1948 C ALA B 39 -8.498 -10.917 3.645 1.00 0.00 C ATOM 1949 O ALA B 39 -7.827 -10.903 4.682 1.00 0.00 O ATOM 1950 CB ALA B 39 -10.773 -10.388 4.521 1.00 0.00 C ATOM 0 H ALA B 39 -10.640 -12.780 5.023 1.00 0.00 H new ATOM 0 HA ALA B 39 -10.327 -11.315 2.639 1.00 0.00 H new ATOM 0 HB1 ALA B 39 -10.650 -9.371 4.148 1.00 0.00 H new ATOM 0 HB2 ALA B 39 -11.826 -10.666 4.476 1.00 0.00 H new ATOM 0 HB3 ALA B 39 -10.428 -10.440 5.554 1.00 0.00 H new ATOM 1956 N LYS B 40 -8.008 -10.583 2.466 1.00 0.00 N ATOM 1957 CA LYS B 40 -6.679 -10.017 2.326 1.00 0.00 C ATOM 1958 C LYS B 40 -6.783 -8.526 2.035 1.00 0.00 C ATOM 1959 O LYS B 40 -7.867 -8.023 1.745 1.00 0.00 O ATOM 1960 CB LYS B 40 -5.884 -10.743 1.238 1.00 0.00 C ATOM 1961 CG LYS B 40 -5.059 -11.899 1.781 1.00 0.00 C ATOM 1962 CD LYS B 40 -4.391 -12.696 0.673 1.00 0.00 C ATOM 1963 CE LYS B 40 -3.256 -13.559 1.212 1.00 0.00 C ATOM 1964 NZ LYS B 40 -3.674 -14.399 2.370 1.00 0.00 N ATOM 0 H LYS B 40 -8.513 -10.695 1.587 1.00 0.00 H new ATOM 0 HA LYS B 40 -6.138 -10.151 3.263 1.00 0.00 H new ATOM 0 HB2 LYS B 40 -6.573 -11.119 0.481 1.00 0.00 H new ATOM 0 HB3 LYS B 40 -5.223 -10.032 0.743 1.00 0.00 H new ATOM 0 HG2 LYS B 40 -4.298 -11.513 2.459 1.00 0.00 H new ATOM 0 HG3 LYS B 40 -5.701 -12.559 2.365 1.00 0.00 H new ATOM 0 HD2 LYS B 40 -5.130 -13.330 0.183 1.00 0.00 H new ATOM 0 HD3 LYS B 40 -4.003 -12.014 -0.084 1.00 0.00 H new ATOM 0 HE2 LYS B 40 -2.885 -14.204 0.415 1.00 0.00 H new ATOM 0 HE3 LYS B 40 -2.428 -12.917 1.514 1.00 0.00 H new ATOM 0 HZ1 LYS B 40 -2.971 -15.150 2.526 1.00 0.00 H new ATOM 0 HZ2 LYS B 40 -3.743 -13.806 3.222 1.00 0.00 H new ATOM 0 HZ3 LYS B 40 -4.600 -14.828 2.171 1.00 0.00 H new ATOM 1978 N PHE B 41 -5.666 -7.825 2.113 1.00 0.00 N ATOM 1979 CA PHE B 41 -5.677 -6.376 2.027 1.00 0.00 C ATOM 1980 C PHE B 41 -5.377 -5.909 0.610 1.00 0.00 C ATOM 1981 O PHE B 41 -4.410 -6.351 -0.007 1.00 0.00 O ATOM 1982 CB PHE B 41 -4.662 -5.791 3.006 1.00 0.00 C ATOM 1983 CG PHE B 41 -4.893 -6.211 4.434 1.00 0.00 C ATOM 1984 CD1 PHE B 41 -4.332 -7.378 4.929 1.00 0.00 C ATOM 1985 CD2 PHE B 41 -5.670 -5.437 5.280 1.00 0.00 C ATOM 1986 CE1 PHE B 41 -4.541 -7.765 6.240 1.00 0.00 C ATOM 1987 CE2 PHE B 41 -5.883 -5.817 6.592 1.00 0.00 C ATOM 1988 CZ PHE B 41 -5.318 -6.984 7.072 1.00 0.00 C ATOM 0 H PHE B 41 -4.740 -8.235 2.236 1.00 0.00 H new ATOM 0 HA PHE B 41 -6.674 -6.023 2.291 1.00 0.00 H new ATOM 0 HB2 PHE B 41 -3.660 -6.096 2.704 1.00 0.00 H new ATOM 0 HB3 PHE B 41 -4.696 -4.703 2.946 1.00 0.00 H new ATOM 0 HD1 PHE B 41 -3.724 -7.993 4.282 1.00 0.00 H new ATOM 0 HD2 PHE B 41 -6.115 -4.525 4.910 1.00 0.00 H new ATOM 0 HE1 PHE B 41 -4.097 -8.677 6.612 1.00 0.00 H new ATOM 0 HE2 PHE B 41 -6.490 -5.203 7.241 1.00 0.00 H new ATOM 0 HZ PHE B 41 -5.484 -7.284 8.096 1.00 0.00 H new ATOM 1998 N ASP B 42 -6.211 -5.020 0.105 1.00 0.00 N ATOM 1999 CA ASP B 42 -6.074 -4.522 -1.257 1.00 0.00 C ATOM 2000 C ASP B 42 -5.846 -3.012 -1.270 1.00 0.00 C ATOM 2001 O ASP B 42 -6.666 -2.241 -0.759 1.00 0.00 O ATOM 2002 CB ASP B 42 -7.325 -4.880 -2.065 1.00 0.00 C ATOM 2003 CG ASP B 42 -7.360 -4.224 -3.431 1.00 0.00 C ATOM 2004 OD1 ASP B 42 -6.403 -4.405 -4.210 1.00 0.00 O ATOM 2005 OD2 ASP B 42 -8.361 -3.534 -3.734 1.00 0.00 O ATOM 0 H ASP B 42 -6.997 -4.623 0.619 1.00 0.00 H new ATOM 0 HA ASP B 42 -5.204 -4.994 -1.713 1.00 0.00 H new ATOM 0 HB2 ASP B 42 -7.374 -5.962 -2.187 1.00 0.00 H new ATOM 0 HB3 ASP B 42 -8.210 -4.582 -1.503 1.00 0.00 H new ATOM 2010 N ILE B 43 -4.710 -2.607 -1.828 1.00 0.00 N ATOM 2011 CA ILE B 43 -4.400 -1.195 -2.028 1.00 0.00 C ATOM 2012 C ILE B 43 -4.543 -0.883 -3.508 1.00 0.00 C ATOM 2013 O ILE B 43 -3.670 -1.232 -4.301 1.00 0.00 O ATOM 2014 CB ILE B 43 -2.954 -0.849 -1.599 1.00 0.00 C ATOM 2015 CG1 ILE B 43 -2.617 -1.476 -0.242 1.00 0.00 C ATOM 2016 CG2 ILE B 43 -2.758 0.661 -1.552 1.00 0.00 C ATOM 2017 CD1 ILE B 43 -3.464 -0.969 0.905 1.00 0.00 C ATOM 0 H ILE B 43 -3.982 -3.243 -2.153 1.00 0.00 H new ATOM 0 HA ILE B 43 -5.085 -0.607 -1.417 1.00 0.00 H new ATOM 0 HB ILE B 43 -2.273 -1.265 -2.342 1.00 0.00 H new ATOM 0 HG12 ILE B 43 -2.735 -2.557 -0.315 1.00 0.00 H new ATOM 0 HG13 ILE B 43 -1.568 -1.284 -0.016 1.00 0.00 H new ATOM 0 HG21 ILE B 43 -1.736 0.886 -1.248 1.00 0.00 H new ATOM 0 HG22 ILE B 43 -2.945 1.083 -2.540 1.00 0.00 H new ATOM 0 HG23 ILE B 43 -3.454 1.096 -0.834 1.00 0.00 H new ATOM 0 HD11 ILE B 43 -3.160 -1.464 1.828 1.00 0.00 H new ATOM 0 HD12 ILE B 43 -3.329 0.108 1.009 1.00 0.00 H new ATOM 0 HD13 ILE B 43 -4.514 -1.185 0.706 1.00 0.00 H new ATOM 2029 N ARG B 44 -5.627 -0.233 -3.892 1.00 0.00 N ATOM 2030 CA ARG B 44 -5.944 -0.116 -5.306 1.00 0.00 C ATOM 2031 C ARG B 44 -6.617 1.212 -5.637 1.00 0.00 C ATOM 2032 O ARG B 44 -7.378 1.757 -4.835 1.00 0.00 O ATOM 2033 CB ARG B 44 -6.827 -1.302 -5.712 1.00 0.00 C ATOM 2034 CG ARG B 44 -7.279 -1.305 -7.162 1.00 0.00 C ATOM 2035 CD ARG B 44 -7.654 -2.712 -7.610 1.00 0.00 C ATOM 2036 NE ARG B 44 -8.329 -3.464 -6.552 1.00 0.00 N ATOM 2037 CZ ARG B 44 -8.939 -4.631 -6.732 1.00 0.00 C ATOM 2038 NH1 ARG B 44 -8.957 -5.216 -7.923 1.00 0.00 N ATOM 2039 NH2 ARG B 44 -9.506 -5.235 -5.700 1.00 0.00 N ATOM 0 H ARG B 44 -6.291 0.214 -3.260 1.00 0.00 H new ATOM 0 HA ARG B 44 -5.015 -0.136 -5.876 1.00 0.00 H new ATOM 0 HB2 ARG B 44 -6.281 -2.225 -5.516 1.00 0.00 H new ATOM 0 HB3 ARG B 44 -7.710 -1.313 -5.073 1.00 0.00 H new ATOM 0 HG2 ARG B 44 -8.135 -0.640 -7.282 1.00 0.00 H new ATOM 0 HG3 ARG B 44 -6.482 -0.917 -7.797 1.00 0.00 H new ATOM 0 HD2 ARG B 44 -8.303 -2.653 -8.483 1.00 0.00 H new ATOM 0 HD3 ARG B 44 -6.755 -3.246 -7.917 1.00 0.00 H new ATOM 0 HE ARG B 44 -8.332 -3.066 -5.613 1.00 0.00 H new ATOM 0 HH11 ARG B 44 -8.498 -4.770 -8.717 1.00 0.00 H new ATOM 0 HH12 ARG B 44 -9.430 -6.112 -8.044 1.00 0.00 H new ATOM 0 HH21 ARG B 44 -9.473 -4.805 -4.776 1.00 0.00 H new ATOM 0 HH22 ARG B 44 -9.976 -6.131 -5.829 1.00 0.00 H new ATOM 2053 N ALA B 45 -6.309 1.733 -6.819 1.00 0.00 N ATOM 2054 CA ALA B 45 -6.897 2.970 -7.300 1.00 0.00 C ATOM 2055 C ALA B 45 -8.012 2.665 -8.290 1.00 0.00 C ATOM 2056 O ALA B 45 -7.955 1.663 -9.010 1.00 0.00 O ATOM 2057 CB ALA B 45 -5.831 3.844 -7.945 1.00 0.00 C ATOM 0 H ALA B 45 -5.646 1.308 -7.467 1.00 0.00 H new ATOM 0 HA ALA B 45 -7.321 3.514 -6.456 1.00 0.00 H new ATOM 0 HB1 ALA B 45 -6.285 4.769 -8.301 1.00 0.00 H new ATOM 0 HB2 ALA B 45 -5.060 4.078 -7.211 1.00 0.00 H new ATOM 0 HB3 ALA B 45 -5.384 3.312 -8.785 1.00 0.00 H new ATOM 2063 N TRP B 46 -9.015 3.523 -8.327 1.00 0.00 N ATOM 2064 CA TRP B 46 -10.170 3.308 -9.182 1.00 0.00 C ATOM 2065 C TRP B 46 -10.404 4.510 -10.090 1.00 0.00 C ATOM 2066 O TRP B 46 -10.166 5.653 -9.704 1.00 0.00 O ATOM 2067 CB TRP B 46 -11.419 3.034 -8.338 1.00 0.00 C ATOM 2068 CG TRP B 46 -11.315 1.806 -7.489 1.00 0.00 C ATOM 2069 CD1 TRP B 46 -10.977 1.749 -6.167 1.00 0.00 C ATOM 2070 CD2 TRP B 46 -11.544 0.452 -7.903 1.00 0.00 C ATOM 2071 NE1 TRP B 46 -10.983 0.446 -5.734 1.00 0.00 N ATOM 2072 CE2 TRP B 46 -11.327 -0.367 -6.780 1.00 0.00 C ATOM 2073 CE3 TRP B 46 -11.915 -0.144 -9.111 1.00 0.00 C ATOM 2074 CZ2 TRP B 46 -11.466 -1.750 -6.829 1.00 0.00 C ATOM 2075 CZ3 TRP B 46 -12.050 -1.519 -9.159 1.00 0.00 C ATOM 2076 CH2 TRP B 46 -11.828 -2.307 -8.025 1.00 0.00 C ATOM 0 H TRP B 46 -9.054 4.379 -7.773 1.00 0.00 H new ATOM 0 HA TRP B 46 -9.970 2.437 -9.807 1.00 0.00 H new ATOM 0 HB2 TRP B 46 -11.608 3.894 -7.696 1.00 0.00 H new ATOM 0 HB3 TRP B 46 -12.279 2.935 -9.000 1.00 0.00 H new ATOM 0 HD1 TRP B 46 -10.740 2.604 -5.552 1.00 0.00 H new ATOM 0 HE1 TRP B 46 -10.766 0.135 -4.787 1.00 0.00 H new ATOM 0 HE3 TRP B 46 -12.093 0.458 -9.990 1.00 0.00 H new ATOM 0 HZ2 TRP B 46 -11.295 -2.361 -5.955 1.00 0.00 H new ATOM 0 HZ3 TRP B 46 -12.332 -1.993 -10.088 1.00 0.00 H new ATOM 0 HH2 TRP B 46 -11.945 -3.378 -8.095 1.00 0.00 H new ATOM 2087 N SER B 47 -10.862 4.242 -11.298 1.00 0.00 N ATOM 2088 CA SER B 47 -11.138 5.286 -12.264 1.00 0.00 C ATOM 2089 C SER B 47 -12.578 5.779 -12.121 1.00 0.00 C ATOM 2090 O SER B 47 -13.419 5.080 -11.548 1.00 0.00 O ATOM 2091 CB SER B 47 -10.891 4.742 -13.672 1.00 0.00 C ATOM 2092 OG SER B 47 -11.570 3.511 -13.864 1.00 0.00 O ATOM 0 H SER B 47 -11.052 3.298 -11.636 1.00 0.00 H new ATOM 0 HA SER B 47 -10.475 6.133 -12.084 1.00 0.00 H new ATOM 0 HB2 SER B 47 -11.229 5.468 -14.411 1.00 0.00 H new ATOM 0 HB3 SER B 47 -9.822 4.601 -13.830 1.00 0.00 H new ATOM 0 HG SER B 47 -12.275 3.628 -14.534 1.00 0.00 H new ATOM 2098 N PRO B 48 -12.884 6.987 -12.631 1.00 0.00 N ATOM 2099 CA PRO B 48 -14.245 7.531 -12.605 1.00 0.00 C ATOM 2100 C PRO B 48 -15.208 6.632 -13.369 1.00 0.00 C ATOM 2101 O PRO B 48 -16.353 6.432 -12.970 1.00 0.00 O ATOM 2102 CB PRO B 48 -14.118 8.886 -13.307 1.00 0.00 C ATOM 2103 CG PRO B 48 -12.668 9.222 -13.252 1.00 0.00 C ATOM 2104 CD PRO B 48 -11.930 7.915 -13.259 1.00 0.00 C ATOM 0 HA PRO B 48 -14.638 7.610 -11.591 1.00 0.00 H new ATOM 0 HB2 PRO B 48 -14.470 8.830 -14.337 1.00 0.00 H new ATOM 0 HB3 PRO B 48 -14.717 9.646 -12.806 1.00 0.00 H new ATOM 0 HG2 PRO B 48 -12.379 9.836 -14.105 1.00 0.00 H new ATOM 0 HG3 PRO B 48 -12.436 9.794 -12.354 1.00 0.00 H new ATOM 0 HD2 PRO B 48 -11.672 7.604 -14.271 1.00 0.00 H new ATOM 0 HD3 PRO B 48 -10.998 7.976 -12.697 1.00 0.00 H new ATOM 2112 N ASP B 49 -14.717 6.095 -14.473 1.00 0.00 N ATOM 2113 CA ASP B 49 -15.467 5.139 -15.269 1.00 0.00 C ATOM 2114 C ASP B 49 -14.611 3.895 -15.477 1.00 0.00 C ATOM 2115 O ASP B 49 -13.412 4.002 -15.746 1.00 0.00 O ATOM 2116 CB ASP B 49 -15.861 5.761 -16.608 1.00 0.00 C ATOM 2117 CG ASP B 49 -16.641 4.809 -17.479 1.00 0.00 C ATOM 2118 OD1 ASP B 49 -16.011 4.071 -18.256 1.00 0.00 O ATOM 2119 OD2 ASP B 49 -17.887 4.802 -17.396 1.00 0.00 O ATOM 0 H ASP B 49 -13.790 6.309 -14.842 1.00 0.00 H new ATOM 0 HA ASP B 49 -16.384 4.861 -14.749 1.00 0.00 H new ATOM 0 HB2 ASP B 49 -16.457 6.655 -16.428 1.00 0.00 H new ATOM 0 HB3 ASP B 49 -14.962 6.078 -17.136 1.00 0.00 H new ATOM 2124 N HIS B 50 -15.215 2.719 -15.357 1.00 0.00 N ATOM 2125 CA HIS B 50 -14.454 1.471 -15.270 1.00 0.00 C ATOM 2126 C HIS B 50 -13.924 0.982 -16.620 1.00 0.00 C ATOM 2127 O HIS B 50 -13.265 -0.054 -16.675 1.00 0.00 O ATOM 2128 CB HIS B 50 -15.293 0.367 -14.616 1.00 0.00 C ATOM 2129 CG HIS B 50 -15.586 0.604 -13.164 1.00 0.00 C ATOM 2130 ND1 HIS B 50 -16.786 0.272 -12.571 1.00 0.00 N ATOM 2131 CD2 HIS B 50 -14.818 1.128 -12.176 1.00 0.00 C ATOM 2132 CE1 HIS B 50 -16.746 0.583 -11.291 1.00 0.00 C ATOM 2133 NE2 HIS B 50 -15.564 1.102 -11.026 1.00 0.00 N ATOM 0 H HIS B 50 -16.227 2.600 -15.317 1.00 0.00 H new ATOM 0 HA HIS B 50 -13.586 1.697 -14.650 1.00 0.00 H new ATOM 0 HB2 HIS B 50 -16.235 0.273 -15.156 1.00 0.00 H new ATOM 0 HB3 HIS B 50 -14.769 -0.583 -14.720 1.00 0.00 H new ATOM 0 HD2 HIS B 50 -13.808 1.497 -12.277 1.00 0.00 H new ATOM 0 HE1 HIS B 50 -17.546 0.437 -10.580 1.00 0.00 H new ATOM 0 HE2 HIS B 50 -15.254 1.432 -10.112 1.00 0.00 H new ATOM 2142 N THR B 51 -14.180 1.706 -17.702 1.00 0.00 N ATOM 2143 CA THR B 51 -13.648 1.302 -19.001 1.00 0.00 C ATOM 2144 C THR B 51 -12.142 1.554 -19.078 1.00 0.00 C ATOM 2145 O THR B 51 -11.420 0.857 -19.791 1.00 0.00 O ATOM 2146 CB THR B 51 -14.347 2.021 -20.172 1.00 0.00 C ATOM 2147 OG1 THR B 51 -14.293 3.441 -19.987 1.00 0.00 O ATOM 2148 CG2 THR B 51 -15.797 1.572 -20.297 1.00 0.00 C ATOM 0 H THR B 51 -14.740 2.558 -17.711 1.00 0.00 H new ATOM 0 HA THR B 51 -13.845 0.234 -19.094 1.00 0.00 H new ATOM 0 HB THR B 51 -13.822 1.759 -21.091 1.00 0.00 H new ATOM 0 HG1 THR B 51 -15.124 3.748 -19.568 1.00 0.00 H new ATOM 0 HG21 THR B 51 -16.269 2.093 -21.130 1.00 0.00 H new ATOM 0 HG22 THR B 51 -15.831 0.497 -20.475 1.00 0.00 H new ATOM 0 HG23 THR B 51 -16.330 1.804 -19.375 1.00 0.00 H new ATOM 2156 N LYS B 52 -11.668 2.547 -18.332 1.00 0.00 N ATOM 2157 CA LYS B 52 -10.243 2.846 -18.293 1.00 0.00 C ATOM 2158 C LYS B 52 -9.550 1.990 -17.238 1.00 0.00 C ATOM 2159 O LYS B 52 -8.335 1.792 -17.287 1.00 0.00 O ATOM 2160 CB LYS B 52 -10.008 4.336 -18.023 1.00 0.00 C ATOM 2161 CG LYS B 52 -10.586 5.233 -19.109 1.00 0.00 C ATOM 2162 CD LYS B 52 -10.106 6.676 -18.994 1.00 0.00 C ATOM 2163 CE LYS B 52 -10.647 7.369 -17.755 1.00 0.00 C ATOM 2164 NZ LYS B 52 -10.295 8.817 -17.735 1.00 0.00 N ATOM 0 H LYS B 52 -12.246 3.154 -17.751 1.00 0.00 H new ATOM 0 HA LYS B 52 -9.814 2.608 -19.266 1.00 0.00 H new ATOM 0 HB2 LYS B 52 -10.454 4.601 -17.064 1.00 0.00 H new ATOM 0 HB3 LYS B 52 -8.937 4.520 -17.938 1.00 0.00 H new ATOM 0 HG2 LYS B 52 -10.309 4.839 -20.087 1.00 0.00 H new ATOM 0 HG3 LYS B 52 -11.674 5.210 -19.053 1.00 0.00 H new ATOM 0 HD2 LYS B 52 -9.016 6.693 -18.970 1.00 0.00 H new ATOM 0 HD3 LYS B 52 -10.414 7.230 -19.881 1.00 0.00 H new ATOM 0 HE2 LYS B 52 -11.731 7.257 -17.720 1.00 0.00 H new ATOM 0 HE3 LYS B 52 -10.248 6.885 -16.864 1.00 0.00 H new ATOM 0 HZ1 LYS B 52 -10.681 9.256 -16.875 1.00 0.00 H new ATOM 0 HZ2 LYS B 52 -9.260 8.923 -17.743 1.00 0.00 H new ATOM 0 HZ3 LYS B 52 -10.698 9.284 -18.573 1.00 0.00 H new ATOM 2178 N MET B 53 -10.351 1.472 -16.305 1.00 0.00 N ATOM 2179 CA MET B 53 -9.871 0.595 -15.233 1.00 0.00 C ATOM 2180 C MET B 53 -8.868 1.298 -14.317 1.00 0.00 C ATOM 2181 O MET B 53 -8.597 2.490 -14.455 1.00 0.00 O ATOM 2182 CB MET B 53 -9.248 -0.683 -15.807 1.00 0.00 C ATOM 2183 CG MET B 53 -10.266 -1.652 -16.390 1.00 0.00 C ATOM 2184 SD MET B 53 -11.389 -2.319 -15.144 1.00 0.00 S ATOM 2185 CE MET B 53 -12.478 -3.311 -16.165 1.00 0.00 C ATOM 0 H MET B 53 -11.355 1.649 -16.271 1.00 0.00 H new ATOM 0 HA MET B 53 -10.741 0.329 -14.633 1.00 0.00 H new ATOM 0 HB2 MET B 53 -8.533 -0.411 -16.583 1.00 0.00 H new ATOM 0 HB3 MET B 53 -8.688 -1.188 -15.020 1.00 0.00 H new ATOM 0 HG2 MET B 53 -10.846 -1.143 -17.160 1.00 0.00 H new ATOM 0 HG3 MET B 53 -9.741 -2.474 -16.877 1.00 0.00 H new ATOM 0 HE1 MET B 53 -13.230 -3.789 -15.537 1.00 0.00 H new ATOM 0 HE2 MET B 53 -12.971 -2.673 -16.898 1.00 0.00 H new ATOM 0 HE3 MET B 53 -11.897 -4.075 -16.681 1.00 0.00 H new ATOM 2195 N GLY B 54 -8.341 0.541 -13.365 1.00 0.00 N ATOM 2196 CA GLY B 54 -7.359 1.064 -12.443 1.00 0.00 C ATOM 2197 C GLY B 54 -6.344 0.011 -12.067 1.00 0.00 C ATOM 2198 O GLY B 54 -6.443 -1.135 -12.512 1.00 0.00 O ATOM 0 H GLY B 54 -8.582 -0.439 -13.216 1.00 0.00 H new ATOM 0 HA2 GLY B 54 -6.851 1.917 -12.894 1.00 0.00 H new ATOM 0 HA3 GLY B 54 -7.858 1.428 -11.545 1.00 0.00 H new ATOM 2202 N LYS B 55 -5.368 0.383 -11.256 1.00 0.00 N ATOM 2203 CA LYS B 55 -4.332 -0.550 -10.842 1.00 0.00 C ATOM 2204 C LYS B 55 -4.199 -0.562 -9.325 1.00 0.00 C ATOM 2205 O LYS B 55 -4.532 0.416 -8.657 1.00 0.00 O ATOM 2206 CB LYS B 55 -2.989 -0.190 -11.486 1.00 0.00 C ATOM 2207 CG LYS B 55 -2.989 -0.281 -13.006 1.00 0.00 C ATOM 2208 CD LYS B 55 -1.619 0.022 -13.588 1.00 0.00 C ATOM 2209 CE LYS B 55 -1.631 -0.030 -15.108 1.00 0.00 C ATOM 2210 NZ LYS B 55 -0.275 0.193 -15.682 1.00 0.00 N ATOM 0 H LYS B 55 -5.271 1.323 -10.871 1.00 0.00 H new ATOM 0 HA LYS B 55 -4.621 -1.547 -11.176 1.00 0.00 H new ATOM 0 HB2 LYS B 55 -2.717 0.824 -11.193 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -2.219 -0.853 -11.092 1.00 0.00 H new ATOM 0 HG2 LYS B 55 -3.301 -1.280 -13.311 1.00 0.00 H new ATOM 0 HG3 LYS B 55 -3.720 0.418 -13.412 1.00 0.00 H new ATOM 0 HD2 LYS B 55 -1.294 1.009 -13.260 1.00 0.00 H new ATOM 0 HD3 LYS B 55 -0.894 -0.696 -13.205 1.00 0.00 H new ATOM 0 HE2 LYS B 55 -2.009 -0.999 -15.435 1.00 0.00 H new ATOM 0 HE3 LYS B 55 -2.316 0.726 -15.492 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 -0.326 0.150 -16.720 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 0.076 1.128 -15.391 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 0.374 -0.543 -15.336 1.00 0.00 H new ATOM 2224 N GLY B 56 -3.713 -1.672 -8.791 1.00 0.00 N ATOM 2225 CA GLY B 56 -3.535 -1.795 -7.363 1.00 0.00 C ATOM 2226 C GLY B 56 -2.685 -2.990 -7.009 1.00 0.00 C ATOM 2227 O GLY B 56 -2.256 -3.728 -7.895 1.00 0.00 O ATOM 0 H GLY B 56 -3.437 -2.495 -9.327 1.00 0.00 H new ATOM 0 HA2 GLY B 56 -3.070 -0.889 -6.975 1.00 0.00 H new ATOM 0 HA3 GLY B 56 -4.509 -1.885 -6.881 1.00 0.00 H new ATOM 2231 N ILE B 57 -2.447 -3.191 -5.725 1.00 0.00 N ATOM 2232 CA ILE B 57 -1.610 -4.287 -5.270 1.00 0.00 C ATOM 2233 C ILE B 57 -2.200 -4.938 -4.017 1.00 0.00 C ATOM 2234 O ILE B 57 -2.687 -4.254 -3.114 1.00 0.00 O ATOM 2235 CB ILE B 57 -0.162 -3.804 -4.999 1.00 0.00 C ATOM 2236 CG1 ILE B 57 0.761 -4.986 -4.684 1.00 0.00 C ATOM 2237 CG2 ILE B 57 -0.133 -2.781 -3.868 1.00 0.00 C ATOM 2238 CD1 ILE B 57 2.221 -4.599 -4.592 1.00 0.00 C ATOM 0 H ILE B 57 -2.823 -2.608 -4.977 1.00 0.00 H new ATOM 0 HA ILE B 57 -1.577 -5.034 -6.063 1.00 0.00 H new ATOM 0 HB ILE B 57 0.205 -3.321 -5.905 1.00 0.00 H new ATOM 0 HG12 ILE B 57 0.452 -5.438 -3.741 1.00 0.00 H new ATOM 0 HG13 ILE B 57 0.642 -5.746 -5.456 1.00 0.00 H new ATOM 0 HG21 ILE B 57 0.894 -2.457 -3.697 1.00 0.00 H new ATOM 0 HG22 ILE B 57 -0.744 -1.921 -4.140 1.00 0.00 H new ATOM 0 HG23 ILE B 57 -0.528 -3.233 -2.958 1.00 0.00 H new ATOM 0 HD11 ILE B 57 2.818 -5.483 -4.367 1.00 0.00 H new ATOM 0 HD12 ILE B 57 2.545 -4.174 -5.542 1.00 0.00 H new ATOM 0 HD13 ILE B 57 2.353 -3.861 -3.801 1.00 0.00 H new ATOM 2250 N THR B 58 -2.178 -6.262 -3.986 1.00 0.00 N ATOM 2251 CA THR B 58 -2.713 -7.007 -2.861 1.00 0.00 C ATOM 2252 C THR B 58 -1.611 -7.311 -1.846 1.00 0.00 C ATOM 2253 O THR B 58 -0.528 -7.777 -2.209 1.00 0.00 O ATOM 2254 CB THR B 58 -3.354 -8.322 -3.341 1.00 0.00 C ATOM 2255 OG1 THR B 58 -4.244 -8.049 -4.431 1.00 0.00 O ATOM 2256 CG2 THR B 58 -4.123 -9.002 -2.217 1.00 0.00 C ATOM 0 H THR B 58 -1.793 -6.843 -4.731 1.00 0.00 H new ATOM 0 HA THR B 58 -3.477 -6.395 -2.381 1.00 0.00 H new ATOM 0 HB THR B 58 -2.558 -8.992 -3.666 1.00 0.00 H new ATOM 0 HG1 THR B 58 -4.651 -8.886 -4.738 1.00 0.00 H new ATOM 0 HG21 THR B 58 -4.564 -9.928 -2.586 1.00 0.00 H new ATOM 0 HG22 THR B 58 -3.443 -9.227 -1.395 1.00 0.00 H new ATOM 0 HG23 THR B 58 -4.913 -8.339 -1.864 1.00 0.00 H new ATOM 2264 N LEU B 59 -1.887 -7.039 -0.580 1.00 0.00 N ATOM 2265 CA LEU B 59 -0.934 -7.284 0.489 1.00 0.00 C ATOM 2266 C LEU B 59 -1.416 -8.432 1.366 1.00 0.00 C ATOM 2267 O LEU B 59 -2.611 -8.551 1.644 1.00 0.00 O ATOM 2268 CB LEU B 59 -0.745 -6.020 1.337 1.00 0.00 C ATOM 2269 CG LEU B 59 -0.247 -4.783 0.578 1.00 0.00 C ATOM 2270 CD1 LEU B 59 -0.137 -3.593 1.514 1.00 0.00 C ATOM 2271 CD2 LEU B 59 1.091 -5.065 -0.089 1.00 0.00 C ATOM 0 H LEU B 59 -2.774 -6.644 -0.267 1.00 0.00 H new ATOM 0 HA LEU B 59 0.024 -7.554 0.045 1.00 0.00 H new ATOM 0 HB2 LEU B 59 -1.696 -5.776 1.810 1.00 0.00 H new ATOM 0 HB3 LEU B 59 -0.039 -6.243 2.137 1.00 0.00 H new ATOM 0 HG LEU B 59 -0.972 -4.543 -0.200 1.00 0.00 H new ATOM 0 HD11 LEU B 59 0.218 -2.725 0.959 1.00 0.00 H new ATOM 0 HD12 LEU B 59 -1.115 -3.375 1.942 1.00 0.00 H new ATOM 0 HD13 LEU B 59 0.566 -3.823 2.314 1.00 0.00 H new ATOM 0 HD21 LEU B 59 1.427 -4.175 -0.622 1.00 0.00 H new ATOM 0 HD22 LEU B 59 1.826 -5.333 0.670 1.00 0.00 H new ATOM 0 HD23 LEU B 59 0.980 -5.889 -0.793 1.00 0.00 H new ATOM 2283 N SER B 60 -0.491 -9.284 1.784 1.00 0.00 N ATOM 2284 CA SER B 60 -0.822 -10.401 2.649 1.00 0.00 C ATOM 2285 C SER B 60 -1.076 -9.910 4.068 1.00 0.00 C ATOM 2286 O SER B 60 -0.630 -8.825 4.445 1.00 0.00 O ATOM 2287 CB SER B 60 0.312 -11.425 2.634 1.00 0.00 C ATOM 2288 OG SER B 60 0.717 -11.705 1.306 1.00 0.00 O ATOM 0 H SER B 60 0.496 -9.220 1.536 1.00 0.00 H new ATOM 0 HA SER B 60 -1.730 -10.878 2.281 1.00 0.00 H new ATOM 0 HB2 SER B 60 1.159 -11.045 3.205 1.00 0.00 H new ATOM 0 HB3 SER B 60 -0.015 -12.344 3.121 1.00 0.00 H new ATOM 0 HG SER B 60 1.479 -11.135 1.069 1.00 0.00 H new ATOM 2294 N ASN B 61 -1.783 -10.715 4.847 1.00 0.00 N ATOM 2295 CA ASN B 61 -2.156 -10.352 6.209 1.00 0.00 C ATOM 2296 C ASN B 61 -0.912 -10.103 7.061 1.00 0.00 C ATOM 2297 O ASN B 61 -0.873 -9.186 7.885 1.00 0.00 O ATOM 2298 CB ASN B 61 -2.998 -11.472 6.827 1.00 0.00 C ATOM 2299 CG ASN B 61 -4.179 -11.868 5.955 1.00 0.00 C ATOM 2300 OD1 ASN B 61 -4.052 -12.716 5.066 1.00 0.00 O ATOM 2301 ND2 ASN B 61 -5.331 -11.265 6.202 1.00 0.00 N ATOM 0 H ASN B 61 -2.114 -11.635 4.556 1.00 0.00 H new ATOM 0 HA ASN B 61 -2.741 -9.433 6.179 1.00 0.00 H new ATOM 0 HB2 ASN B 61 -2.367 -12.345 6.995 1.00 0.00 H new ATOM 0 HB3 ASN B 61 -3.363 -11.150 7.802 1.00 0.00 H new ATOM 0 HD21 ASN B 61 -6.156 -11.495 5.649 1.00 0.00 H new ATOM 0 HD22 ASN B 61 -5.394 -10.570 6.946 1.00 0.00 H new ATOM 2308 N GLU B 62 0.103 -10.921 6.837 1.00 0.00 N ATOM 2309 CA GLU B 62 1.357 -10.833 7.568 1.00 0.00 C ATOM 2310 C GLU B 62 2.123 -9.576 7.164 1.00 0.00 C ATOM 2311 O GLU B 62 2.609 -8.822 8.011 1.00 0.00 O ATOM 2312 CB GLU B 62 2.227 -12.069 7.294 1.00 0.00 C ATOM 2313 CG GLU B 62 1.562 -13.408 7.610 1.00 0.00 C ATOM 2314 CD GLU B 62 0.434 -13.771 6.656 1.00 0.00 C ATOM 2315 OE1 GLU B 62 0.394 -13.226 5.533 1.00 0.00 O ATOM 2316 OE2 GLU B 62 -0.431 -14.588 7.036 1.00 0.00 O ATOM 0 H GLU B 62 0.081 -11.667 6.141 1.00 0.00 H new ATOM 0 HA GLU B 62 1.125 -10.786 8.632 1.00 0.00 H new ATOM 0 HB2 GLU B 62 2.519 -12.064 6.244 1.00 0.00 H new ATOM 0 HB3 GLU B 62 3.143 -11.988 7.880 1.00 0.00 H new ATOM 0 HG2 GLU B 62 2.317 -14.194 7.582 1.00 0.00 H new ATOM 0 HG3 GLU B 62 1.171 -13.378 8.627 1.00 0.00 H new ATOM 2323 N GLU B 63 2.213 -9.355 5.860 1.00 0.00 N ATOM 2324 CA GLU B 63 2.966 -8.232 5.313 1.00 0.00 C ATOM 2325 C GLU B 63 2.315 -6.900 5.673 1.00 0.00 C ATOM 2326 O GLU B 63 3.003 -5.928 5.980 1.00 0.00 O ATOM 2327 CB GLU B 63 3.084 -8.372 3.794 1.00 0.00 C ATOM 2328 CG GLU B 63 3.822 -9.629 3.360 1.00 0.00 C ATOM 2329 CD GLU B 63 3.884 -9.784 1.854 1.00 0.00 C ATOM 2330 OE1 GLU B 63 4.822 -9.253 1.232 1.00 0.00 O ATOM 2331 OE2 GLU B 63 2.990 -10.444 1.279 1.00 0.00 O ATOM 0 H GLU B 63 1.770 -9.944 5.155 1.00 0.00 H new ATOM 0 HA GLU B 63 3.963 -8.245 5.753 1.00 0.00 H new ATOM 0 HB2 GLU B 63 2.085 -8.377 3.358 1.00 0.00 H new ATOM 0 HB3 GLU B 63 3.601 -7.500 3.395 1.00 0.00 H new ATOM 0 HG2 GLU B 63 4.836 -9.606 3.760 1.00 0.00 H new ATOM 0 HG3 GLU B 63 3.329 -10.501 3.790 1.00 0.00 H new ATOM 2338 N PHE B 64 0.988 -6.868 5.649 1.00 0.00 N ATOM 2339 CA PHE B 64 0.244 -5.657 5.967 1.00 0.00 C ATOM 2340 C PHE B 64 0.482 -5.251 7.422 1.00 0.00 C ATOM 2341 O PHE B 64 0.754 -4.087 7.714 1.00 0.00 O ATOM 2342 CB PHE B 64 -1.247 -5.881 5.719 1.00 0.00 C ATOM 2343 CG PHE B 64 -2.059 -4.614 5.678 1.00 0.00 C ATOM 2344 CD1 PHE B 64 -2.163 -3.891 4.502 1.00 0.00 C ATOM 2345 CD2 PHE B 64 -2.729 -4.158 6.802 1.00 0.00 C ATOM 2346 CE1 PHE B 64 -2.918 -2.736 4.445 1.00 0.00 C ATOM 2347 CE2 PHE B 64 -3.483 -2.999 6.750 1.00 0.00 C ATOM 2348 CZ PHE B 64 -3.577 -2.289 5.570 1.00 0.00 C ATOM 0 H PHE B 64 0.404 -7.670 5.412 1.00 0.00 H new ATOM 0 HA PHE B 64 0.594 -4.851 5.322 1.00 0.00 H new ATOM 0 HB2 PHE B 64 -1.372 -6.411 4.775 1.00 0.00 H new ATOM 0 HB3 PHE B 64 -1.642 -6.528 6.502 1.00 0.00 H new ATOM 0 HD1 PHE B 64 -1.647 -4.235 3.618 1.00 0.00 H new ATOM 0 HD2 PHE B 64 -2.662 -4.712 7.727 1.00 0.00 H new ATOM 0 HE1 PHE B 64 -2.992 -2.184 3.520 1.00 0.00 H new ATOM 0 HE2 PHE B 64 -3.998 -2.650 7.633 1.00 0.00 H new ATOM 0 HZ PHE B 64 -4.166 -1.385 5.528 1.00 0.00 H new ATOM 2358 N GLN B 65 0.397 -6.223 8.327 1.00 0.00 N ATOM 2359 CA GLN B 65 0.660 -5.979 9.742 1.00 0.00 C ATOM 2360 C GLN B 65 2.080 -5.440 9.920 1.00 0.00 C ATOM 2361 O GLN B 65 2.320 -4.518 10.704 1.00 0.00 O ATOM 2362 CB GLN B 65 0.491 -7.273 10.549 1.00 0.00 C ATOM 2363 CG GLN B 65 0.559 -7.070 12.056 1.00 0.00 C ATOM 2364 CD GLN B 65 -0.707 -6.456 12.622 1.00 0.00 C ATOM 2365 OE1 GLN B 65 -1.804 -6.701 12.123 1.00 0.00 O ATOM 2366 NE2 GLN B 65 -0.568 -5.649 13.663 1.00 0.00 N ATOM 0 H GLN B 65 0.148 -7.187 8.105 1.00 0.00 H new ATOM 0 HA GLN B 65 -0.055 -5.242 10.108 1.00 0.00 H new ATOM 0 HB2 GLN B 65 -0.468 -7.726 10.296 1.00 0.00 H new ATOM 0 HB3 GLN B 65 1.266 -7.980 10.252 1.00 0.00 H new ATOM 0 HG2 GLN B 65 0.740 -8.030 12.540 1.00 0.00 H new ATOM 0 HG3 GLN B 65 1.407 -6.428 12.294 1.00 0.00 H new ATOM 0 HE21 GLN B 65 0.359 -5.470 14.049 1.00 0.00 H new ATOM 0 HE22 GLN B 65 -1.388 -5.207 14.078 1.00 0.00 H new ATOM 2375 N THR B 66 3.004 -6.018 9.165 1.00 0.00 N ATOM 2376 CA THR B 66 4.404 -5.624 9.204 1.00 0.00 C ATOM 2377 C THR B 66 4.584 -4.145 8.855 1.00 0.00 C ATOM 2378 O THR B 66 5.231 -3.398 9.597 1.00 0.00 O ATOM 2379 CB THR B 66 5.235 -6.494 8.235 1.00 0.00 C ATOM 2380 OG1 THR B 66 5.131 -7.874 8.613 1.00 0.00 O ATOM 2381 CG2 THR B 66 6.698 -6.074 8.220 1.00 0.00 C ATOM 0 H THR B 66 2.804 -6.773 8.509 1.00 0.00 H new ATOM 0 HA THR B 66 4.758 -5.777 10.223 1.00 0.00 H new ATOM 0 HB THR B 66 4.835 -6.354 7.231 1.00 0.00 H new ATOM 0 HG1 THR B 66 4.250 -8.218 8.355 1.00 0.00 H new ATOM 0 HG21 THR B 66 7.251 -6.708 7.527 1.00 0.00 H new ATOM 0 HG22 THR B 66 6.775 -5.035 7.901 1.00 0.00 H new ATOM 0 HG23 THR B 66 7.117 -6.178 9.221 1.00 0.00 H new ATOM 2389 N MET B 67 3.997 -3.720 7.740 1.00 0.00 N ATOM 2390 CA MET B 67 4.159 -2.344 7.283 1.00 0.00 C ATOM 2391 C MET B 67 3.538 -1.371 8.277 1.00 0.00 C ATOM 2392 O MET B 67 4.107 -0.320 8.556 1.00 0.00 O ATOM 2393 CB MET B 67 3.544 -2.129 5.891 1.00 0.00 C ATOM 2394 CG MET B 67 2.038 -1.919 5.907 1.00 0.00 C ATOM 2395 SD MET B 67 1.389 -1.277 4.358 1.00 0.00 S ATOM 2396 CE MET B 67 -0.229 -0.725 4.899 1.00 0.00 C ATOM 0 H MET B 67 3.411 -4.302 7.142 1.00 0.00 H new ATOM 0 HA MET B 67 5.230 -2.152 7.213 1.00 0.00 H new ATOM 0 HB2 MET B 67 4.016 -1.264 5.426 1.00 0.00 H new ATOM 0 HB3 MET B 67 3.774 -2.992 5.266 1.00 0.00 H new ATOM 0 HG2 MET B 67 1.549 -2.867 6.132 1.00 0.00 H new ATOM 0 HG3 MET B 67 1.783 -1.230 6.712 1.00 0.00 H new ATOM 0 HE1 MET B 67 -0.904 -0.683 4.044 1.00 0.00 H new ATOM 0 HE2 MET B 67 -0.623 -1.422 5.639 1.00 0.00 H new ATOM 0 HE3 MET B 67 -0.145 0.267 5.344 1.00 0.00 H new ATOM 2406 N VAL B 68 2.384 -1.742 8.822 1.00 0.00 N ATOM 2407 CA VAL B 68 1.645 -0.873 9.722 1.00 0.00 C ATOM 2408 C VAL B 68 2.456 -0.553 10.968 1.00 0.00 C ATOM 2409 O VAL B 68 2.519 0.600 11.390 1.00 0.00 O ATOM 2410 CB VAL B 68 0.286 -1.504 10.101 1.00 0.00 C ATOM 2411 CG1 VAL B 68 -0.364 -0.777 11.267 1.00 0.00 C ATOM 2412 CG2 VAL B 68 -0.639 -1.494 8.893 1.00 0.00 C ATOM 0 H VAL B 68 1.941 -2.645 8.653 1.00 0.00 H new ATOM 0 HA VAL B 68 1.454 0.064 9.198 1.00 0.00 H new ATOM 0 HB VAL B 68 0.466 -2.532 10.414 1.00 0.00 H new ATOM 0 HG11 VAL B 68 -1.317 -1.249 11.504 1.00 0.00 H new ATOM 0 HG12 VAL B 68 0.291 -0.825 12.137 1.00 0.00 H new ATOM 0 HG13 VAL B 68 -0.533 0.265 10.997 1.00 0.00 H new ATOM 0 HG21 VAL B 68 -1.596 -1.940 9.164 1.00 0.00 H new ATOM 0 HG22 VAL B 68 -0.797 -0.467 8.564 1.00 0.00 H new ATOM 0 HG23 VAL B 68 -0.187 -2.068 8.084 1.00 0.00 H new ATOM 2422 N ASP B 69 3.108 -1.565 11.530 1.00 0.00 N ATOM 2423 CA ASP B 69 3.918 -1.374 12.727 1.00 0.00 C ATOM 2424 C ASP B 69 5.128 -0.491 12.424 1.00 0.00 C ATOM 2425 O ASP B 69 5.539 0.333 13.249 1.00 0.00 O ATOM 2426 CB ASP B 69 4.363 -2.720 13.297 1.00 0.00 C ATOM 2427 CG ASP B 69 5.045 -2.579 14.641 1.00 0.00 C ATOM 2428 OD1 ASP B 69 4.384 -2.143 15.607 1.00 0.00 O ATOM 2429 OD2 ASP B 69 6.243 -2.909 14.742 1.00 0.00 O ATOM 0 H ASP B 69 3.092 -2.522 11.178 1.00 0.00 H new ATOM 0 HA ASP B 69 3.307 -0.871 13.476 1.00 0.00 H new ATOM 0 HB2 ASP B 69 3.496 -3.373 13.399 1.00 0.00 H new ATOM 0 HB3 ASP B 69 5.044 -3.202 12.595 1.00 0.00 H new ATOM 2434 N ALA B 70 5.676 -0.640 11.224 1.00 0.00 N ATOM 2435 CA ALA B 70 6.806 0.175 10.800 1.00 0.00 C ATOM 2436 C ALA B 70 6.384 1.631 10.601 1.00 0.00 C ATOM 2437 O ALA B 70 7.157 2.555 10.863 1.00 0.00 O ATOM 2438 CB ALA B 70 7.406 -0.381 9.520 1.00 0.00 C ATOM 0 H ALA B 70 5.357 -1.316 10.530 1.00 0.00 H new ATOM 0 HA ALA B 70 7.562 0.144 11.585 1.00 0.00 H new ATOM 0 HB1 ALA B 70 8.250 0.238 9.215 1.00 0.00 H new ATOM 0 HB2 ALA B 70 7.748 -1.402 9.692 1.00 0.00 H new ATOM 0 HB3 ALA B 70 6.651 -0.379 8.734 1.00 0.00 H new ATOM 2444 N PHE B 71 5.147 1.831 10.147 1.00 0.00 N ATOM 2445 CA PHE B 71 4.632 3.172 9.888 1.00 0.00 C ATOM 2446 C PHE B 71 4.146 3.847 11.170 1.00 0.00 C ATOM 2447 O PHE B 71 4.252 5.065 11.309 1.00 0.00 O ATOM 2448 CB PHE B 71 3.523 3.133 8.831 1.00 0.00 C ATOM 2449 CG PHE B 71 4.018 2.706 7.478 1.00 0.00 C ATOM 2450 CD1 PHE B 71 5.265 3.110 7.024 1.00 0.00 C ATOM 2451 CD2 PHE B 71 3.248 1.891 6.670 1.00 0.00 C ATOM 2452 CE1 PHE B 71 5.728 2.709 5.787 1.00 0.00 C ATOM 2453 CE2 PHE B 71 3.706 1.487 5.434 1.00 0.00 C ATOM 2454 CZ PHE B 71 4.948 1.895 4.992 1.00 0.00 C ATOM 0 H PHE B 71 4.484 1.081 9.952 1.00 0.00 H new ATOM 0 HA PHE B 71 5.454 3.772 9.498 1.00 0.00 H new ATOM 0 HB2 PHE B 71 2.740 2.449 9.158 1.00 0.00 H new ATOM 0 HB3 PHE B 71 3.070 4.121 8.751 1.00 0.00 H new ATOM 0 HD1 PHE B 71 5.880 3.745 7.645 1.00 0.00 H new ATOM 0 HD2 PHE B 71 2.276 1.567 7.011 1.00 0.00 H new ATOM 0 HE1 PHE B 71 6.699 3.032 5.442 1.00 0.00 H new ATOM 0 HE2 PHE B 71 3.093 0.852 4.812 1.00 0.00 H new ATOM 0 HZ PHE B 71 5.309 1.577 4.025 1.00 0.00 H new ATOM 2464 N LYS B 72 3.623 3.062 12.110 1.00 0.00 N ATOM 2465 CA LYS B 72 3.274 3.600 13.425 1.00 0.00 C ATOM 2466 C LYS B 72 4.541 3.887 14.216 1.00 0.00 C ATOM 2467 O LYS B 72 4.513 4.598 15.221 1.00 0.00 O ATOM 2468 CB LYS B 72 2.351 2.655 14.207 1.00 0.00 C ATOM 2469 CG LYS B 72 2.882 1.242 14.361 1.00 0.00 C ATOM 2470 CD LYS B 72 1.901 0.348 15.102 1.00 0.00 C ATOM 2471 CE LYS B 72 2.094 0.418 16.607 1.00 0.00 C ATOM 2472 NZ LYS B 72 3.424 -0.107 17.016 1.00 0.00 N ATOM 0 H LYS B 72 3.434 2.067 11.990 1.00 0.00 H new ATOM 0 HA LYS B 72 2.724 4.529 13.272 1.00 0.00 H new ATOM 0 HB2 LYS B 72 2.178 3.075 15.198 1.00 0.00 H new ATOM 0 HB3 LYS B 72 1.384 2.614 13.705 1.00 0.00 H new ATOM 0 HG2 LYS B 72 3.085 0.821 13.376 1.00 0.00 H new ATOM 0 HG3 LYS B 72 3.830 1.266 14.899 1.00 0.00 H new ATOM 0 HD2 LYS B 72 0.882 0.643 14.853 1.00 0.00 H new ATOM 0 HD3 LYS B 72 2.025 -0.682 14.768 1.00 0.00 H new ATOM 0 HE2 LYS B 72 1.993 1.451 16.939 1.00 0.00 H new ATOM 0 HE3 LYS B 72 1.309 -0.154 17.102 1.00 0.00 H new ATOM 0 HZ1 LYS B 72 3.316 -0.706 17.859 1.00 0.00 H new ATOM 0 HZ2 LYS B 72 3.828 -0.670 16.241 1.00 0.00 H new ATOM 0 HZ3 LYS B 72 4.059 0.687 17.234 1.00 0.00 H new ATOM 2486 N GLY B 73 5.656 3.330 13.748 1.00 0.00 N ATOM 2487 CA GLY B 73 6.952 3.640 14.318 1.00 0.00 C ATOM 2488 C GLY B 73 7.489 4.988 13.858 1.00 0.00 C ATOM 2489 O GLY B 73 8.689 5.129 13.622 1.00 0.00 O ATOM 0 H GLY B 73 5.681 2.663 12.976 1.00 0.00 H new ATOM 0 HA2 GLY B 73 6.877 3.636 15.405 1.00 0.00 H new ATOM 0 HA3 GLY B 73 7.661 2.859 14.044 1.00 0.00 H new ATOM 2493 N ASN B 74 6.586 5.963 13.722 1.00 0.00 N ATOM 2494 CA ASN B 74 6.926 7.352 13.388 1.00 0.00 C ATOM 2495 C ASN B 74 7.257 7.534 11.905 1.00 0.00 C ATOM 2496 O ASN B 74 8.377 7.279 11.458 1.00 0.00 O ATOM 2497 CB ASN B 74 8.074 7.867 14.267 1.00 0.00 C ATOM 2498 CG ASN B 74 8.368 9.342 14.060 1.00 0.00 C ATOM 2499 OD1 ASN B 74 9.205 9.721 13.241 1.00 0.00 O ATOM 2500 ND2 ASN B 74 7.685 10.186 14.816 1.00 0.00 N ATOM 0 H ASN B 74 5.585 5.810 13.842 1.00 0.00 H new ATOM 0 HA ASN B 74 6.037 7.948 13.593 1.00 0.00 H new ATOM 0 HB2 ASN B 74 7.826 7.696 15.315 1.00 0.00 H new ATOM 0 HB3 ASN B 74 8.974 7.290 14.054 1.00 0.00 H new ATOM 0 HD21 ASN B 74 7.844 11.190 14.731 1.00 0.00 H new ATOM 0 HD22 ASN B 74 6.999 9.833 15.484 1.00 0.00 H new ATOM 2507 N LEU B 75 6.257 7.969 11.151 1.00 0.00 N ATOM 2508 CA LEU B 75 6.438 8.347 9.753 1.00 0.00 C ATOM 2509 C LEU B 75 6.364 9.860 9.624 1.00 0.00 C ATOM 2510 O LEU B 75 7.233 10.502 9.028 1.00 0.00 O ATOM 2511 CB LEU B 75 5.357 7.720 8.862 1.00 0.00 C ATOM 2512 CG LEU B 75 5.295 8.291 7.439 1.00 0.00 C ATOM 2513 CD1 LEU B 75 6.435 7.770 6.587 1.00 0.00 C ATOM 2514 CD2 LEU B 75 3.967 7.972 6.781 1.00 0.00 C ATOM 0 H LEU B 75 5.300 8.070 11.488 1.00 0.00 H new ATOM 0 HA LEU B 75 7.413 7.983 9.428 1.00 0.00 H new ATOM 0 HB2 LEU B 75 5.532 6.646 8.802 1.00 0.00 H new ATOM 0 HB3 LEU B 75 4.386 7.859 9.338 1.00 0.00 H new ATOM 0 HG LEU B 75 5.392 9.374 7.520 1.00 0.00 H new ATOM 0 HD11 LEU B 75 6.363 8.193 5.585 1.00 0.00 H new ATOM 0 HD12 LEU B 75 7.386 8.059 7.035 1.00 0.00 H new ATOM 0 HD13 LEU B 75 6.377 6.683 6.527 1.00 0.00 H new ATOM 0 HD21 LEU B 75 3.951 8.389 5.774 1.00 0.00 H new ATOM 0 HD22 LEU B 75 3.837 6.891 6.729 1.00 0.00 H new ATOM 0 HD23 LEU B 75 3.157 8.407 7.367 1.00 0.00 H new ATOM 2526 N GLU B 76 5.324 10.416 10.226 1.00 0.00 N ATOM 2527 CA GLU B 76 5.028 11.838 10.144 1.00 0.00 C ATOM 2528 C GLU B 76 6.107 12.669 10.827 1.00 0.00 C ATOM 2529 O GLU B 76 6.314 13.830 10.475 1.00 0.00 O ATOM 2530 CB GLU B 76 3.654 12.133 10.772 1.00 0.00 C ATOM 2531 CG GLU B 76 3.546 11.833 12.269 1.00 0.00 C ATOM 2532 CD GLU B 76 3.772 10.372 12.613 1.00 0.00 C ATOM 2533 OE1 GLU B 76 2.825 9.567 12.470 1.00 0.00 O ATOM 2534 OE2 GLU B 76 4.906 10.025 13.003 1.00 0.00 O ATOM 0 H GLU B 76 4.657 9.889 10.789 1.00 0.00 H new ATOM 0 HA GLU B 76 5.006 12.116 9.090 1.00 0.00 H new ATOM 0 HB2 GLU B 76 3.416 13.184 10.610 1.00 0.00 H new ATOM 0 HB3 GLU B 76 2.898 11.550 10.245 1.00 0.00 H new ATOM 0 HG2 GLU B 76 4.274 12.441 12.806 1.00 0.00 H new ATOM 0 HG3 GLU B 76 2.559 12.132 12.621 1.00 0.00 H new ATOM 2541 N HIS B 77 6.780 12.071 11.811 1.00 0.00 N ATOM 2542 CA HIS B 77 7.822 12.751 12.585 1.00 0.00 C ATOM 2543 C HIS B 77 7.221 13.837 13.473 1.00 0.00 C ATOM 2544 O HIS B 77 7.939 14.587 14.127 1.00 0.00 O ATOM 2545 CB HIS B 77 8.894 13.346 11.666 1.00 0.00 C ATOM 2546 CG HIS B 77 9.871 12.343 11.141 1.00 0.00 C ATOM 2547 ND1 HIS B 77 9.581 11.457 10.124 1.00 0.00 N ATOM 2548 CD2 HIS B 77 11.151 12.096 11.500 1.00 0.00 C ATOM 2549 CE1 HIS B 77 10.644 10.709 9.882 1.00 0.00 C ATOM 2550 NE2 HIS B 77 11.607 11.078 10.702 1.00 0.00 N ATOM 0 H HIS B 77 6.620 11.104 12.094 1.00 0.00 H new ATOM 0 HA HIS B 77 8.296 12.007 13.224 1.00 0.00 H new ATOM 0 HB2 HIS B 77 8.405 13.836 10.824 1.00 0.00 H new ATOM 0 HB3 HIS B 77 9.438 14.117 12.212 1.00 0.00 H new ATOM 0 HD1 HIS B 77 8.688 11.390 9.636 1.00 0.00 H new ATOM 0 HD2 HIS B 77 11.710 12.605 12.271 1.00 0.00 H new ATOM 0 HE1 HIS B 77 10.711 9.928 9.139 1.00 0.00 H new ATOM 2559 N HIS B 78 5.896 13.899 13.501 1.00 0.00 N ATOM 2560 CA HIS B 78 5.187 14.884 14.301 1.00 0.00 C ATOM 2561 C HIS B 78 4.155 14.191 15.174 1.00 0.00 C ATOM 2562 O HIS B 78 2.957 14.470 15.087 1.00 0.00 O ATOM 2563 CB HIS B 78 4.504 15.934 13.413 1.00 0.00 C ATOM 2564 CG HIS B 78 5.455 16.735 12.574 1.00 0.00 C ATOM 2565 ND1 HIS B 78 6.358 17.631 13.103 1.00 0.00 N ATOM 2566 CD2 HIS B 78 5.651 16.758 11.234 1.00 0.00 C ATOM 2567 CE1 HIS B 78 7.063 18.172 12.130 1.00 0.00 C ATOM 2568 NE2 HIS B 78 6.656 17.658 10.986 1.00 0.00 N ATOM 0 H HIS B 78 5.288 13.272 12.974 1.00 0.00 H new ATOM 0 HA HIS B 78 5.912 15.397 14.932 1.00 0.00 H new ATOM 0 HB2 HIS B 78 3.791 15.433 12.758 1.00 0.00 H new ATOM 0 HB3 HIS B 78 3.933 16.613 14.045 1.00 0.00 H new ATOM 0 HD2 HIS B 78 5.116 16.176 10.498 1.00 0.00 H new ATOM 0 HE1 HIS B 78 7.842 18.911 12.249 1.00 0.00 H new ATOM 0 HE2 HIS B 78 7.028 17.892 10.066 1.00 0.00 H new ATOM 2577 N HIS B 79 4.621 13.258 15.994 1.00 0.00 N ATOM 2578 CA HIS B 79 3.744 12.549 16.915 1.00 0.00 C ATOM 2579 C HIS B 79 3.133 13.527 17.911 1.00 0.00 C ATOM 2580 O HIS B 79 3.841 14.199 18.661 1.00 0.00 O ATOM 2581 CB HIS B 79 4.488 11.415 17.641 1.00 0.00 C ATOM 2582 CG HIS B 79 5.775 11.826 18.306 1.00 0.00 C ATOM 2583 ND1 HIS B 79 5.885 12.075 19.657 1.00 0.00 N ATOM 2584 CD2 HIS B 79 7.012 12.014 17.791 1.00 0.00 C ATOM 2585 CE1 HIS B 79 7.134 12.401 19.939 1.00 0.00 C ATOM 2586 NE2 HIS B 79 7.837 12.371 18.824 1.00 0.00 N ATOM 0 H HIS B 79 5.600 12.975 16.040 1.00 0.00 H new ATOM 0 HA HIS B 79 2.942 12.090 16.337 1.00 0.00 H new ATOM 0 HB2 HIS B 79 3.826 10.990 18.395 1.00 0.00 H new ATOM 0 HB3 HIS B 79 4.703 10.623 16.923 1.00 0.00 H new ATOM 0 HD2 HIS B 79 7.297 11.903 16.755 1.00 0.00 H new ATOM 0 HE1 HIS B 79 7.515 12.650 20.918 1.00 0.00 H new ATOM 0 HE2 HIS B 79 8.832 12.580 18.744 1.00 0.00 H new ATOM 2595 N HIS B 80 1.816 13.619 17.890 1.00 0.00 N ATOM 2596 CA HIS B 80 1.102 14.578 18.722 1.00 0.00 C ATOM 2597 C HIS B 80 0.067 13.872 19.586 1.00 0.00 C ATOM 2598 O HIS B 80 -0.761 14.512 20.235 1.00 0.00 O ATOM 2599 CB HIS B 80 0.450 15.672 17.856 1.00 0.00 C ATOM 2600 CG HIS B 80 -0.357 15.162 16.694 1.00 0.00 C ATOM 2601 ND1 HIS B 80 0.197 14.874 15.466 1.00 0.00 N ATOM 2602 CD2 HIS B 80 -1.682 14.912 16.571 1.00 0.00 C ATOM 2603 CE1 HIS B 80 -0.750 14.474 14.639 1.00 0.00 C ATOM 2604 NE2 HIS B 80 -1.904 14.485 15.283 1.00 0.00 N ATOM 0 H HIS B 80 1.214 13.040 17.304 1.00 0.00 H new ATOM 0 HA HIS B 80 1.820 15.061 19.385 1.00 0.00 H new ATOM 0 HB2 HIS B 80 -0.196 16.280 18.490 1.00 0.00 H new ATOM 0 HB3 HIS B 80 1.233 16.329 17.476 1.00 0.00 H new ATOM 0 HD1 HIS B 80 1.186 14.957 15.232 1.00 0.00 H new ATOM 0 HD2 HIS B 80 -2.428 15.027 17.343 1.00 0.00 H new ATOM 0 HE1 HIS B 80 -0.606 14.186 13.608 1.00 0.00 H new ATOM 2613 N HIS B 81 0.131 12.550 19.588 1.00 0.00 N ATOM 2614 CA HIS B 81 -0.744 11.732 20.414 1.00 0.00 C ATOM 2615 C HIS B 81 -0.153 10.333 20.542 1.00 0.00 C ATOM 2616 O HIS B 81 0.333 9.773 19.561 1.00 0.00 O ATOM 2617 CB HIS B 81 -2.150 11.659 19.800 1.00 0.00 C ATOM 2618 CG HIS B 81 -3.139 10.894 20.633 1.00 0.00 C ATOM 2619 ND1 HIS B 81 -3.507 9.594 20.361 1.00 0.00 N ATOM 2620 CD2 HIS B 81 -3.830 11.251 21.742 1.00 0.00 C ATOM 2621 CE1 HIS B 81 -4.378 9.185 21.263 1.00 0.00 C ATOM 2622 NE2 HIS B 81 -4.591 10.171 22.113 1.00 0.00 N ATOM 0 H HIS B 81 0.788 12.015 19.020 1.00 0.00 H new ATOM 0 HA HIS B 81 -0.827 12.183 21.403 1.00 0.00 H new ATOM 0 HB2 HIS B 81 -2.523 12.672 19.650 1.00 0.00 H new ATOM 0 HB3 HIS B 81 -2.083 11.195 18.816 1.00 0.00 H new ATOM 0 HD2 HIS B 81 -3.790 12.208 22.241 1.00 0.00 H new ATOM 0 HE1 HIS B 81 -4.839 8.209 21.299 1.00 0.00 H new ATOM 0 HE2 HIS B 81 -5.219 10.136 22.916 1.00 0.00 H new ATOM 2631 N HIS B 82 -0.175 9.780 21.744 1.00 0.00 N ATOM 2632 CA HIS B 82 0.328 8.433 21.963 1.00 0.00 C ATOM 2633 C HIS B 82 -0.758 7.572 22.592 1.00 0.00 C ATOM 2634 O HIS B 82 -1.414 6.806 21.861 1.00 0.00 O ATOM 2635 CB HIS B 82 1.576 8.461 22.859 1.00 0.00 C ATOM 2636 CG HIS B 82 2.324 7.159 22.906 1.00 0.00 C ATOM 2637 ND1 HIS B 82 1.890 5.875 22.879 1.00 0.00 N flip ATOM 2638 CD2 HIS B 82 3.697 7.088 22.999 1.00 0.00 C flip ATOM 2639 CE1 HIS B 82 2.992 5.065 22.950 1.00 0.00 C flip ATOM 2640 NE2 HIS B 82 4.070 5.821 23.023 1.00 0.00 N flip ATOM 2641 OXT HIS B 82 -0.956 7.674 23.818 1.00 0.00 O ATOM 0 H HIS B 82 -0.534 10.241 22.580 1.00 0.00 H new ATOM 0 HA HIS B 82 0.609 8.003 21.002 1.00 0.00 H new ATOM 0 HB2 HIS B 82 2.248 9.242 22.504 1.00 0.00 H new ATOM 0 HB3 HIS B 82 1.278 8.734 23.871 1.00 0.00 H new ATOM 0 HD2 HIS B 82 4.364 7.936 23.045 1.00 0.00 H new ATOM 0 HE1 HIS B 82 2.980 3.985 22.947 1.00 0.00 H new ATOM 0 HE2 HIS B 82 5.031 5.484 23.087 1.00 0.00 H new TER 2650 HIS B 82