USER MOD reduce.3.24.130724 H: found=0, std=0, add=1204, rem=0, adj=48 USER MOD reduce.3.24.130724 removed 1204 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 59 GLN : amide:sc= -0.858 K(o=-0.77,f=-3.8!) USER MOD Set 1.2: B 68 HIS : no HE2:sc= 0.0875 K(o=-0.77,f=-1.6) USER MOD Set 2.1: B 7 THR OG1 : rot 132:sc= 1.01 USER MOD Set 2.2: B 9 THR OG1 : rot 180:sc= 1.08 USER MOD Set 3.1: A 38 LYS NZ :NH3+ 138:sc= 1.23 (180deg=-0.24) USER MOD Set 3.2: A 39 SER OG : rot -100:sc= 1.06 USER MOD Single : A 1 MET CE :methyl -164:sc= -0.068 (180deg=-0.425) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 LYS NZ :NH3+ 169:sc= -0.0231 (180deg=-0.172) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 LYS NZ :NH3+ 172:sc= -0.0119 (180deg=-0.0804) USER MOD Single : A 7 LYS NZ :NH3+ 173:sc= 1.22 (180deg=1.04) USER MOD Single : A 12 GLN : amide:sc= -0.532 X(o=-0.53,f=-0.7) USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 MET CE :methyl 157:sc= -0.174 (180deg=-0.981) USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 20 GLN : amide:sc= -0.221 X(o=-0.22,f=-0.54) USER MOD Single : A 24 THR OG1 : rot 180:sc= -0.0118 USER MOD Single : A 26 LYS NZ :NH3+ 156:sc= -0.504! (180deg=-1.82!) USER MOD Single : A 27 SER OG : rot 44:sc= 0.00636 USER MOD Single : A 30 LYS NZ :NH3+ -165:sc= 1.28 (180deg=0.982) USER MOD Single : A 32 TYR OH : rot 0:sc= 0.84 USER MOD Single : A 37 LYS NZ :NH3+ -134:sc= -0.0602 (180deg=-0.37) USER MOD Single : A 40 LYS NZ :NH3+ -169:sc= -0.0662 (180deg=-0.326) USER MOD Single : A 44 MET CE :methyl -136:sc= -0.132 (180deg=-0.559) USER MOD Single : A 45 CYS SG : rot 8:sc= -1.92! USER MOD Single : A 46 GLN : amide:sc= 0.816 K(o=0.82,f=-0.91) USER MOD Single : A 50 SER OG : rot 180:sc= -0.327 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 SER OG : rot 180:sc= -0.23 USER MOD Single : A 67 LYS NZ :NH3+ 165:sc= -0.0232 (180deg=-0.231) USER MOD Single : A 68 LYS NZ :NH3+ -178:sc= 1.32 (180deg=1.15) USER MOD Single : A 69 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : B 1 MET CE :methyl -176:sc= -0.95 (180deg=-0.973) USER MOD Single : B 1 MET N :NH3+ 171:sc= 2.17 (180deg=1.83) USER MOD Single : B 2 GLN : amide:sc= -0.238 K(o=-0.24,f=-1.5) USER MOD Single : B 6 LYS NZ :NH3+ -121:sc= 0.208 (180deg=0.0761) USER MOD Single : B 11 LYS NZ :NH3+ 145:sc= 1.08 (180deg=-0.873!) USER MOD Single : B 12 THR OG1 : rot 59:sc= -0.584 USER MOD Single : B 14 THR OG1 : rot -77:sc= 0.187 USER MOD Single : B 19 SER OG : rot 180:sc= 0.0189 USER MOD Single : B 20 SER OG : rot 180:sc= -0.0498 USER MOD Single : B 22 THR OG1 : rot 180:sc= 0 USER MOD Single : B 25 ASN : amide:sc= 0.603 K(o=0.6,f=-0.00021) USER MOD Single : B 27 LYS NZ :NH3+ -156:sc= -0.0789 (180deg=-1.25!) USER MOD Single : B 28 SER OG : rot 180:sc= 0 USER MOD Single : B 29 LYS NZ :NH3+ 170:sc= -0.0134 (180deg=-0.147) USER MOD Single : B 31 GLN : amide:sc= 0 X(o=0,f=-0.29) USER MOD Single : B 33 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00542) USER MOD Single : B 40 GLN : amide:sc= -2.65! K(o=-2.7!,f=-0.7) USER MOD Single : B 41 GLN : amide:sc= -1.3 K(o=-1.3,f=-5.5!) USER MOD Single : B 48 LYS NZ :NH3+ -156:sc= 1.14 (180deg=0.514) USER MOD Single : B 49 GLN : amide:sc= 0.18 K(o=0.18,f=-0.5) USER MOD Single : B 55 THR OG1 : rot 180:sc= 0.00149 USER MOD Single : B 57 SER OG : rot 180:sc= -1.25 USER MOD Single : B 59 TYR OH : rot -140:sc= 0.994 USER MOD Single : B 60 ASN : amide:sc= -1.48! K(o=-1.5!,f=-0.091) USER MOD Single : B 62 GLN : amide:sc=-0.00286 K(o=-0.0029,f=-0.89) USER MOD Single : B 63 LYS NZ :NH3+ -164:sc= 0.954 (180deg=0.612) USER MOD Single : B 65 SER OG : rot -99:sc= 0.584 USER MOD Single : B 66 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -32.096 4.494 -7.771 1.00 0.00 N ATOM 2 CA MET A 1 -32.053 4.082 -6.353 1.00 0.00 C ATOM 3 C MET A 1 -31.245 5.084 -5.537 1.00 0.00 C ATOM 4 O MET A 1 -30.018 5.128 -5.628 1.00 0.00 O ATOM 5 CB MET A 1 -31.443 2.682 -6.221 1.00 0.00 C ATOM 6 CG MET A 1 -31.373 2.179 -4.787 1.00 0.00 C ATOM 7 SD MET A 1 -30.563 0.573 -4.646 1.00 0.00 S ATOM 8 CE MET A 1 -31.688 -0.462 -5.581 1.00 0.00 C ATOM 0 H1 MET A 1 -32.650 3.803 -8.317 1.00 0.00 H new ATOM 0 H2 MET A 1 -32.541 5.431 -7.847 1.00 0.00 H new ATOM 0 H3 MET A 1 -31.128 4.538 -8.149 1.00 0.00 H new ATOM 0 HA MET A 1 -33.073 4.056 -5.969 1.00 0.00 H new ATOM 0 HB2 MET A 1 -32.031 1.982 -6.814 1.00 0.00 H new ATOM 0 HB3 MET A 1 -30.438 2.692 -6.643 1.00 0.00 H new ATOM 0 HG2 MET A 1 -30.836 2.906 -4.178 1.00 0.00 H new ATOM 0 HG3 MET A 1 -32.383 2.108 -4.382 1.00 0.00 H new ATOM 0 HE1 MET A 1 -31.491 -1.510 -5.356 1.00 0.00 H new ATOM 0 HE2 MET A 1 -32.716 -0.220 -5.310 1.00 0.00 H new ATOM 0 HE3 MET A 1 -31.543 -0.287 -6.647 1.00 0.00 H new ATOM 20 N ALA A 2 -31.938 5.894 -4.747 1.00 0.00 N ATOM 21 CA ALA A 2 -31.283 6.900 -3.919 1.00 0.00 C ATOM 22 C ALA A 2 -30.812 6.290 -2.604 1.00 0.00 C ATOM 23 O ALA A 2 -30.032 6.897 -1.868 1.00 0.00 O ATOM 24 CB ALA A 2 -32.228 8.064 -3.656 1.00 0.00 C ATOM 0 H ALA A 2 -32.954 5.874 -4.662 1.00 0.00 H new ATOM 0 HA ALA A 2 -30.410 7.273 -4.455 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -31.726 8.807 -3.037 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -32.519 8.518 -4.603 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -33.117 7.702 -3.139 1.00 0.00 H new ATOM 30 N SER A 3 -31.295 5.088 -2.317 1.00 0.00 N ATOM 31 CA SER A 3 -30.934 4.378 -1.101 1.00 0.00 C ATOM 32 C SER A 3 -29.471 3.942 -1.144 1.00 0.00 C ATOM 33 O SER A 3 -29.091 3.078 -1.938 1.00 0.00 O ATOM 34 CB SER A 3 -31.850 3.168 -0.930 1.00 0.00 C ATOM 35 OG SER A 3 -33.206 3.550 -1.090 1.00 0.00 O ATOM 0 H SER A 3 -31.945 4.582 -2.918 1.00 0.00 H new ATOM 0 HA SER A 3 -31.058 5.046 -0.248 1.00 0.00 H new ATOM 0 HB2 SER A 3 -31.592 2.402 -1.662 1.00 0.00 H new ATOM 0 HB3 SER A 3 -31.703 2.729 0.057 1.00 0.00 H new ATOM 0 HG SER A 3 -33.782 2.765 -0.980 1.00 0.00 H new ATOM 41 N LYS A 4 -28.657 4.556 -0.300 1.00 0.00 N ATOM 42 CA LYS A 4 -27.232 4.270 -0.258 1.00 0.00 C ATOM 43 C LYS A 4 -26.828 3.852 1.148 1.00 0.00 C ATOM 44 O LYS A 4 -27.240 4.475 2.128 1.00 0.00 O ATOM 45 CB LYS A 4 -26.430 5.507 -0.682 1.00 0.00 C ATOM 46 CG LYS A 4 -26.804 6.044 -2.056 1.00 0.00 C ATOM 47 CD LYS A 4 -26.377 5.102 -3.168 1.00 0.00 C ATOM 48 CE LYS A 4 -26.880 5.576 -4.523 1.00 0.00 C ATOM 49 NZ LYS A 4 -26.451 6.967 -4.833 1.00 0.00 N ATOM 0 H LYS A 4 -28.962 5.261 0.370 1.00 0.00 H new ATOM 0 HA LYS A 4 -27.018 3.456 -0.950 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -26.577 6.294 0.057 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -25.369 5.259 -0.676 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -27.882 6.198 -2.105 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -26.336 7.017 -2.205 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -25.290 5.029 -3.187 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -26.760 4.102 -2.966 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -26.513 4.904 -5.299 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -27.968 5.522 -4.543 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -26.654 7.179 -5.831 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -26.969 7.634 -4.225 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -25.430 7.062 -4.660 1.00 0.00 H new ATOM 63 N SER A 5 -26.040 2.797 1.249 1.00 0.00 N ATOM 64 CA SER A 5 -25.585 2.312 2.541 1.00 0.00 C ATOM 65 C SER A 5 -24.164 2.788 2.811 1.00 0.00 C ATOM 66 O SER A 5 -23.921 3.572 3.727 1.00 0.00 O ATOM 67 CB SER A 5 -25.653 0.782 2.588 1.00 0.00 C ATOM 68 OG SER A 5 -25.179 0.274 3.828 1.00 0.00 O ATOM 0 H SER A 5 -25.701 2.259 0.452 1.00 0.00 H new ATOM 0 HA SER A 5 -26.239 2.712 3.315 1.00 0.00 H new ATOM 0 HB2 SER A 5 -26.682 0.458 2.431 1.00 0.00 H new ATOM 0 HB3 SER A 5 -25.060 0.366 1.773 1.00 0.00 H new ATOM 0 HG SER A 5 -25.238 -0.704 3.825 1.00 0.00 H new ATOM 74 N LYS A 6 -23.231 2.334 1.992 1.00 0.00 N ATOM 75 CA LYS A 6 -21.832 2.660 2.187 1.00 0.00 C ATOM 76 C LYS A 6 -21.111 2.669 0.846 1.00 0.00 C ATOM 77 O LYS A 6 -21.620 2.137 -0.143 1.00 0.00 O ATOM 78 CB LYS A 6 -21.192 1.653 3.154 1.00 0.00 C ATOM 79 CG LYS A 6 -19.817 2.062 3.664 1.00 0.00 C ATOM 80 CD LYS A 6 -19.840 3.428 4.343 1.00 0.00 C ATOM 81 CE LYS A 6 -20.769 3.458 5.548 1.00 0.00 C ATOM 82 NZ LYS A 6 -20.344 2.506 6.605 1.00 0.00 N ATOM 0 H LYS A 6 -23.419 1.738 1.186 1.00 0.00 H new ATOM 0 HA LYS A 6 -21.747 3.654 2.625 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -21.856 1.513 4.007 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -21.109 0.688 2.653 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -19.455 1.313 4.369 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -19.114 2.083 2.832 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -18.831 3.692 4.659 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -20.157 4.184 3.624 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -20.796 4.467 5.959 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -21.783 3.216 5.229 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -20.920 2.654 7.458 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -20.472 1.531 6.266 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -19.342 2.665 6.833 1.00 0.00 H new ATOM 96 N LYS A 7 -19.937 3.281 0.818 1.00 0.00 N ATOM 97 CA LYS A 7 -19.166 3.417 -0.406 1.00 0.00 C ATOM 98 C LYS A 7 -18.646 2.065 -0.875 1.00 0.00 C ATOM 99 O LYS A 7 -17.905 1.398 -0.161 1.00 0.00 O ATOM 100 CB LYS A 7 -17.980 4.359 -0.180 1.00 0.00 C ATOM 101 CG LYS A 7 -18.350 5.678 0.480 1.00 0.00 C ATOM 102 CD LYS A 7 -17.128 6.559 0.686 1.00 0.00 C ATOM 103 CE LYS A 7 -17.477 7.831 1.444 1.00 0.00 C ATOM 104 NZ LYS A 7 -17.856 7.556 2.858 1.00 0.00 N ATOM 0 H LYS A 7 -19.495 3.695 1.639 1.00 0.00 H new ATOM 0 HA LYS A 7 -19.823 3.829 -1.172 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -17.240 3.851 0.438 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -17.506 4.566 -1.140 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -19.079 6.203 -0.137 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -18.827 5.484 1.441 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -16.367 6.004 1.235 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -16.698 6.818 -0.282 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -16.625 8.510 1.423 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -18.300 8.338 0.941 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -17.970 8.455 3.368 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -18.752 7.029 2.881 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -17.111 6.992 3.314 1.00 0.00 H new ATOM 118 N ARG A 8 -19.048 1.656 -2.066 1.00 0.00 N ATOM 119 CA ARG A 8 -18.468 0.478 -2.688 1.00 0.00 C ATOM 120 C ARG A 8 -17.177 0.870 -3.386 1.00 0.00 C ATOM 121 O ARG A 8 -17.036 2.007 -3.835 1.00 0.00 O ATOM 122 CB ARG A 8 -19.435 -0.161 -3.689 1.00 0.00 C ATOM 123 CG ARG A 8 -20.596 -0.891 -3.036 1.00 0.00 C ATOM 124 CD ARG A 8 -21.532 -1.497 -4.071 1.00 0.00 C ATOM 125 NE ARG A 8 -22.600 -2.281 -3.449 1.00 0.00 N ATOM 126 CZ ARG A 8 -23.451 -3.058 -4.120 1.00 0.00 C ATOM 127 NH1 ARG A 8 -23.372 -3.154 -5.440 1.00 0.00 N ATOM 128 NH2 ARG A 8 -24.385 -3.738 -3.465 1.00 0.00 N ATOM 0 H ARG A 8 -19.769 2.119 -2.619 1.00 0.00 H new ATOM 0 HA ARG A 8 -18.263 -0.260 -1.912 1.00 0.00 H new ATOM 0 HB2 ARG A 8 -19.828 0.614 -4.346 1.00 0.00 H new ATOM 0 HB3 ARG A 8 -18.884 -0.861 -4.317 1.00 0.00 H new ATOM 0 HG2 ARG A 8 -20.212 -1.678 -2.387 1.00 0.00 H new ATOM 0 HG3 ARG A 8 -21.152 -0.199 -2.403 1.00 0.00 H new ATOM 0 HD2 ARG A 8 -21.970 -0.702 -4.674 1.00 0.00 H new ATOM 0 HD3 ARG A 8 -20.962 -2.133 -4.748 1.00 0.00 H new ATOM 0 HE ARG A 8 -22.700 -2.230 -2.435 1.00 0.00 H new ATOM 0 HH11 ARG A 8 -22.658 -2.632 -5.947 1.00 0.00 H new ATOM 0 HH12 ARG A 8 -24.026 -3.750 -5.948 1.00 0.00 H new ATOM 0 HH21 ARG A 8 -24.451 -3.666 -2.450 1.00 0.00 H new ATOM 0 HH22 ARG A 8 -25.036 -4.333 -3.977 1.00 0.00 H new ATOM 142 N GLY A 9 -16.239 -0.054 -3.468 1.00 0.00 N ATOM 143 CA GLY A 9 -14.976 0.236 -4.110 1.00 0.00 C ATOM 144 C GLY A 9 -14.441 -0.940 -4.900 1.00 0.00 C ATOM 145 O GLY A 9 -14.760 -2.097 -4.602 1.00 0.00 O ATOM 0 H GLY A 9 -16.328 -1.002 -3.102 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -15.099 1.090 -4.776 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -14.246 0.523 -3.354 1.00 0.00 H new ATOM 149 N ILE A 10 -13.646 -0.640 -5.918 1.00 0.00 N ATOM 150 CA ILE A 10 -12.990 -1.665 -6.708 1.00 0.00 C ATOM 151 C ILE A 10 -11.497 -1.652 -6.420 1.00 0.00 C ATOM 152 O ILE A 10 -10.861 -0.595 -6.442 1.00 0.00 O ATOM 153 CB ILE A 10 -13.223 -1.464 -8.228 1.00 0.00 C ATOM 154 CG1 ILE A 10 -14.710 -1.597 -8.574 1.00 0.00 C ATOM 155 CG2 ILE A 10 -12.400 -2.455 -9.040 1.00 0.00 C ATOM 156 CD1 ILE A 10 -15.316 -2.940 -8.211 1.00 0.00 C ATOM 0 H ILE A 10 -13.441 0.314 -6.215 1.00 0.00 H new ATOM 0 HA ILE A 10 -13.422 -2.626 -6.428 1.00 0.00 H new ATOM 0 HB ILE A 10 -12.898 -0.456 -8.485 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -15.263 -0.811 -8.060 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -14.839 -1.430 -9.643 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -12.581 -2.294 -10.103 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -11.341 -2.310 -8.826 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -12.688 -3.472 -8.773 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -16.370 -2.951 -8.489 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -14.792 -3.732 -8.746 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -15.222 -3.103 -7.137 1.00 0.00 H new ATOM 168 N VAL A 11 -10.951 -2.816 -6.121 1.00 0.00 N ATOM 169 CA VAL A 11 -9.522 -2.948 -5.900 1.00 0.00 C ATOM 170 C VAL A 11 -8.798 -3.139 -7.233 1.00 0.00 C ATOM 171 O VAL A 11 -8.996 -4.137 -7.929 1.00 0.00 O ATOM 172 CB VAL A 11 -9.206 -4.111 -4.929 1.00 0.00 C ATOM 173 CG1 VAL A 11 -10.018 -5.345 -5.275 1.00 0.00 C ATOM 174 CG2 VAL A 11 -7.719 -4.433 -4.927 1.00 0.00 C ATOM 0 H VAL A 11 -11.476 -3.685 -6.025 1.00 0.00 H new ATOM 0 HA VAL A 11 -9.164 -2.029 -5.436 1.00 0.00 H new ATOM 0 HB VAL A 11 -9.486 -3.790 -3.926 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -9.777 -6.147 -4.577 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -11.081 -5.112 -5.207 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -9.781 -5.664 -6.290 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -7.525 -5.254 -4.236 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -7.408 -4.723 -5.931 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -7.157 -3.554 -4.613 1.00 0.00 H new ATOM 184 N GLN A 12 -7.977 -2.160 -7.588 1.00 0.00 N ATOM 185 CA GLN A 12 -7.271 -2.174 -8.863 1.00 0.00 C ATOM 186 C GLN A 12 -5.981 -2.976 -8.765 1.00 0.00 C ATOM 187 O GLN A 12 -5.682 -3.800 -9.630 1.00 0.00 O ATOM 188 CB GLN A 12 -6.957 -0.748 -9.316 1.00 0.00 C ATOM 189 CG GLN A 12 -8.190 0.088 -9.614 1.00 0.00 C ATOM 190 CD GLN A 12 -7.844 1.488 -10.083 1.00 0.00 C ATOM 191 OE1 GLN A 12 -6.801 1.714 -10.700 1.00 0.00 O ATOM 192 NE2 GLN A 12 -8.718 2.439 -9.801 1.00 0.00 N ATOM 0 H GLN A 12 -7.783 -1.343 -7.009 1.00 0.00 H new ATOM 0 HA GLN A 12 -7.921 -2.649 -9.598 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -6.372 -0.252 -8.542 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -6.334 -0.790 -10.209 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -8.787 -0.410 -10.378 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -8.807 0.151 -8.718 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -9.570 2.213 -9.288 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -8.540 3.399 -10.096 1.00 0.00 H new ATOM 201 N TYR A 13 -5.221 -2.739 -7.707 1.00 0.00 N ATOM 202 CA TYR A 13 -3.956 -3.429 -7.518 1.00 0.00 C ATOM 203 C TYR A 13 -4.063 -4.422 -6.373 1.00 0.00 C ATOM 204 O TYR A 13 -4.612 -4.108 -5.319 1.00 0.00 O ATOM 205 CB TYR A 13 -2.825 -2.433 -7.257 1.00 0.00 C ATOM 206 CG TYR A 13 -2.558 -1.503 -8.420 1.00 0.00 C ATOM 207 CD1 TYR A 13 -1.957 -1.972 -9.579 1.00 0.00 C ATOM 208 CD2 TYR A 13 -2.894 -0.155 -8.354 1.00 0.00 C ATOM 209 CE1 TYR A 13 -1.706 -1.130 -10.643 1.00 0.00 C ATOM 210 CE2 TYR A 13 -2.647 0.694 -9.418 1.00 0.00 C ATOM 211 CZ TYR A 13 -2.051 0.201 -10.558 1.00 0.00 C ATOM 212 OH TYR A 13 -1.798 1.040 -11.620 1.00 0.00 O ATOM 0 H TYR A 13 -5.458 -2.076 -6.969 1.00 0.00 H new ATOM 0 HA TYR A 13 -3.724 -3.973 -8.433 1.00 0.00 H new ATOM 0 HB2 TYR A 13 -3.071 -1.839 -6.377 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -1.913 -2.984 -7.026 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -1.681 -3.014 -9.650 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -3.355 0.235 -7.458 1.00 0.00 H new ATOM 0 HE1 TYR A 13 -1.241 -1.513 -11.539 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -2.920 1.737 -9.355 1.00 0.00 H new ATOM 0 HH TYR A 13 -2.102 1.946 -11.401 1.00 0.00 H new ATOM 222 N ASP A 14 -3.543 -5.618 -6.598 1.00 0.00 N ATOM 223 CA ASP A 14 -3.636 -6.701 -5.628 1.00 0.00 C ATOM 224 C ASP A 14 -2.845 -6.376 -4.366 1.00 0.00 C ATOM 225 O ASP A 14 -1.835 -5.674 -4.418 1.00 0.00 O ATOM 226 CB ASP A 14 -3.122 -8.005 -6.245 1.00 0.00 C ATOM 227 CG ASP A 14 -3.818 -8.348 -7.549 1.00 0.00 C ATOM 228 OD1 ASP A 14 -3.435 -7.786 -8.598 1.00 0.00 O ATOM 229 OD2 ASP A 14 -4.752 -9.173 -7.538 1.00 0.00 O ATOM 0 H ASP A 14 -3.046 -5.866 -7.454 1.00 0.00 H new ATOM 0 HA ASP A 14 -4.684 -6.821 -5.353 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -2.050 -7.921 -6.421 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -3.266 -8.820 -5.535 1.00 0.00 H new ATOM 234 N PHE A 15 -3.304 -6.897 -3.240 1.00 0.00 N ATOM 235 CA PHE A 15 -2.670 -6.636 -1.957 1.00 0.00 C ATOM 236 C PHE A 15 -2.627 -7.901 -1.112 1.00 0.00 C ATOM 237 O PHE A 15 -3.667 -8.465 -0.772 1.00 0.00 O ATOM 238 CB PHE A 15 -3.421 -5.528 -1.214 1.00 0.00 C ATOM 239 CG PHE A 15 -2.956 -5.317 0.197 1.00 0.00 C ATOM 240 CD1 PHE A 15 -1.710 -4.774 0.458 1.00 0.00 C ATOM 241 CD2 PHE A 15 -3.771 -5.663 1.263 1.00 0.00 C ATOM 242 CE1 PHE A 15 -1.286 -4.581 1.758 1.00 0.00 C ATOM 243 CE2 PHE A 15 -3.354 -5.472 2.564 1.00 0.00 C ATOM 244 CZ PHE A 15 -2.109 -4.929 2.813 1.00 0.00 C ATOM 0 H PHE A 15 -4.119 -7.508 -3.188 1.00 0.00 H new ATOM 0 HA PHE A 15 -1.646 -6.309 -2.138 1.00 0.00 H new ATOM 0 HB2 PHE A 15 -3.310 -4.595 -1.766 1.00 0.00 H new ATOM 0 HB3 PHE A 15 -4.484 -5.768 -1.203 1.00 0.00 H new ATOM 0 HD1 PHE A 15 -1.064 -4.499 -0.362 1.00 0.00 H new ATOM 0 HD2 PHE A 15 -4.746 -6.088 1.073 1.00 0.00 H new ATOM 0 HE1 PHE A 15 -0.311 -4.158 1.951 1.00 0.00 H new ATOM 0 HE2 PHE A 15 -3.999 -5.746 3.385 1.00 0.00 H new ATOM 0 HZ PHE A 15 -1.779 -4.776 3.830 1.00 0.00 H new ATOM 254 N MET A 16 -1.426 -8.347 -0.782 1.00 0.00 N ATOM 255 CA MET A 16 -1.267 -9.517 0.068 1.00 0.00 C ATOM 256 C MET A 16 -0.935 -9.086 1.490 1.00 0.00 C ATOM 257 O MET A 16 -0.055 -8.250 1.713 1.00 0.00 O ATOM 258 CB MET A 16 -0.189 -10.464 -0.480 1.00 0.00 C ATOM 259 CG MET A 16 1.207 -9.866 -0.509 1.00 0.00 C ATOM 260 SD MET A 16 2.429 -10.968 -1.254 1.00 0.00 S ATOM 261 CE MET A 16 1.728 -11.197 -2.889 1.00 0.00 C ATOM 0 H MET A 16 -0.551 -7.920 -1.087 1.00 0.00 H new ATOM 0 HA MET A 16 -2.210 -10.064 0.076 1.00 0.00 H new ATOM 0 HB2 MET A 16 -0.172 -11.368 0.128 1.00 0.00 H new ATOM 0 HB3 MET A 16 -0.465 -10.765 -1.491 1.00 0.00 H new ATOM 0 HG2 MET A 16 1.184 -8.929 -1.065 1.00 0.00 H new ATOM 0 HG3 MET A 16 1.515 -9.625 0.509 1.00 0.00 H new ATOM 0 HE1 MET A 16 2.515 -11.490 -3.584 1.00 0.00 H new ATOM 0 HE2 MET A 16 0.967 -11.977 -2.853 1.00 0.00 H new ATOM 0 HE3 MET A 16 1.276 -10.264 -3.225 1.00 0.00 H new ATOM 271 N ALA A 17 -1.651 -9.646 2.448 1.00 0.00 N ATOM 272 CA ALA A 17 -1.481 -9.273 3.841 1.00 0.00 C ATOM 273 C ALA A 17 -0.578 -10.257 4.570 1.00 0.00 C ATOM 274 O ALA A 17 -0.576 -11.453 4.275 1.00 0.00 O ATOM 275 CB ALA A 17 -2.832 -9.198 4.524 1.00 0.00 C ATOM 0 H ALA A 17 -2.358 -10.363 2.286 1.00 0.00 H new ATOM 0 HA ALA A 17 -1.005 -8.293 3.875 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -2.697 -8.918 5.569 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -3.451 -8.452 4.025 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -3.322 -10.170 4.470 1.00 0.00 H new ATOM 281 N GLU A 18 0.193 -9.747 5.518 1.00 0.00 N ATOM 282 CA GLU A 18 1.048 -10.590 6.338 1.00 0.00 C ATOM 283 C GLU A 18 0.415 -10.761 7.715 1.00 0.00 C ATOM 284 O GLU A 18 0.644 -11.753 8.408 1.00 0.00 O ATOM 285 CB GLU A 18 2.451 -9.980 6.442 1.00 0.00 C ATOM 286 CG GLU A 18 3.449 -10.826 7.218 1.00 0.00 C ATOM 287 CD GLU A 18 3.504 -12.263 6.734 1.00 0.00 C ATOM 288 OE1 GLU A 18 3.675 -12.485 5.517 1.00 0.00 O ATOM 289 OE2 GLU A 18 3.389 -13.179 7.574 1.00 0.00 O ATOM 0 H GLU A 18 0.244 -8.752 5.738 1.00 0.00 H new ATOM 0 HA GLU A 18 1.148 -11.572 5.876 1.00 0.00 H new ATOM 0 HB2 GLU A 18 2.838 -9.815 5.436 1.00 0.00 H new ATOM 0 HB3 GLU A 18 2.374 -9.002 6.918 1.00 0.00 H new ATOM 0 HG2 GLU A 18 4.440 -10.380 7.132 1.00 0.00 H new ATOM 0 HG3 GLU A 18 3.184 -10.813 8.275 1.00 0.00 H new ATOM 296 N SER A 19 -0.402 -9.791 8.095 1.00 0.00 N ATOM 297 CA SER A 19 -1.165 -9.875 9.325 1.00 0.00 C ATOM 298 C SER A 19 -2.635 -10.075 8.984 1.00 0.00 C ATOM 299 O SER A 19 -3.117 -9.528 7.994 1.00 0.00 O ATOM 300 CB SER A 19 -0.976 -8.599 10.144 1.00 0.00 C ATOM 301 OG SER A 19 0.401 -8.321 10.328 1.00 0.00 O ATOM 0 H SER A 19 -0.552 -8.933 7.564 1.00 0.00 H new ATOM 0 HA SER A 19 -0.815 -10.719 9.919 1.00 0.00 H new ATOM 0 HB2 SER A 19 -1.457 -7.762 9.638 1.00 0.00 H new ATOM 0 HB3 SER A 19 -1.463 -8.708 11.113 1.00 0.00 H new ATOM 0 HG SER A 19 0.502 -7.500 10.853 1.00 0.00 H new ATOM 307 N GLN A 20 -3.352 -10.843 9.797 1.00 0.00 N ATOM 308 CA GLN A 20 -4.753 -11.147 9.508 1.00 0.00 C ATOM 309 C GLN A 20 -5.626 -9.925 9.785 1.00 0.00 C ATOM 310 O GLN A 20 -6.820 -9.906 9.480 1.00 0.00 O ATOM 311 CB GLN A 20 -5.232 -12.340 10.337 1.00 0.00 C ATOM 312 CG GLN A 20 -6.490 -12.995 9.791 1.00 0.00 C ATOM 313 CD GLN A 20 -6.273 -13.617 8.425 1.00 0.00 C ATOM 314 OE1 GLN A 20 -6.453 -12.969 7.391 1.00 0.00 O ATOM 315 NE2 GLN A 20 -5.875 -14.879 8.413 1.00 0.00 N ATOM 0 H GLN A 20 -2.993 -11.264 10.654 1.00 0.00 H new ATOM 0 HA GLN A 20 -4.837 -11.408 8.453 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -4.436 -13.083 10.382 1.00 0.00 H new ATOM 0 HB3 GLN A 20 -5.419 -12.010 11.359 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -6.828 -13.763 10.487 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -7.284 -12.252 9.726 1.00 0.00 H new ATOM 0 HE21 GLN A 20 -5.738 -15.379 9.291 1.00 0.00 H new ATOM 0 HE22 GLN A 20 -5.705 -15.352 7.525 1.00 0.00 H new ATOM 324 N ASP A 21 -5.011 -8.914 10.385 1.00 0.00 N ATOM 325 CA ASP A 21 -5.653 -7.621 10.593 1.00 0.00 C ATOM 326 C ASP A 21 -5.818 -6.917 9.254 1.00 0.00 C ATOM 327 O ASP A 21 -6.719 -6.099 9.062 1.00 0.00 O ATOM 328 CB ASP A 21 -4.808 -6.752 11.530 1.00 0.00 C ATOM 329 CG ASP A 21 -4.558 -7.408 12.871 1.00 0.00 C ATOM 330 OD1 ASP A 21 -3.670 -8.288 12.954 1.00 0.00 O ATOM 331 OD2 ASP A 21 -5.249 -7.055 13.848 1.00 0.00 O ATOM 0 H ASP A 21 -4.056 -8.966 10.740 1.00 0.00 H new ATOM 0 HA ASP A 21 -6.631 -7.780 11.048 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -3.852 -6.534 11.053 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -5.311 -5.798 11.686 1.00 0.00 H new ATOM 336 N GLU A 22 -4.933 -7.256 8.330 1.00 0.00 N ATOM 337 CA GLU A 22 -4.951 -6.690 6.996 1.00 0.00 C ATOM 338 C GLU A 22 -5.710 -7.632 6.067 1.00 0.00 C ATOM 339 O GLU A 22 -5.699 -8.849 6.264 1.00 0.00 O ATOM 340 CB GLU A 22 -3.516 -6.479 6.508 1.00 0.00 C ATOM 341 CG GLU A 22 -2.646 -5.724 7.501 1.00 0.00 C ATOM 342 CD GLU A 22 -1.179 -5.726 7.116 1.00 0.00 C ATOM 343 OE1 GLU A 22 -0.672 -6.789 6.687 1.00 0.00 O ATOM 344 OE2 GLU A 22 -0.516 -4.680 7.271 1.00 0.00 O ATOM 0 H GLU A 22 -4.184 -7.931 8.486 1.00 0.00 H new ATOM 0 HA GLU A 22 -5.454 -5.723 7.004 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -3.063 -7.449 6.304 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -3.537 -5.932 5.565 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -2.996 -4.694 7.575 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -2.758 -6.171 8.489 1.00 0.00 H new ATOM 351 N LEU A 23 -6.369 -7.081 5.066 1.00 0.00 N ATOM 352 CA LEU A 23 -7.235 -7.877 4.209 1.00 0.00 C ATOM 353 C LEU A 23 -6.567 -8.166 2.869 1.00 0.00 C ATOM 354 O LEU A 23 -6.360 -7.261 2.062 1.00 0.00 O ATOM 355 CB LEU A 23 -8.570 -7.155 3.992 1.00 0.00 C ATOM 356 CG LEU A 23 -9.627 -7.943 3.212 1.00 0.00 C ATOM 357 CD1 LEU A 23 -9.990 -9.225 3.945 1.00 0.00 C ATOM 358 CD2 LEU A 23 -10.864 -7.085 2.987 1.00 0.00 C ATOM 0 H LEU A 23 -6.324 -6.091 4.825 1.00 0.00 H new ATOM 0 HA LEU A 23 -7.422 -8.829 4.705 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -8.983 -6.892 4.966 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -8.376 -6.221 3.465 1.00 0.00 H new ATOM 0 HG LEU A 23 -9.211 -8.214 2.241 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -10.742 -9.770 3.374 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -9.100 -9.845 4.057 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -10.388 -8.981 4.930 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -11.607 -7.657 2.432 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -11.280 -6.787 3.949 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -10.592 -6.196 2.419 1.00 0.00 H new ATOM 370 N THR A 24 -6.219 -9.426 2.649 1.00 0.00 N ATOM 371 CA THR A 24 -5.647 -9.852 1.379 1.00 0.00 C ATOM 372 C THR A 24 -6.696 -9.760 0.270 1.00 0.00 C ATOM 373 O THR A 24 -7.676 -10.510 0.258 1.00 0.00 O ATOM 374 CB THR A 24 -5.110 -11.294 1.473 1.00 0.00 C ATOM 375 OG1 THR A 24 -4.219 -11.407 2.592 1.00 0.00 O ATOM 376 CG2 THR A 24 -4.376 -11.692 0.199 1.00 0.00 C ATOM 0 H THR A 24 -6.323 -10.173 3.335 1.00 0.00 H new ATOM 0 HA THR A 24 -4.815 -9.188 1.142 1.00 0.00 H new ATOM 0 HB THR A 24 -5.959 -11.964 1.605 1.00 0.00 H new ATOM 0 HG1 THR A 24 -3.881 -12.325 2.650 1.00 0.00 H new ATOM 0 HG21 THR A 24 -4.009 -12.714 0.295 1.00 0.00 H new ATOM 0 HG22 THR A 24 -5.058 -11.630 -0.649 1.00 0.00 H new ATOM 0 HG23 THR A 24 -3.535 -11.018 0.038 1.00 0.00 H new ATOM 384 N ILE A 25 -6.488 -8.829 -0.648 1.00 0.00 N ATOM 385 CA ILE A 25 -7.452 -8.558 -1.701 1.00 0.00 C ATOM 386 C ILE A 25 -6.837 -8.763 -3.078 1.00 0.00 C ATOM 387 O ILE A 25 -5.643 -8.528 -3.282 1.00 0.00 O ATOM 388 CB ILE A 25 -8.007 -7.122 -1.593 1.00 0.00 C ATOM 389 CG1 ILE A 25 -6.860 -6.107 -1.553 1.00 0.00 C ATOM 390 CG2 ILE A 25 -8.886 -6.987 -0.358 1.00 0.00 C ATOM 391 CD1 ILE A 25 -7.318 -4.676 -1.389 1.00 0.00 C ATOM 0 H ILE A 25 -5.653 -8.245 -0.684 1.00 0.00 H new ATOM 0 HA ILE A 25 -8.272 -9.264 -1.573 1.00 0.00 H new ATOM 0 HB ILE A 25 -8.616 -6.916 -2.474 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -6.191 -6.361 -0.731 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -6.281 -6.190 -2.473 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -9.271 -5.969 -0.295 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -9.719 -7.686 -0.426 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -8.298 -7.209 0.533 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -6.451 -4.016 -1.369 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -7.963 -4.402 -2.224 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -7.871 -4.576 -0.455 1.00 0.00 H new ATOM 403 N LYS A 26 -7.658 -9.213 -4.012 1.00 0.00 N ATOM 404 CA LYS A 26 -7.218 -9.462 -5.373 1.00 0.00 C ATOM 405 C LYS A 26 -7.904 -8.494 -6.323 1.00 0.00 C ATOM 406 O LYS A 26 -9.056 -8.125 -6.109 1.00 0.00 O ATOM 407 CB LYS A 26 -7.543 -10.901 -5.776 1.00 0.00 C ATOM 408 CG LYS A 26 -6.861 -11.954 -4.917 1.00 0.00 C ATOM 409 CD LYS A 26 -7.373 -13.357 -5.219 1.00 0.00 C ATOM 410 CE LYS A 26 -8.674 -13.671 -4.483 1.00 0.00 C ATOM 411 NZ LYS A 26 -9.816 -12.829 -4.929 1.00 0.00 N ATOM 0 H LYS A 26 -8.644 -9.415 -3.849 1.00 0.00 H new ATOM 0 HA LYS A 26 -6.139 -9.314 -5.427 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -8.622 -11.047 -5.723 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -7.252 -11.051 -6.816 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -5.785 -11.917 -5.085 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -7.027 -11.726 -3.864 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -7.532 -13.460 -6.292 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -6.614 -14.087 -4.937 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -8.925 -14.721 -4.633 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -8.522 -13.529 -3.413 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -10.710 -13.321 -4.726 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -9.797 -11.922 -4.421 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -9.741 -12.655 -5.952 1.00 0.00 H new ATOM 425 N SER A 27 -7.199 -8.089 -7.366 1.00 0.00 N ATOM 426 CA SER A 27 -7.738 -7.146 -8.332 1.00 0.00 C ATOM 427 C SER A 27 -9.000 -7.701 -8.989 1.00 0.00 C ATOM 428 O SER A 27 -8.982 -8.779 -9.591 1.00 0.00 O ATOM 429 CB SER A 27 -6.675 -6.805 -9.381 1.00 0.00 C ATOM 430 OG SER A 27 -5.996 -7.969 -9.830 1.00 0.00 O ATOM 0 H SER A 27 -6.248 -8.400 -7.566 1.00 0.00 H new ATOM 0 HA SER A 27 -8.014 -6.230 -7.810 1.00 0.00 H new ATOM 0 HB2 SER A 27 -7.145 -6.307 -10.229 1.00 0.00 H new ATOM 0 HB3 SER A 27 -5.956 -6.103 -8.958 1.00 0.00 H new ATOM 0 HG SER A 27 -6.645 -8.687 -9.986 1.00 0.00 H new ATOM 436 N GLY A 28 -10.093 -6.963 -8.857 1.00 0.00 N ATOM 437 CA GLY A 28 -11.362 -7.411 -9.391 1.00 0.00 C ATOM 438 C GLY A 28 -12.362 -7.763 -8.305 1.00 0.00 C ATOM 439 O GLY A 28 -13.559 -7.892 -8.578 1.00 0.00 O ATOM 0 H GLY A 28 -10.123 -6.058 -8.387 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -11.781 -6.630 -10.026 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -11.198 -8.283 -10.025 1.00 0.00 H new ATOM 443 N ASP A 29 -11.879 -7.916 -7.072 1.00 0.00 N ATOM 444 CA ASP A 29 -12.759 -8.201 -5.938 1.00 0.00 C ATOM 445 C ASP A 29 -13.598 -6.978 -5.601 1.00 0.00 C ATOM 446 O ASP A 29 -13.200 -5.843 -5.879 1.00 0.00 O ATOM 447 CB ASP A 29 -11.964 -8.628 -4.698 1.00 0.00 C ATOM 448 CG ASP A 29 -11.321 -9.993 -4.837 1.00 0.00 C ATOM 449 OD1 ASP A 29 -11.860 -10.842 -5.580 1.00 0.00 O ATOM 450 OD2 ASP A 29 -10.268 -10.229 -4.203 1.00 0.00 O ATOM 0 H ASP A 29 -10.890 -7.848 -6.833 1.00 0.00 H new ATOM 0 HA ASP A 29 -13.409 -9.026 -6.230 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -11.189 -7.888 -4.500 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -12.628 -8.634 -3.834 1.00 0.00 H new ATOM 455 N LYS A 30 -14.759 -7.207 -5.008 1.00 0.00 N ATOM 456 CA LYS A 30 -15.647 -6.119 -4.634 1.00 0.00 C ATOM 457 C LYS A 30 -15.512 -5.830 -3.144 1.00 0.00 C ATOM 458 O LYS A 30 -15.577 -6.750 -2.324 1.00 0.00 O ATOM 459 CB LYS A 30 -17.098 -6.482 -4.956 1.00 0.00 C ATOM 460 CG LYS A 30 -17.297 -7.091 -6.334 1.00 0.00 C ATOM 461 CD LYS A 30 -16.826 -6.163 -7.439 1.00 0.00 C ATOM 462 CE LYS A 30 -17.033 -6.786 -8.808 1.00 0.00 C ATOM 463 NZ LYS A 30 -16.268 -8.053 -8.973 1.00 0.00 N ATOM 0 H LYS A 30 -15.108 -8.137 -4.776 1.00 0.00 H new ATOM 0 HA LYS A 30 -15.370 -5.231 -5.203 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -17.460 -7.184 -4.205 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -17.712 -5.585 -4.876 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -16.753 -8.034 -6.396 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -18.352 -7.322 -6.480 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -17.369 -5.220 -7.381 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -15.770 -5.932 -7.298 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -18.094 -6.983 -8.959 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -16.728 -6.077 -9.578 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -16.230 -8.307 -9.981 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -15.301 -7.924 -8.612 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -16.737 -8.814 -8.441 1.00 0.00 H new ATOM 477 N VAL A 31 -15.321 -4.565 -2.782 1.00 0.00 N ATOM 478 CA VAL A 31 -15.176 -4.204 -1.375 1.00 0.00 C ATOM 479 C VAL A 31 -16.071 -3.027 -0.987 1.00 0.00 C ATOM 480 O VAL A 31 -16.386 -2.168 -1.809 1.00 0.00 O ATOM 481 CB VAL A 31 -13.707 -3.867 -1.015 1.00 0.00 C ATOM 482 CG1 VAL A 31 -12.826 -5.103 -1.119 1.00 0.00 C ATOM 483 CG2 VAL A 31 -13.167 -2.755 -1.903 1.00 0.00 C ATOM 0 H VAL A 31 -15.264 -3.782 -3.433 1.00 0.00 H new ATOM 0 HA VAL A 31 -15.488 -5.081 -0.809 1.00 0.00 H new ATOM 0 HB VAL A 31 -13.690 -3.518 0.017 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -11.800 -4.841 -0.862 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -13.189 -5.867 -0.432 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -12.857 -5.488 -2.138 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -12.135 -2.539 -1.628 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -13.207 -3.070 -2.946 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -13.772 -1.858 -1.772 1.00 0.00 H new ATOM 493 N TYR A 32 -16.512 -3.034 0.263 1.00 0.00 N ATOM 494 CA TYR A 32 -17.200 -1.898 0.860 1.00 0.00 C ATOM 495 C TYR A 32 -16.217 -1.091 1.689 1.00 0.00 C ATOM 496 O TYR A 32 -15.521 -1.644 2.539 1.00 0.00 O ATOM 497 CB TYR A 32 -18.349 -2.356 1.765 1.00 0.00 C ATOM 498 CG TYR A 32 -19.689 -2.457 1.079 1.00 0.00 C ATOM 499 CD1 TYR A 32 -20.428 -1.316 0.790 1.00 0.00 C ATOM 500 CD2 TYR A 32 -20.223 -3.689 0.730 1.00 0.00 C ATOM 501 CE1 TYR A 32 -21.657 -1.402 0.170 1.00 0.00 C ATOM 502 CE2 TYR A 32 -21.453 -3.783 0.109 1.00 0.00 C ATOM 503 CZ TYR A 32 -22.165 -2.636 -0.167 1.00 0.00 C ATOM 504 OH TYR A 32 -23.390 -2.724 -0.787 1.00 0.00 O ATOM 0 H TYR A 32 -16.403 -3.829 0.893 1.00 0.00 H new ATOM 0 HA TYR A 32 -17.611 -1.290 0.054 1.00 0.00 H new ATOM 0 HB2 TYR A 32 -18.097 -3.330 2.185 1.00 0.00 H new ATOM 0 HB3 TYR A 32 -18.435 -1.661 2.600 1.00 0.00 H new ATOM 0 HD1 TYR A 32 -20.033 -0.346 1.055 1.00 0.00 H new ATOM 0 HD2 TYR A 32 -19.668 -4.589 0.948 1.00 0.00 H new ATOM 0 HE1 TYR A 32 -22.218 -0.506 -0.050 1.00 0.00 H new ATOM 0 HE2 TYR A 32 -21.854 -4.749 -0.159 1.00 0.00 H new ATOM 0 HH TYR A 32 -23.759 -1.825 -0.912 1.00 0.00 H new ATOM 514 N ILE A 33 -16.156 0.204 1.448 1.00 0.00 N ATOM 515 CA ILE A 33 -15.275 1.072 2.208 1.00 0.00 C ATOM 516 C ILE A 33 -15.952 1.473 3.513 1.00 0.00 C ATOM 517 O ILE A 33 -16.753 2.406 3.550 1.00 0.00 O ATOM 518 CB ILE A 33 -14.887 2.334 1.410 1.00 0.00 C ATOM 519 CG1 ILE A 33 -14.338 1.940 0.035 1.00 0.00 C ATOM 520 CG2 ILE A 33 -13.853 3.146 2.179 1.00 0.00 C ATOM 521 CD1 ILE A 33 -14.031 3.120 -0.861 1.00 0.00 C ATOM 0 H ILE A 33 -16.706 0.679 0.732 1.00 0.00 H new ATOM 0 HA ILE A 33 -14.360 0.519 2.419 1.00 0.00 H new ATOM 0 HB ILE A 33 -15.777 2.948 1.269 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -13.430 1.353 0.171 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -15.062 1.296 -0.464 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -13.588 4.034 1.605 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -14.268 3.446 3.141 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -12.962 2.540 2.342 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -13.647 2.761 -1.816 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -14.941 3.696 -1.029 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -13.284 3.754 -0.384 1.00 0.00 H new ATOM 533 N LEU A 34 -15.640 0.738 4.569 1.00 0.00 N ATOM 534 CA LEU A 34 -16.259 0.943 5.870 1.00 0.00 C ATOM 535 C LEU A 34 -15.866 2.296 6.450 1.00 0.00 C ATOM 536 O LEU A 34 -16.723 3.132 6.739 1.00 0.00 O ATOM 537 CB LEU A 34 -15.844 -0.174 6.831 1.00 0.00 C ATOM 538 CG LEU A 34 -16.169 -1.596 6.366 1.00 0.00 C ATOM 539 CD1 LEU A 34 -15.660 -2.614 7.374 1.00 0.00 C ATOM 540 CD2 LEU A 34 -17.667 -1.761 6.157 1.00 0.00 C ATOM 0 H LEU A 34 -14.953 -0.015 4.549 1.00 0.00 H new ATOM 0 HA LEU A 34 -17.341 0.923 5.740 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -14.770 -0.103 7.002 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -16.331 -0.004 7.791 1.00 0.00 H new ATOM 0 HG LEU A 34 -15.667 -1.769 5.414 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -15.899 -3.620 7.028 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -14.580 -2.514 7.479 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -16.136 -2.440 8.339 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -17.878 -2.778 5.827 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -18.189 -1.568 7.094 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -18.009 -1.055 5.400 1.00 0.00 H new ATOM 552 N ASP A 35 -14.568 2.507 6.622 1.00 0.00 N ATOM 553 CA ASP A 35 -14.068 3.770 7.143 1.00 0.00 C ATOM 554 C ASP A 35 -13.026 4.362 6.210 1.00 0.00 C ATOM 555 O ASP A 35 -11.866 3.933 6.199 1.00 0.00 O ATOM 556 CB ASP A 35 -13.482 3.600 8.550 1.00 0.00 C ATOM 557 CG ASP A 35 -14.544 3.508 9.629 1.00 0.00 C ATOM 558 OD1 ASP A 35 -15.170 2.435 9.770 1.00 0.00 O ATOM 559 OD2 ASP A 35 -14.740 4.504 10.361 1.00 0.00 O ATOM 0 H ASP A 35 -13.844 1.821 6.409 1.00 0.00 H new ATOM 0 HA ASP A 35 -14.912 4.457 7.207 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -12.868 2.700 8.575 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -12.824 4.441 8.767 1.00 0.00 H new ATOM 564 N ASP A 36 -13.469 5.321 5.405 1.00 0.00 N ATOM 565 CA ASP A 36 -12.592 6.088 4.524 1.00 0.00 C ATOM 566 C ASP A 36 -12.104 7.340 5.238 1.00 0.00 C ATOM 567 O ASP A 36 -11.170 8.008 4.798 1.00 0.00 O ATOM 568 CB ASP A 36 -13.344 6.482 3.246 1.00 0.00 C ATOM 569 CG ASP A 36 -14.610 7.273 3.533 1.00 0.00 C ATOM 570 OD1 ASP A 36 -15.611 6.663 3.975 1.00 0.00 O ATOM 571 OD2 ASP A 36 -14.619 8.500 3.309 1.00 0.00 O ATOM 0 H ASP A 36 -14.451 5.591 5.344 1.00 0.00 H new ATOM 0 HA ASP A 36 -11.734 5.470 4.257 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -12.686 7.074 2.610 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -13.601 5.582 2.688 1.00 0.00 H new ATOM 576 N LYS A 37 -12.745 7.639 6.356 1.00 0.00 N ATOM 577 CA LYS A 37 -12.426 8.826 7.133 1.00 0.00 C ATOM 578 C LYS A 37 -11.542 8.474 8.321 1.00 0.00 C ATOM 579 O LYS A 37 -11.303 9.302 9.202 1.00 0.00 O ATOM 580 CB LYS A 37 -13.715 9.491 7.617 1.00 0.00 C ATOM 581 CG LYS A 37 -14.627 9.927 6.485 1.00 0.00 C ATOM 582 CD LYS A 37 -15.917 10.527 7.011 1.00 0.00 C ATOM 583 CE LYS A 37 -16.785 11.053 5.882 1.00 0.00 C ATOM 584 NZ LYS A 37 -16.094 12.109 5.094 1.00 0.00 N ATOM 0 H LYS A 37 -13.496 7.071 6.748 1.00 0.00 H new ATOM 0 HA LYS A 37 -11.880 9.521 6.495 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -14.254 8.797 8.262 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -13.462 10.359 8.225 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -14.112 10.658 5.862 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -14.855 9.071 5.850 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -16.467 9.773 7.574 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -15.687 11.337 7.703 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -17.060 10.230 5.222 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -17.711 11.455 6.293 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -16.742 12.908 4.941 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -15.256 12.438 5.615 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -15.800 11.720 4.175 1.00 0.00 H new ATOM 598 N LYS A 38 -11.058 7.241 8.345 1.00 0.00 N ATOM 599 CA LYS A 38 -10.222 6.782 9.441 1.00 0.00 C ATOM 600 C LYS A 38 -8.802 7.308 9.284 1.00 0.00 C ATOM 601 O LYS A 38 -8.235 7.882 10.214 1.00 0.00 O ATOM 602 CB LYS A 38 -10.199 5.252 9.499 1.00 0.00 C ATOM 603 CG LYS A 38 -9.524 4.705 10.750 1.00 0.00 C ATOM 604 CD LYS A 38 -9.349 3.196 10.684 1.00 0.00 C ATOM 605 CE LYS A 38 -8.302 2.798 9.654 1.00 0.00 C ATOM 606 NZ LYS A 38 -6.939 3.255 10.035 1.00 0.00 N ATOM 0 H LYS A 38 -11.230 6.544 7.621 1.00 0.00 H new ATOM 0 HA LYS A 38 -10.644 7.165 10.370 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -11.222 4.879 9.454 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -9.681 4.870 8.619 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -8.550 5.179 10.874 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -10.118 4.964 11.626 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -9.057 2.820 11.664 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -10.302 2.729 10.434 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -8.301 1.714 9.539 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -8.568 3.221 8.685 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -6.251 2.501 9.835 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -6.691 4.103 9.487 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -6.920 3.481 11.050 1.00 0.00 H new ATOM 620 N SER A 39 -8.245 7.139 8.095 1.00 0.00 N ATOM 621 CA SER A 39 -6.861 7.501 7.848 1.00 0.00 C ATOM 622 C SER A 39 -6.682 8.015 6.425 1.00 0.00 C ATOM 623 O SER A 39 -7.636 8.058 5.644 1.00 0.00 O ATOM 624 CB SER A 39 -5.959 6.289 8.086 1.00 0.00 C ATOM 625 OG SER A 39 -6.161 5.751 9.382 1.00 0.00 O ATOM 0 H SER A 39 -8.732 6.753 7.286 1.00 0.00 H new ATOM 0 HA SER A 39 -6.582 8.299 8.537 1.00 0.00 H new ATOM 0 HB2 SER A 39 -6.164 5.526 7.336 1.00 0.00 H new ATOM 0 HB3 SER A 39 -4.915 6.579 7.968 1.00 0.00 H new ATOM 0 HG SER A 39 -5.448 6.060 9.979 1.00 0.00 H new ATOM 631 N LYS A 40 -5.461 8.406 6.097 1.00 0.00 N ATOM 632 CA LYS A 40 -5.143 8.922 4.775 1.00 0.00 C ATOM 633 C LYS A 40 -4.761 7.794 3.826 1.00 0.00 C ATOM 634 O LYS A 40 -5.126 7.802 2.649 1.00 0.00 O ATOM 635 CB LYS A 40 -3.976 9.906 4.871 1.00 0.00 C ATOM 636 CG LYS A 40 -4.256 11.127 5.735 1.00 0.00 C ATOM 637 CD LYS A 40 -5.148 12.130 5.022 1.00 0.00 C ATOM 638 CE LYS A 40 -4.491 12.660 3.754 1.00 0.00 C ATOM 639 NZ LYS A 40 -3.150 13.251 4.020 1.00 0.00 N ATOM 0 H LYS A 40 -4.666 8.375 6.736 1.00 0.00 H new ATOM 0 HA LYS A 40 -6.028 9.425 4.387 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -3.107 9.383 5.272 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -3.713 10.239 3.867 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -4.732 10.813 6.664 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -3.314 11.605 6.005 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -6.098 11.659 4.771 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -5.371 12.961 5.692 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -4.392 11.849 3.032 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -5.135 13.414 3.301 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -2.822 13.762 3.175 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -3.214 13.911 4.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -2.476 12.493 4.250 1.00 0.00 H new ATOM 653 N ASP A 41 -4.027 6.826 4.351 1.00 0.00 N ATOM 654 CA ASP A 41 -3.443 5.771 3.533 1.00 0.00 C ATOM 655 C ASP A 41 -4.120 4.419 3.740 1.00 0.00 C ATOM 656 O ASP A 41 -4.253 3.644 2.796 1.00 0.00 O ATOM 657 CB ASP A 41 -1.940 5.655 3.815 1.00 0.00 C ATOM 658 CG ASP A 41 -1.585 5.818 5.281 1.00 0.00 C ATOM 659 OD1 ASP A 41 -2.439 5.531 6.150 1.00 0.00 O ATOM 660 OD2 ASP A 41 -0.457 6.267 5.568 1.00 0.00 O ATOM 0 H ASP A 41 -3.820 6.748 5.347 1.00 0.00 H new ATOM 0 HA ASP A 41 -3.603 6.052 2.492 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -1.588 4.683 3.470 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -1.410 6.410 3.235 1.00 0.00 H new ATOM 665 N TRP A 42 -4.532 4.124 4.960 1.00 0.00 N ATOM 666 CA TRP A 42 -5.170 2.845 5.248 1.00 0.00 C ATOM 667 C TRP A 42 -6.646 3.017 5.569 1.00 0.00 C ATOM 668 O TRP A 42 -7.015 3.737 6.500 1.00 0.00 O ATOM 669 CB TRP A 42 -4.461 2.134 6.401 1.00 0.00 C ATOM 670 CG TRP A 42 -3.094 1.641 6.040 1.00 0.00 C ATOM 671 CD1 TRP A 42 -1.931 2.353 6.069 1.00 0.00 C ATOM 672 CD2 TRP A 42 -2.748 0.326 5.595 1.00 0.00 C ATOM 673 NE1 TRP A 42 -0.884 1.560 5.671 1.00 0.00 N ATOM 674 CE2 TRP A 42 -1.358 0.312 5.373 1.00 0.00 C ATOM 675 CE3 TRP A 42 -3.477 -0.843 5.364 1.00 0.00 C ATOM 676 CZ2 TRP A 42 -0.686 -0.822 4.930 1.00 0.00 C ATOM 677 CZ3 TRP A 42 -2.807 -1.968 4.924 1.00 0.00 C ATOM 678 CH2 TRP A 42 -1.425 -1.951 4.713 1.00 0.00 C ATOM 0 H TRP A 42 -4.439 4.745 5.764 1.00 0.00 H new ATOM 0 HA TRP A 42 -5.089 2.231 4.351 1.00 0.00 H new ATOM 0 HB2 TRP A 42 -4.382 2.817 7.247 1.00 0.00 H new ATOM 0 HB3 TRP A 42 -5.069 1.291 6.728 1.00 0.00 H new ATOM 0 HD1 TRP A 42 -1.846 3.389 6.362 1.00 0.00 H new ATOM 0 HE1 TRP A 42 0.091 1.854 5.608 1.00 0.00 H new ATOM 0 HE3 TRP A 42 -4.544 -0.867 5.526 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 0.381 -0.811 4.763 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 -3.361 -2.877 4.740 1.00 0.00 H new ATOM 0 HH2 TRP A 42 -0.931 -2.849 4.371 1.00 0.00 H new ATOM 689 N TRP A 43 -7.483 2.340 4.798 1.00 0.00 N ATOM 690 CA TRP A 43 -8.923 2.400 4.989 1.00 0.00 C ATOM 691 C TRP A 43 -9.456 1.052 5.446 1.00 0.00 C ATOM 692 O TRP A 43 -8.755 0.042 5.381 1.00 0.00 O ATOM 693 CB TRP A 43 -9.631 2.812 3.694 1.00 0.00 C ATOM 694 CG TRP A 43 -9.393 4.238 3.299 1.00 0.00 C ATOM 695 CD1 TRP A 43 -9.030 5.267 4.121 1.00 0.00 C ATOM 696 CD2 TRP A 43 -9.517 4.797 1.986 1.00 0.00 C ATOM 697 NE1 TRP A 43 -8.919 6.429 3.401 1.00 0.00 N ATOM 698 CE2 TRP A 43 -9.216 6.170 2.088 1.00 0.00 C ATOM 699 CE3 TRP A 43 -9.854 4.273 0.732 1.00 0.00 C ATOM 700 CZ2 TRP A 43 -9.241 7.021 0.987 1.00 0.00 C ATOM 701 CZ3 TRP A 43 -9.878 5.121 -0.358 1.00 0.00 C ATOM 702 CH2 TRP A 43 -9.575 6.482 -0.225 1.00 0.00 C ATOM 0 H TRP A 43 -7.187 1.739 4.029 1.00 0.00 H new ATOM 0 HA TRP A 43 -9.125 3.148 5.756 1.00 0.00 H new ATOM 0 HB2 TRP A 43 -9.297 2.161 2.886 1.00 0.00 H new ATOM 0 HB3 TRP A 43 -10.703 2.652 3.811 1.00 0.00 H new ATOM 0 HD1 TRP A 43 -8.856 5.178 5.183 1.00 0.00 H new ATOM 0 HE1 TRP A 43 -8.658 7.339 3.781 1.00 0.00 H new ATOM 0 HE3 TRP A 43 -10.091 3.225 0.619 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 -9.005 8.070 1.086 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 -10.135 4.728 -1.330 1.00 0.00 H new ATOM 0 HH2 TRP A 43 -9.606 7.119 -1.097 1.00 0.00 H new ATOM 713 N MET A 44 -10.695 1.043 5.912 1.00 0.00 N ATOM 714 CA MET A 44 -11.351 -0.203 6.283 1.00 0.00 C ATOM 715 C MET A 44 -12.197 -0.681 5.117 1.00 0.00 C ATOM 716 O MET A 44 -13.023 0.072 4.608 1.00 0.00 O ATOM 717 CB MET A 44 -12.252 -0.016 7.508 1.00 0.00 C ATOM 718 CG MET A 44 -11.569 0.644 8.691 1.00 0.00 C ATOM 719 SD MET A 44 -10.207 -0.332 9.358 1.00 0.00 S ATOM 720 CE MET A 44 -11.079 -1.792 9.926 1.00 0.00 C ATOM 0 H MET A 44 -11.265 1.879 6.042 1.00 0.00 H new ATOM 0 HA MET A 44 -10.583 -0.936 6.530 1.00 0.00 H new ATOM 0 HB2 MET A 44 -13.116 0.584 7.221 1.00 0.00 H new ATOM 0 HB3 MET A 44 -12.630 -0.990 7.819 1.00 0.00 H new ATOM 0 HG2 MET A 44 -11.193 1.621 8.387 1.00 0.00 H new ATOM 0 HG3 MET A 44 -12.304 0.816 9.477 1.00 0.00 H new ATOM 0 HE1 MET A 44 -10.712 -2.074 10.913 1.00 0.00 H new ATOM 0 HE2 MET A 44 -12.146 -1.579 9.983 1.00 0.00 H new ATOM 0 HE3 MET A 44 -10.909 -2.612 9.228 1.00 0.00 H new ATOM 730 N CYS A 45 -11.997 -1.908 4.678 1.00 0.00 N ATOM 731 CA CYS A 45 -12.810 -2.447 3.600 1.00 0.00 C ATOM 732 C CYS A 45 -13.350 -3.820 3.945 1.00 0.00 C ATOM 733 O CYS A 45 -12.707 -4.601 4.650 1.00 0.00 O ATOM 734 CB CYS A 45 -12.035 -2.484 2.283 1.00 0.00 C ATOM 735 SG CYS A 45 -11.798 -0.851 1.542 1.00 0.00 S ATOM 0 H CYS A 45 -11.289 -2.545 5.043 1.00 0.00 H new ATOM 0 HA CYS A 45 -13.660 -1.777 3.471 1.00 0.00 H new ATOM 0 HB2 CYS A 45 -11.061 -2.941 2.456 1.00 0.00 H new ATOM 0 HB3 CYS A 45 -12.565 -3.122 1.576 1.00 0.00 H new ATOM 0 HG CYS A 45 -12.199 0.065 2.373 1.00 0.00 H new ATOM 741 N GLN A 46 -14.550 -4.083 3.460 1.00 0.00 N ATOM 742 CA GLN A 46 -15.233 -5.338 3.698 1.00 0.00 C ATOM 743 C GLN A 46 -15.550 -6.009 2.366 1.00 0.00 C ATOM 744 O GLN A 46 -16.108 -5.380 1.472 1.00 0.00 O ATOM 745 CB GLN A 46 -16.521 -5.075 4.478 1.00 0.00 C ATOM 746 CG GLN A 46 -17.285 -6.331 4.849 1.00 0.00 C ATOM 747 CD GLN A 46 -18.614 -6.027 5.511 1.00 0.00 C ATOM 748 OE1 GLN A 46 -19.243 -5.008 5.229 1.00 0.00 O ATOM 749 NE2 GLN A 46 -19.048 -6.909 6.396 1.00 0.00 N ATOM 0 H GLN A 46 -15.080 -3.427 2.887 1.00 0.00 H new ATOM 0 HA GLN A 46 -14.593 -6.000 4.281 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -16.277 -4.528 5.389 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -17.169 -4.431 3.883 1.00 0.00 H new ATOM 0 HG2 GLN A 46 -17.457 -6.926 3.952 1.00 0.00 H new ATOM 0 HG3 GLN A 46 -16.678 -6.937 5.522 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -18.495 -7.741 6.600 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -19.936 -6.757 6.874 1.00 0.00 H new ATOM 758 N LEU A 47 -15.187 -7.276 2.232 1.00 0.00 N ATOM 759 CA LEU A 47 -15.422 -8.012 0.993 1.00 0.00 C ATOM 760 C LEU A 47 -16.914 -8.145 0.711 1.00 0.00 C ATOM 761 O LEU A 47 -17.651 -8.714 1.510 1.00 0.00 O ATOM 762 CB LEU A 47 -14.791 -9.406 1.067 1.00 0.00 C ATOM 763 CG LEU A 47 -13.269 -9.434 1.173 1.00 0.00 C ATOM 764 CD1 LEU A 47 -12.768 -10.865 1.290 1.00 0.00 C ATOM 765 CD2 LEU A 47 -12.636 -8.748 -0.027 1.00 0.00 C ATOM 0 H LEU A 47 -14.728 -7.818 2.964 1.00 0.00 H new ATOM 0 HA LEU A 47 -14.959 -7.450 0.182 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -15.207 -9.929 1.928 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -15.086 -9.967 0.180 1.00 0.00 H new ATOM 0 HG LEU A 47 -12.979 -8.891 2.073 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -11.681 -10.865 1.365 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -13.193 -11.328 2.181 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -13.071 -11.430 0.408 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -11.551 -8.778 0.067 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -12.936 -9.262 -0.940 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -12.968 -7.711 -0.070 1.00 0.00 H new ATOM 777 N VAL A 48 -17.344 -7.630 -0.432 1.00 0.00 N ATOM 778 CA VAL A 48 -18.739 -7.732 -0.851 1.00 0.00 C ATOM 779 C VAL A 48 -19.089 -9.187 -1.145 1.00 0.00 C ATOM 780 O VAL A 48 -20.220 -9.629 -0.933 1.00 0.00 O ATOM 781 CB VAL A 48 -19.008 -6.871 -2.112 1.00 0.00 C ATOM 782 CG1 VAL A 48 -20.423 -7.068 -2.641 1.00 0.00 C ATOM 783 CG2 VAL A 48 -18.757 -5.399 -1.821 1.00 0.00 C ATOM 0 H VAL A 48 -16.744 -7.134 -1.091 1.00 0.00 H new ATOM 0 HA VAL A 48 -19.363 -7.360 -0.038 1.00 0.00 H new ATOM 0 HB VAL A 48 -18.314 -7.203 -2.884 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -20.571 -6.447 -3.525 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -20.570 -8.115 -2.905 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -21.142 -6.783 -1.873 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -18.951 -4.812 -2.719 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -19.419 -5.068 -1.021 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -17.720 -5.260 -1.515 1.00 0.00 H new ATOM 793 N ASP A 49 -18.089 -9.929 -1.602 1.00 0.00 N ATOM 794 CA ASP A 49 -18.268 -11.321 -1.999 1.00 0.00 C ATOM 795 C ASP A 49 -18.207 -12.265 -0.799 1.00 0.00 C ATOM 796 O ASP A 49 -18.288 -13.484 -0.963 1.00 0.00 O ATOM 797 CB ASP A 49 -17.184 -11.726 -3.006 1.00 0.00 C ATOM 798 CG ASP A 49 -17.181 -10.869 -4.256 1.00 0.00 C ATOM 799 OD1 ASP A 49 -18.064 -11.065 -5.121 1.00 0.00 O ATOM 800 OD2 ASP A 49 -16.287 -10.007 -4.387 1.00 0.00 O ATOM 0 H ASP A 49 -17.134 -9.586 -1.708 1.00 0.00 H new ATOM 0 HA ASP A 49 -19.255 -11.403 -2.454 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -16.208 -11.660 -2.526 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -17.331 -12.769 -3.288 1.00 0.00 H new ATOM 805 N SER A 50 -18.073 -11.716 0.404 1.00 0.00 N ATOM 806 CA SER A 50 -17.882 -12.549 1.586 1.00 0.00 C ATOM 807 C SER A 50 -18.462 -11.902 2.845 1.00 0.00 C ATOM 808 O SER A 50 -19.385 -12.437 3.461 1.00 0.00 O ATOM 809 CB SER A 50 -16.387 -12.830 1.775 1.00 0.00 C ATOM 810 OG SER A 50 -16.143 -13.595 2.940 1.00 0.00 O ATOM 0 H SER A 50 -18.093 -10.712 0.585 1.00 0.00 H new ATOM 0 HA SER A 50 -18.419 -13.485 1.429 1.00 0.00 H new ATOM 0 HB2 SER A 50 -16.003 -13.361 0.904 1.00 0.00 H new ATOM 0 HB3 SER A 50 -15.844 -11.887 1.838 1.00 0.00 H new ATOM 0 HG SER A 50 -15.181 -13.757 3.029 1.00 0.00 H new ATOM 816 N GLY A 51 -17.927 -10.751 3.218 1.00 0.00 N ATOM 817 CA GLY A 51 -18.327 -10.113 4.454 1.00 0.00 C ATOM 818 C GLY A 51 -17.148 -9.895 5.380 1.00 0.00 C ATOM 819 O GLY A 51 -17.247 -9.162 6.363 1.00 0.00 O ATOM 0 H GLY A 51 -17.220 -10.245 2.685 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -18.798 -9.155 4.233 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -19.075 -10.728 4.955 1.00 0.00 H new ATOM 823 N LYS A 52 -16.032 -10.542 5.063 1.00 0.00 N ATOM 824 CA LYS A 52 -14.798 -10.375 5.825 1.00 0.00 C ATOM 825 C LYS A 52 -14.264 -8.955 5.661 1.00 0.00 C ATOM 826 O LYS A 52 -14.309 -8.394 4.565 1.00 0.00 O ATOM 827 CB LYS A 52 -13.747 -11.382 5.353 1.00 0.00 C ATOM 828 CG LYS A 52 -14.180 -12.831 5.496 1.00 0.00 C ATOM 829 CD LYS A 52 -13.157 -13.776 4.888 1.00 0.00 C ATOM 830 CE LYS A 52 -13.603 -15.224 4.995 1.00 0.00 C ATOM 831 NZ LYS A 52 -12.623 -16.151 4.371 1.00 0.00 N ATOM 0 H LYS A 52 -15.956 -11.191 4.279 1.00 0.00 H new ATOM 0 HA LYS A 52 -15.013 -10.553 6.879 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -13.511 -11.184 4.307 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -12.829 -11.229 5.921 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -14.317 -13.069 6.551 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -15.145 -12.974 5.009 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -13.000 -13.519 3.840 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -12.199 -13.651 5.393 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -13.735 -15.487 6.045 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -14.573 -15.342 4.512 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -12.963 -17.130 4.464 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -12.516 -15.916 3.364 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -11.704 -16.057 4.848 1.00 0.00 H new ATOM 845 N SER A 53 -13.761 -8.380 6.743 1.00 0.00 N ATOM 846 CA SER A 53 -13.272 -7.007 6.721 1.00 0.00 C ATOM 847 C SER A 53 -11.800 -6.955 7.129 1.00 0.00 C ATOM 848 O SER A 53 -11.287 -7.896 7.736 1.00 0.00 O ATOM 849 CB SER A 53 -14.107 -6.149 7.673 1.00 0.00 C ATOM 850 OG SER A 53 -15.486 -6.465 7.564 1.00 0.00 O ATOM 0 H SER A 53 -13.680 -8.842 7.649 1.00 0.00 H new ATOM 0 HA SER A 53 -13.364 -6.618 5.707 1.00 0.00 H new ATOM 0 HB2 SER A 53 -13.774 -6.308 8.699 1.00 0.00 H new ATOM 0 HB3 SER A 53 -13.953 -5.094 7.447 1.00 0.00 H new ATOM 0 HG SER A 53 -16.000 -5.905 8.183 1.00 0.00 H new ATOM 856 N GLY A 54 -11.122 -5.864 6.797 1.00 0.00 N ATOM 857 CA GLY A 54 -9.735 -5.722 7.185 1.00 0.00 C ATOM 858 C GLY A 54 -9.126 -4.416 6.720 1.00 0.00 C ATOM 859 O GLY A 54 -9.792 -3.610 6.058 1.00 0.00 O ATOM 0 H GLY A 54 -11.506 -5.080 6.269 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -9.658 -5.788 8.270 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -9.161 -6.552 6.774 1.00 0.00 H new ATOM 863 N LEU A 55 -7.867 -4.204 7.086 1.00 0.00 N ATOM 864 CA LEU A 55 -7.129 -3.013 6.683 1.00 0.00 C ATOM 865 C LEU A 55 -6.618 -3.151 5.255 1.00 0.00 C ATOM 866 O LEU A 55 -6.037 -4.178 4.891 1.00 0.00 O ATOM 867 CB LEU A 55 -5.941 -2.763 7.623 1.00 0.00 C ATOM 868 CG LEU A 55 -6.250 -2.013 8.925 1.00 0.00 C ATOM 869 CD1 LEU A 55 -6.793 -0.628 8.620 1.00 0.00 C ATOM 870 CD2 LEU A 55 -7.220 -2.796 9.797 1.00 0.00 C ATOM 0 H LEU A 55 -7.332 -4.849 7.667 1.00 0.00 H new ATOM 0 HA LEU A 55 -7.814 -2.167 6.739 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -5.499 -3.726 7.880 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -5.184 -2.201 7.076 1.00 0.00 H new ATOM 0 HG LEU A 55 -5.320 -1.906 9.483 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -7.008 -0.108 9.553 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -6.053 -0.064 8.052 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -7.709 -0.717 8.035 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -7.419 -2.238 10.712 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -8.154 -2.949 9.256 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -6.784 -3.763 10.049 1.00 0.00 H new ATOM 882 N VAL A 56 -6.843 -2.120 4.450 1.00 0.00 N ATOM 883 CA VAL A 56 -6.369 -2.100 3.073 1.00 0.00 C ATOM 884 C VAL A 56 -5.778 -0.734 2.727 1.00 0.00 C ATOM 885 O VAL A 56 -6.165 0.285 3.307 1.00 0.00 O ATOM 886 CB VAL A 56 -7.497 -2.426 2.067 1.00 0.00 C ATOM 887 CG1 VAL A 56 -8.054 -3.822 2.296 1.00 0.00 C ATOM 888 CG2 VAL A 56 -8.602 -1.388 2.150 1.00 0.00 C ATOM 0 H VAL A 56 -7.354 -1.283 4.730 1.00 0.00 H new ATOM 0 HA VAL A 56 -5.601 -2.869 2.994 1.00 0.00 H new ATOM 0 HB VAL A 56 -7.070 -2.398 1.065 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -8.845 -4.021 1.573 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -7.258 -4.556 2.174 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -8.459 -3.891 3.306 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -9.387 -1.634 1.435 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -9.018 -1.380 3.157 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -8.195 -0.404 1.918 1.00 0.00 H new ATOM 898 N PRO A 57 -4.818 -0.697 1.794 1.00 0.00 N ATOM 899 CA PRO A 57 -4.216 0.547 1.324 1.00 0.00 C ATOM 900 C PRO A 57 -5.133 1.297 0.362 1.00 0.00 C ATOM 901 O PRO A 57 -5.608 0.734 -0.627 1.00 0.00 O ATOM 902 CB PRO A 57 -2.939 0.092 0.598 1.00 0.00 C ATOM 903 CG PRO A 57 -2.831 -1.378 0.846 1.00 0.00 C ATOM 904 CD PRO A 57 -4.223 -1.858 1.132 1.00 0.00 C ATOM 0 HA PRO A 57 -4.024 1.238 2.145 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -2.999 0.305 -0.469 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -2.064 0.618 0.979 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -2.414 -1.889 -0.021 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -2.168 -1.583 1.687 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -4.757 -2.125 0.220 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -4.226 -2.739 1.774 1.00 0.00 H new ATOM 912 N ALA A 58 -5.360 2.570 0.653 1.00 0.00 N ATOM 913 CA ALA A 58 -6.227 3.421 -0.156 1.00 0.00 C ATOM 914 C ALA A 58 -5.732 3.514 -1.593 1.00 0.00 C ATOM 915 O ALA A 58 -6.520 3.670 -2.524 1.00 0.00 O ATOM 916 CB ALA A 58 -6.309 4.809 0.458 1.00 0.00 C ATOM 0 H ALA A 58 -4.949 3.044 1.457 1.00 0.00 H new ATOM 0 HA ALA A 58 -7.220 2.972 -0.173 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -6.958 5.439 -0.151 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -6.716 4.737 1.467 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -5.312 5.248 0.499 1.00 0.00 H new ATOM 922 N GLN A 59 -4.422 3.390 -1.764 1.00 0.00 N ATOM 923 CA GLN A 59 -3.797 3.476 -3.083 1.00 0.00 C ATOM 924 C GLN A 59 -4.208 2.318 -3.991 1.00 0.00 C ATOM 925 O GLN A 59 -3.899 2.321 -5.183 1.00 0.00 O ATOM 926 CB GLN A 59 -2.268 3.517 -2.957 1.00 0.00 C ATOM 927 CG GLN A 59 -1.687 2.474 -2.012 1.00 0.00 C ATOM 928 CD GLN A 59 -0.176 2.393 -2.087 1.00 0.00 C ATOM 929 OE1 GLN A 59 0.500 3.361 -2.434 1.00 0.00 O ATOM 930 NE2 GLN A 59 0.368 1.238 -1.743 1.00 0.00 N ATOM 0 H GLN A 59 -3.765 3.228 -1.001 1.00 0.00 H new ATOM 0 HA GLN A 59 -4.148 4.401 -3.540 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -1.830 3.378 -3.946 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -1.970 4.507 -2.613 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -1.984 2.710 -0.990 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -2.111 1.498 -2.249 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -0.226 0.458 -1.461 1.00 0.00 H new ATOM 0 HE22 GLN A 59 1.382 1.127 -1.760 1.00 0.00 H new ATOM 939 N PHE A 60 -4.904 1.332 -3.440 1.00 0.00 N ATOM 940 CA PHE A 60 -5.294 0.166 -4.223 1.00 0.00 C ATOM 941 C PHE A 60 -6.808 0.104 -4.393 1.00 0.00 C ATOM 942 O PHE A 60 -7.325 -0.752 -5.111 1.00 0.00 O ATOM 943 CB PHE A 60 -4.785 -1.124 -3.568 1.00 0.00 C ATOM 944 CG PHE A 60 -3.283 -1.255 -3.542 1.00 0.00 C ATOM 945 CD1 PHE A 60 -2.490 -0.584 -4.461 1.00 0.00 C ATOM 946 CD2 PHE A 60 -2.667 -2.065 -2.603 1.00 0.00 C ATOM 947 CE1 PHE A 60 -1.114 -0.720 -4.443 1.00 0.00 C ATOM 948 CE2 PHE A 60 -1.292 -2.204 -2.579 1.00 0.00 C ATOM 949 CZ PHE A 60 -0.515 -1.530 -3.501 1.00 0.00 C ATOM 0 H PHE A 60 -5.207 1.315 -2.466 1.00 0.00 H new ATOM 0 HA PHE A 60 -4.839 0.261 -5.209 1.00 0.00 H new ATOM 0 HB2 PHE A 60 -5.160 -1.171 -2.546 1.00 0.00 H new ATOM 0 HB3 PHE A 60 -5.203 -1.978 -4.101 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -2.953 0.053 -5.200 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -3.269 -2.595 -1.880 1.00 0.00 H new ATOM 0 HE1 PHE A 60 -0.509 -0.193 -5.166 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -0.826 -2.839 -1.840 1.00 0.00 H new ATOM 0 HZ PHE A 60 0.560 -1.637 -3.484 1.00 0.00 H new ATOM 959 N ILE A 61 -7.511 1.029 -3.752 1.00 0.00 N ATOM 960 CA ILE A 61 -8.968 1.023 -3.764 1.00 0.00 C ATOM 961 C ILE A 61 -9.514 2.285 -4.429 1.00 0.00 C ATOM 962 O ILE A 61 -9.069 3.396 -4.137 1.00 0.00 O ATOM 963 CB ILE A 61 -9.541 0.923 -2.329 1.00 0.00 C ATOM 964 CG1 ILE A 61 -9.009 -0.324 -1.613 1.00 0.00 C ATOM 965 CG2 ILE A 61 -11.064 0.907 -2.355 1.00 0.00 C ATOM 966 CD1 ILE A 61 -9.403 -1.628 -2.277 1.00 0.00 C ATOM 0 H ILE A 61 -7.096 1.792 -3.218 1.00 0.00 H new ATOM 0 HA ILE A 61 -9.279 0.148 -4.335 1.00 0.00 H new ATOM 0 HB ILE A 61 -9.213 1.803 -1.776 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -7.922 -0.267 -1.564 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -9.375 -0.325 -0.586 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -11.445 0.836 -1.336 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -11.430 1.824 -2.816 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -11.409 0.049 -2.932 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -8.989 -2.463 -1.712 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -10.490 -1.710 -2.302 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -9.014 -1.650 -3.295 1.00 0.00 H new ATOM 978 N GLU A 62 -10.462 2.107 -5.338 1.00 0.00 N ATOM 979 CA GLU A 62 -11.149 3.233 -5.955 1.00 0.00 C ATOM 980 C GLU A 62 -12.658 3.047 -5.817 1.00 0.00 C ATOM 981 O GLU A 62 -13.208 2.051 -6.291 1.00 0.00 O ATOM 982 CB GLU A 62 -10.771 3.356 -7.434 1.00 0.00 C ATOM 983 CG GLU A 62 -11.251 4.646 -8.087 1.00 0.00 C ATOM 984 CD GLU A 62 -10.475 5.867 -7.625 1.00 0.00 C ATOM 985 OE1 GLU A 62 -10.595 6.247 -6.441 1.00 0.00 O ATOM 986 OE2 GLU A 62 -9.737 6.455 -8.446 1.00 0.00 O ATOM 0 H GLU A 62 -10.773 1.192 -5.665 1.00 0.00 H new ATOM 0 HA GLU A 62 -10.846 4.149 -5.447 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -9.687 3.294 -7.529 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -11.188 2.508 -7.977 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -11.163 4.554 -9.170 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -12.308 4.788 -7.864 1.00 0.00 H new ATOM 993 N PRO A 63 -13.339 3.984 -5.137 1.00 0.00 N ATOM 994 CA PRO A 63 -14.795 3.938 -4.957 1.00 0.00 C ATOM 995 C PRO A 63 -15.547 3.811 -6.280 1.00 0.00 C ATOM 996 O PRO A 63 -15.251 4.516 -7.248 1.00 0.00 O ATOM 997 CB PRO A 63 -15.115 5.282 -4.294 1.00 0.00 C ATOM 998 CG PRO A 63 -13.854 5.672 -3.608 1.00 0.00 C ATOM 999 CD PRO A 63 -12.741 5.156 -4.476 1.00 0.00 C ATOM 0 HA PRO A 63 -15.101 3.070 -4.372 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -15.412 6.027 -5.032 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -15.939 5.189 -3.586 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -13.790 6.754 -3.492 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -13.803 5.241 -2.608 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -12.416 5.903 -5.200 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -11.866 4.882 -3.887 1.00 0.00 H new ATOM 1007 N VAL A 64 -16.518 2.909 -6.310 1.00 0.00 N ATOM 1008 CA VAL A 64 -17.322 2.671 -7.500 1.00 0.00 C ATOM 1009 C VAL A 64 -18.168 3.895 -7.816 1.00 0.00 C ATOM 1010 O VAL A 64 -18.823 4.439 -6.926 1.00 0.00 O ATOM 1011 CB VAL A 64 -18.257 1.457 -7.316 1.00 0.00 C ATOM 1012 CG1 VAL A 64 -19.039 1.183 -8.587 1.00 0.00 C ATOM 1013 CG2 VAL A 64 -17.471 0.227 -6.903 1.00 0.00 C ATOM 0 H VAL A 64 -16.770 2.324 -5.513 1.00 0.00 H new ATOM 0 HA VAL A 64 -16.635 2.466 -8.321 1.00 0.00 H new ATOM 0 HB VAL A 64 -18.964 1.695 -6.521 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -19.691 0.323 -8.435 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -19.642 2.056 -8.839 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -18.347 0.973 -9.402 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -18.152 -0.615 -6.779 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -16.736 -0.010 -7.672 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -16.960 0.422 -5.960 1.00 0.00 H new ATOM 1023 N ARG A 65 -18.111 4.340 -9.075 1.00 0.00 N ATOM 1024 CA ARG A 65 -18.895 5.475 -9.561 1.00 0.00 C ATOM 1025 C ARG A 65 -18.336 6.803 -9.035 1.00 0.00 C ATOM 1026 O ARG A 65 -18.541 7.855 -9.644 1.00 0.00 O ATOM 1027 CB ARG A 65 -20.367 5.289 -9.186 1.00 0.00 C ATOM 1028 CG ARG A 65 -21.301 6.325 -9.766 1.00 0.00 C ATOM 1029 CD ARG A 65 -22.749 5.878 -9.659 1.00 0.00 C ATOM 1030 NE ARG A 65 -22.979 4.596 -10.331 1.00 0.00 N ATOM 1031 CZ ARG A 65 -24.185 4.073 -10.555 1.00 0.00 C ATOM 1032 NH1 ARG A 65 -25.276 4.761 -10.239 1.00 0.00 N ATOM 1033 NH2 ARG A 65 -24.300 2.874 -11.116 1.00 0.00 N ATOM 0 H ARG A 65 -17.516 3.919 -9.788 1.00 0.00 H new ATOM 0 HA ARG A 65 -18.823 5.513 -10.648 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -20.690 4.302 -9.517 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -20.456 5.306 -8.100 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -21.170 7.271 -9.242 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -21.048 6.502 -10.811 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -23.025 5.791 -8.608 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -23.396 6.638 -10.097 1.00 0.00 H new ATOM 0 HE ARG A 65 -22.164 4.070 -10.648 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -25.191 5.689 -9.825 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -26.199 4.361 -10.410 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -23.464 2.351 -11.377 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -25.224 2.477 -11.286 1.00 0.00 H new ATOM 1047 N ASP A 66 -17.620 6.726 -7.912 1.00 0.00 N ATOM 1048 CA ASP A 66 -16.907 7.861 -7.318 1.00 0.00 C ATOM 1049 C ASP A 66 -17.841 8.889 -6.686 1.00 0.00 C ATOM 1050 O ASP A 66 -18.891 9.233 -7.232 1.00 0.00 O ATOM 1051 CB ASP A 66 -15.988 8.548 -8.335 1.00 0.00 C ATOM 1052 CG ASP A 66 -15.571 9.936 -7.884 1.00 0.00 C ATOM 1053 OD1 ASP A 66 -14.783 10.048 -6.920 1.00 0.00 O ATOM 1054 OD2 ASP A 66 -16.056 10.923 -8.475 1.00 0.00 O ATOM 0 H ASP A 66 -17.517 5.861 -7.381 1.00 0.00 H new ATOM 0 HA ASP A 66 -16.298 7.437 -6.520 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -15.100 7.936 -8.491 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -16.499 8.618 -9.295 1.00 0.00 H new ATOM 1059 N LYS A 67 -17.433 9.367 -5.519 1.00 0.00 N ATOM 1060 CA LYS A 67 -18.115 10.448 -4.826 1.00 0.00 C ATOM 1061 C LYS A 67 -17.136 11.076 -3.834 1.00 0.00 C ATOM 1062 O LYS A 67 -17.524 11.616 -2.796 1.00 0.00 O ATOM 1063 CB LYS A 67 -19.362 9.921 -4.100 1.00 0.00 C ATOM 1064 CG LYS A 67 -20.330 11.016 -3.672 1.00 0.00 C ATOM 1065 CD LYS A 67 -20.946 11.713 -4.876 1.00 0.00 C ATOM 1066 CE LYS A 67 -21.781 12.918 -4.466 1.00 0.00 C ATOM 1067 NZ LYS A 67 -20.947 13.998 -3.872 1.00 0.00 N ATOM 0 H LYS A 67 -16.614 9.013 -5.024 1.00 0.00 H new ATOM 0 HA LYS A 67 -18.446 11.199 -5.543 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -19.884 9.222 -4.754 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -19.049 9.360 -3.219 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -21.119 10.586 -3.055 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -19.806 11.746 -3.055 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -20.155 12.033 -5.555 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -21.571 11.008 -5.424 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -22.310 13.306 -5.337 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -22.538 12.607 -3.746 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -21.494 14.882 -3.841 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -20.668 13.730 -2.907 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -20.095 14.138 -4.452 1.00 0.00 H new ATOM 1081 N LYS A 68 -15.853 11.008 -4.180 1.00 0.00 N ATOM 1082 CA LYS A 68 -14.788 11.455 -3.287 1.00 0.00 C ATOM 1083 C LYS A 68 -14.711 12.975 -3.245 1.00 0.00 C ATOM 1084 O LYS A 68 -14.868 13.641 -4.272 1.00 0.00 O ATOM 1085 CB LYS A 68 -13.437 10.898 -3.743 1.00 0.00 C ATOM 1086 CG LYS A 68 -13.396 9.383 -3.842 1.00 0.00 C ATOM 1087 CD LYS A 68 -12.020 8.881 -4.265 1.00 0.00 C ATOM 1088 CE LYS A 68 -11.613 9.414 -5.633 1.00 0.00 C ATOM 1089 NZ LYS A 68 -10.304 8.860 -6.080 1.00 0.00 N ATOM 0 H LYS A 68 -15.525 10.646 -5.076 1.00 0.00 H new ATOM 0 HA LYS A 68 -15.019 11.083 -2.289 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -13.190 11.322 -4.716 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -12.666 11.228 -3.047 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -13.661 8.948 -2.878 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -14.143 9.045 -4.560 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -11.280 9.183 -3.524 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -12.023 7.791 -4.287 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -12.382 9.163 -6.364 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -11.553 10.502 -5.595 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -10.048 9.274 -6.999 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -9.571 9.092 -5.379 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -10.378 7.827 -6.174 1.00 0.00 H new ATOM 1103 N HIS A 69 -14.458 13.517 -2.062 1.00 0.00 N ATOM 1104 CA HIS A 69 -14.278 14.951 -1.905 1.00 0.00 C ATOM 1105 C HIS A 69 -12.824 15.320 -2.177 1.00 0.00 C ATOM 1106 O HIS A 69 -11.972 15.224 -1.294 1.00 0.00 O ATOM 1107 CB HIS A 69 -14.682 15.410 -0.498 1.00 0.00 C ATOM 1108 CG HIS A 69 -16.153 15.309 -0.219 1.00 0.00 C ATOM 1109 ND1 HIS A 69 -16.961 16.410 -0.041 1.00 0.00 N ATOM 1110 CD2 HIS A 69 -16.961 14.230 -0.077 1.00 0.00 C ATOM 1111 CE1 HIS A 69 -18.195 16.014 0.198 1.00 0.00 C ATOM 1112 NE2 HIS A 69 -18.228 14.696 0.180 1.00 0.00 N ATOM 0 H HIS A 69 -14.373 12.984 -1.197 1.00 0.00 H new ATOM 0 HA HIS A 69 -14.923 15.458 -2.623 1.00 0.00 H new ATOM 0 HB2 HIS A 69 -14.142 14.812 0.236 1.00 0.00 H new ATOM 0 HB3 HIS A 69 -14.367 16.445 -0.361 1.00 0.00 H new ATOM 0 HD2 HIS A 69 -16.664 13.194 -0.152 1.00 0.00 H new ATOM 0 HE1 HIS A 69 -19.040 16.662 0.379 1.00 0.00 H new ATOM 0 HE2 HIS A 69 -19.055 14.119 0.331 1.00 0.00 H new ATOM 1121 N THR A 70 -12.539 15.696 -3.414 1.00 0.00 N ATOM 1122 CA THR A 70 -11.193 16.088 -3.799 1.00 0.00 C ATOM 1123 C THR A 70 -10.954 17.561 -3.476 1.00 0.00 C ATOM 1124 O THR A 70 -11.835 18.403 -3.677 1.00 0.00 O ATOM 1125 CB THR A 70 -10.937 15.818 -5.303 1.00 0.00 C ATOM 1126 OG1 THR A 70 -9.636 16.286 -5.687 1.00 0.00 O ATOM 1127 CG2 THR A 70 -11.998 16.480 -6.171 1.00 0.00 C ATOM 0 H THR A 70 -13.223 15.738 -4.169 1.00 0.00 H new ATOM 0 HA THR A 70 -10.491 15.483 -3.225 1.00 0.00 H new ATOM 0 HB THR A 70 -10.988 14.740 -5.456 1.00 0.00 H new ATOM 0 HG1 THR A 70 -9.491 16.106 -6.639 1.00 0.00 H new ATOM 0 HG21 THR A 70 -11.791 16.272 -7.221 1.00 0.00 H new ATOM 0 HG22 THR A 70 -12.980 16.085 -5.910 1.00 0.00 H new ATOM 0 HG23 THR A 70 -11.984 17.557 -6.005 1.00 0.00 H new ATOM 1135 N GLU A 71 -9.777 17.862 -2.950 1.00 0.00 N ATOM 1136 CA GLU A 71 -9.422 19.225 -2.603 1.00 0.00 C ATOM 1137 C GLU A 71 -8.246 19.678 -3.456 1.00 0.00 C ATOM 1138 O GLU A 71 -8.470 20.434 -4.425 1.00 0.00 O ATOM 1139 CB GLU A 71 -9.067 19.334 -1.116 1.00 0.00 C ATOM 1140 CG GLU A 71 -10.154 18.816 -0.185 1.00 0.00 C ATOM 1141 CD GLU A 71 -9.905 19.177 1.266 1.00 0.00 C ATOM 1142 OE1 GLU A 71 -9.039 18.547 1.911 1.00 0.00 O ATOM 1143 OE2 GLU A 71 -10.577 20.102 1.769 1.00 0.00 O ATOM 1144 OXT GLU A 71 -7.107 19.252 -3.172 1.00 0.00 O ATOM 0 H GLU A 71 -9.049 17.175 -2.754 1.00 0.00 H new ATOM 0 HA GLU A 71 -10.280 19.869 -2.795 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -8.148 18.779 -0.930 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -8.863 20.378 -0.876 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -11.116 19.222 -0.496 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -10.220 17.732 -0.279 1.00 0.00 H new TER 1151 GLU A 71 ATOM 1152 N MET B 1 21.227 -0.095 -8.577 1.00 0.00 N ATOM 1153 CA MET B 1 20.013 0.119 -9.395 1.00 0.00 C ATOM 1154 C MET B 1 19.098 1.137 -8.739 1.00 0.00 C ATOM 1155 O MET B 1 19.045 1.247 -7.516 1.00 0.00 O ATOM 1156 CB MET B 1 19.245 -1.191 -9.624 1.00 0.00 C ATOM 1157 CG MET B 1 18.839 -1.931 -8.359 1.00 0.00 C ATOM 1158 SD MET B 1 17.245 -1.392 -7.722 1.00 0.00 S ATOM 1159 CE MET B 1 16.969 -2.603 -6.432 1.00 0.00 C ATOM 0 H1 MET B 1 21.765 -0.899 -8.958 1.00 0.00 H new ATOM 0 H2 MET B 1 21.818 0.760 -8.603 1.00 0.00 H new ATOM 0 H3 MET B 1 20.952 -0.297 -7.594 1.00 0.00 H new ATOM 0 HA MET B 1 20.340 0.498 -10.363 1.00 0.00 H new ATOM 0 HB2 MET B 1 18.347 -0.971 -10.202 1.00 0.00 H new ATOM 0 HB3 MET B 1 19.861 -1.854 -10.232 1.00 0.00 H new ATOM 0 HG2 MET B 1 18.801 -3.001 -8.565 1.00 0.00 H new ATOM 0 HG3 MET B 1 19.601 -1.781 -7.594 1.00 0.00 H new ATOM 0 HE1 MET B 1 15.985 -2.446 -5.990 1.00 0.00 H new ATOM 0 HE2 MET B 1 17.020 -3.605 -6.857 1.00 0.00 H new ATOM 0 HE3 MET B 1 17.734 -2.496 -5.663 1.00 0.00 H new ATOM 1171 N GLN B 2 18.386 1.883 -9.558 1.00 0.00 N ATOM 1172 CA GLN B 2 17.439 2.860 -9.062 1.00 0.00 C ATOM 1173 C GLN B 2 16.103 2.203 -8.738 1.00 0.00 C ATOM 1174 O GLN B 2 15.679 1.272 -9.420 1.00 0.00 O ATOM 1175 CB GLN B 2 17.241 3.968 -10.099 1.00 0.00 C ATOM 1176 CG GLN B 2 18.450 4.880 -10.252 1.00 0.00 C ATOM 1177 CD GLN B 2 18.317 5.853 -11.411 1.00 0.00 C ATOM 1178 OE1 GLN B 2 17.212 6.218 -11.819 1.00 0.00 O ATOM 1179 NE2 GLN B 2 19.447 6.303 -11.930 1.00 0.00 N ATOM 0 H GLN B 2 18.446 1.831 -10.575 1.00 0.00 H new ATOM 0 HA GLN B 2 17.839 3.293 -8.145 1.00 0.00 H new ATOM 0 HB2 GLN B 2 17.013 3.515 -11.064 1.00 0.00 H new ATOM 0 HB3 GLN B 2 16.376 4.569 -9.817 1.00 0.00 H new ATOM 0 HG2 GLN B 2 18.594 5.441 -9.329 1.00 0.00 H new ATOM 0 HG3 GLN B 2 19.342 4.270 -10.397 1.00 0.00 H new ATOM 0 HE21 GLN B 2 20.342 5.977 -11.565 1.00 0.00 H new ATOM 0 HE22 GLN B 2 19.424 6.976 -12.696 1.00 0.00 H new ATOM 1188 N ILE B 3 15.475 2.655 -7.666 1.00 0.00 N ATOM 1189 CA ILE B 3 14.091 2.312 -7.386 1.00 0.00 C ATOM 1190 C ILE B 3 13.283 3.585 -7.242 1.00 0.00 C ATOM 1191 O ILE B 3 13.756 4.572 -6.675 1.00 0.00 O ATOM 1192 CB ILE B 3 13.907 1.451 -6.113 1.00 0.00 C ATOM 1193 CG1 ILE B 3 14.593 2.097 -4.905 1.00 0.00 C ATOM 1194 CG2 ILE B 3 14.424 0.038 -6.341 1.00 0.00 C ATOM 1195 CD1 ILE B 3 14.315 1.388 -3.594 1.00 0.00 C ATOM 0 H ILE B 3 15.905 3.265 -6.971 1.00 0.00 H new ATOM 0 HA ILE B 3 13.743 1.710 -8.225 1.00 0.00 H new ATOM 0 HB ILE B 3 12.840 1.393 -5.897 1.00 0.00 H new ATOM 0 HG12 ILE B 3 15.669 2.115 -5.077 1.00 0.00 H new ATOM 0 HG13 ILE B 3 14.265 3.133 -4.824 1.00 0.00 H new ATOM 0 HG21 ILE B 3 14.285 -0.551 -5.434 1.00 0.00 H new ATOM 0 HG22 ILE B 3 13.873 -0.423 -7.161 1.00 0.00 H new ATOM 0 HG23 ILE B 3 15.484 0.074 -6.591 1.00 0.00 H new ATOM 0 HD11 ILE B 3 14.834 1.902 -2.785 1.00 0.00 H new ATOM 0 HD12 ILE B 3 13.243 1.392 -3.398 1.00 0.00 H new ATOM 0 HD13 ILE B 3 14.668 0.359 -3.655 1.00 0.00 H new ATOM 1207 N PHE B 4 12.086 3.576 -7.780 1.00 0.00 N ATOM 1208 CA PHE B 4 11.224 4.734 -7.703 1.00 0.00 C ATOM 1209 C PHE B 4 10.252 4.578 -6.548 1.00 0.00 C ATOM 1210 O PHE B 4 9.328 3.767 -6.604 1.00 0.00 O ATOM 1211 CB PHE B 4 10.475 4.930 -9.021 1.00 0.00 C ATOM 1212 CG PHE B 4 11.389 5.067 -10.208 1.00 0.00 C ATOM 1213 CD1 PHE B 4 11.979 6.284 -10.509 1.00 0.00 C ATOM 1214 CD2 PHE B 4 11.664 3.976 -11.018 1.00 0.00 C ATOM 1215 CE1 PHE B 4 12.824 6.411 -11.594 1.00 0.00 C ATOM 1216 CE2 PHE B 4 12.508 4.097 -12.105 1.00 0.00 C ATOM 1217 CZ PHE B 4 13.089 5.316 -12.393 1.00 0.00 C ATOM 0 H PHE B 4 11.686 2.780 -8.276 1.00 0.00 H new ATOM 0 HA PHE B 4 11.834 5.620 -7.527 1.00 0.00 H new ATOM 0 HB2 PHE B 4 9.807 4.084 -9.181 1.00 0.00 H new ATOM 0 HB3 PHE B 4 9.850 5.820 -8.947 1.00 0.00 H new ATOM 0 HD1 PHE B 4 11.776 7.144 -9.888 1.00 0.00 H new ATOM 0 HD2 PHE B 4 11.213 3.020 -10.797 1.00 0.00 H new ATOM 0 HE1 PHE B 4 13.277 7.366 -11.817 1.00 0.00 H new ATOM 0 HE2 PHE B 4 12.713 3.239 -12.729 1.00 0.00 H new ATOM 0 HZ PHE B 4 13.750 5.413 -13.242 1.00 0.00 H new ATOM 1227 N VAL B 5 10.491 5.328 -5.489 1.00 0.00 N ATOM 1228 CA VAL B 5 9.630 5.292 -4.321 1.00 0.00 C ATOM 1229 C VAL B 5 8.465 6.249 -4.516 1.00 0.00 C ATOM 1230 O VAL B 5 8.618 7.463 -4.382 1.00 0.00 O ATOM 1231 CB VAL B 5 10.400 5.660 -3.036 1.00 0.00 C ATOM 1232 CG1 VAL B 5 9.489 5.592 -1.820 1.00 0.00 C ATOM 1233 CG2 VAL B 5 11.606 4.748 -2.857 1.00 0.00 C ATOM 0 H VAL B 5 11.278 5.973 -5.413 1.00 0.00 H new ATOM 0 HA VAL B 5 9.258 4.274 -4.207 1.00 0.00 H new ATOM 0 HB VAL B 5 10.756 6.686 -3.134 1.00 0.00 H new ATOM 0 HG11 VAL B 5 10.055 5.856 -0.926 1.00 0.00 H new ATOM 0 HG12 VAL B 5 8.662 6.291 -1.945 1.00 0.00 H new ATOM 0 HG13 VAL B 5 9.096 4.581 -1.716 1.00 0.00 H new ATOM 0 HG21 VAL B 5 12.137 5.022 -1.946 1.00 0.00 H new ATOM 0 HG22 VAL B 5 11.272 3.713 -2.785 1.00 0.00 H new ATOM 0 HG23 VAL B 5 12.273 4.855 -3.712 1.00 0.00 H new ATOM 1243 N LYS B 6 7.315 5.697 -4.867 1.00 0.00 N ATOM 1244 CA LYS B 6 6.141 6.500 -5.158 1.00 0.00 C ATOM 1245 C LYS B 6 5.110 6.376 -4.046 1.00 0.00 C ATOM 1246 O LYS B 6 4.620 5.282 -3.761 1.00 0.00 O ATOM 1247 CB LYS B 6 5.509 6.057 -6.478 1.00 0.00 C ATOM 1248 CG LYS B 6 4.352 6.936 -6.918 1.00 0.00 C ATOM 1249 CD LYS B 6 3.397 6.179 -7.825 1.00 0.00 C ATOM 1250 CE LYS B 6 2.204 7.036 -8.224 1.00 0.00 C ATOM 1251 NZ LYS B 6 1.370 7.425 -7.053 1.00 0.00 N ATOM 0 H LYS B 6 7.170 4.691 -4.957 1.00 0.00 H new ATOM 0 HA LYS B 6 6.459 7.540 -5.235 1.00 0.00 H new ATOM 0 HB2 LYS B 6 6.272 6.058 -7.256 1.00 0.00 H new ATOM 0 HB3 LYS B 6 5.158 5.030 -6.377 1.00 0.00 H new ATOM 0 HG2 LYS B 6 3.814 7.298 -6.042 1.00 0.00 H new ATOM 0 HG3 LYS B 6 4.736 7.812 -7.441 1.00 0.00 H new ATOM 0 HD2 LYS B 6 3.926 5.852 -8.720 1.00 0.00 H new ATOM 0 HD3 LYS B 6 3.047 5.281 -7.316 1.00 0.00 H new ATOM 0 HE2 LYS B 6 2.558 7.934 -8.730 1.00 0.00 H new ATOM 0 HE3 LYS B 6 1.590 6.489 -8.939 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 0.400 7.076 -7.187 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 1.771 7.010 -6.188 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 1.356 8.461 -6.966 1.00 0.00 H new ATOM 1265 N THR B 7 4.780 7.490 -3.422 1.00 0.00 N ATOM 1266 CA THR B 7 3.734 7.506 -2.419 1.00 0.00 C ATOM 1267 C THR B 7 2.367 7.542 -3.095 1.00 0.00 C ATOM 1268 O THR B 7 2.268 7.781 -4.306 1.00 0.00 O ATOM 1269 CB THR B 7 3.874 8.719 -1.480 1.00 0.00 C ATOM 1270 OG1 THR B 7 3.703 9.938 -2.218 1.00 0.00 O ATOM 1271 CG2 THR B 7 5.238 8.720 -0.803 1.00 0.00 C ATOM 0 H THR B 7 5.220 8.394 -3.592 1.00 0.00 H new ATOM 0 HA THR B 7 3.829 6.598 -1.823 1.00 0.00 H new ATOM 0 HB THR B 7 3.101 8.649 -0.715 1.00 0.00 H new ATOM 0 HG1 THR B 7 3.071 10.520 -1.747 1.00 0.00 H new ATOM 0 HG21 THR B 7 5.317 9.585 -0.144 1.00 0.00 H new ATOM 0 HG22 THR B 7 5.355 7.807 -0.219 1.00 0.00 H new ATOM 0 HG23 THR B 7 6.020 8.769 -1.561 1.00 0.00 H new ATOM 1279 N LEU B 8 1.314 7.313 -2.323 1.00 0.00 N ATOM 1280 CA LEU B 8 -0.039 7.340 -2.863 1.00 0.00 C ATOM 1281 C LEU B 8 -0.513 8.772 -3.103 1.00 0.00 C ATOM 1282 O LEU B 8 -1.586 8.997 -3.659 1.00 0.00 O ATOM 1283 CB LEU B 8 -1.007 6.579 -1.946 1.00 0.00 C ATOM 1284 CG LEU B 8 -0.861 6.828 -0.439 1.00 0.00 C ATOM 1285 CD1 LEU B 8 -1.392 8.198 -0.047 1.00 0.00 C ATOM 1286 CD2 LEU B 8 -1.580 5.738 0.337 1.00 0.00 C ATOM 0 H LEU B 8 1.369 7.107 -1.325 1.00 0.00 H new ATOM 0 HA LEU B 8 -0.024 6.836 -3.829 1.00 0.00 H new ATOM 0 HB2 LEU B 8 -2.026 6.836 -2.237 1.00 0.00 H new ATOM 0 HB3 LEU B 8 -0.882 5.512 -2.129 1.00 0.00 H new ATOM 0 HG LEU B 8 0.200 6.804 -0.192 1.00 0.00 H new ATOM 0 HD11 LEU B 8 -1.273 8.341 1.027 1.00 0.00 H new ATOM 0 HD12 LEU B 8 -0.836 8.970 -0.580 1.00 0.00 H new ATOM 0 HD13 LEU B 8 -2.448 8.267 -0.307 1.00 0.00 H new ATOM 0 HD21 LEU B 8 -1.472 5.921 1.406 1.00 0.00 H new ATOM 0 HD22 LEU B 8 -2.638 5.741 0.073 1.00 0.00 H new ATOM 0 HD23 LEU B 8 -1.147 4.769 0.089 1.00 0.00 H new ATOM 1298 N THR B 9 0.293 9.739 -2.691 1.00 0.00 N ATOM 1299 CA THR B 9 -0.021 11.136 -2.932 1.00 0.00 C ATOM 1300 C THR B 9 0.555 11.585 -4.272 1.00 0.00 C ATOM 1301 O THR B 9 -0.092 12.310 -5.027 1.00 0.00 O ATOM 1302 CB THR B 9 0.515 12.042 -1.805 1.00 0.00 C ATOM 1303 OG1 THR B 9 1.934 11.877 -1.667 1.00 0.00 O ATOM 1304 CG2 THR B 9 -0.167 11.727 -0.481 1.00 0.00 C ATOM 0 H THR B 9 1.167 9.581 -2.189 1.00 0.00 H new ATOM 0 HA THR B 9 -1.107 11.229 -2.954 1.00 0.00 H new ATOM 0 HB THR B 9 0.295 13.076 -2.072 1.00 0.00 H new ATOM 0 HG1 THR B 9 2.263 12.458 -0.950 1.00 0.00 H new ATOM 0 HG21 THR B 9 0.229 12.380 0.297 1.00 0.00 H new ATOM 0 HG22 THR B 9 -1.241 11.888 -0.578 1.00 0.00 H new ATOM 0 HG23 THR B 9 0.022 10.687 -0.213 1.00 0.00 H new ATOM 1312 N GLY B 10 1.768 11.128 -4.573 1.00 0.00 N ATOM 1313 CA GLY B 10 2.403 11.495 -5.823 1.00 0.00 C ATOM 1314 C GLY B 10 3.907 11.628 -5.701 1.00 0.00 C ATOM 1315 O GLY B 10 4.613 11.649 -6.708 1.00 0.00 O ATOM 0 H GLY B 10 2.319 10.513 -3.975 1.00 0.00 H new ATOM 0 HA2 GLY B 10 2.169 10.744 -6.578 1.00 0.00 H new ATOM 0 HA3 GLY B 10 1.987 12.440 -6.173 1.00 0.00 H new ATOM 1319 N LYS B 11 4.396 11.716 -4.467 1.00 0.00 N ATOM 1320 CA LYS B 11 5.827 11.867 -4.211 1.00 0.00 C ATOM 1321 C LYS B 11 6.595 10.647 -4.707 1.00 0.00 C ATOM 1322 O LYS B 11 6.501 9.567 -4.127 1.00 0.00 O ATOM 1323 CB LYS B 11 6.080 12.088 -2.712 1.00 0.00 C ATOM 1324 CG LYS B 11 5.410 13.342 -2.164 1.00 0.00 C ATOM 1325 CD LYS B 11 5.435 13.387 -0.642 1.00 0.00 C ATOM 1326 CE LYS B 11 6.854 13.452 -0.094 1.00 0.00 C ATOM 1327 NZ LYS B 11 7.576 14.670 -0.545 1.00 0.00 N ATOM 0 H LYS B 11 3.821 11.685 -3.625 1.00 0.00 H new ATOM 0 HA LYS B 11 6.184 12.740 -4.757 1.00 0.00 H new ATOM 0 HB2 LYS B 11 5.720 11.221 -2.158 1.00 0.00 H new ATOM 0 HB3 LYS B 11 7.154 12.153 -2.538 1.00 0.00 H new ATOM 0 HG2 LYS B 11 5.913 14.224 -2.561 1.00 0.00 H new ATOM 0 HG3 LYS B 11 4.377 13.381 -2.510 1.00 0.00 H new ATOM 0 HD2 LYS B 11 4.873 14.255 -0.296 1.00 0.00 H new ATOM 0 HD3 LYS B 11 4.934 12.504 -0.245 1.00 0.00 H new ATOM 0 HE2 LYS B 11 6.822 13.434 0.995 1.00 0.00 H new ATOM 0 HE3 LYS B 11 7.405 12.567 -0.412 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 8.207 15.000 0.213 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 8.139 14.447 -1.391 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 6.889 15.416 -0.773 1.00 0.00 H new ATOM 1341 N THR B 12 7.322 10.823 -5.801 1.00 0.00 N ATOM 1342 CA THR B 12 8.089 9.745 -6.398 1.00 0.00 C ATOM 1343 C THR B 12 9.570 10.104 -6.426 1.00 0.00 C ATOM 1344 O THR B 12 10.001 10.935 -7.227 1.00 0.00 O ATOM 1345 CB THR B 12 7.605 9.464 -7.831 1.00 0.00 C ATOM 1346 OG1 THR B 12 6.172 9.489 -7.864 1.00 0.00 O ATOM 1347 CG2 THR B 12 8.106 8.114 -8.325 1.00 0.00 C ATOM 0 H THR B 12 7.395 11.712 -6.295 1.00 0.00 H new ATOM 0 HA THR B 12 7.944 8.850 -5.792 1.00 0.00 H new ATOM 0 HB THR B 12 8.005 10.236 -8.488 1.00 0.00 H new ATOM 0 HG1 THR B 12 5.853 10.366 -7.566 1.00 0.00 H new ATOM 0 HG21 THR B 12 7.748 7.942 -9.340 1.00 0.00 H new ATOM 0 HG22 THR B 12 9.196 8.106 -8.318 1.00 0.00 H new ATOM 0 HG23 THR B 12 7.733 7.326 -7.671 1.00 0.00 H new ATOM 1355 N ILE B 13 10.340 9.495 -5.539 1.00 0.00 N ATOM 1356 CA ILE B 13 11.757 9.782 -5.447 1.00 0.00 C ATOM 1357 C ILE B 13 12.590 8.635 -6.007 1.00 0.00 C ATOM 1358 O ILE B 13 12.285 7.463 -5.783 1.00 0.00 O ATOM 1359 CB ILE B 13 12.180 10.063 -3.992 1.00 0.00 C ATOM 1360 CG1 ILE B 13 11.799 8.894 -3.074 1.00 0.00 C ATOM 1361 CG2 ILE B 13 11.547 11.357 -3.501 1.00 0.00 C ATOM 1362 CD1 ILE B 13 12.261 9.063 -1.640 1.00 0.00 C ATOM 0 H ILE B 13 10.005 8.799 -4.873 1.00 0.00 H new ATOM 0 HA ILE B 13 11.940 10.676 -6.044 1.00 0.00 H new ATOM 0 HB ILE B 13 13.264 10.172 -3.965 1.00 0.00 H new ATOM 0 HG12 ILE B 13 10.716 8.775 -3.085 1.00 0.00 H new ATOM 0 HG13 ILE B 13 12.225 7.975 -3.477 1.00 0.00 H new ATOM 0 HG21 ILE B 13 11.854 11.544 -2.472 1.00 0.00 H new ATOM 0 HG22 ILE B 13 11.872 12.184 -4.133 1.00 0.00 H new ATOM 0 HG23 ILE B 13 10.461 11.271 -3.546 1.00 0.00 H new ATOM 0 HD11 ILE B 13 11.954 8.197 -1.054 1.00 0.00 H new ATOM 0 HD12 ILE B 13 13.347 9.151 -1.616 1.00 0.00 H new ATOM 0 HD13 ILE B 13 11.814 9.963 -1.218 1.00 0.00 H new ATOM 1374 N THR B 14 13.631 8.979 -6.748 1.00 0.00 N ATOM 1375 CA THR B 14 14.539 7.988 -7.296 1.00 0.00 C ATOM 1376 C THR B 14 15.633 7.652 -6.285 1.00 0.00 C ATOM 1377 O THR B 14 16.405 8.525 -5.876 1.00 0.00 O ATOM 1378 CB THR B 14 15.182 8.496 -8.600 1.00 0.00 C ATOM 1379 OG1 THR B 14 14.163 8.907 -9.521 1.00 0.00 O ATOM 1380 CG2 THR B 14 16.034 7.417 -9.239 1.00 0.00 C ATOM 0 H THR B 14 13.868 9.943 -6.984 1.00 0.00 H new ATOM 0 HA THR B 14 13.962 7.089 -7.515 1.00 0.00 H new ATOM 0 HB THR B 14 15.819 9.346 -8.356 1.00 0.00 H new ATOM 0 HG1 THR B 14 13.754 8.116 -9.931 1.00 0.00 H new ATOM 0 HG21 THR B 14 16.477 7.800 -10.158 1.00 0.00 H new ATOM 0 HG22 THR B 14 16.825 7.123 -8.550 1.00 0.00 H new ATOM 0 HG23 THR B 14 15.413 6.551 -9.469 1.00 0.00 H new ATOM 1388 N LEU B 15 15.692 6.397 -5.872 1.00 0.00 N ATOM 1389 CA LEU B 15 16.664 5.975 -4.879 1.00 0.00 C ATOM 1390 C LEU B 15 17.637 4.953 -5.461 1.00 0.00 C ATOM 1391 O LEU B 15 17.229 3.882 -5.911 1.00 0.00 O ATOM 1392 CB LEU B 15 15.950 5.396 -3.668 1.00 0.00 C ATOM 1393 CG LEU B 15 16.809 5.300 -2.414 1.00 0.00 C ATOM 1394 CD1 LEU B 15 17.408 6.656 -2.064 1.00 0.00 C ATOM 1395 CD2 LEU B 15 15.974 4.786 -1.267 1.00 0.00 C ATOM 0 H LEU B 15 15.079 5.654 -6.209 1.00 0.00 H new ATOM 0 HA LEU B 15 17.240 6.848 -4.571 1.00 0.00 H new ATOM 0 HB2 LEU B 15 15.077 6.011 -3.449 1.00 0.00 H new ATOM 0 HB3 LEU B 15 15.584 4.401 -3.919 1.00 0.00 H new ATOM 0 HG LEU B 15 17.629 4.607 -2.602 1.00 0.00 H new ATOM 0 HD11 LEU B 15 18.018 6.563 -1.165 1.00 0.00 H new ATOM 0 HD12 LEU B 15 18.029 7.003 -2.890 1.00 0.00 H new ATOM 0 HD13 LEU B 15 16.606 7.373 -1.887 1.00 0.00 H new ATOM 0 HD21 LEU B 15 16.590 4.718 -0.370 1.00 0.00 H new ATOM 0 HD22 LEU B 15 15.144 5.469 -1.086 1.00 0.00 H new ATOM 0 HD23 LEU B 15 15.584 3.799 -1.515 1.00 0.00 H new ATOM 1407 N GLU B 16 18.920 5.298 -5.465 1.00 0.00 N ATOM 1408 CA GLU B 16 19.960 4.391 -5.943 1.00 0.00 C ATOM 1409 C GLU B 16 20.299 3.361 -4.866 1.00 0.00 C ATOM 1410 O GLU B 16 21.007 3.658 -3.904 1.00 0.00 O ATOM 1411 CB GLU B 16 21.217 5.174 -6.340 1.00 0.00 C ATOM 1412 CG GLU B 16 22.326 4.318 -6.947 1.00 0.00 C ATOM 1413 CD GLU B 16 21.987 3.795 -8.332 1.00 0.00 C ATOM 1414 OE1 GLU B 16 21.906 4.612 -9.275 1.00 0.00 O ATOM 1415 OE2 GLU B 16 21.827 2.567 -8.491 1.00 0.00 O ATOM 0 H GLU B 16 19.266 6.201 -5.142 1.00 0.00 H new ATOM 0 HA GLU B 16 19.585 3.870 -6.824 1.00 0.00 H new ATOM 0 HB2 GLU B 16 20.938 5.947 -7.056 1.00 0.00 H new ATOM 0 HB3 GLU B 16 21.608 5.682 -5.458 1.00 0.00 H new ATOM 0 HG2 GLU B 16 23.242 4.907 -7.002 1.00 0.00 H new ATOM 0 HG3 GLU B 16 22.528 3.475 -6.287 1.00 0.00 H new ATOM 1422 N VAL B 17 19.767 2.162 -5.024 1.00 0.00 N ATOM 1423 CA VAL B 17 20.007 1.070 -4.090 1.00 0.00 C ATOM 1424 C VAL B 17 20.495 -0.146 -4.862 1.00 0.00 C ATOM 1425 O VAL B 17 21.017 -0.007 -5.963 1.00 0.00 O ATOM 1426 CB VAL B 17 18.726 0.705 -3.302 1.00 0.00 C ATOM 1427 CG1 VAL B 17 18.260 1.879 -2.457 1.00 0.00 C ATOM 1428 CG2 VAL B 17 17.618 0.262 -4.245 1.00 0.00 C ATOM 0 H VAL B 17 19.156 1.915 -5.803 1.00 0.00 H new ATOM 0 HA VAL B 17 20.761 1.391 -3.372 1.00 0.00 H new ATOM 0 HB VAL B 17 18.966 -0.126 -2.638 1.00 0.00 H new ATOM 0 HG11 VAL B 17 17.358 1.600 -1.912 1.00 0.00 H new ATOM 0 HG12 VAL B 17 19.043 2.151 -1.749 1.00 0.00 H new ATOM 0 HG13 VAL B 17 18.044 2.730 -3.103 1.00 0.00 H new ATOM 0 HG21 VAL B 17 16.728 0.011 -3.668 1.00 0.00 H new ATOM 0 HG22 VAL B 17 17.385 1.071 -4.938 1.00 0.00 H new ATOM 0 HG23 VAL B 17 17.946 -0.613 -4.806 1.00 0.00 H new ATOM 1438 N GLU B 18 20.347 -1.330 -4.300 1.00 0.00 N ATOM 1439 CA GLU B 18 20.678 -2.535 -5.032 1.00 0.00 C ATOM 1440 C GLU B 18 19.837 -3.697 -4.534 1.00 0.00 C ATOM 1441 O GLU B 18 19.395 -3.703 -3.388 1.00 0.00 O ATOM 1442 CB GLU B 18 22.174 -2.848 -4.920 1.00 0.00 C ATOM 1443 CG GLU B 18 22.655 -3.831 -5.974 1.00 0.00 C ATOM 1444 CD GLU B 18 22.095 -3.512 -7.346 1.00 0.00 C ATOM 1445 OE1 GLU B 18 22.663 -2.650 -8.046 1.00 0.00 O ATOM 1446 OE2 GLU B 18 21.068 -4.113 -7.723 1.00 0.00 O ATOM 0 H GLU B 18 20.004 -1.482 -3.351 1.00 0.00 H new ATOM 0 HA GLU B 18 20.453 -2.375 -6.086 1.00 0.00 H new ATOM 0 HB2 GLU B 18 22.741 -1.921 -5.009 1.00 0.00 H new ATOM 0 HB3 GLU B 18 22.381 -3.255 -3.930 1.00 0.00 H new ATOM 0 HG2 GLU B 18 23.744 -3.815 -6.014 1.00 0.00 H new ATOM 0 HG3 GLU B 18 22.361 -4.841 -5.688 1.00 0.00 H new ATOM 1453 N SER B 19 19.607 -4.672 -5.403 1.00 0.00 N ATOM 1454 CA SER B 19 18.778 -5.814 -5.061 1.00 0.00 C ATOM 1455 C SER B 19 19.424 -6.655 -3.959 1.00 0.00 C ATOM 1456 O SER B 19 18.738 -7.346 -3.208 1.00 0.00 O ATOM 1457 CB SER B 19 18.503 -6.654 -6.311 1.00 0.00 C ATOM 1458 OG SER B 19 19.680 -6.844 -7.081 1.00 0.00 O ATOM 0 H SER B 19 19.984 -4.693 -6.350 1.00 0.00 H new ATOM 0 HA SER B 19 17.827 -5.449 -4.673 1.00 0.00 H new ATOM 0 HB2 SER B 19 18.099 -7.623 -6.018 1.00 0.00 H new ATOM 0 HB3 SER B 19 17.744 -6.163 -6.920 1.00 0.00 H new ATOM 0 HG SER B 19 19.470 -7.385 -7.871 1.00 0.00 H new ATOM 1464 N SER B 20 20.743 -6.558 -3.850 1.00 0.00 N ATOM 1465 CA SER B 20 21.492 -7.301 -2.847 1.00 0.00 C ATOM 1466 C SER B 20 21.610 -6.510 -1.541 1.00 0.00 C ATOM 1467 O SER B 20 22.406 -6.849 -0.664 1.00 0.00 O ATOM 1468 CB SER B 20 22.873 -7.639 -3.406 1.00 0.00 C ATOM 1469 OG SER B 20 23.328 -6.604 -4.266 1.00 0.00 O ATOM 0 H SER B 20 21.319 -5.967 -4.449 1.00 0.00 H new ATOM 0 HA SER B 20 20.958 -8.223 -2.616 1.00 0.00 H new ATOM 0 HB2 SER B 20 23.579 -7.777 -2.587 1.00 0.00 H new ATOM 0 HB3 SER B 20 22.830 -8.581 -3.952 1.00 0.00 H new ATOM 0 HG SER B 20 24.214 -6.834 -4.615 1.00 0.00 H new ATOM 1475 N ASP B 21 20.810 -5.458 -1.416 1.00 0.00 N ATOM 1476 CA ASP B 21 20.781 -4.658 -0.199 1.00 0.00 C ATOM 1477 C ASP B 21 19.562 -5.045 0.635 1.00 0.00 C ATOM 1478 O ASP B 21 18.707 -5.800 0.169 1.00 0.00 O ATOM 1479 CB ASP B 21 20.753 -3.166 -0.550 1.00 0.00 C ATOM 1480 CG ASP B 21 21.007 -2.269 0.645 1.00 0.00 C ATOM 1481 OD1 ASP B 21 21.747 -2.692 1.562 1.00 0.00 O ATOM 1482 OD2 ASP B 21 20.496 -1.130 0.660 1.00 0.00 O ATOM 0 H ASP B 21 20.172 -5.139 -2.145 1.00 0.00 H new ATOM 0 HA ASP B 21 21.680 -4.851 0.386 1.00 0.00 H new ATOM 0 HB2 ASP B 21 21.504 -2.965 -1.314 1.00 0.00 H new ATOM 0 HB3 ASP B 21 19.784 -2.919 -0.983 1.00 0.00 H new ATOM 1487 N THR B 22 19.480 -4.545 1.857 1.00 0.00 N ATOM 1488 CA THR B 22 18.372 -4.877 2.738 1.00 0.00 C ATOM 1489 C THR B 22 17.355 -3.740 2.798 1.00 0.00 C ATOM 1490 O THR B 22 17.716 -2.568 2.688 1.00 0.00 O ATOM 1491 CB THR B 22 18.867 -5.191 4.163 1.00 0.00 C ATOM 1492 OG1 THR B 22 19.682 -4.113 4.643 1.00 0.00 O ATOM 1493 CG2 THR B 22 19.662 -6.490 4.194 1.00 0.00 C ATOM 0 H THR B 22 20.167 -3.908 2.261 1.00 0.00 H new ATOM 0 HA THR B 22 17.891 -5.764 2.325 1.00 0.00 H new ATOM 0 HB THR B 22 17.996 -5.307 4.808 1.00 0.00 H new ATOM 0 HG1 THR B 22 19.993 -4.317 5.550 1.00 0.00 H new ATOM 0 HG21 THR B 22 19.999 -6.686 5.212 1.00 0.00 H new ATOM 0 HG22 THR B 22 19.030 -7.311 3.856 1.00 0.00 H new ATOM 0 HG23 THR B 22 20.527 -6.403 3.536 1.00 0.00 H new ATOM 1501 N ILE B 23 16.085 -4.097 2.977 1.00 0.00 N ATOM 1502 CA ILE B 23 15.007 -3.115 3.095 1.00 0.00 C ATOM 1503 C ILE B 23 15.296 -2.124 4.224 1.00 0.00 C ATOM 1504 O ILE B 23 14.976 -0.939 4.124 1.00 0.00 O ATOM 1505 CB ILE B 23 13.636 -3.812 3.335 1.00 0.00 C ATOM 1506 CG1 ILE B 23 13.083 -4.401 2.030 1.00 0.00 C ATOM 1507 CG2 ILE B 23 12.619 -2.849 3.938 1.00 0.00 C ATOM 1508 CD1 ILE B 23 13.940 -5.481 1.406 1.00 0.00 C ATOM 0 H ILE B 23 15.775 -5.066 3.044 1.00 0.00 H new ATOM 0 HA ILE B 23 14.955 -2.568 2.153 1.00 0.00 H new ATOM 0 HB ILE B 23 13.807 -4.622 4.044 1.00 0.00 H new ATOM 0 HG12 ILE B 23 12.092 -4.811 2.224 1.00 0.00 H new ATOM 0 HG13 ILE B 23 12.958 -3.594 1.308 1.00 0.00 H new ATOM 0 HG21 ILE B 23 11.673 -3.368 4.092 1.00 0.00 H new ATOM 0 HG22 ILE B 23 12.990 -2.479 4.894 1.00 0.00 H new ATOM 0 HG23 ILE B 23 12.466 -2.010 3.259 1.00 0.00 H new ATOM 0 HD11 ILE B 23 13.468 -5.835 0.489 1.00 0.00 H new ATOM 0 HD12 ILE B 23 14.925 -5.075 1.174 1.00 0.00 H new ATOM 0 HD13 ILE B 23 14.045 -6.311 2.105 1.00 0.00 H new ATOM 1520 N ASP B 24 15.927 -2.621 5.283 1.00 0.00 N ATOM 1521 CA ASP B 24 16.299 -1.793 6.426 1.00 0.00 C ATOM 1522 C ASP B 24 17.201 -0.637 5.999 1.00 0.00 C ATOM 1523 O ASP B 24 16.987 0.510 6.393 1.00 0.00 O ATOM 1524 CB ASP B 24 17.003 -2.646 7.485 1.00 0.00 C ATOM 1525 CG ASP B 24 17.653 -1.813 8.572 1.00 0.00 C ATOM 1526 OD1 ASP B 24 16.964 -1.443 9.544 1.00 0.00 O ATOM 1527 OD2 ASP B 24 18.866 -1.537 8.466 1.00 0.00 O ATOM 0 H ASP B 24 16.193 -3.601 5.374 1.00 0.00 H new ATOM 0 HA ASP B 24 15.388 -1.372 6.851 1.00 0.00 H new ATOM 0 HB2 ASP B 24 16.280 -3.325 7.937 1.00 0.00 H new ATOM 0 HB3 ASP B 24 17.762 -3.262 7.003 1.00 0.00 H new ATOM 1532 N ASN B 25 18.195 -0.941 5.174 1.00 0.00 N ATOM 1533 CA ASN B 25 19.129 0.075 4.707 1.00 0.00 C ATOM 1534 C ASN B 25 18.438 1.025 3.734 1.00 0.00 C ATOM 1535 O ASN B 25 18.690 2.231 3.742 1.00 0.00 O ATOM 1536 CB ASN B 25 20.350 -0.579 4.052 1.00 0.00 C ATOM 1537 CG ASN B 25 21.418 0.430 3.674 1.00 0.00 C ATOM 1538 OD1 ASN B 25 22.239 0.818 4.506 1.00 0.00 O ATOM 1539 ND2 ASN B 25 21.451 0.824 2.414 1.00 0.00 N ATOM 0 H ASN B 25 18.375 -1.879 4.816 1.00 0.00 H new ATOM 0 HA ASN B 25 19.471 0.653 5.565 1.00 0.00 H new ATOM 0 HB2 ASN B 25 20.775 -1.314 4.736 1.00 0.00 H new ATOM 0 HB3 ASN B 25 20.034 -1.119 3.160 1.00 0.00 H new ATOM 0 HD21 ASN B 25 22.174 1.472 2.101 1.00 0.00 H new ATOM 0 HD22 ASN B 25 20.753 0.481 1.754 1.00 0.00 H new ATOM 1546 N VAL B 26 17.547 0.478 2.912 1.00 0.00 N ATOM 1547 CA VAL B 26 16.767 1.277 1.981 1.00 0.00 C ATOM 1548 C VAL B 26 15.905 2.294 2.734 1.00 0.00 C ATOM 1549 O VAL B 26 15.815 3.455 2.333 1.00 0.00 O ATOM 1550 CB VAL B 26 15.872 0.386 1.093 1.00 0.00 C ATOM 1551 CG1 VAL B 26 15.045 1.233 0.148 1.00 0.00 C ATOM 1552 CG2 VAL B 26 16.714 -0.608 0.310 1.00 0.00 C ATOM 0 H VAL B 26 17.349 -0.522 2.874 1.00 0.00 H new ATOM 0 HA VAL B 26 17.467 1.811 1.338 1.00 0.00 H new ATOM 0 HB VAL B 26 15.195 -0.169 1.742 1.00 0.00 H new ATOM 0 HG11 VAL B 26 14.421 0.586 -0.469 1.00 0.00 H new ATOM 0 HG12 VAL B 26 14.411 1.907 0.724 1.00 0.00 H new ATOM 0 HG13 VAL B 26 15.707 1.816 -0.492 1.00 0.00 H new ATOM 0 HG21 VAL B 26 16.065 -1.226 -0.310 1.00 0.00 H new ATOM 0 HG22 VAL B 26 17.416 -0.069 -0.326 1.00 0.00 H new ATOM 0 HG23 VAL B 26 17.266 -1.243 1.003 1.00 0.00 H new ATOM 1562 N LYS B 27 15.294 1.853 3.836 1.00 0.00 N ATOM 1563 CA LYS B 27 14.506 2.740 4.695 1.00 0.00 C ATOM 1564 C LYS B 27 15.333 3.940 5.137 1.00 0.00 C ATOM 1565 O LYS B 27 14.867 5.081 5.101 1.00 0.00 O ATOM 1566 CB LYS B 27 14.007 2.001 5.938 1.00 0.00 C ATOM 1567 CG LYS B 27 12.853 1.045 5.691 1.00 0.00 C ATOM 1568 CD LYS B 27 12.424 0.391 6.992 1.00 0.00 C ATOM 1569 CE LYS B 27 11.127 -0.386 6.842 1.00 0.00 C ATOM 1570 NZ LYS B 27 10.707 -1.006 8.127 1.00 0.00 N ATOM 0 H LYS B 27 15.330 0.885 4.155 1.00 0.00 H new ATOM 0 HA LYS B 27 13.651 3.080 4.110 1.00 0.00 H new ATOM 0 HB2 LYS B 27 14.838 1.442 6.369 1.00 0.00 H new ATOM 0 HB3 LYS B 27 13.698 2.736 6.681 1.00 0.00 H new ATOM 0 HG2 LYS B 27 12.013 1.584 5.252 1.00 0.00 H new ATOM 0 HG3 LYS B 27 13.152 0.281 4.973 1.00 0.00 H new ATOM 0 HD2 LYS B 27 13.211 -0.281 7.336 1.00 0.00 H new ATOM 0 HD3 LYS B 27 12.301 1.156 7.758 1.00 0.00 H new ATOM 0 HE2 LYS B 27 10.342 0.281 6.486 1.00 0.00 H new ATOM 0 HE3 LYS B 27 11.253 -1.162 6.087 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 10.094 -1.824 7.934 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 11.548 -1.320 8.652 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 10.185 -0.308 8.695 1.00 0.00 H new ATOM 1584 N SER B 28 16.563 3.668 5.545 1.00 0.00 N ATOM 1585 CA SER B 28 17.472 4.705 5.997 1.00 0.00 C ATOM 1586 C SER B 28 17.812 5.668 4.861 1.00 0.00 C ATOM 1587 O SER B 28 17.938 6.873 5.074 1.00 0.00 O ATOM 1588 CB SER B 28 18.736 4.065 6.566 1.00 0.00 C ATOM 1589 OG SER B 28 19.670 5.039 6.996 1.00 0.00 O ATOM 0 H SER B 28 16.956 2.727 5.571 1.00 0.00 H new ATOM 0 HA SER B 28 16.984 5.284 6.782 1.00 0.00 H new ATOM 0 HB2 SER B 28 18.471 3.420 7.404 1.00 0.00 H new ATOM 0 HB3 SER B 28 19.195 3.431 5.808 1.00 0.00 H new ATOM 0 HG SER B 28 20.465 4.593 7.355 1.00 0.00 H new ATOM 1595 N LYS B 29 17.934 5.137 3.649 1.00 0.00 N ATOM 1596 CA LYS B 29 18.236 5.962 2.485 1.00 0.00 C ATOM 1597 C LYS B 29 17.052 6.856 2.118 1.00 0.00 C ATOM 1598 O LYS B 29 17.233 7.948 1.583 1.00 0.00 O ATOM 1599 CB LYS B 29 18.645 5.091 1.297 1.00 0.00 C ATOM 1600 CG LYS B 29 19.947 4.343 1.523 1.00 0.00 C ATOM 1601 CD LYS B 29 20.357 3.548 0.296 1.00 0.00 C ATOM 1602 CE LYS B 29 20.563 4.446 -0.915 1.00 0.00 C ATOM 1603 NZ LYS B 29 21.627 5.457 -0.691 1.00 0.00 N ATOM 0 H LYS B 29 17.829 4.143 3.447 1.00 0.00 H new ATOM 0 HA LYS B 29 19.075 6.609 2.742 1.00 0.00 H new ATOM 0 HB2 LYS B 29 17.852 4.372 1.092 1.00 0.00 H new ATOM 0 HB3 LYS B 29 18.743 5.719 0.411 1.00 0.00 H new ATOM 0 HG2 LYS B 29 20.735 5.052 1.777 1.00 0.00 H new ATOM 0 HG3 LYS B 29 19.837 3.670 2.373 1.00 0.00 H new ATOM 0 HD2 LYS B 29 21.278 3.004 0.506 1.00 0.00 H new ATOM 0 HD3 LYS B 29 19.592 2.805 0.072 1.00 0.00 H new ATOM 0 HE2 LYS B 29 20.822 3.834 -1.779 1.00 0.00 H new ATOM 0 HE3 LYS B 29 19.628 4.953 -1.153 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 21.850 5.931 -1.589 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 21.297 6.161 -0.000 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 22.480 4.988 -0.326 1.00 0.00 H new ATOM 1617 N ILE B 30 15.841 6.398 2.414 1.00 0.00 N ATOM 1618 CA ILE B 30 14.656 7.224 2.209 1.00 0.00 C ATOM 1619 C ILE B 30 14.611 8.324 3.266 1.00 0.00 C ATOM 1620 O ILE B 30 14.251 9.471 2.979 1.00 0.00 O ATOM 1621 CB ILE B 30 13.349 6.406 2.271 1.00 0.00 C ATOM 1622 CG1 ILE B 30 13.411 5.226 1.299 1.00 0.00 C ATOM 1623 CG2 ILE B 30 12.157 7.298 1.943 1.00 0.00 C ATOM 1624 CD1 ILE B 30 12.205 4.315 1.371 1.00 0.00 C ATOM 0 H ILE B 30 15.654 5.470 2.793 1.00 0.00 H new ATOM 0 HA ILE B 30 14.729 7.654 1.210 1.00 0.00 H new ATOM 0 HB ILE B 30 13.229 6.016 3.282 1.00 0.00 H new ATOM 0 HG12 ILE B 30 13.506 5.608 0.283 1.00 0.00 H new ATOM 0 HG13 ILE B 30 14.309 4.643 1.506 1.00 0.00 H new ATOM 0 HG21 ILE B 30 11.240 6.711 1.989 1.00 0.00 H new ATOM 0 HG22 ILE B 30 12.103 8.113 2.665 1.00 0.00 H new ATOM 0 HG23 ILE B 30 12.275 7.708 0.940 1.00 0.00 H new ATOM 0 HD11 ILE B 30 12.320 3.502 0.654 1.00 0.00 H new ATOM 0 HD12 ILE B 30 12.120 3.903 2.376 1.00 0.00 H new ATOM 0 HD13 ILE B 30 11.305 4.883 1.134 1.00 0.00 H new ATOM 1636 N GLN B 31 14.995 7.967 4.488 1.00 0.00 N ATOM 1637 CA GLN B 31 15.112 8.937 5.570 1.00 0.00 C ATOM 1638 C GLN B 31 16.172 9.975 5.212 1.00 0.00 C ATOM 1639 O GLN B 31 16.039 11.154 5.525 1.00 0.00 O ATOM 1640 CB GLN B 31 15.487 8.243 6.882 1.00 0.00 C ATOM 1641 CG GLN B 31 15.440 9.171 8.086 1.00 0.00 C ATOM 1642 CD GLN B 31 16.122 8.593 9.310 1.00 0.00 C ATOM 1643 OE1 GLN B 31 16.179 7.376 9.496 1.00 0.00 O ATOM 1644 NE2 GLN B 31 16.630 9.469 10.163 1.00 0.00 N ATOM 0 H GLN B 31 15.231 7.011 4.753 1.00 0.00 H new ATOM 0 HA GLN B 31 14.149 9.429 5.704 1.00 0.00 H new ATOM 0 HB2 GLN B 31 14.809 7.406 7.050 1.00 0.00 H new ATOM 0 HB3 GLN B 31 16.490 7.827 6.791 1.00 0.00 H new ATOM 0 HG2 GLN B 31 15.914 10.117 7.826 1.00 0.00 H new ATOM 0 HG3 GLN B 31 14.400 9.391 8.327 1.00 0.00 H new ATOM 0 HE21 GLN B 31 16.561 10.468 9.970 1.00 0.00 H new ATOM 0 HE22 GLN B 31 17.091 9.145 11.013 1.00 0.00 H new ATOM 1653 N ASP B 32 17.215 9.515 4.537 1.00 0.00 N ATOM 1654 CA ASP B 32 18.287 10.382 4.058 1.00 0.00 C ATOM 1655 C ASP B 32 17.740 11.462 3.122 1.00 0.00 C ATOM 1656 O ASP B 32 18.284 12.565 3.042 1.00 0.00 O ATOM 1657 CB ASP B 32 19.340 9.534 3.336 1.00 0.00 C ATOM 1658 CG ASP B 32 20.492 10.348 2.783 1.00 0.00 C ATOM 1659 OD1 ASP B 32 21.390 10.722 3.562 1.00 0.00 O ATOM 1660 OD2 ASP B 32 20.520 10.594 1.557 1.00 0.00 O ATOM 0 H ASP B 32 17.344 8.530 4.305 1.00 0.00 H new ATOM 0 HA ASP B 32 18.745 10.882 4.912 1.00 0.00 H new ATOM 0 HB2 ASP B 32 19.731 8.788 4.027 1.00 0.00 H new ATOM 0 HB3 ASP B 32 18.862 8.993 2.519 1.00 0.00 H new ATOM 1665 N LYS B 33 16.647 11.148 2.432 1.00 0.00 N ATOM 1666 CA LYS B 33 16.037 12.087 1.501 1.00 0.00 C ATOM 1667 C LYS B 33 15.166 13.111 2.221 1.00 0.00 C ATOM 1668 O LYS B 33 15.494 14.297 2.258 1.00 0.00 O ATOM 1669 CB LYS B 33 15.198 11.360 0.444 1.00 0.00 C ATOM 1670 CG LYS B 33 16.014 10.539 -0.544 1.00 0.00 C ATOM 1671 CD LYS B 33 17.098 11.369 -1.227 1.00 0.00 C ATOM 1672 CE LYS B 33 16.558 12.675 -1.802 1.00 0.00 C ATOM 1673 NZ LYS B 33 15.457 12.462 -2.777 1.00 0.00 N ATOM 0 H LYS B 33 16.167 10.251 2.501 1.00 0.00 H new ATOM 0 HA LYS B 33 16.856 12.611 1.007 1.00 0.00 H new ATOM 0 HB2 LYS B 33 14.490 10.702 0.948 1.00 0.00 H new ATOM 0 HB3 LYS B 33 14.613 12.095 -0.108 1.00 0.00 H new ATOM 0 HG2 LYS B 33 16.475 9.700 -0.023 1.00 0.00 H new ATOM 0 HG3 LYS B 33 15.350 10.119 -1.300 1.00 0.00 H new ATOM 0 HD2 LYS B 33 17.888 11.591 -0.509 1.00 0.00 H new ATOM 0 HD3 LYS B 33 17.550 10.783 -2.027 1.00 0.00 H new ATOM 0 HE2 LYS B 33 16.200 13.305 -0.988 1.00 0.00 H new ATOM 0 HE3 LYS B 33 17.370 13.215 -2.289 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 15.163 13.377 -3.174 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 15.788 11.842 -3.544 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 14.649 12.017 -2.297 1.00 0.00 H new ATOM 1687 N GLU B 34 14.056 12.657 2.795 1.00 0.00 N ATOM 1688 CA GLU B 34 13.077 13.581 3.365 1.00 0.00 C ATOM 1689 C GLU B 34 12.841 13.336 4.853 1.00 0.00 C ATOM 1690 O GLU B 34 11.860 13.820 5.415 1.00 0.00 O ATOM 1691 CB GLU B 34 11.755 13.502 2.599 1.00 0.00 C ATOM 1692 CG GLU B 34 11.879 13.924 1.144 1.00 0.00 C ATOM 1693 CD GLU B 34 10.552 14.282 0.516 1.00 0.00 C ATOM 1694 OE1 GLU B 34 9.642 14.724 1.245 1.00 0.00 O ATOM 1695 OE2 GLU B 34 10.417 14.129 -0.716 1.00 0.00 O ATOM 0 H GLU B 34 13.812 11.670 2.878 1.00 0.00 H new ATOM 0 HA GLU B 34 13.492 14.584 3.265 1.00 0.00 H new ATOM 0 HB2 GLU B 34 11.378 12.480 2.643 1.00 0.00 H new ATOM 0 HB3 GLU B 34 11.018 14.136 3.093 1.00 0.00 H new ATOM 0 HG2 GLU B 34 12.549 14.781 1.076 1.00 0.00 H new ATOM 0 HG3 GLU B 34 12.337 13.115 0.575 1.00 0.00 H new ATOM 1702 N GLY B 35 13.750 12.614 5.489 1.00 0.00 N ATOM 1703 CA GLY B 35 13.669 12.410 6.927 1.00 0.00 C ATOM 1704 C GLY B 35 12.431 11.649 7.351 1.00 0.00 C ATOM 1705 O GLY B 35 11.780 12.008 8.332 1.00 0.00 O ATOM 0 H GLY B 35 14.546 12.163 5.037 1.00 0.00 H new ATOM 0 HA2 GLY B 35 14.554 11.868 7.261 1.00 0.00 H new ATOM 0 HA3 GLY B 35 13.681 13.379 7.426 1.00 0.00 H new ATOM 1709 N ILE B 36 12.101 10.601 6.616 1.00 0.00 N ATOM 1710 CA ILE B 36 10.940 9.790 6.935 1.00 0.00 C ATOM 1711 C ILE B 36 11.360 8.597 7.791 1.00 0.00 C ATOM 1712 O ILE B 36 12.188 7.790 7.369 1.00 0.00 O ATOM 1713 CB ILE B 36 10.231 9.288 5.659 1.00 0.00 C ATOM 1714 CG1 ILE B 36 10.037 10.441 4.668 1.00 0.00 C ATOM 1715 CG2 ILE B 36 8.888 8.668 6.017 1.00 0.00 C ATOM 1716 CD1 ILE B 36 9.416 10.019 3.352 1.00 0.00 C ATOM 0 H ILE B 36 12.621 10.292 5.795 1.00 0.00 H new ATOM 0 HA ILE B 36 10.239 10.414 7.489 1.00 0.00 H new ATOM 0 HB ILE B 36 10.854 8.528 5.188 1.00 0.00 H new ATOM 0 HG12 ILE B 36 9.407 11.202 5.129 1.00 0.00 H new ATOM 0 HG13 ILE B 36 11.004 10.905 4.471 1.00 0.00 H new ATOM 0 HG21 ILE B 36 8.396 8.317 5.110 1.00 0.00 H new ATOM 0 HG22 ILE B 36 9.044 7.828 6.694 1.00 0.00 H new ATOM 0 HG23 ILE B 36 8.261 9.415 6.504 1.00 0.00 H new ATOM 0 HD11 ILE B 36 9.311 10.889 2.704 1.00 0.00 H new ATOM 0 HD12 ILE B 36 10.056 9.281 2.868 1.00 0.00 H new ATOM 0 HD13 ILE B 36 8.434 9.583 3.536 1.00 0.00 H new ATOM 1728 N PRO B 37 10.812 8.492 9.014 1.00 0.00 N ATOM 1729 CA PRO B 37 11.146 7.412 9.954 1.00 0.00 C ATOM 1730 C PRO B 37 10.930 6.018 9.360 1.00 0.00 C ATOM 1731 O PRO B 37 9.839 5.697 8.885 1.00 0.00 O ATOM 1732 CB PRO B 37 10.185 7.646 11.124 1.00 0.00 C ATOM 1733 CG PRO B 37 9.835 9.090 11.047 1.00 0.00 C ATOM 1734 CD PRO B 37 9.830 9.432 9.585 1.00 0.00 C ATOM 0 HA PRO B 37 12.199 7.437 10.233 1.00 0.00 H new ATOM 0 HB2 PRO B 37 9.298 7.019 11.038 1.00 0.00 H new ATOM 0 HB3 PRO B 37 10.656 7.404 12.077 1.00 0.00 H new ATOM 0 HG2 PRO B 37 8.861 9.281 11.497 1.00 0.00 H new ATOM 0 HG3 PRO B 37 10.560 9.698 11.588 1.00 0.00 H new ATOM 0 HD2 PRO B 37 8.842 9.299 9.144 1.00 0.00 H new ATOM 0 HD3 PRO B 37 10.119 10.469 9.413 1.00 0.00 H new ATOM 1742 N PRO B 38 11.981 5.181 9.379 1.00 0.00 N ATOM 1743 CA PRO B 38 11.935 3.803 8.862 1.00 0.00 C ATOM 1744 C PRO B 38 10.781 2.978 9.432 1.00 0.00 C ATOM 1745 O PRO B 38 10.138 2.213 8.708 1.00 0.00 O ATOM 1746 CB PRO B 38 13.274 3.216 9.310 1.00 0.00 C ATOM 1747 CG PRO B 38 14.181 4.389 9.419 1.00 0.00 C ATOM 1748 CD PRO B 38 13.321 5.527 9.892 1.00 0.00 C ATOM 0 HA PRO B 38 11.774 3.790 7.784 1.00 0.00 H new ATOM 0 HB2 PRO B 38 13.180 2.698 10.264 1.00 0.00 H new ATOM 0 HB3 PRO B 38 13.650 2.490 8.589 1.00 0.00 H new ATOM 0 HG2 PRO B 38 14.992 4.193 10.121 1.00 0.00 H new ATOM 0 HG3 PRO B 38 14.640 4.619 8.458 1.00 0.00 H new ATOM 0 HD2 PRO B 38 13.326 5.609 10.979 1.00 0.00 H new ATOM 0 HD3 PRO B 38 13.667 6.483 9.498 1.00 0.00 H new ATOM 1756 N ASP B 39 10.503 3.151 10.720 1.00 0.00 N ATOM 1757 CA ASP B 39 9.461 2.370 11.389 1.00 0.00 C ATOM 1758 C ASP B 39 8.075 2.797 10.931 1.00 0.00 C ATOM 1759 O ASP B 39 7.097 2.074 11.115 1.00 0.00 O ATOM 1760 CB ASP B 39 9.555 2.510 12.912 1.00 0.00 C ATOM 1761 CG ASP B 39 10.830 1.927 13.481 1.00 0.00 C ATOM 1762 OD1 ASP B 39 10.961 0.685 13.514 1.00 0.00 O ATOM 1763 OD2 ASP B 39 11.711 2.712 13.894 1.00 0.00 O ATOM 0 H ASP B 39 10.981 3.822 11.322 1.00 0.00 H new ATOM 0 HA ASP B 39 9.620 1.326 11.117 1.00 0.00 H new ATOM 0 HB2 ASP B 39 9.493 3.565 13.179 1.00 0.00 H new ATOM 0 HB3 ASP B 39 8.699 2.015 13.371 1.00 0.00 H new ATOM 1768 N GLN B 40 7.992 3.967 10.325 1.00 0.00 N ATOM 1769 CA GLN B 40 6.714 4.511 9.901 1.00 0.00 C ATOM 1770 C GLN B 40 6.450 4.181 8.437 1.00 0.00 C ATOM 1771 O GLN B 40 5.379 4.463 7.918 1.00 0.00 O ATOM 1772 CB GLN B 40 6.708 6.028 10.096 1.00 0.00 C ATOM 1773 CG GLN B 40 5.343 6.677 9.907 1.00 0.00 C ATOM 1774 CD GLN B 40 5.444 8.158 9.600 1.00 0.00 C ATOM 1775 OE1 GLN B 40 4.585 8.948 9.988 1.00 0.00 O ATOM 1776 NE2 GLN B 40 6.476 8.539 8.861 1.00 0.00 N ATOM 0 H GLN B 40 8.795 4.560 10.115 1.00 0.00 H new ATOM 0 HA GLN B 40 5.927 4.062 10.507 1.00 0.00 H new ATOM 0 HB2 GLN B 40 7.070 6.255 11.099 1.00 0.00 H new ATOM 0 HB3 GLN B 40 7.411 6.476 9.394 1.00 0.00 H new ATOM 0 HG2 GLN B 40 4.815 6.176 9.096 1.00 0.00 H new ATOM 0 HG3 GLN B 40 4.749 6.536 10.810 1.00 0.00 H new ATOM 0 HE21 GLN B 40 7.168 7.853 8.559 1.00 0.00 H new ATOM 0 HE22 GLN B 40 6.579 9.518 8.594 1.00 0.00 H new ATOM 1785 N GLN B 41 7.419 3.577 7.768 1.00 0.00 N ATOM 1786 CA GLN B 41 7.288 3.322 6.340 1.00 0.00 C ATOM 1787 C GLN B 41 6.956 1.862 6.049 1.00 0.00 C ATOM 1788 O GLN B 41 7.493 0.949 6.678 1.00 0.00 O ATOM 1789 CB GLN B 41 8.564 3.715 5.603 1.00 0.00 C ATOM 1790 CG GLN B 41 8.931 5.176 5.758 1.00 0.00 C ATOM 1791 CD GLN B 41 10.172 5.550 4.975 1.00 0.00 C ATOM 1792 OE1 GLN B 41 10.093 5.906 3.806 1.00 0.00 O ATOM 1793 NE2 GLN B 41 11.322 5.492 5.623 1.00 0.00 N ATOM 0 H GLN B 41 8.294 3.257 8.183 1.00 0.00 H new ATOM 0 HA GLN B 41 6.460 3.934 5.982 1.00 0.00 H new ATOM 0 HB2 GLN B 41 9.388 3.102 5.969 1.00 0.00 H new ATOM 0 HB3 GLN B 41 8.445 3.490 4.543 1.00 0.00 H new ATOM 0 HG2 GLN B 41 8.096 5.794 5.426 1.00 0.00 H new ATOM 0 HG3 GLN B 41 9.091 5.397 6.813 1.00 0.00 H new ATOM 0 HE21 GLN B 41 11.344 5.190 6.597 1.00 0.00 H new ATOM 0 HE22 GLN B 41 12.188 5.749 5.149 1.00 0.00 H new ATOM 1802 N ARG B 42 6.059 1.663 5.094 1.00 0.00 N ATOM 1803 CA ARG B 42 5.692 0.343 4.616 1.00 0.00 C ATOM 1804 C ARG B 42 5.789 0.307 3.090 1.00 0.00 C ATOM 1805 O ARG B 42 4.937 0.850 2.387 1.00 0.00 O ATOM 1806 CB ARG B 42 4.266 -0.010 5.066 1.00 0.00 C ATOM 1807 CG ARG B 42 3.751 -1.315 4.481 1.00 0.00 C ATOM 1808 CD ARG B 42 4.518 -2.506 5.025 1.00 0.00 C ATOM 1809 NE ARG B 42 3.965 -2.995 6.287 1.00 0.00 N ATOM 1810 CZ ARG B 42 4.637 -3.760 7.143 1.00 0.00 C ATOM 1811 NH1 ARG B 42 5.895 -4.104 6.883 1.00 0.00 N ATOM 1812 NH2 ARG B 42 4.047 -4.192 8.251 1.00 0.00 N ATOM 0 H ARG B 42 5.563 2.422 4.627 1.00 0.00 H new ATOM 0 HA ARG B 42 6.378 -0.393 5.037 1.00 0.00 H new ATOM 0 HB2 ARG B 42 4.242 -0.074 6.154 1.00 0.00 H new ATOM 0 HB3 ARG B 42 3.593 0.798 4.780 1.00 0.00 H new ATOM 0 HG2 ARG B 42 2.692 -1.426 4.712 1.00 0.00 H new ATOM 0 HG3 ARG B 42 3.839 -1.289 3.395 1.00 0.00 H new ATOM 0 HD2 ARG B 42 4.504 -3.310 4.289 1.00 0.00 H new ATOM 0 HD3 ARG B 42 5.561 -2.226 5.172 1.00 0.00 H new ATOM 0 HE ARG B 42 3.008 -2.734 6.525 1.00 0.00 H new ATOM 0 HH11 ARG B 42 6.345 -3.781 6.027 1.00 0.00 H new ATOM 0 HH12 ARG B 42 6.409 -4.691 7.540 1.00 0.00 H new ATOM 0 HH21 ARG B 42 3.079 -3.937 8.446 1.00 0.00 H new ATOM 0 HH22 ARG B 42 4.562 -4.779 8.908 1.00 0.00 H new ATOM 1826 N LEU B 43 6.841 -0.310 2.581 1.00 0.00 N ATOM 1827 CA LEU B 43 7.045 -0.389 1.142 1.00 0.00 C ATOM 1828 C LEU B 43 6.250 -1.550 0.559 1.00 0.00 C ATOM 1829 O LEU B 43 6.268 -2.656 1.101 1.00 0.00 O ATOM 1830 CB LEU B 43 8.534 -0.547 0.800 1.00 0.00 C ATOM 1831 CG LEU B 43 9.428 0.665 1.106 1.00 0.00 C ATOM 1832 CD1 LEU B 43 9.665 0.819 2.604 1.00 0.00 C ATOM 1833 CD2 LEU B 43 10.754 0.541 0.371 1.00 0.00 C ATOM 0 H LEU B 43 7.565 -0.762 3.139 1.00 0.00 H new ATOM 0 HA LEU B 43 6.692 0.543 0.701 1.00 0.00 H new ATOM 0 HB2 LEU B 43 8.922 -1.407 1.346 1.00 0.00 H new ATOM 0 HB3 LEU B 43 8.620 -0.778 -0.262 1.00 0.00 H new ATOM 0 HG LEU B 43 8.910 1.559 0.757 1.00 0.00 H new ATOM 0 HD11 LEU B 43 10.301 1.686 2.785 1.00 0.00 H new ATOM 0 HD12 LEU B 43 8.710 0.958 3.111 1.00 0.00 H new ATOM 0 HD13 LEU B 43 10.154 -0.076 2.989 1.00 0.00 H new ATOM 0 HD21 LEU B 43 11.377 1.406 0.597 1.00 0.00 H new ATOM 0 HD22 LEU B 43 11.264 -0.367 0.692 1.00 0.00 H new ATOM 0 HD23 LEU B 43 10.572 0.495 -0.703 1.00 0.00 H new ATOM 1845 N ILE B 44 5.534 -1.287 -0.528 1.00 0.00 N ATOM 1846 CA ILE B 44 4.754 -2.318 -1.202 1.00 0.00 C ATOM 1847 C ILE B 44 5.197 -2.468 -2.655 1.00 0.00 C ATOM 1848 O ILE B 44 5.175 -1.505 -3.430 1.00 0.00 O ATOM 1849 CB ILE B 44 3.237 -2.013 -1.161 1.00 0.00 C ATOM 1850 CG1 ILE B 44 2.747 -1.925 0.287 1.00 0.00 C ATOM 1851 CG2 ILE B 44 2.457 -3.079 -1.923 1.00 0.00 C ATOM 1852 CD1 ILE B 44 1.273 -1.598 0.409 1.00 0.00 C ATOM 0 H ILE B 44 5.478 -0.366 -0.962 1.00 0.00 H new ATOM 0 HA ILE B 44 4.933 -3.250 -0.666 1.00 0.00 H new ATOM 0 HB ILE B 44 3.066 -1.050 -1.643 1.00 0.00 H new ATOM 0 HG12 ILE B 44 2.943 -2.874 0.786 1.00 0.00 H new ATOM 0 HG13 ILE B 44 3.324 -1.164 0.812 1.00 0.00 H new ATOM 0 HG21 ILE B 44 1.392 -2.849 -1.884 1.00 0.00 H new ATOM 0 HG22 ILE B 44 2.786 -3.098 -2.962 1.00 0.00 H new ATOM 0 HG23 ILE B 44 2.634 -4.054 -1.469 1.00 0.00 H new ATOM 0 HD11 ILE B 44 0.997 -1.552 1.462 1.00 0.00 H new ATOM 0 HD12 ILE B 44 1.074 -0.635 -0.061 1.00 0.00 H new ATOM 0 HD13 ILE B 44 0.686 -2.372 -0.086 1.00 0.00 H new ATOM 1864 N PHE B 45 5.597 -3.677 -3.019 1.00 0.00 N ATOM 1865 CA PHE B 45 6.031 -3.975 -4.376 1.00 0.00 C ATOM 1866 C PHE B 45 5.179 -5.094 -4.968 1.00 0.00 C ATOM 1867 O PHE B 45 5.162 -6.208 -4.445 1.00 0.00 O ATOM 1868 CB PHE B 45 7.513 -4.367 -4.383 1.00 0.00 C ATOM 1869 CG PHE B 45 8.059 -4.674 -5.751 1.00 0.00 C ATOM 1870 CD1 PHE B 45 8.405 -3.653 -6.622 1.00 0.00 C ATOM 1871 CD2 PHE B 45 8.234 -5.986 -6.161 1.00 0.00 C ATOM 1872 CE1 PHE B 45 8.912 -3.936 -7.876 1.00 0.00 C ATOM 1873 CE2 PHE B 45 8.741 -6.275 -7.413 1.00 0.00 C ATOM 1874 CZ PHE B 45 9.081 -5.249 -8.272 1.00 0.00 C ATOM 0 H PHE B 45 5.630 -4.476 -2.386 1.00 0.00 H new ATOM 0 HA PHE B 45 5.906 -3.083 -4.990 1.00 0.00 H new ATOM 0 HB2 PHE B 45 8.095 -3.556 -3.945 1.00 0.00 H new ATOM 0 HB3 PHE B 45 7.650 -5.239 -3.744 1.00 0.00 H new ATOM 0 HD1 PHE B 45 8.277 -2.625 -6.317 1.00 0.00 H new ATOM 0 HD2 PHE B 45 7.971 -6.793 -5.493 1.00 0.00 H new ATOM 0 HE1 PHE B 45 9.176 -3.131 -8.546 1.00 0.00 H new ATOM 0 HE2 PHE B 45 8.871 -7.302 -7.720 1.00 0.00 H new ATOM 0 HZ PHE B 45 9.478 -5.472 -9.251 1.00 0.00 H new ATOM 1884 N ALA B 46 4.441 -4.773 -6.033 1.00 0.00 N ATOM 1885 CA ALA B 46 3.596 -5.744 -6.735 1.00 0.00 C ATOM 1886 C ALA B 46 2.491 -6.281 -5.825 1.00 0.00 C ATOM 1887 O ALA B 46 1.939 -7.358 -6.063 1.00 0.00 O ATOM 1888 CB ALA B 46 4.440 -6.887 -7.292 1.00 0.00 C ATOM 0 H ALA B 46 4.412 -3.835 -6.433 1.00 0.00 H new ATOM 0 HA ALA B 46 3.118 -5.229 -7.568 1.00 0.00 H new ATOM 0 HB1 ALA B 46 3.795 -7.597 -7.809 1.00 0.00 H new ATOM 0 HB2 ALA B 46 5.176 -6.489 -7.991 1.00 0.00 H new ATOM 0 HB3 ALA B 46 4.953 -7.392 -6.474 1.00 0.00 H new ATOM 1894 N GLY B 47 2.158 -5.512 -4.796 1.00 0.00 N ATOM 1895 CA GLY B 47 1.134 -5.925 -3.858 1.00 0.00 C ATOM 1896 C GLY B 47 1.718 -6.608 -2.640 1.00 0.00 C ATOM 1897 O GLY B 47 0.994 -6.960 -1.709 1.00 0.00 O ATOM 0 H GLY B 47 2.581 -4.606 -4.595 1.00 0.00 H new ATOM 0 HA2 GLY B 47 0.559 -5.054 -3.544 1.00 0.00 H new ATOM 0 HA3 GLY B 47 0.440 -6.603 -4.355 1.00 0.00 H new ATOM 1901 N LYS B 48 3.031 -6.793 -2.650 1.00 0.00 N ATOM 1902 CA LYS B 48 3.726 -7.444 -1.550 1.00 0.00 C ATOM 1903 C LYS B 48 4.304 -6.412 -0.589 1.00 0.00 C ATOM 1904 O LYS B 48 5.044 -5.515 -0.997 1.00 0.00 O ATOM 1905 CB LYS B 48 4.845 -8.340 -2.095 1.00 0.00 C ATOM 1906 CG LYS B 48 5.684 -9.012 -1.018 1.00 0.00 C ATOM 1907 CD LYS B 48 6.821 -9.827 -1.620 1.00 0.00 C ATOM 1908 CE LYS B 48 6.303 -11.007 -2.426 1.00 0.00 C ATOM 1909 NZ LYS B 48 5.536 -11.958 -1.581 1.00 0.00 N ATOM 0 H LYS B 48 3.639 -6.499 -3.414 1.00 0.00 H new ATOM 0 HA LYS B 48 3.009 -8.058 -1.004 1.00 0.00 H new ATOM 0 HB2 LYS B 48 4.404 -9.109 -2.729 1.00 0.00 H new ATOM 0 HB3 LYS B 48 5.499 -7.741 -2.729 1.00 0.00 H new ATOM 0 HG2 LYS B 48 6.093 -8.255 -0.349 1.00 0.00 H new ATOM 0 HG3 LYS B 48 5.050 -9.661 -0.414 1.00 0.00 H new ATOM 0 HD2 LYS B 48 7.428 -9.187 -2.261 1.00 0.00 H new ATOM 0 HD3 LYS B 48 7.471 -10.188 -0.823 1.00 0.00 H new ATOM 0 HE2 LYS B 48 5.667 -10.644 -3.234 1.00 0.00 H new ATOM 0 HE3 LYS B 48 7.142 -11.527 -2.889 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 5.548 -12.901 -2.020 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 5.969 -12.010 -0.637 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 4.553 -11.630 -1.494 1.00 0.00 H new ATOM 1923 N GLN B 49 3.953 -6.538 0.683 1.00 0.00 N ATOM 1924 CA GLN B 49 4.496 -5.667 1.714 1.00 0.00 C ATOM 1925 C GLN B 49 5.893 -6.126 2.103 1.00 0.00 C ATOM 1926 O GLN B 49 6.146 -7.324 2.230 1.00 0.00 O ATOM 1927 CB GLN B 49 3.596 -5.658 2.948 1.00 0.00 C ATOM 1928 CG GLN B 49 2.196 -5.138 2.681 1.00 0.00 C ATOM 1929 CD GLN B 49 1.387 -5.000 3.952 1.00 0.00 C ATOM 1930 OE1 GLN B 49 1.400 -3.951 4.592 1.00 0.00 O ATOM 1931 NE2 GLN B 49 0.679 -6.055 4.323 1.00 0.00 N ATOM 0 H GLN B 49 3.293 -7.237 1.026 1.00 0.00 H new ATOM 0 HA GLN B 49 4.546 -4.655 1.312 1.00 0.00 H new ATOM 0 HB2 GLN B 49 3.528 -6.671 3.344 1.00 0.00 H new ATOM 0 HB3 GLN B 49 4.060 -5.045 3.720 1.00 0.00 H new ATOM 0 HG2 GLN B 49 2.258 -4.170 2.185 1.00 0.00 H new ATOM 0 HG3 GLN B 49 1.683 -5.814 1.997 1.00 0.00 H new ATOM 0 HE21 GLN B 49 0.698 -6.906 3.760 1.00 0.00 H new ATOM 0 HE22 GLN B 49 0.114 -6.017 5.171 1.00 0.00 H new ATOM 1940 N LEU B 50 6.795 -5.176 2.280 1.00 0.00 N ATOM 1941 CA LEU B 50 8.173 -5.495 2.614 1.00 0.00 C ATOM 1942 C LEU B 50 8.418 -5.378 4.116 1.00 0.00 C ATOM 1943 O LEU B 50 8.120 -4.346 4.728 1.00 0.00 O ATOM 1944 CB LEU B 50 9.130 -4.567 1.859 1.00 0.00 C ATOM 1945 CG LEU B 50 8.904 -4.477 0.345 1.00 0.00 C ATOM 1946 CD1 LEU B 50 9.961 -3.593 -0.298 1.00 0.00 C ATOM 1947 CD2 LEU B 50 8.910 -5.861 -0.285 1.00 0.00 C ATOM 0 H LEU B 50 6.599 -4.178 2.198 1.00 0.00 H new ATOM 0 HA LEU B 50 8.359 -6.526 2.315 1.00 0.00 H new ATOM 0 HB2 LEU B 50 9.046 -3.566 2.282 1.00 0.00 H new ATOM 0 HB3 LEU B 50 10.151 -4.904 2.037 1.00 0.00 H new ATOM 0 HG LEU B 50 7.926 -4.029 0.171 1.00 0.00 H new ATOM 0 HD11 LEU B 50 9.786 -3.540 -1.373 1.00 0.00 H new ATOM 0 HD12 LEU B 50 9.906 -2.591 0.129 1.00 0.00 H new ATOM 0 HD13 LEU B 50 10.949 -4.013 -0.112 1.00 0.00 H new ATOM 0 HD21 LEU B 50 8.748 -5.772 -1.359 1.00 0.00 H new ATOM 0 HD22 LEU B 50 9.872 -6.340 -0.101 1.00 0.00 H new ATOM 0 HD23 LEU B 50 8.115 -6.464 0.153 1.00 0.00 H new ATOM 1959 N GLU B 51 8.938 -6.450 4.700 1.00 0.00 N ATOM 1960 CA GLU B 51 9.374 -6.444 6.089 1.00 0.00 C ATOM 1961 C GLU B 51 10.883 -6.228 6.149 1.00 0.00 C ATOM 1962 O GLU B 51 11.574 -6.347 5.133 1.00 0.00 O ATOM 1963 CB GLU B 51 9.000 -7.763 6.774 1.00 0.00 C ATOM 1964 CG GLU B 51 7.517 -7.895 7.086 1.00 0.00 C ATOM 1965 CD GLU B 51 7.114 -7.147 8.343 1.00 0.00 C ATOM 1966 OE1 GLU B 51 7.070 -5.902 8.318 1.00 0.00 O ATOM 1967 OE2 GLU B 51 6.833 -7.806 9.366 1.00 0.00 O ATOM 0 H GLU B 51 9.069 -7.344 4.226 1.00 0.00 H new ATOM 0 HA GLU B 51 8.873 -5.631 6.615 1.00 0.00 H new ATOM 0 HB2 GLU B 51 9.302 -8.592 6.134 1.00 0.00 H new ATOM 0 HB3 GLU B 51 9.566 -7.853 7.701 1.00 0.00 H new ATOM 0 HG2 GLU B 51 6.938 -7.519 6.243 1.00 0.00 H new ATOM 0 HG3 GLU B 51 7.266 -8.950 7.200 1.00 0.00 H new ATOM 1974 N ASP B 52 11.388 -5.914 7.332 1.00 0.00 N ATOM 1975 CA ASP B 52 12.812 -5.636 7.515 1.00 0.00 C ATOM 1976 C ASP B 52 13.630 -6.921 7.547 1.00 0.00 C ATOM 1977 O ASP B 52 13.083 -8.020 7.630 1.00 0.00 O ATOM 1978 CB ASP B 52 13.048 -4.859 8.810 1.00 0.00 C ATOM 1979 CG ASP B 52 12.330 -3.529 8.837 1.00 0.00 C ATOM 1980 OD1 ASP B 52 11.154 -3.488 9.253 1.00 0.00 O ATOM 1981 OD2 ASP B 52 12.933 -2.513 8.439 1.00 0.00 O ATOM 0 H ASP B 52 10.834 -5.844 8.185 1.00 0.00 H new ATOM 0 HA ASP B 52 13.135 -5.035 6.665 1.00 0.00 H new ATOM 0 HB2 ASP B 52 12.717 -5.462 9.655 1.00 0.00 H new ATOM 0 HB3 ASP B 52 14.117 -4.692 8.938 1.00 0.00 H new ATOM 1986 N GLY B 53 14.948 -6.773 7.481 1.00 0.00 N ATOM 1987 CA GLY B 53 15.835 -7.919 7.572 1.00 0.00 C ATOM 1988 C GLY B 53 16.165 -8.526 6.219 1.00 0.00 C ATOM 1989 O GLY B 53 17.330 -8.780 5.912 1.00 0.00 O ATOM 0 H GLY B 53 15.420 -5.876 7.366 1.00 0.00 H new ATOM 0 HA2 GLY B 53 16.760 -7.617 8.063 1.00 0.00 H new ATOM 0 HA3 GLY B 53 15.373 -8.679 8.202 1.00 0.00 H new ATOM 1993 N ARG B 54 15.141 -8.739 5.405 1.00 0.00 N ATOM 1994 CA ARG B 54 15.306 -9.412 4.119 1.00 0.00 C ATOM 1995 C ARG B 54 15.878 -8.458 3.072 1.00 0.00 C ATOM 1996 O ARG B 54 15.877 -7.236 3.261 1.00 0.00 O ATOM 1997 CB ARG B 54 13.959 -9.972 3.652 1.00 0.00 C ATOM 1998 CG ARG B 54 13.286 -10.865 4.685 1.00 0.00 C ATOM 1999 CD ARG B 54 13.982 -12.212 4.808 1.00 0.00 C ATOM 2000 NE ARG B 54 13.534 -13.152 3.784 1.00 0.00 N ATOM 2001 CZ ARG B 54 13.434 -14.466 3.966 1.00 0.00 C ATOM 2002 NH1 ARG B 54 13.731 -15.010 5.138 1.00 0.00 N ATOM 2003 NH2 ARG B 54 13.026 -15.234 2.971 1.00 0.00 N ATOM 0 H ARG B 54 14.183 -8.455 5.611 1.00 0.00 H new ATOM 0 HA ARG B 54 16.011 -10.233 4.245 1.00 0.00 H new ATOM 0 HB2 ARG B 54 13.293 -9.143 3.410 1.00 0.00 H new ATOM 0 HB3 ARG B 54 14.108 -10.540 2.734 1.00 0.00 H new ATOM 0 HG2 ARG B 54 13.288 -10.365 5.654 1.00 0.00 H new ATOM 0 HG3 ARG B 54 12.243 -11.019 4.408 1.00 0.00 H new ATOM 0 HD2 ARG B 54 15.060 -12.072 4.726 1.00 0.00 H new ATOM 0 HD3 ARG B 54 13.789 -12.632 5.795 1.00 0.00 H new ATOM 0 HE ARG B 54 13.281 -12.777 2.870 1.00 0.00 H new ATOM 0 HH11 ARG B 54 14.040 -14.420 5.911 1.00 0.00 H new ATOM 0 HH12 ARG B 54 13.651 -16.019 5.267 1.00 0.00 H new ATOM 0 HH21 ARG B 54 12.790 -14.819 2.070 1.00 0.00 H new ATOM 0 HH22 ARG B 54 12.947 -16.242 3.104 1.00 0.00 H new ATOM 2017 N THR B 55 16.376 -9.021 1.979 1.00 0.00 N ATOM 2018 CA THR B 55 16.951 -8.235 0.898 1.00 0.00 C ATOM 2019 C THR B 55 15.923 -7.987 -0.205 1.00 0.00 C ATOM 2020 O THR B 55 14.858 -8.608 -0.221 1.00 0.00 O ATOM 2021 CB THR B 55 18.181 -8.946 0.300 1.00 0.00 C ATOM 2022 OG1 THR B 55 17.846 -10.299 -0.039 1.00 0.00 O ATOM 2023 CG2 THR B 55 19.343 -8.938 1.282 1.00 0.00 C ATOM 0 H THR B 55 16.393 -10.028 1.818 1.00 0.00 H new ATOM 0 HA THR B 55 17.259 -7.277 1.317 1.00 0.00 H new ATOM 0 HB THR B 55 18.483 -8.408 -0.599 1.00 0.00 H new ATOM 0 HG1 THR B 55 18.631 -10.745 -0.420 1.00 0.00 H new ATOM 0 HG21 THR B 55 20.199 -9.445 0.837 1.00 0.00 H new ATOM 0 HG22 THR B 55 19.613 -7.909 1.517 1.00 0.00 H new ATOM 0 HG23 THR B 55 19.050 -9.454 2.196 1.00 0.00 H new ATOM 2031 N LEU B 56 16.244 -7.084 -1.125 1.00 0.00 N ATOM 2032 CA LEU B 56 15.354 -6.775 -2.242 1.00 0.00 C ATOM 2033 C LEU B 56 15.168 -8.003 -3.138 1.00 0.00 C ATOM 2034 O LEU B 56 14.062 -8.282 -3.605 1.00 0.00 O ATOM 2035 CB LEU B 56 15.896 -5.600 -3.076 1.00 0.00 C ATOM 2036 CG LEU B 56 15.770 -4.194 -2.463 1.00 0.00 C ATOM 2037 CD1 LEU B 56 14.354 -3.935 -1.982 1.00 0.00 C ATOM 2038 CD2 LEU B 56 16.767 -3.985 -1.335 1.00 0.00 C ATOM 0 H LEU B 56 17.114 -6.552 -1.121 1.00 0.00 H new ATOM 0 HA LEU B 56 14.389 -6.488 -1.825 1.00 0.00 H new ATOM 0 HB2 LEU B 56 16.950 -5.787 -3.281 1.00 0.00 H new ATOM 0 HB3 LEU B 56 15.380 -5.599 -4.036 1.00 0.00 H new ATOM 0 HG LEU B 56 16.002 -3.474 -3.248 1.00 0.00 H new ATOM 0 HD11 LEU B 56 14.293 -2.935 -1.553 1.00 0.00 H new ATOM 0 HD12 LEU B 56 13.664 -4.013 -2.822 1.00 0.00 H new ATOM 0 HD13 LEU B 56 14.087 -4.671 -1.224 1.00 0.00 H new ATOM 0 HD21 LEU B 56 16.649 -2.981 -0.926 1.00 0.00 H new ATOM 0 HD22 LEU B 56 16.588 -4.720 -0.550 1.00 0.00 H new ATOM 0 HD23 LEU B 56 17.780 -4.104 -1.718 1.00 0.00 H new ATOM 2050 N SER B 57 16.255 -8.740 -3.362 1.00 0.00 N ATOM 2051 CA SER B 57 16.224 -9.936 -4.186 1.00 0.00 C ATOM 2052 C SER B 57 15.317 -11.008 -3.584 1.00 0.00 C ATOM 2053 O SER B 57 14.746 -11.825 -4.309 1.00 0.00 O ATOM 2054 CB SER B 57 17.644 -10.478 -4.354 1.00 0.00 C ATOM 2055 OG SER B 57 18.457 -9.570 -5.079 1.00 0.00 O ATOM 0 H SER B 57 17.174 -8.522 -2.978 1.00 0.00 H new ATOM 0 HA SER B 57 15.816 -9.669 -5.161 1.00 0.00 H new ATOM 0 HB2 SER B 57 18.084 -10.662 -3.374 1.00 0.00 H new ATOM 0 HB3 SER B 57 17.611 -11.436 -4.873 1.00 0.00 H new ATOM 0 HG SER B 57 19.360 -9.940 -5.170 1.00 0.00 H new ATOM 2061 N ASP B 58 15.165 -10.990 -2.264 1.00 0.00 N ATOM 2062 CA ASP B 58 14.343 -11.982 -1.583 1.00 0.00 C ATOM 2063 C ASP B 58 12.875 -11.801 -1.942 1.00 0.00 C ATOM 2064 O ASP B 58 12.132 -12.771 -2.073 1.00 0.00 O ATOM 2065 CB ASP B 58 14.520 -11.889 -0.069 1.00 0.00 C ATOM 2066 CG ASP B 58 13.916 -13.077 0.644 1.00 0.00 C ATOM 2067 OD1 ASP B 58 14.585 -14.131 0.715 1.00 0.00 O ATOM 2068 OD2 ASP B 58 12.780 -12.966 1.144 1.00 0.00 O ATOM 0 H ASP B 58 15.598 -10.303 -1.647 1.00 0.00 H new ATOM 0 HA ASP B 58 14.669 -12.968 -1.913 1.00 0.00 H new ATOM 0 HB2 ASP B 58 15.582 -11.824 0.169 1.00 0.00 H new ATOM 0 HB3 ASP B 58 14.055 -10.973 0.295 1.00 0.00 H new ATOM 2073 N TYR B 59 12.472 -10.550 -2.128 1.00 0.00 N ATOM 2074 CA TYR B 59 11.091 -10.231 -2.473 1.00 0.00 C ATOM 2075 C TYR B 59 10.899 -10.180 -3.988 1.00 0.00 C ATOM 2076 O TYR B 59 9.859 -9.730 -4.469 1.00 0.00 O ATOM 2077 CB TYR B 59 10.687 -8.888 -1.865 1.00 0.00 C ATOM 2078 CG TYR B 59 10.703 -8.859 -0.353 1.00 0.00 C ATOM 2079 CD1 TYR B 59 9.679 -9.438 0.388 1.00 0.00 C ATOM 2080 CD2 TYR B 59 11.731 -8.230 0.333 1.00 0.00 C ATOM 2081 CE1 TYR B 59 9.685 -9.394 1.770 1.00 0.00 C ATOM 2082 CE2 TYR B 59 11.746 -8.184 1.712 1.00 0.00 C ATOM 2083 CZ TYR B 59 10.721 -8.762 2.426 1.00 0.00 C ATOM 2084 OH TYR B 59 10.737 -8.712 3.803 1.00 0.00 O ATOM 0 H TYR B 59 13.083 -9.738 -2.046 1.00 0.00 H new ATOM 0 HA TYR B 59 10.458 -11.020 -2.067 1.00 0.00 H new ATOM 0 HB2 TYR B 59 11.360 -8.116 -2.239 1.00 0.00 H new ATOM 0 HB3 TYR B 59 9.685 -8.632 -2.211 1.00 0.00 H new ATOM 0 HD1 TYR B 59 8.866 -9.930 -0.124 1.00 0.00 H new ATOM 0 HD2 TYR B 59 12.534 -7.768 -0.222 1.00 0.00 H new ATOM 0 HE1 TYR B 59 8.884 -9.851 2.332 1.00 0.00 H new ATOM 0 HE2 TYR B 59 12.559 -7.696 2.229 1.00 0.00 H new ATOM 0 HH TYR B 59 11.050 -7.830 4.095 1.00 0.00 H new ATOM 2094 N ASN B 60 11.913 -10.636 -4.727 1.00 0.00 N ATOM 2095 CA ASN B 60 11.872 -10.668 -6.195 1.00 0.00 C ATOM 2096 C ASN B 60 11.845 -9.265 -6.792 1.00 0.00 C ATOM 2097 O ASN B 60 11.354 -9.063 -7.903 1.00 0.00 O ATOM 2098 CB ASN B 60 10.665 -11.473 -6.698 1.00 0.00 C ATOM 2099 CG ASN B 60 10.854 -12.972 -6.562 1.00 0.00 C ATOM 2100 OD1 ASN B 60 9.901 -13.710 -6.308 1.00 0.00 O ATOM 2101 ND2 ASN B 60 12.079 -13.440 -6.757 1.00 0.00 N ATOM 0 H ASN B 60 12.782 -10.992 -4.330 1.00 0.00 H new ATOM 0 HA ASN B 60 12.787 -11.160 -6.525 1.00 0.00 H new ATOM 0 HB2 ASN B 60 9.777 -11.172 -6.141 1.00 0.00 H new ATOM 0 HB3 ASN B 60 10.483 -11.229 -7.745 1.00 0.00 H new ATOM 0 HD21 ASN B 60 12.257 -14.443 -6.699 1.00 0.00 H new ATOM 0 HD22 ASN B 60 12.843 -12.797 -6.965 1.00 0.00 H new ATOM 2108 N ILE B 61 12.398 -8.305 -6.066 1.00 0.00 N ATOM 2109 CA ILE B 61 12.461 -6.933 -6.544 1.00 0.00 C ATOM 2110 C ILE B 61 13.605 -6.774 -7.543 1.00 0.00 C ATOM 2111 O ILE B 61 14.692 -7.327 -7.355 1.00 0.00 O ATOM 2112 CB ILE B 61 12.613 -5.942 -5.370 1.00 0.00 C ATOM 2113 CG1 ILE B 61 11.428 -6.113 -4.415 1.00 0.00 C ATOM 2114 CG2 ILE B 61 12.698 -4.505 -5.874 1.00 0.00 C ATOM 2115 CD1 ILE B 61 11.457 -5.187 -3.223 1.00 0.00 C ATOM 0 H ILE B 61 12.809 -8.451 -5.144 1.00 0.00 H new ATOM 0 HA ILE B 61 11.524 -6.703 -7.051 1.00 0.00 H new ATOM 0 HB ILE B 61 13.541 -6.156 -4.839 1.00 0.00 H new ATOM 0 HG12 ILE B 61 10.503 -5.947 -4.968 1.00 0.00 H new ATOM 0 HG13 ILE B 61 11.407 -7.143 -4.060 1.00 0.00 H new ATOM 0 HG21 ILE B 61 12.805 -3.828 -5.027 1.00 0.00 H new ATOM 0 HG22 ILE B 61 13.560 -4.401 -6.532 1.00 0.00 H new ATOM 0 HG23 ILE B 61 11.790 -4.258 -6.424 1.00 0.00 H new ATOM 0 HD11 ILE B 61 10.584 -5.372 -2.597 1.00 0.00 H new ATOM 0 HD12 ILE B 61 12.363 -5.367 -2.644 1.00 0.00 H new ATOM 0 HD13 ILE B 61 11.445 -4.152 -3.566 1.00 0.00 H new ATOM 2127 N GLN B 62 13.344 -6.029 -8.606 1.00 0.00 N ATOM 2128 CA GLN B 62 14.265 -5.935 -9.730 1.00 0.00 C ATOM 2129 C GLN B 62 15.009 -4.605 -9.738 1.00 0.00 C ATOM 2130 O GLN B 62 14.871 -3.794 -8.824 1.00 0.00 O ATOM 2131 CB GLN B 62 13.490 -6.088 -11.038 1.00 0.00 C ATOM 2132 CG GLN B 62 12.710 -7.388 -11.135 1.00 0.00 C ATOM 2133 CD GLN B 62 11.810 -7.439 -12.353 1.00 0.00 C ATOM 2134 OE1 GLN B 62 11.325 -6.410 -12.828 1.00 0.00 O ATOM 2135 NE2 GLN B 62 11.575 -8.637 -12.861 1.00 0.00 N ATOM 0 H GLN B 62 12.494 -5.476 -8.715 1.00 0.00 H new ATOM 0 HA GLN B 62 15.000 -6.734 -9.629 1.00 0.00 H new ATOM 0 HB2 GLN B 62 12.799 -5.251 -11.141 1.00 0.00 H new ATOM 0 HB3 GLN B 62 14.188 -6.030 -11.873 1.00 0.00 H new ATOM 0 HG2 GLN B 62 13.408 -8.224 -11.169 1.00 0.00 H new ATOM 0 HG3 GLN B 62 12.106 -7.513 -10.236 1.00 0.00 H new ATOM 0 HE21 GLN B 62 11.997 -9.463 -12.436 1.00 0.00 H new ATOM 0 HE22 GLN B 62 10.972 -8.735 -13.678 1.00 0.00 H new ATOM 2144 N LYS B 63 15.805 -4.402 -10.778 1.00 0.00 N ATOM 2145 CA LYS B 63 16.513 -3.148 -10.976 1.00 0.00 C ATOM 2146 C LYS B 63 15.615 -2.140 -11.686 1.00 0.00 C ATOM 2147 O LYS B 63 14.882 -2.508 -12.609 1.00 0.00 O ATOM 2148 CB LYS B 63 17.774 -3.372 -11.816 1.00 0.00 C ATOM 2149 CG LYS B 63 18.816 -4.268 -11.164 1.00 0.00 C ATOM 2150 CD LYS B 63 20.016 -4.466 -12.075 1.00 0.00 C ATOM 2151 CE LYS B 63 21.099 -5.304 -11.414 1.00 0.00 C ATOM 2152 NZ LYS B 63 21.741 -4.605 -10.267 1.00 0.00 N ATOM 0 H LYS B 63 15.977 -5.098 -11.504 1.00 0.00 H new ATOM 0 HA LYS B 63 16.795 -2.760 -9.997 1.00 0.00 H new ATOM 0 HB2 LYS B 63 17.485 -3.808 -12.772 1.00 0.00 H new ATOM 0 HB3 LYS B 63 18.228 -2.405 -12.031 1.00 0.00 H new ATOM 0 HG2 LYS B 63 19.140 -3.827 -10.221 1.00 0.00 H new ATOM 0 HG3 LYS B 63 18.372 -5.235 -10.928 1.00 0.00 H new ATOM 0 HD2 LYS B 63 19.695 -4.950 -12.998 1.00 0.00 H new ATOM 0 HD3 LYS B 63 20.426 -3.495 -12.351 1.00 0.00 H new ATOM 0 HE2 LYS B 63 20.667 -6.243 -11.067 1.00 0.00 H new ATOM 0 HE3 LYS B 63 21.859 -5.557 -12.153 1.00 0.00 H new ATOM 0 HZ1 LYS B 63 22.633 -5.082 -10.025 1.00 0.00 H new ATOM 0 HZ2 LYS B 63 21.937 -3.617 -10.528 1.00 0.00 H new ATOM 0 HZ3 LYS B 63 21.103 -4.626 -9.446 1.00 0.00 H new ATOM 2166 N GLU B 64 15.663 -0.878 -11.244 1.00 0.00 N ATOM 2167 CA GLU B 64 14.954 0.217 -11.912 1.00 0.00 C ATOM 2168 C GLU B 64 13.447 0.061 -11.750 1.00 0.00 C ATOM 2169 O GLU B 64 12.661 0.573 -12.549 1.00 0.00 O ATOM 2170 CB GLU B 64 15.339 0.280 -13.392 1.00 0.00 C ATOM 2171 CG GLU B 64 16.839 0.376 -13.609 1.00 0.00 C ATOM 2172 CD GLU B 64 17.226 0.287 -15.066 1.00 0.00 C ATOM 2173 OE1 GLU B 64 17.354 -0.844 -15.583 1.00 0.00 O ATOM 2174 OE2 GLU B 64 17.419 1.345 -15.696 1.00 0.00 O ATOM 0 H GLU B 64 16.190 -0.589 -10.420 1.00 0.00 H new ATOM 0 HA GLU B 64 15.249 1.155 -11.442 1.00 0.00 H new ATOM 0 HB2 GLU B 64 14.960 -0.607 -13.899 1.00 0.00 H new ATOM 0 HB3 GLU B 64 14.855 1.141 -13.852 1.00 0.00 H new ATOM 0 HG2 GLU B 64 17.201 1.318 -13.198 1.00 0.00 H new ATOM 0 HG3 GLU B 64 17.333 -0.423 -13.057 1.00 0.00 H new ATOM 2181 N SER B 65 13.054 -0.633 -10.692 1.00 0.00 N ATOM 2182 CA SER B 65 11.645 -0.878 -10.423 1.00 0.00 C ATOM 2183 C SER B 65 11.010 0.262 -9.630 1.00 0.00 C ATOM 2184 O SER B 65 11.701 1.080 -9.023 1.00 0.00 O ATOM 2185 CB SER B 65 11.471 -2.193 -9.670 1.00 0.00 C ATOM 2186 OG SER B 65 12.358 -2.280 -8.568 1.00 0.00 O ATOM 0 H SER B 65 13.691 -1.037 -10.006 1.00 0.00 H new ATOM 0 HA SER B 65 11.136 -0.939 -11.385 1.00 0.00 H new ATOM 0 HB2 SER B 65 10.443 -2.279 -9.319 1.00 0.00 H new ATOM 0 HB3 SER B 65 11.648 -3.028 -10.348 1.00 0.00 H new ATOM 0 HG SER B 65 13.139 -2.816 -8.818 1.00 0.00 H new ATOM 2192 N THR B 66 9.686 0.296 -9.641 1.00 0.00 N ATOM 2193 CA THR B 66 8.930 1.297 -8.902 1.00 0.00 C ATOM 2194 C THR B 66 8.187 0.640 -7.740 1.00 0.00 C ATOM 2195 O THR B 66 7.566 -0.412 -7.907 1.00 0.00 O ATOM 2196 CB THR B 66 7.923 2.021 -9.822 1.00 0.00 C ATOM 2197 OG1 THR B 66 8.603 2.525 -10.979 1.00 0.00 O ATOM 2198 CG2 THR B 66 7.237 3.171 -9.096 1.00 0.00 C ATOM 0 H THR B 66 9.108 -0.365 -10.159 1.00 0.00 H new ATOM 0 HA THR B 66 9.633 2.034 -8.513 1.00 0.00 H new ATOM 0 HB THR B 66 7.161 1.302 -10.121 1.00 0.00 H new ATOM 0 HG1 THR B 66 7.962 2.983 -11.562 1.00 0.00 H new ATOM 0 HG21 THR B 66 6.535 3.660 -9.771 1.00 0.00 H new ATOM 0 HG22 THR B 66 6.699 2.785 -8.230 1.00 0.00 H new ATOM 0 HG23 THR B 66 7.986 3.892 -8.767 1.00 0.00 H new ATOM 2206 N LEU B 67 8.280 1.242 -6.561 1.00 0.00 N ATOM 2207 CA LEU B 67 7.621 0.714 -5.374 1.00 0.00 C ATOM 2208 C LEU B 67 6.632 1.733 -4.820 1.00 0.00 C ATOM 2209 O LEU B 67 6.824 2.939 -4.972 1.00 0.00 O ATOM 2210 CB LEU B 67 8.644 0.352 -4.284 1.00 0.00 C ATOM 2211 CG LEU B 67 9.553 -0.849 -4.574 1.00 0.00 C ATOM 2212 CD1 LEU B 67 10.622 -0.499 -5.601 1.00 0.00 C ATOM 2213 CD2 LEU B 67 10.196 -1.344 -3.287 1.00 0.00 C ATOM 0 H LEU B 67 8.808 2.100 -6.401 1.00 0.00 H new ATOM 0 HA LEU B 67 7.088 -0.191 -5.667 1.00 0.00 H new ATOM 0 HB2 LEU B 67 9.275 1.223 -4.105 1.00 0.00 H new ATOM 0 HB3 LEU B 67 8.102 0.155 -3.359 1.00 0.00 H new ATOM 0 HG LEU B 67 8.937 -1.645 -4.992 1.00 0.00 H new ATOM 0 HD11 LEU B 67 11.250 -1.371 -5.785 1.00 0.00 H new ATOM 0 HD12 LEU B 67 10.145 -0.192 -6.532 1.00 0.00 H new ATOM 0 HD13 LEU B 67 11.237 0.317 -5.222 1.00 0.00 H new ATOM 0 HD21 LEU B 67 10.839 -2.197 -3.506 1.00 0.00 H new ATOM 0 HD22 LEU B 67 10.791 -0.544 -2.847 1.00 0.00 H new ATOM 0 HD23 LEU B 67 9.419 -1.646 -2.585 1.00 0.00 H new ATOM 2225 N HIS B 68 5.575 1.246 -4.187 1.00 0.00 N ATOM 2226 CA HIS B 68 4.602 2.120 -3.544 1.00 0.00 C ATOM 2227 C HIS B 68 4.966 2.328 -2.084 1.00 0.00 C ATOM 2228 O HIS B 68 5.182 1.362 -1.350 1.00 0.00 O ATOM 2229 CB HIS B 68 3.187 1.540 -3.631 1.00 0.00 C ATOM 2230 CG HIS B 68 2.541 1.692 -4.974 1.00 0.00 C ATOM 2231 ND1 HIS B 68 1.557 2.623 -5.236 1.00 0.00 N ATOM 2232 CD2 HIS B 68 2.728 1.011 -6.129 1.00 0.00 C ATOM 2233 CE1 HIS B 68 1.165 2.502 -6.492 1.00 0.00 C ATOM 2234 NE2 HIS B 68 1.861 1.533 -7.054 1.00 0.00 N ATOM 0 H HIS B 68 5.368 0.251 -4.104 1.00 0.00 H new ATOM 0 HA HIS B 68 4.621 3.075 -4.070 1.00 0.00 H new ATOM 0 HB2 HIS B 68 3.225 0.481 -3.377 1.00 0.00 H new ATOM 0 HB3 HIS B 68 2.561 2.026 -2.882 1.00 0.00 H new ATOM 0 HD1 HIS B 68 1.190 3.298 -4.566 1.00 0.00 H new ATOM 0 HD2 HIS B 68 3.430 0.206 -6.292 1.00 0.00 H new ATOM 0 HE1 HIS B 68 0.404 3.096 -6.976 1.00 0.00 H new ATOM 2243 N LEU B 69 5.037 3.580 -1.670 1.00 0.00 N ATOM 2244 CA LEU B 69 5.347 3.903 -0.292 1.00 0.00 C ATOM 2245 C LEU B 69 4.080 4.278 0.463 1.00 0.00 C ATOM 2246 O LEU B 69 3.500 5.343 0.247 1.00 0.00 O ATOM 2247 CB LEU B 69 6.362 5.047 -0.212 1.00 0.00 C ATOM 2248 CG LEU B 69 6.808 5.419 1.206 1.00 0.00 C ATOM 2249 CD1 LEU B 69 7.527 4.249 1.865 1.00 0.00 C ATOM 2250 CD2 LEU B 69 7.696 6.655 1.182 1.00 0.00 C ATOM 0 H LEU B 69 4.884 4.390 -2.271 1.00 0.00 H new ATOM 0 HA LEU B 69 5.787 3.019 0.170 1.00 0.00 H new ATOM 0 HB2 LEU B 69 7.242 4.773 -0.793 1.00 0.00 H new ATOM 0 HB3 LEU B 69 5.930 5.929 -0.684 1.00 0.00 H new ATOM 0 HG LEU B 69 5.921 5.650 1.796 1.00 0.00 H new ATOM 0 HD11 LEU B 69 7.836 4.532 2.871 1.00 0.00 H new ATOM 0 HD12 LEU B 69 6.855 3.393 1.919 1.00 0.00 H new ATOM 0 HD13 LEU B 69 8.405 3.984 1.277 1.00 0.00 H new ATOM 0 HD21 LEU B 69 8.002 6.903 2.198 1.00 0.00 H new ATOM 0 HD22 LEU B 69 8.579 6.457 0.575 1.00 0.00 H new ATOM 0 HD23 LEU B 69 7.143 7.492 0.755 1.00 0.00 H new ATOM 2262 N VAL B 70 3.642 3.378 1.321 1.00 0.00 N ATOM 2263 CA VAL B 70 2.529 3.640 2.213 1.00 0.00 C ATOM 2264 C VAL B 70 3.073 3.646 3.635 1.00 0.00 C ATOM 2265 O VAL B 70 4.106 3.037 3.898 1.00 0.00 O ATOM 2266 CB VAL B 70 1.404 2.586 2.043 1.00 0.00 C ATOM 2267 CG1 VAL B 70 1.802 1.241 2.621 1.00 0.00 C ATOM 2268 CG2 VAL B 70 0.105 3.070 2.656 1.00 0.00 C ATOM 0 H VAL B 70 4.046 2.447 1.420 1.00 0.00 H new ATOM 0 HA VAL B 70 2.079 4.604 1.977 1.00 0.00 H new ATOM 0 HB VAL B 70 1.248 2.452 0.973 1.00 0.00 H new ATOM 0 HG11 VAL B 70 0.988 0.530 2.482 1.00 0.00 H new ATOM 0 HG12 VAL B 70 2.694 0.875 2.111 1.00 0.00 H new ATOM 0 HG13 VAL B 70 2.011 1.350 3.685 1.00 0.00 H new ATOM 0 HG21 VAL B 70 -0.666 2.311 2.522 1.00 0.00 H new ATOM 0 HG22 VAL B 70 0.251 3.254 3.720 1.00 0.00 H new ATOM 0 HG23 VAL B 70 -0.206 3.993 2.167 1.00 0.00 H new ATOM 2278 N LEU B 71 2.440 4.358 4.543 1.00 0.00 N ATOM 2279 CA LEU B 71 2.982 4.466 5.886 1.00 0.00 C ATOM 2280 C LEU B 71 2.360 3.443 6.823 1.00 0.00 C ATOM 2281 O LEU B 71 1.243 2.978 6.605 1.00 0.00 O ATOM 2282 CB LEU B 71 2.800 5.876 6.432 1.00 0.00 C ATOM 2283 CG LEU B 71 3.553 6.963 5.661 1.00 0.00 C ATOM 2284 CD1 LEU B 71 3.500 8.263 6.428 1.00 0.00 C ATOM 2285 CD2 LEU B 71 5.002 6.561 5.398 1.00 0.00 C ATOM 0 H LEU B 71 1.568 4.862 4.384 1.00 0.00 H new ATOM 0 HA LEU B 71 4.050 4.255 5.827 1.00 0.00 H new ATOM 0 HB2 LEU B 71 1.737 6.118 6.429 1.00 0.00 H new ATOM 0 HB3 LEU B 71 3.128 5.894 7.471 1.00 0.00 H new ATOM 0 HG LEU B 71 3.067 7.093 4.694 1.00 0.00 H new ATOM 0 HD11 LEU B 71 4.037 9.034 5.875 1.00 0.00 H new ATOM 0 HD12 LEU B 71 2.461 8.567 6.558 1.00 0.00 H new ATOM 0 HD13 LEU B 71 3.963 8.128 7.405 1.00 0.00 H new ATOM 0 HD21 LEU B 71 5.506 7.356 4.849 1.00 0.00 H new ATOM 0 HD22 LEU B 71 5.512 6.396 6.347 1.00 0.00 H new ATOM 0 HD23 LEU B 71 5.024 5.643 4.810 1.00 0.00 H new ATOM 2297 N ARG B 72 3.112 3.070 7.846 1.00 0.00 N ATOM 2298 CA ARG B 72 2.612 2.178 8.874 1.00 0.00 C ATOM 2299 C ARG B 72 1.934 2.996 9.963 1.00 0.00 C ATOM 2300 O ARG B 72 2.578 3.817 10.616 1.00 0.00 O ATOM 2301 CB ARG B 72 3.733 1.340 9.504 1.00 0.00 C ATOM 2302 CG ARG B 72 4.328 0.287 8.583 1.00 0.00 C ATOM 2303 CD ARG B 72 5.002 -0.832 9.372 1.00 0.00 C ATOM 2304 NE ARG B 72 5.952 -0.319 10.360 1.00 0.00 N ATOM 2305 CZ ARG B 72 6.541 -1.062 11.303 1.00 0.00 C ATOM 2306 NH1 ARG B 72 6.319 -2.368 11.382 1.00 0.00 N ATOM 2307 NH2 ARG B 72 7.366 -0.487 12.165 1.00 0.00 N ATOM 0 H ARG B 72 4.076 3.374 7.985 1.00 0.00 H new ATOM 0 HA ARG B 72 1.904 1.495 8.405 1.00 0.00 H new ATOM 0 HB2 ARG B 72 4.529 2.009 9.832 1.00 0.00 H new ATOM 0 HB3 ARG B 72 3.344 0.847 10.395 1.00 0.00 H new ATOM 0 HG2 ARG B 72 3.543 -0.132 7.954 1.00 0.00 H new ATOM 0 HG3 ARG B 72 5.055 0.753 7.918 1.00 0.00 H new ATOM 0 HD2 ARG B 72 4.241 -1.427 9.877 1.00 0.00 H new ATOM 0 HD3 ARG B 72 5.522 -1.498 8.683 1.00 0.00 H new ATOM 0 HE ARG B 72 6.181 0.674 10.327 1.00 0.00 H new ATOM 0 HH11 ARG B 72 5.691 -2.820 10.717 1.00 0.00 H new ATOM 0 HH12 ARG B 72 6.776 -2.920 12.107 1.00 0.00 H new ATOM 0 HH21 ARG B 72 7.548 0.515 12.106 1.00 0.00 H new ATOM 0 HH22 ARG B 72 7.820 -1.046 12.888 1.00 0.00 H new ATOM 2321 N LEU B 73 0.652 2.755 10.183 1.00 0.00 N ATOM 2322 CA LEU B 73 -0.101 3.481 11.205 1.00 0.00 C ATOM 2323 C LEU B 73 0.212 2.929 12.594 1.00 0.00 C ATOM 2324 O LEU B 73 -0.562 3.091 13.535 1.00 0.00 O ATOM 2325 CB LEU B 73 -1.600 3.376 10.927 1.00 0.00 C ATOM 2326 CG LEU B 73 -2.048 3.930 9.575 1.00 0.00 C ATOM 2327 CD1 LEU B 73 -3.549 3.782 9.415 1.00 0.00 C ATOM 2328 CD2 LEU B 73 -1.638 5.387 9.430 1.00 0.00 C ATOM 0 H LEU B 73 0.106 2.063 9.670 1.00 0.00 H new ATOM 0 HA LEU B 73 0.194 4.530 11.172 1.00 0.00 H new ATOM 0 HB2 LEU B 73 -1.893 2.328 10.988 1.00 0.00 H new ATOM 0 HB3 LEU B 73 -2.138 3.903 11.715 1.00 0.00 H new ATOM 0 HG LEU B 73 -1.557 3.357 8.788 1.00 0.00 H new ATOM 0 HD11 LEU B 73 -3.853 4.181 8.447 1.00 0.00 H new ATOM 0 HD12 LEU B 73 -3.819 2.728 9.474 1.00 0.00 H new ATOM 0 HD13 LEU B 73 -4.055 4.331 10.209 1.00 0.00 H new ATOM 0 HD21 LEU B 73 -1.966 5.763 8.461 1.00 0.00 H new ATOM 0 HD22 LEU B 73 -2.100 5.976 10.223 1.00 0.00 H new ATOM 0 HD23 LEU B 73 -0.553 5.469 9.502 1.00 0.00 H new ATOM 2340 N ARG B 74 1.372 2.302 12.709 1.00 0.00 N ATOM 2341 CA ARG B 74 1.788 1.654 13.939 1.00 0.00 C ATOM 2342 C ARG B 74 3.038 2.332 14.485 1.00 0.00 C ATOM 2343 O ARG B 74 3.678 1.840 15.415 1.00 0.00 O ATOM 2344 CB ARG B 74 2.052 0.172 13.670 1.00 0.00 C ATOM 2345 CG ARG B 74 0.816 -0.572 13.187 1.00 0.00 C ATOM 2346 CD ARG B 74 1.169 -1.860 12.452 1.00 0.00 C ATOM 2347 NE ARG B 74 1.891 -2.811 13.292 1.00 0.00 N ATOM 2348 CZ ARG B 74 1.462 -4.042 13.554 1.00 0.00 C ATOM 2349 NH1 ARG B 74 0.259 -4.437 13.144 1.00 0.00 N ATOM 2350 NH2 ARG B 74 2.224 -4.866 14.258 1.00 0.00 N ATOM 0 H ARG B 74 2.051 2.229 11.951 1.00 0.00 H new ATOM 0 HA ARG B 74 0.997 1.741 14.684 1.00 0.00 H new ATOM 0 HB2 ARG B 74 2.841 0.078 12.924 1.00 0.00 H new ATOM 0 HB3 ARG B 74 2.419 -0.298 14.582 1.00 0.00 H new ATOM 0 HG2 ARG B 74 0.178 -0.805 14.040 1.00 0.00 H new ATOM 0 HG3 ARG B 74 0.240 0.075 12.526 1.00 0.00 H new ATOM 0 HD2 ARG B 74 0.254 -2.327 12.086 1.00 0.00 H new ATOM 0 HD3 ARG B 74 1.776 -1.620 11.579 1.00 0.00 H new ATOM 0 HE ARG B 74 2.776 -2.514 13.702 1.00 0.00 H new ATOM 0 HH11 ARG B 74 -0.340 -3.794 12.626 1.00 0.00 H new ATOM 0 HH12 ARG B 74 -0.064 -5.383 13.348 1.00 0.00 H new ATOM 0 HH21 ARG B 74 3.135 -4.555 14.596 1.00 0.00 H new ATOM 0 HH22 ARG B 74 1.900 -5.811 14.462 1.00 0.00 H new ATOM 2364 N GLY B 75 3.373 3.471 13.895 1.00 0.00 N ATOM 2365 CA GLY B 75 4.519 4.235 14.336 1.00 0.00 C ATOM 2366 C GLY B 75 4.106 5.427 15.173 1.00 0.00 C ATOM 2367 O GLY B 75 4.410 6.571 14.834 1.00 0.00 O ATOM 0 H GLY B 75 2.865 3.881 13.111 1.00 0.00 H new ATOM 0 HA2 GLY B 75 5.182 3.594 14.917 1.00 0.00 H new ATOM 0 HA3 GLY B 75 5.084 4.577 13.469 1.00 0.00 H new ATOM 2371 N GLY B 76 3.395 5.159 16.257 1.00 0.00 N ATOM 2372 CA GLY B 76 2.919 6.214 17.122 1.00 0.00 C ATOM 2373 C GLY B 76 1.920 5.686 18.122 1.00 0.00 C ATOM 2374 O GLY B 76 1.043 6.453 18.566 1.00 0.00 O ATOM 2375 OXT GLY B 76 2.002 4.486 18.456 1.00 0.00 O ATOM 0 H GLY B 76 3.137 4.218 16.554 1.00 0.00 H new ATOM 0 HA2 GLY B 76 3.761 6.665 17.647 1.00 0.00 H new ATOM 0 HA3 GLY B 76 2.459 7.000 16.523 1.00 0.00 H new TER 2379 GLY B 76