USER MOD reduce.3.24.130724 H: found=0, std=0, add=771, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 782 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 56 SER OG : rot -133:sc= 0.431 USER MOD Set 1.2: A 69 THR OG1 : rot 180:sc= 0.286 USER MOD Set 2.1: A 1 MET CE :methyl -139:sc= -0.245 (180deg=-1.05) USER MOD Set 2.2: A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 1 MET N :NH3+ 144:sc= 0.0253 (180deg=0) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 5 HIS :FLIP no HD1:sc= -0.211 F(o=-1.1,f=-0.21) USER MOD Single : A 6 HIS : no HD1:sc= 0 X(o=0,f=-0.014) USER MOD Single : A 7 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 8 HIS : no HD1:sc= 0 X(o=0,f=-0.29) USER MOD Single : A 9 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 10 HIS : no HD1:sc= -0.17 K(o=-0.17,f=-2.2!) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 16 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 18 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 GLN : amide:sc= -0.203 X(o=-0.2,f=-0.17) USER MOD Single : A 22 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 23 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 33 LYS NZ :NH3+ -160:sc= -0.0629 (180deg=-0.373) USER MOD Single : A 34 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0241) USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 MET CE :methyl 137:sc= -1.26 (180deg=-3.94!) USER MOD Single : A 52 SER OG : rot 5:sc= 1.12 USER MOD Single : A 54 GLN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 55 ASN : amide:sc= -0.191 K(o=-0.19,f=-6.1!) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 32:sc= 1.21 USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot -172:sc= -1.02 USER MOD Single : A 83 LYS NZ :NH3+ -166:sc= -0.0354 (180deg=-0.222) USER MOD Single : A 89 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.0714) USER MOD Single : A 94 LYS NZ :NH3+ 166:sc= 2.17 (180deg=1.73) USER MOD Single : A 98 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 13.324 6.234 -35.404 1.00 0.00 N ATOM 2 CA MET A 1 14.016 6.717 -34.187 1.00 0.00 C ATOM 3 C MET A 1 15.043 7.785 -34.544 1.00 0.00 C ATOM 4 O MET A 1 15.672 7.723 -35.599 1.00 0.00 O ATOM 5 CB MET A 1 14.710 5.558 -33.455 1.00 0.00 C ATOM 6 CG MET A 1 15.820 4.892 -34.260 1.00 0.00 C ATOM 7 SD MET A 1 16.738 3.665 -33.305 1.00 0.00 S ATOM 8 CE MET A 1 17.407 4.695 -31.999 1.00 0.00 C ATOM 0 H1 MET A 1 13.131 5.216 -35.313 1.00 0.00 H new ATOM 0 H2 MET A 1 12.427 6.747 -35.520 1.00 0.00 H new ATOM 0 H3 MET A 1 13.927 6.399 -36.235 1.00 0.00 H new ATOM 0 HA MET A 1 13.265 7.150 -33.526 1.00 0.00 H new ATOM 0 HB2 MET A 1 15.127 5.931 -32.519 1.00 0.00 H new ATOM 0 HB3 MET A 1 13.964 4.807 -33.195 1.00 0.00 H new ATOM 0 HG2 MET A 1 15.388 4.413 -35.139 1.00 0.00 H new ATOM 0 HG3 MET A 1 16.510 5.656 -34.620 1.00 0.00 H new ATOM 0 HE1 MET A 1 18.438 4.403 -31.797 1.00 0.00 H new ATOM 0 HE2 MET A 1 17.380 5.739 -32.310 1.00 0.00 H new ATOM 0 HE3 MET A 1 16.811 4.570 -31.095 1.00 0.00 H new ATOM 18 N GLY A 2 15.196 8.769 -33.666 1.00 0.00 N ATOM 19 CA GLY A 2 16.196 9.798 -33.863 1.00 0.00 C ATOM 20 C GLY A 2 17.191 9.825 -32.725 1.00 0.00 C ATOM 21 O GLY A 2 16.875 10.286 -31.629 1.00 0.00 O ATOM 0 H GLY A 2 14.641 8.872 -32.816 1.00 0.00 H new ATOM 0 HA2 GLY A 2 16.720 9.623 -34.803 1.00 0.00 H new ATOM 0 HA3 GLY A 2 15.709 10.770 -33.946 1.00 0.00 H new ATOM 25 N SER A 3 18.392 9.325 -32.982 1.00 0.00 N ATOM 26 CA SER A 3 19.418 9.224 -31.957 1.00 0.00 C ATOM 27 C SER A 3 20.014 10.594 -31.637 1.00 0.00 C ATOM 28 O SER A 3 20.181 10.953 -30.472 1.00 0.00 O ATOM 29 CB SER A 3 20.514 8.263 -32.416 1.00 0.00 C ATOM 30 OG SER A 3 19.957 7.022 -32.827 1.00 0.00 O ATOM 0 H SER A 3 18.679 8.981 -33.898 1.00 0.00 H new ATOM 0 HA SER A 3 18.959 8.838 -31.047 1.00 0.00 H new ATOM 0 HB2 SER A 3 21.072 8.707 -33.240 1.00 0.00 H new ATOM 0 HB3 SER A 3 21.222 8.098 -31.604 1.00 0.00 H new ATOM 0 HG SER A 3 20.675 6.422 -33.119 1.00 0.00 H new ATOM 36 N SER A 4 20.332 11.358 -32.673 1.00 0.00 N ATOM 37 CA SER A 4 20.908 12.685 -32.489 1.00 0.00 C ATOM 38 C SER A 4 19.828 13.705 -32.128 1.00 0.00 C ATOM 39 O SER A 4 20.103 14.729 -31.499 1.00 0.00 O ATOM 40 CB SER A 4 21.640 13.112 -33.762 1.00 0.00 C ATOM 41 OG SER A 4 22.597 12.139 -34.141 1.00 0.00 O ATOM 0 H SER A 4 20.202 11.084 -33.647 1.00 0.00 H new ATOM 0 HA SER A 4 21.619 12.643 -31.664 1.00 0.00 H new ATOM 0 HB2 SER A 4 20.922 13.256 -34.569 1.00 0.00 H new ATOM 0 HB3 SER A 4 22.133 14.070 -33.599 1.00 0.00 H new ATOM 0 HG SER A 4 23.053 12.430 -34.958 1.00 0.00 H new ATOM 47 N HIS A 5 18.598 13.411 -32.518 1.00 0.00 N ATOM 48 CA HIS A 5 17.480 14.314 -32.286 1.00 0.00 C ATOM 49 C HIS A 5 16.164 13.548 -32.261 1.00 0.00 C ATOM 50 O HIS A 5 15.587 13.234 -33.302 1.00 0.00 O ATOM 51 CB HIS A 5 17.446 15.436 -33.342 1.00 0.00 C ATOM 52 CG HIS A 5 17.509 14.964 -34.769 1.00 0.00 C ATOM 53 ND1 HIS A 5 18.542 14.476 -35.498 1.00 0.00 N flip ATOM 54 CD2 HIS A 5 16.422 14.978 -35.617 1.00 0.00 C flip ATOM 55 CE1 HIS A 5 18.065 14.207 -36.755 1.00 0.00 C flip ATOM 56 NE2 HIS A 5 16.784 14.517 -36.802 1.00 0.00 N flip ATOM 0 H HIS A 5 18.347 12.548 -33.000 1.00 0.00 H new ATOM 0 HA HIS A 5 17.619 14.780 -31.310 1.00 0.00 H new ATOM 0 HB2 HIS A 5 16.533 16.015 -33.206 1.00 0.00 H new ATOM 0 HB3 HIS A 5 18.282 16.111 -33.161 1.00 0.00 H new ATOM 0 HD2 HIS A 5 15.430 15.313 -35.354 1.00 0.00 H new ATOM 0 HE1 HIS A 5 18.644 13.806 -37.574 1.00 0.00 H new ATOM 0 HE2 HIS A 5 16.176 14.418 -37.615 1.00 0.00 H new ATOM 65 N HIS A 6 15.712 13.223 -31.058 1.00 0.00 N ATOM 66 CA HIS A 6 14.452 12.512 -30.880 1.00 0.00 C ATOM 67 C HIS A 6 13.293 13.496 -30.995 1.00 0.00 C ATOM 68 O HIS A 6 12.193 13.136 -31.410 1.00 0.00 O ATOM 69 CB HIS A 6 14.430 11.806 -29.520 1.00 0.00 C ATOM 70 CG HIS A 6 13.464 10.660 -29.452 1.00 0.00 C ATOM 71 ND1 HIS A 6 12.308 10.680 -28.700 1.00 0.00 N ATOM 72 CD2 HIS A 6 13.503 9.441 -30.042 1.00 0.00 C ATOM 73 CE1 HIS A 6 11.680 9.525 -28.830 1.00 0.00 C ATOM 74 NE2 HIS A 6 12.384 8.758 -29.639 1.00 0.00 N ATOM 0 H HIS A 6 16.199 13.440 -30.189 1.00 0.00 H new ATOM 0 HA HIS A 6 14.351 11.754 -31.657 1.00 0.00 H new ATOM 0 HB2 HIS A 6 15.431 11.440 -29.294 1.00 0.00 H new ATOM 0 HB3 HIS A 6 14.175 12.532 -28.748 1.00 0.00 H new ATOM 0 HD2 HIS A 6 14.272 9.075 -30.706 1.00 0.00 H new ATOM 0 HE1 HIS A 6 10.749 9.255 -28.355 1.00 0.00 H new ATOM 0 HE2 HIS A 6 12.136 7.809 -29.920 1.00 0.00 H new ATOM 83 N HIS A 7 13.567 14.743 -30.617 1.00 0.00 N ATOM 84 CA HIS A 7 12.627 15.851 -30.780 1.00 0.00 C ATOM 85 C HIS A 7 13.265 17.117 -30.214 1.00 0.00 C ATOM 86 O HIS A 7 13.401 18.124 -30.904 1.00 0.00 O ATOM 87 CB HIS A 7 11.293 15.575 -30.075 1.00 0.00 C ATOM 88 CG HIS A 7 10.144 16.322 -30.682 1.00 0.00 C ATOM 89 ND1 HIS A 7 9.599 17.460 -30.129 1.00 0.00 N ATOM 90 CD2 HIS A 7 9.435 16.083 -31.811 1.00 0.00 C ATOM 91 CE1 HIS A 7 8.609 17.888 -30.889 1.00 0.00 C ATOM 92 NE2 HIS A 7 8.487 17.071 -31.918 1.00 0.00 N ATOM 0 H HIS A 7 14.451 15.015 -30.187 1.00 0.00 H new ATOM 0 HA HIS A 7 12.412 15.973 -31.841 1.00 0.00 H new ATOM 0 HB2 HIS A 7 11.084 14.506 -30.111 1.00 0.00 H new ATOM 0 HB3 HIS A 7 11.381 15.847 -29.023 1.00 0.00 H new ATOM 0 HD2 HIS A 7 9.587 15.266 -32.500 1.00 0.00 H new ATOM 0 HE1 HIS A 7 8.001 18.760 -30.701 1.00 0.00 H new ATOM 0 HE2 HIS A 7 7.802 17.159 -32.669 1.00 0.00 H new ATOM 101 N HIS A 8 13.663 17.038 -28.953 1.00 0.00 N ATOM 102 CA HIS A 8 14.430 18.098 -28.309 1.00 0.00 C ATOM 103 C HIS A 8 15.772 17.514 -27.884 1.00 0.00 C ATOM 104 O HIS A 8 16.078 17.435 -26.696 1.00 0.00 O ATOM 105 CB HIS A 8 13.663 18.641 -27.093 1.00 0.00 C ATOM 106 CG HIS A 8 14.234 19.898 -26.503 1.00 0.00 C ATOM 107 ND1 HIS A 8 15.101 19.904 -25.434 1.00 0.00 N ATOM 108 CD2 HIS A 8 14.028 21.198 -26.823 1.00 0.00 C ATOM 109 CE1 HIS A 8 15.403 21.149 -25.120 1.00 0.00 C ATOM 110 NE2 HIS A 8 14.766 21.956 -25.947 1.00 0.00 N ATOM 0 H HIS A 8 13.465 16.241 -28.348 1.00 0.00 H new ATOM 0 HA HIS A 8 14.588 18.928 -28.998 1.00 0.00 H new ATOM 0 HB2 HIS A 8 12.630 18.830 -27.386 1.00 0.00 H new ATOM 0 HB3 HIS A 8 13.640 17.871 -26.322 1.00 0.00 H new ATOM 0 HD2 HIS A 8 13.400 21.570 -27.619 1.00 0.00 H new ATOM 0 HE1 HIS A 8 16.061 21.456 -24.321 1.00 0.00 H new ATOM 0 HE2 HIS A 8 14.814 22.975 -25.937 1.00 0.00 H new ATOM 119 N HIS A 9 16.559 17.092 -28.877 1.00 0.00 N ATOM 120 CA HIS A 9 17.740 16.259 -28.648 1.00 0.00 C ATOM 121 C HIS A 9 17.334 14.931 -28.015 1.00 0.00 C ATOM 122 O HIS A 9 17.122 13.940 -28.715 1.00 0.00 O ATOM 123 CB HIS A 9 18.790 16.976 -27.788 1.00 0.00 C ATOM 124 CG HIS A 9 19.650 17.930 -28.555 1.00 0.00 C ATOM 125 ND1 HIS A 9 19.445 19.293 -28.568 1.00 0.00 N ATOM 126 CD2 HIS A 9 20.739 17.709 -29.328 1.00 0.00 C ATOM 127 CE1 HIS A 9 20.368 19.865 -29.317 1.00 0.00 C ATOM 128 NE2 HIS A 9 21.164 18.927 -29.789 1.00 0.00 N ATOM 0 H HIS A 9 16.396 17.318 -29.858 1.00 0.00 H new ATOM 0 HA HIS A 9 18.200 16.062 -29.616 1.00 0.00 H new ATOM 0 HB2 HIS A 9 18.283 17.519 -26.990 1.00 0.00 H new ATOM 0 HB3 HIS A 9 19.426 16.230 -27.312 1.00 0.00 H new ATOM 0 HD2 HIS A 9 21.189 16.751 -29.542 1.00 0.00 H new ATOM 0 HE1 HIS A 9 20.456 20.924 -29.511 1.00 0.00 H new ATOM 0 HE2 HIS A 9 21.967 19.083 -30.399 1.00 0.00 H new ATOM 137 N HIS A 10 17.200 14.924 -26.698 1.00 0.00 N ATOM 138 CA HIS A 10 16.733 13.750 -25.974 1.00 0.00 C ATOM 139 C HIS A 10 15.741 14.158 -24.893 1.00 0.00 C ATOM 140 O HIS A 10 14.574 14.419 -25.182 1.00 0.00 O ATOM 141 CB HIS A 10 17.898 12.973 -25.349 1.00 0.00 C ATOM 142 CG HIS A 10 18.663 12.128 -26.320 1.00 0.00 C ATOM 143 ND1 HIS A 10 18.406 10.791 -26.508 1.00 0.00 N ATOM 144 CD2 HIS A 10 19.688 12.432 -27.149 1.00 0.00 C ATOM 145 CE1 HIS A 10 19.237 10.308 -27.408 1.00 0.00 C ATOM 146 NE2 HIS A 10 20.027 11.282 -27.818 1.00 0.00 N ATOM 0 H HIS A 10 17.410 15.726 -26.103 1.00 0.00 H new ATOM 0 HA HIS A 10 16.238 13.095 -26.690 1.00 0.00 H new ATOM 0 HB2 HIS A 10 18.583 13.681 -24.882 1.00 0.00 H new ATOM 0 HB3 HIS A 10 17.510 12.334 -24.556 1.00 0.00 H new ATOM 0 HD2 HIS A 10 20.153 13.400 -27.263 1.00 0.00 H new ATOM 0 HE1 HIS A 10 19.267 9.285 -27.753 1.00 0.00 H new ATOM 0 HE2 HIS A 10 20.766 11.195 -28.516 1.00 0.00 H new ATOM 155 N SER A 11 16.228 14.252 -23.659 1.00 0.00 N ATOM 156 CA SER A 11 15.398 14.588 -22.514 1.00 0.00 C ATOM 157 C SER A 11 16.276 14.688 -21.268 1.00 0.00 C ATOM 158 O SER A 11 17.345 14.079 -21.214 1.00 0.00 O ATOM 159 CB SER A 11 14.315 13.519 -22.315 1.00 0.00 C ATOM 160 OG SER A 11 13.345 13.927 -21.363 1.00 0.00 O ATOM 0 H SER A 11 17.209 14.097 -23.428 1.00 0.00 H new ATOM 0 HA SER A 11 14.909 15.546 -22.689 1.00 0.00 H new ATOM 0 HB2 SER A 11 13.826 13.314 -23.268 1.00 0.00 H new ATOM 0 HB3 SER A 11 14.778 12.588 -21.987 1.00 0.00 H new ATOM 0 HG SER A 11 12.670 13.224 -21.262 1.00 0.00 H new ATOM 166 N SER A 12 15.840 15.469 -20.289 1.00 0.00 N ATOM 167 CA SER A 12 16.571 15.598 -19.039 1.00 0.00 C ATOM 168 C SER A 12 16.266 14.403 -18.138 1.00 0.00 C ATOM 169 O SER A 12 15.197 14.326 -17.526 1.00 0.00 O ATOM 170 CB SER A 12 16.194 16.909 -18.342 1.00 0.00 C ATOM 171 OG SER A 12 16.380 18.021 -19.209 1.00 0.00 O ATOM 0 H SER A 12 14.984 16.022 -20.338 1.00 0.00 H new ATOM 0 HA SER A 12 17.641 15.615 -19.248 1.00 0.00 H new ATOM 0 HB2 SER A 12 15.154 16.866 -18.018 1.00 0.00 H new ATOM 0 HB3 SER A 12 16.802 17.036 -17.446 1.00 0.00 H new ATOM 0 HG SER A 12 16.131 18.846 -18.742 1.00 0.00 H new ATOM 177 N GLY A 13 17.204 13.468 -18.077 1.00 0.00 N ATOM 178 CA GLY A 13 16.979 12.230 -17.358 1.00 0.00 C ATOM 179 C GLY A 13 17.303 12.334 -15.884 1.00 0.00 C ATOM 180 O GLY A 13 16.632 11.720 -15.050 1.00 0.00 O ATOM 0 H GLY A 13 18.122 13.546 -18.515 1.00 0.00 H new ATOM 0 HA2 GLY A 13 15.937 11.933 -17.475 1.00 0.00 H new ATOM 0 HA3 GLY A 13 17.587 11.442 -17.803 1.00 0.00 H new ATOM 184 N ARG A 14 18.331 13.108 -15.554 1.00 0.00 N ATOM 185 CA ARG A 14 18.746 13.264 -14.165 1.00 0.00 C ATOM 186 C ARG A 14 17.813 14.210 -13.421 1.00 0.00 C ATOM 187 O ARG A 14 18.088 15.403 -13.301 1.00 0.00 O ATOM 188 CB ARG A 14 20.184 13.779 -14.063 1.00 0.00 C ATOM 189 CG ARG A 14 21.216 12.872 -14.709 1.00 0.00 C ATOM 190 CD ARG A 14 22.625 13.330 -14.374 1.00 0.00 C ATOM 191 NE ARG A 14 23.647 12.594 -15.117 1.00 0.00 N ATOM 192 CZ ARG A 14 24.842 12.279 -14.618 1.00 0.00 C ATOM 193 NH1 ARG A 14 25.100 12.473 -13.332 1.00 0.00 N ATOM 194 NH2 ARG A 14 25.767 11.730 -15.394 1.00 0.00 N ATOM 0 H ARG A 14 18.890 13.635 -16.225 1.00 0.00 H new ATOM 0 HA ARG A 14 18.697 12.277 -13.704 1.00 0.00 H new ATOM 0 HB2 ARG A 14 20.240 14.763 -14.528 1.00 0.00 H new ATOM 0 HB3 ARG A 14 20.438 13.909 -13.011 1.00 0.00 H new ATOM 0 HG2 ARG A 14 21.071 11.847 -14.366 1.00 0.00 H new ATOM 0 HG3 ARG A 14 21.078 12.869 -15.790 1.00 0.00 H new ATOM 0 HD2 ARG A 14 22.719 14.394 -14.591 1.00 0.00 H new ATOM 0 HD3 ARG A 14 22.799 13.207 -13.305 1.00 0.00 H new ATOM 0 HE ARG A 14 23.433 12.305 -16.072 1.00 0.00 H new ATOM 0 HH11 ARG A 14 24.383 12.864 -12.721 1.00 0.00 H new ATOM 0 HH12 ARG A 14 26.016 12.231 -12.953 1.00 0.00 H new ATOM 0 HH21 ARG A 14 25.565 11.547 -16.377 1.00 0.00 H new ATOM 0 HH22 ARG A 14 26.680 11.491 -15.008 1.00 0.00 H new ATOM 208 N GLU A 15 16.691 13.682 -12.963 1.00 0.00 N ATOM 209 CA GLU A 15 15.764 14.447 -12.146 1.00 0.00 C ATOM 210 C GLU A 15 15.246 13.570 -11.009 1.00 0.00 C ATOM 211 O GLU A 15 14.219 13.852 -10.389 1.00 0.00 O ATOM 212 CB GLU A 15 14.603 14.972 -13.002 1.00 0.00 C ATOM 213 CG GLU A 15 13.780 16.054 -12.318 1.00 0.00 C ATOM 214 CD GLU A 15 12.601 16.516 -13.145 1.00 0.00 C ATOM 215 OE1 GLU A 15 12.767 17.458 -13.949 1.00 0.00 O ATOM 216 OE2 GLU A 15 11.497 15.953 -12.981 1.00 0.00 O ATOM 0 H GLU A 15 16.399 12.722 -13.144 1.00 0.00 H new ATOM 0 HA GLU A 15 16.283 15.307 -11.721 1.00 0.00 H new ATOM 0 HB2 GLU A 15 15.002 15.367 -13.936 1.00 0.00 H new ATOM 0 HB3 GLU A 15 13.949 14.140 -13.261 1.00 0.00 H new ATOM 0 HG2 GLU A 15 13.419 15.677 -11.361 1.00 0.00 H new ATOM 0 HG3 GLU A 15 14.422 16.908 -12.102 1.00 0.00 H new ATOM 224 N ASN A 16 15.975 12.499 -10.730 1.00 0.00 N ATOM 225 CA ASN A 16 15.603 11.580 -9.664 1.00 0.00 C ATOM 226 C ASN A 16 15.945 12.190 -8.311 1.00 0.00 C ATOM 227 O ASN A 16 17.092 12.144 -7.868 1.00 0.00 O ATOM 228 CB ASN A 16 16.315 10.237 -9.842 1.00 0.00 C ATOM 229 CG ASN A 16 15.824 9.184 -8.869 1.00 0.00 C ATOM 230 OD1 ASN A 16 16.364 9.028 -7.773 1.00 0.00 O ATOM 231 ND2 ASN A 16 14.797 8.451 -9.269 1.00 0.00 N ATOM 0 H ASN A 16 16.828 12.245 -11.228 1.00 0.00 H new ATOM 0 HA ASN A 16 14.528 11.405 -9.709 1.00 0.00 H new ATOM 0 HB2 ASN A 16 16.165 9.883 -10.862 1.00 0.00 H new ATOM 0 HB3 ASN A 16 17.388 10.378 -9.708 1.00 0.00 H new ATOM 0 HD21 ASN A 16 14.423 7.723 -8.661 1.00 0.00 H new ATOM 0 HD22 ASN A 16 14.380 8.614 -10.185 1.00 0.00 H new ATOM 238 N LEU A 17 14.948 12.787 -7.677 1.00 0.00 N ATOM 239 CA LEU A 17 15.157 13.523 -6.436 1.00 0.00 C ATOM 240 C LEU A 17 14.413 12.884 -5.268 1.00 0.00 C ATOM 241 O LEU A 17 14.158 13.532 -4.249 1.00 0.00 O ATOM 242 CB LEU A 17 14.724 14.986 -6.625 1.00 0.00 C ATOM 243 CG LEU A 17 13.407 15.202 -7.391 1.00 0.00 C ATOM 244 CD1 LEU A 17 12.197 14.836 -6.542 1.00 0.00 C ATOM 245 CD2 LEU A 17 13.304 16.641 -7.870 1.00 0.00 C ATOM 0 H LEU A 17 13.981 12.777 -8.002 1.00 0.00 H new ATOM 0 HA LEU A 17 16.219 13.491 -6.194 1.00 0.00 H new ATOM 0 HB2 LEU A 17 14.630 15.447 -5.642 1.00 0.00 H new ATOM 0 HB3 LEU A 17 15.519 15.515 -7.151 1.00 0.00 H new ATOM 0 HG LEU A 17 13.415 14.540 -8.257 1.00 0.00 H new ATOM 0 HD11 LEU A 17 11.286 15.002 -7.117 1.00 0.00 H new ATOM 0 HD12 LEU A 17 12.259 13.787 -6.254 1.00 0.00 H new ATOM 0 HD13 LEU A 17 12.179 15.457 -5.647 1.00 0.00 H new ATOM 0 HD21 LEU A 17 12.367 16.779 -8.410 1.00 0.00 H new ATOM 0 HD22 LEU A 17 13.330 17.313 -7.012 1.00 0.00 H new ATOM 0 HD23 LEU A 17 14.141 16.865 -8.532 1.00 0.00 H new ATOM 257 N TYR A 18 14.072 11.610 -5.404 1.00 0.00 N ATOM 258 CA TYR A 18 13.364 10.916 -4.343 1.00 0.00 C ATOM 259 C TYR A 18 14.147 9.699 -3.860 1.00 0.00 C ATOM 260 O TYR A 18 13.977 8.588 -4.363 1.00 0.00 O ATOM 261 CB TYR A 18 11.960 10.504 -4.792 1.00 0.00 C ATOM 262 CG TYR A 18 11.105 9.968 -3.662 1.00 0.00 C ATOM 263 CD1 TYR A 18 10.384 10.830 -2.844 1.00 0.00 C ATOM 264 CD2 TYR A 18 11.027 8.604 -3.404 1.00 0.00 C ATOM 265 CE1 TYR A 18 9.620 10.349 -1.798 1.00 0.00 C ATOM 266 CE2 TYR A 18 10.260 8.115 -2.363 1.00 0.00 C ATOM 267 CZ TYR A 18 9.556 8.993 -1.565 1.00 0.00 C ATOM 268 OH TYR A 18 8.804 8.511 -0.517 1.00 0.00 O ATOM 0 H TYR A 18 14.272 11.044 -6.228 1.00 0.00 H new ATOM 0 HA TYR A 18 13.266 11.611 -3.509 1.00 0.00 H new ATOM 0 HB2 TYR A 18 11.462 11.364 -5.239 1.00 0.00 H new ATOM 0 HB3 TYR A 18 12.042 9.744 -5.569 1.00 0.00 H new ATOM 0 HD1 TYR A 18 10.422 11.893 -3.029 1.00 0.00 H new ATOM 0 HD2 TYR A 18 11.576 7.914 -4.028 1.00 0.00 H new ATOM 0 HE1 TYR A 18 9.075 11.034 -1.165 1.00 0.00 H new ATOM 0 HE2 TYR A 18 10.212 7.052 -2.176 1.00 0.00 H new ATOM 0 HH TYR A 18 8.865 7.533 -0.493 1.00 0.00 H new ATOM 278 N PHE A 19 15.044 9.934 -2.918 1.00 0.00 N ATOM 279 CA PHE A 19 15.731 8.861 -2.210 1.00 0.00 C ATOM 280 C PHE A 19 15.765 9.206 -0.723 1.00 0.00 C ATOM 281 O PHE A 19 16.566 8.682 0.051 1.00 0.00 O ATOM 282 CB PHE A 19 17.149 8.668 -2.771 1.00 0.00 C ATOM 283 CG PHE A 19 17.820 7.406 -2.299 1.00 0.00 C ATOM 284 CD1 PHE A 19 17.272 6.169 -2.588 1.00 0.00 C ATOM 285 CD2 PHE A 19 18.999 7.461 -1.570 1.00 0.00 C ATOM 286 CE1 PHE A 19 17.876 5.007 -2.149 1.00 0.00 C ATOM 287 CE2 PHE A 19 19.608 6.303 -1.127 1.00 0.00 C ATOM 288 CZ PHE A 19 19.050 5.074 -1.422 1.00 0.00 C ATOM 0 H PHE A 19 15.318 10.871 -2.621 1.00 0.00 H new ATOM 0 HA PHE A 19 15.198 7.920 -2.349 1.00 0.00 H new ATOM 0 HB2 PHE A 19 17.101 8.658 -3.860 1.00 0.00 H new ATOM 0 HB3 PHE A 19 17.762 9.523 -2.487 1.00 0.00 H new ATOM 0 HD1 PHE A 19 16.360 6.111 -3.164 1.00 0.00 H new ATOM 0 HD2 PHE A 19 19.445 8.419 -1.347 1.00 0.00 H new ATOM 0 HE1 PHE A 19 17.432 4.048 -2.373 1.00 0.00 H new ATOM 0 HE2 PHE A 19 20.520 6.358 -0.551 1.00 0.00 H new ATOM 0 HZ PHE A 19 19.530 4.167 -1.085 1.00 0.00 H new ATOM 298 N GLN A 20 14.861 10.093 -0.335 1.00 0.00 N ATOM 299 CA GLN A 20 14.779 10.567 1.036 1.00 0.00 C ATOM 300 C GLN A 20 14.113 9.513 1.917 1.00 0.00 C ATOM 301 O GLN A 20 12.914 9.255 1.796 1.00 0.00 O ATOM 302 CB GLN A 20 13.994 11.881 1.084 1.00 0.00 C ATOM 303 CG GLN A 20 14.043 12.592 2.426 1.00 0.00 C ATOM 304 CD GLN A 20 15.461 12.898 2.868 1.00 0.00 C ATOM 305 OE1 GLN A 20 16.030 13.923 2.496 1.00 0.00 O ATOM 306 NE2 GLN A 20 16.027 12.032 3.696 1.00 0.00 N ATOM 0 H GLN A 20 14.167 10.502 -0.960 1.00 0.00 H new ATOM 0 HA GLN A 20 15.786 10.746 1.414 1.00 0.00 H new ATOM 0 HB2 GLN A 20 14.383 12.551 0.317 1.00 0.00 H new ATOM 0 HB3 GLN A 20 12.953 11.678 0.832 1.00 0.00 H new ATOM 0 HG2 GLN A 20 13.477 13.521 2.362 1.00 0.00 H new ATOM 0 HG3 GLN A 20 13.556 11.973 3.180 1.00 0.00 H new ATOM 0 HE21 GLN A 20 15.521 11.193 3.981 1.00 0.00 H new ATOM 0 HE22 GLN A 20 16.968 12.204 4.049 1.00 0.00 H new ATOM 315 N GLY A 21 14.902 8.889 2.778 1.00 0.00 N ATOM 316 CA GLY A 21 14.377 7.866 3.656 1.00 0.00 C ATOM 317 C GLY A 21 14.722 6.477 3.164 1.00 0.00 C ATOM 318 O GLY A 21 14.224 6.034 2.128 1.00 0.00 O ATOM 0 H GLY A 21 15.899 9.074 2.884 1.00 0.00 H new ATOM 0 HA2 GLY A 21 14.778 8.007 4.660 1.00 0.00 H new ATOM 0 HA3 GLY A 21 13.294 7.968 3.728 1.00 0.00 H new ATOM 322 N HIS A 22 15.581 5.788 3.897 1.00 0.00 N ATOM 323 CA HIS A 22 16.013 4.457 3.507 1.00 0.00 C ATOM 324 C HIS A 22 16.181 3.576 4.742 1.00 0.00 C ATOM 325 O HIS A 22 17.214 3.610 5.411 1.00 0.00 O ATOM 326 CB HIS A 22 17.326 4.535 2.718 1.00 0.00 C ATOM 327 CG HIS A 22 17.687 3.263 2.012 1.00 0.00 C ATOM 328 ND1 HIS A 22 18.863 2.577 2.238 1.00 0.00 N ATOM 329 CD2 HIS A 22 17.026 2.562 1.061 1.00 0.00 C ATOM 330 CE1 HIS A 22 18.907 1.515 1.457 1.00 0.00 C ATOM 331 NE2 HIS A 22 17.806 1.481 0.732 1.00 0.00 N ATOM 0 H HIS A 22 15.993 6.129 4.766 1.00 0.00 H new ATOM 0 HA HIS A 22 15.252 4.013 2.866 1.00 0.00 H new ATOM 0 HB2 HIS A 22 17.250 5.337 1.984 1.00 0.00 H new ATOM 0 HB3 HIS A 22 18.133 4.802 3.400 1.00 0.00 H new ATOM 0 HD2 HIS A 22 16.063 2.808 0.639 1.00 0.00 H new ATOM 0 HE1 HIS A 22 19.710 0.794 1.418 1.00 0.00 H new ATOM 0 HE2 HIS A 22 17.572 0.769 0.040 1.00 0.00 H new ATOM 340 N MET A 23 15.150 2.802 5.047 1.00 0.00 N ATOM 341 CA MET A 23 15.150 1.939 6.220 1.00 0.00 C ATOM 342 C MET A 23 14.501 0.606 5.859 1.00 0.00 C ATOM 343 O MET A 23 13.351 0.564 5.421 1.00 0.00 O ATOM 344 CB MET A 23 14.400 2.629 7.370 1.00 0.00 C ATOM 345 CG MET A 23 14.625 2.014 8.750 1.00 0.00 C ATOM 346 SD MET A 23 13.744 0.460 8.997 1.00 0.00 S ATOM 347 CE MET A 23 14.164 0.103 10.702 1.00 0.00 C ATOM 0 H MET A 23 14.295 2.754 4.493 1.00 0.00 H new ATOM 0 HA MET A 23 16.172 1.751 6.549 1.00 0.00 H new ATOM 0 HB2 MET A 23 14.700 3.676 7.403 1.00 0.00 H new ATOM 0 HB3 MET A 23 13.333 2.610 7.150 1.00 0.00 H new ATOM 0 HG2 MET A 23 15.692 1.844 8.894 1.00 0.00 H new ATOM 0 HG3 MET A 23 14.310 2.726 9.512 1.00 0.00 H new ATOM 0 HE1 MET A 23 13.692 -0.832 11.005 1.00 0.00 H new ATOM 0 HE2 MET A 23 15.246 0.012 10.799 1.00 0.00 H new ATOM 0 HE3 MET A 23 13.810 0.912 11.341 1.00 0.00 H new ATOM 357 N ALA A 24 15.248 -0.477 6.018 1.00 0.00 N ATOM 358 CA ALA A 24 14.781 -1.792 5.601 1.00 0.00 C ATOM 359 C ALA A 24 14.470 -2.678 6.802 1.00 0.00 C ATOM 360 O ALA A 24 14.808 -2.333 7.938 1.00 0.00 O ATOM 361 CB ALA A 24 15.820 -2.449 4.707 1.00 0.00 C ATOM 0 H ALA A 24 16.180 -0.472 6.433 1.00 0.00 H new ATOM 0 HA ALA A 24 13.856 -1.664 5.039 1.00 0.00 H new ATOM 0 HB1 ALA A 24 15.465 -3.432 4.398 1.00 0.00 H new ATOM 0 HB2 ALA A 24 15.985 -1.830 3.825 1.00 0.00 H new ATOM 0 HB3 ALA A 24 16.756 -2.557 5.255 1.00 0.00 H new ATOM 367 N ALA A 25 13.837 -3.823 6.533 1.00 0.00 N ATOM 368 CA ALA A 25 13.445 -4.775 7.572 1.00 0.00 C ATOM 369 C ALA A 25 12.441 -4.150 8.536 1.00 0.00 C ATOM 370 O ALA A 25 12.568 -4.269 9.757 1.00 0.00 O ATOM 371 CB ALA A 25 14.670 -5.291 8.320 1.00 0.00 C ATOM 0 H ALA A 25 13.583 -4.115 5.589 1.00 0.00 H new ATOM 0 HA ALA A 25 12.960 -5.623 7.088 1.00 0.00 H new ATOM 0 HB1 ALA A 25 14.356 -5.998 9.088 1.00 0.00 H new ATOM 0 HB2 ALA A 25 15.340 -5.790 7.620 1.00 0.00 H new ATOM 0 HB3 ALA A 25 15.190 -4.455 8.787 1.00 0.00 H new ATOM 377 N ARG A 26 11.438 -3.485 7.978 1.00 0.00 N ATOM 378 CA ARG A 26 10.390 -2.868 8.773 1.00 0.00 C ATOM 379 C ARG A 26 9.063 -2.937 8.029 1.00 0.00 C ATOM 380 O ARG A 26 8.956 -2.488 6.885 1.00 0.00 O ATOM 381 CB ARG A 26 10.735 -1.410 9.095 1.00 0.00 C ATOM 382 CG ARG A 26 9.827 -0.794 10.151 1.00 0.00 C ATOM 383 CD ARG A 26 9.986 -1.505 11.485 1.00 0.00 C ATOM 384 NE ARG A 26 9.014 -1.057 12.482 1.00 0.00 N ATOM 385 CZ ARG A 26 9.006 -1.480 13.749 1.00 0.00 C ATOM 386 NH1 ARG A 26 9.933 -2.328 14.176 1.00 0.00 N ATOM 387 NH2 ARG A 26 8.066 -1.065 14.590 1.00 0.00 N ATOM 0 H ARG A 26 11.330 -3.360 6.971 1.00 0.00 H new ATOM 0 HA ARG A 26 10.305 -3.415 9.712 1.00 0.00 H new ATOM 0 HB2 ARG A 26 11.768 -1.356 9.438 1.00 0.00 H new ATOM 0 HB3 ARG A 26 10.671 -0.819 8.182 1.00 0.00 H new ATOM 0 HG2 ARG A 26 10.064 0.264 10.268 1.00 0.00 H new ATOM 0 HG3 ARG A 26 8.789 -0.854 9.824 1.00 0.00 H new ATOM 0 HD2 ARG A 26 9.878 -2.579 11.335 1.00 0.00 H new ATOM 0 HD3 ARG A 26 10.994 -1.336 11.864 1.00 0.00 H new ATOM 0 HE ARG A 26 8.303 -0.385 12.194 1.00 0.00 H new ATOM 0 HH11 ARG A 26 10.655 -2.659 13.536 1.00 0.00 H new ATOM 0 HH12 ARG A 26 9.924 -2.649 15.144 1.00 0.00 H new ATOM 0 HH21 ARG A 26 7.344 -0.419 14.270 1.00 0.00 H new ATOM 0 HH22 ARG A 26 8.066 -1.392 15.556 1.00 0.00 H new ATOM 401 N ILE A 27 8.060 -3.505 8.678 1.00 0.00 N ATOM 402 CA ILE A 27 6.745 -3.662 8.078 1.00 0.00 C ATOM 403 C ILE A 27 5.825 -2.521 8.494 1.00 0.00 C ATOM 404 O ILE A 27 5.496 -2.374 9.670 1.00 0.00 O ATOM 405 CB ILE A 27 6.098 -5.006 8.482 1.00 0.00 C ATOM 406 CG1 ILE A 27 7.025 -6.173 8.126 1.00 0.00 C ATOM 407 CG2 ILE A 27 4.745 -5.172 7.798 1.00 0.00 C ATOM 408 CD1 ILE A 27 6.505 -7.525 8.572 1.00 0.00 C ATOM 0 H ILE A 27 8.133 -3.868 9.628 1.00 0.00 H new ATOM 0 HA ILE A 27 6.880 -3.647 6.996 1.00 0.00 H new ATOM 0 HB ILE A 27 5.942 -5.005 9.561 1.00 0.00 H new ATOM 0 HG12 ILE A 27 7.175 -6.190 7.046 1.00 0.00 H new ATOM 0 HG13 ILE A 27 8.001 -6.001 8.580 1.00 0.00 H new ATOM 0 HG21 ILE A 27 4.303 -6.123 8.093 1.00 0.00 H new ATOM 0 HG22 ILE A 27 4.085 -4.357 8.095 1.00 0.00 H new ATOM 0 HG23 ILE A 27 4.879 -5.154 6.716 1.00 0.00 H new ATOM 0 HD11 ILE A 27 7.215 -8.301 8.285 1.00 0.00 H new ATOM 0 HD12 ILE A 27 6.382 -7.528 9.655 1.00 0.00 H new ATOM 0 HD13 ILE A 27 5.543 -7.720 8.097 1.00 0.00 H new ATOM 420 N THR A 28 5.426 -1.708 7.529 1.00 0.00 N ATOM 421 CA THR A 28 4.490 -0.625 7.784 1.00 0.00 C ATOM 422 C THR A 28 3.076 -1.053 7.391 1.00 0.00 C ATOM 423 O THR A 28 2.870 -1.647 6.329 1.00 0.00 O ATOM 424 CB THR A 28 4.895 0.668 7.032 1.00 0.00 C ATOM 425 OG1 THR A 28 3.974 1.729 7.323 1.00 0.00 O ATOM 426 CG2 THR A 28 4.954 0.442 5.526 1.00 0.00 C ATOM 0 H THR A 28 5.737 -1.778 6.560 1.00 0.00 H new ATOM 0 HA THR A 28 4.513 -0.404 8.851 1.00 0.00 H new ATOM 0 HB THR A 28 5.890 0.948 7.377 1.00 0.00 H new ATOM 0 HG1 THR A 28 4.245 2.539 6.842 1.00 0.00 H new ATOM 0 HG21 THR A 28 5.241 1.369 5.030 1.00 0.00 H new ATOM 0 HG22 THR A 28 5.689 -0.332 5.303 1.00 0.00 H new ATOM 0 HG23 THR A 28 3.974 0.126 5.167 1.00 0.00 H new ATOM 434 N GLY A 29 2.108 -0.769 8.252 1.00 0.00 N ATOM 435 CA GLY A 29 0.748 -1.209 8.001 1.00 0.00 C ATOM 436 C GLY A 29 -0.189 -0.058 7.706 1.00 0.00 C ATOM 437 O GLY A 29 -0.915 -0.080 6.710 1.00 0.00 O ATOM 0 H GLY A 29 2.238 -0.244 9.117 1.00 0.00 H new ATOM 0 HA2 GLY A 29 0.743 -1.902 7.159 1.00 0.00 H new ATOM 0 HA3 GLY A 29 0.382 -1.758 8.868 1.00 0.00 H new ATOM 441 N GLU A 30 -0.170 0.950 8.569 1.00 0.00 N ATOM 442 CA GLU A 30 -1.044 2.108 8.419 1.00 0.00 C ATOM 443 C GLU A 30 -0.220 3.377 8.214 1.00 0.00 C ATOM 444 O GLU A 30 0.108 4.073 9.175 1.00 0.00 O ATOM 445 CB GLU A 30 -1.962 2.281 9.641 1.00 0.00 C ATOM 446 CG GLU A 30 -2.941 1.137 9.881 1.00 0.00 C ATOM 447 CD GLU A 30 -2.286 -0.110 10.448 1.00 0.00 C ATOM 448 OE1 GLU A 30 -2.470 -1.200 9.869 1.00 0.00 O ATOM 449 OE2 GLU A 30 -1.583 -0.007 11.476 1.00 0.00 O ATOM 0 H GLU A 30 0.443 0.989 9.383 1.00 0.00 H new ATOM 0 HA GLU A 30 -1.667 1.936 7.542 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -1.341 2.399 10.529 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -2.528 3.205 9.523 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -3.719 1.473 10.566 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -3.431 0.885 8.941 1.00 0.00 H new ATOM 457 N PRO A 31 0.160 3.673 6.964 1.00 0.00 N ATOM 458 CA PRO A 31 0.942 4.849 6.630 1.00 0.00 C ATOM 459 C PRO A 31 0.079 6.029 6.183 1.00 0.00 C ATOM 460 O PRO A 31 -1.095 5.863 5.836 1.00 0.00 O ATOM 461 CB PRO A 31 1.801 4.339 5.475 1.00 0.00 C ATOM 462 CG PRO A 31 0.985 3.269 4.809 1.00 0.00 C ATOM 463 CD PRO A 31 -0.119 2.872 5.766 1.00 0.00 C ATOM 0 HA PRO A 31 1.504 5.236 7.480 1.00 0.00 H new ATOM 0 HB2 PRO A 31 2.038 5.143 4.778 1.00 0.00 H new ATOM 0 HB3 PRO A 31 2.749 3.941 5.837 1.00 0.00 H new ATOM 0 HG2 PRO A 31 0.566 3.635 3.872 1.00 0.00 H new ATOM 0 HG3 PRO A 31 1.608 2.408 4.565 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -1.104 3.093 5.356 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -0.097 1.804 5.983 1.00 0.00 H new ATOM 471 N SER A 32 0.660 7.220 6.215 1.00 0.00 N ATOM 472 CA SER A 32 -0.013 8.415 5.725 1.00 0.00 C ATOM 473 C SER A 32 0.011 8.438 4.199 1.00 0.00 C ATOM 474 O SER A 32 -0.976 8.788 3.546 1.00 0.00 O ATOM 475 CB SER A 32 0.674 9.661 6.280 1.00 0.00 C ATOM 476 OG SER A 32 0.768 9.607 7.694 1.00 0.00 O ATOM 0 H SER A 32 1.599 7.385 6.577 1.00 0.00 H new ATOM 0 HA SER A 32 -1.050 8.403 6.060 1.00 0.00 H new ATOM 0 HB2 SER A 32 1.671 9.752 5.850 1.00 0.00 H new ATOM 0 HB3 SER A 32 0.117 10.550 5.983 1.00 0.00 H new ATOM 0 HG SER A 32 1.213 10.416 8.023 1.00 0.00 H new ATOM 482 N LYS A 33 1.152 8.058 3.641 1.00 0.00 N ATOM 483 CA LYS A 33 1.310 7.960 2.204 1.00 0.00 C ATOM 484 C LYS A 33 0.779 6.609 1.739 1.00 0.00 C ATOM 485 O LYS A 33 0.798 5.643 2.505 1.00 0.00 O ATOM 486 CB LYS A 33 2.791 8.115 1.838 1.00 0.00 C ATOM 487 CG LYS A 33 3.059 8.267 0.349 1.00 0.00 C ATOM 488 CD LYS A 33 2.435 9.533 -0.211 1.00 0.00 C ATOM 489 CE LYS A 33 3.007 9.880 -1.579 1.00 0.00 C ATOM 490 NZ LYS A 33 4.448 10.255 -1.504 1.00 0.00 N ATOM 0 H LYS A 33 1.987 7.811 4.172 1.00 0.00 H new ATOM 0 HA LYS A 33 0.749 8.753 1.709 1.00 0.00 H new ATOM 0 HB2 LYS A 33 3.192 8.986 2.357 1.00 0.00 H new ATOM 0 HB3 LYS A 33 3.336 7.246 2.206 1.00 0.00 H new ATOM 0 HG2 LYS A 33 4.135 8.284 0.173 1.00 0.00 H new ATOM 0 HG3 LYS A 33 2.663 7.401 -0.182 1.00 0.00 H new ATOM 0 HD2 LYS A 33 1.355 9.404 -0.289 1.00 0.00 H new ATOM 0 HD3 LYS A 33 2.608 10.360 0.477 1.00 0.00 H new ATOM 0 HE2 LYS A 33 2.889 9.028 -2.248 1.00 0.00 H new ATOM 0 HE3 LYS A 33 2.440 10.705 -2.010 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 4.711 10.796 -2.353 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 4.612 10.837 -0.658 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 5.028 9.394 -1.449 1.00 0.00 H new ATOM 504 N LYS A 34 0.291 6.544 0.505 1.00 0.00 N ATOM 505 CA LYS A 34 -0.275 5.307 -0.021 1.00 0.00 C ATOM 506 C LYS A 34 0.731 4.162 0.037 1.00 0.00 C ATOM 507 O LYS A 34 1.923 4.348 -0.218 1.00 0.00 O ATOM 508 CB LYS A 34 -0.755 5.486 -1.461 1.00 0.00 C ATOM 509 CG LYS A 34 -1.904 6.463 -1.614 1.00 0.00 C ATOM 510 CD LYS A 34 -2.515 6.369 -3.003 1.00 0.00 C ATOM 511 CE LYS A 34 -3.638 7.370 -3.195 1.00 0.00 C ATOM 512 NZ LYS A 34 -3.136 8.767 -3.278 1.00 0.00 N ATOM 0 H LYS A 34 0.276 7.329 -0.147 1.00 0.00 H new ATOM 0 HA LYS A 34 -1.128 5.058 0.611 1.00 0.00 H new ATOM 0 HB2 LYS A 34 0.081 5.827 -2.072 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -1.062 4.517 -1.853 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -2.666 6.255 -0.863 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -1.549 7.478 -1.436 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -1.742 6.542 -3.752 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -2.896 5.361 -3.165 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -4.187 7.128 -4.105 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -4.342 7.287 -2.367 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -3.920 9.403 -3.527 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -2.740 9.049 -2.359 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -2.397 8.827 -4.007 1.00 0.00 H new ATOM 526 N ALA A 35 0.241 2.988 0.388 1.00 0.00 N ATOM 527 CA ALA A 35 1.059 1.794 0.419 1.00 0.00 C ATOM 528 C ALA A 35 0.510 0.771 -0.561 1.00 0.00 C ATOM 529 O ALA A 35 -0.410 1.068 -1.328 1.00 0.00 O ATOM 530 CB ALA A 35 1.109 1.220 1.826 1.00 0.00 C ATOM 0 H ALA A 35 -0.731 2.837 0.658 1.00 0.00 H new ATOM 0 HA ALA A 35 2.076 2.051 0.124 1.00 0.00 H new ATOM 0 HB1 ALA A 35 1.728 0.323 1.831 1.00 0.00 H new ATOM 0 HB2 ALA A 35 1.535 1.959 2.505 1.00 0.00 H new ATOM 0 HB3 ALA A 35 0.100 0.967 2.152 1.00 0.00 H new ATOM 536 N VAL A 36 1.071 -0.422 -0.549 1.00 0.00 N ATOM 537 CA VAL A 36 0.610 -1.476 -1.438 1.00 0.00 C ATOM 538 C VAL A 36 -0.374 -2.392 -0.716 1.00 0.00 C ATOM 539 O VAL A 36 -1.097 -3.164 -1.340 1.00 0.00 O ATOM 540 CB VAL A 36 1.795 -2.289 -1.998 1.00 0.00 C ATOM 541 CG1 VAL A 36 2.436 -3.141 -0.917 1.00 0.00 C ATOM 542 CG2 VAL A 36 1.369 -3.136 -3.184 1.00 0.00 C ATOM 0 H VAL A 36 1.843 -0.687 0.062 1.00 0.00 H new ATOM 0 HA VAL A 36 0.097 -1.007 -2.278 1.00 0.00 H new ATOM 0 HB VAL A 36 2.545 -1.581 -2.350 1.00 0.00 H new ATOM 0 HG11 VAL A 36 3.268 -3.702 -1.342 1.00 0.00 H new ATOM 0 HG12 VAL A 36 2.803 -2.498 -0.117 1.00 0.00 H new ATOM 0 HG13 VAL A 36 1.698 -3.835 -0.515 1.00 0.00 H new ATOM 0 HG21 VAL A 36 2.226 -3.697 -3.557 1.00 0.00 H new ATOM 0 HG22 VAL A 36 0.588 -3.830 -2.874 1.00 0.00 H new ATOM 0 HG23 VAL A 36 0.987 -2.490 -3.974 1.00 0.00 H new ATOM 552 N SER A 37 -0.411 -2.244 0.605 1.00 0.00 N ATOM 553 CA SER A 37 -1.249 -3.055 1.484 1.00 0.00 C ATOM 554 C SER A 37 -0.816 -4.527 1.487 1.00 0.00 C ATOM 555 O SER A 37 -0.684 -5.165 0.442 1.00 0.00 O ATOM 556 CB SER A 37 -2.724 -2.922 1.101 1.00 0.00 C ATOM 557 OG SER A 37 -3.153 -1.569 1.185 1.00 0.00 O ATOM 0 H SER A 37 0.147 -1.549 1.102 1.00 0.00 H new ATOM 0 HA SER A 37 -1.120 -2.677 2.498 1.00 0.00 H new ATOM 0 HB2 SER A 37 -2.875 -3.293 0.087 1.00 0.00 H new ATOM 0 HB3 SER A 37 -3.332 -3.541 1.761 1.00 0.00 H new ATOM 0 HG SER A 37 -4.098 -1.509 0.934 1.00 0.00 H new ATOM 563 N ASP A 38 -0.613 -5.069 2.683 1.00 0.00 N ATOM 564 CA ASP A 38 -0.123 -6.437 2.839 1.00 0.00 C ATOM 565 C ASP A 38 -1.241 -7.455 2.616 1.00 0.00 C ATOM 566 O ASP A 38 -1.005 -8.665 2.616 1.00 0.00 O ATOM 567 CB ASP A 38 0.476 -6.631 4.234 1.00 0.00 C ATOM 568 CG ASP A 38 -0.571 -6.556 5.327 1.00 0.00 C ATOM 569 OD1 ASP A 38 -0.995 -5.434 5.675 1.00 0.00 O ATOM 570 OD2 ASP A 38 -0.974 -7.617 5.844 1.00 0.00 O ATOM 0 H ASP A 38 -0.781 -4.581 3.563 1.00 0.00 H new ATOM 0 HA ASP A 38 0.648 -6.601 2.087 1.00 0.00 H new ATOM 0 HB2 ASP A 38 0.977 -7.598 4.280 1.00 0.00 H new ATOM 0 HB3 ASP A 38 1.236 -5.869 4.409 1.00 0.00 H new ATOM 576 N ARG A 39 -2.457 -6.961 2.416 1.00 0.00 N ATOM 577 CA ARG A 39 -3.612 -7.831 2.214 1.00 0.00 C ATOM 578 C ARG A 39 -3.539 -8.536 0.859 1.00 0.00 C ATOM 579 O ARG A 39 -4.197 -9.556 0.641 1.00 0.00 O ATOM 580 CB ARG A 39 -4.912 -7.029 2.324 1.00 0.00 C ATOM 581 CG ARG A 39 -6.163 -7.876 2.139 1.00 0.00 C ATOM 582 CD ARG A 39 -7.429 -7.070 2.360 1.00 0.00 C ATOM 583 NE ARG A 39 -7.630 -6.722 3.765 1.00 0.00 N ATOM 584 CZ ARG A 39 -8.820 -6.422 4.291 1.00 0.00 C ATOM 585 NH1 ARG A 39 -9.908 -6.454 3.530 1.00 0.00 N ATOM 586 NH2 ARG A 39 -8.924 -6.108 5.577 1.00 0.00 N ATOM 0 H ARG A 39 -2.670 -5.964 2.389 1.00 0.00 H new ATOM 0 HA ARG A 39 -3.600 -8.592 2.995 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -4.951 -6.546 3.300 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -4.905 -6.236 1.576 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -6.171 -8.297 1.133 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -6.140 -8.714 2.835 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -7.384 -6.158 1.765 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -8.287 -7.641 2.004 1.00 0.00 H new ATOM 0 HE ARG A 39 -6.815 -6.707 4.378 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -9.834 -6.708 2.545 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -10.818 -6.225 3.931 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -8.093 -6.095 6.168 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -9.835 -5.880 5.974 1.00 0.00 H new ATOM 600 N LEU A 40 -2.726 -7.998 -0.046 1.00 0.00 N ATOM 601 CA LEU A 40 -2.571 -8.580 -1.374 1.00 0.00 C ATOM 602 C LEU A 40 -1.811 -9.902 -1.303 1.00 0.00 C ATOM 603 O LEU A 40 -1.916 -10.738 -2.201 1.00 0.00 O ATOM 604 CB LEU A 40 -1.851 -7.603 -2.309 1.00 0.00 C ATOM 605 CG LEU A 40 -2.597 -6.290 -2.576 1.00 0.00 C ATOM 606 CD1 LEU A 40 -1.807 -5.421 -3.539 1.00 0.00 C ATOM 607 CD2 LEU A 40 -3.988 -6.567 -3.129 1.00 0.00 C ATOM 0 H LEU A 40 -2.166 -7.161 0.116 1.00 0.00 H new ATOM 0 HA LEU A 40 -3.565 -8.777 -1.774 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -0.875 -7.369 -1.883 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -1.671 -8.101 -3.262 1.00 0.00 H new ATOM 0 HG LEU A 40 -2.703 -5.756 -1.632 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -2.349 -4.492 -3.719 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -0.832 -5.194 -3.108 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -1.673 -5.952 -4.482 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -4.501 -5.623 -3.312 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -3.904 -7.122 -4.064 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -4.556 -7.155 -2.408 1.00 0.00 H new ATOM 619 N ILE A 41 -1.062 -10.093 -0.225 1.00 0.00 N ATOM 620 CA ILE A 41 -0.298 -11.319 -0.035 1.00 0.00 C ATOM 621 C ILE A 41 -1.233 -12.492 0.216 1.00 0.00 C ATOM 622 O ILE A 41 -1.989 -12.501 1.192 1.00 0.00 O ATOM 623 CB ILE A 41 0.699 -11.193 1.140 1.00 0.00 C ATOM 624 CG1 ILE A 41 1.662 -10.032 0.886 1.00 0.00 C ATOM 625 CG2 ILE A 41 1.471 -12.494 1.338 1.00 0.00 C ATOM 626 CD1 ILE A 41 2.467 -10.190 -0.384 1.00 0.00 C ATOM 0 H ILE A 41 -0.967 -9.415 0.531 1.00 0.00 H new ATOM 0 HA ILE A 41 0.270 -11.493 -0.949 1.00 0.00 H new ATOM 0 HB ILE A 41 0.137 -10.992 2.052 1.00 0.00 H new ATOM 0 HG12 ILE A 41 1.094 -9.103 0.835 1.00 0.00 H new ATOM 0 HG13 ILE A 41 2.344 -9.943 1.732 1.00 0.00 H new ATOM 0 HG21 ILE A 41 2.166 -12.382 2.170 1.00 0.00 H new ATOM 0 HG22 ILE A 41 0.773 -13.302 1.556 1.00 0.00 H new ATOM 0 HG23 ILE A 41 2.027 -12.729 0.430 1.00 0.00 H new ATOM 0 HD11 ILE A 41 3.129 -9.333 -0.504 1.00 0.00 H new ATOM 0 HD12 ILE A 41 3.061 -11.102 -0.327 1.00 0.00 H new ATOM 0 HD13 ILE A 41 1.792 -10.249 -1.238 1.00 0.00 H new ATOM 638 N GLY A 42 -1.183 -13.470 -0.676 1.00 0.00 N ATOM 639 CA GLY A 42 -2.028 -14.635 -0.550 1.00 0.00 C ATOM 640 C GLY A 42 -3.264 -14.545 -1.421 1.00 0.00 C ATOM 641 O GLY A 42 -4.155 -15.392 -1.340 1.00 0.00 O ATOM 0 H GLY A 42 -0.567 -13.475 -1.489 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -1.459 -15.525 -0.821 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -2.328 -14.753 0.491 1.00 0.00 H new ATOM 645 N ARG A 43 -3.331 -13.511 -2.250 1.00 0.00 N ATOM 646 CA ARG A 43 -4.474 -13.317 -3.130 1.00 0.00 C ATOM 647 C ARG A 43 -4.120 -13.663 -4.572 1.00 0.00 C ATOM 648 O ARG A 43 -2.947 -13.666 -4.958 1.00 0.00 O ATOM 649 CB ARG A 43 -4.964 -11.870 -3.068 1.00 0.00 C ATOM 650 CG ARG A 43 -5.396 -11.395 -1.688 1.00 0.00 C ATOM 651 CD ARG A 43 -6.556 -12.205 -1.126 1.00 0.00 C ATOM 652 NE ARG A 43 -6.102 -13.377 -0.376 1.00 0.00 N ATOM 653 CZ ARG A 43 -6.130 -13.460 0.957 1.00 0.00 C ATOM 654 NH1 ARG A 43 -6.635 -12.457 1.674 1.00 0.00 N ATOM 655 NH2 ARG A 43 -5.674 -14.551 1.564 1.00 0.00 N ATOM 0 H ARG A 43 -2.608 -12.796 -2.331 1.00 0.00 H new ATOM 0 HA ARG A 43 -5.266 -13.983 -2.788 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -4.169 -11.217 -3.428 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -5.804 -11.757 -3.754 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -4.549 -11.458 -1.005 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -5.684 -10.345 -1.743 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -7.158 -11.571 -0.475 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -7.201 -12.527 -1.943 1.00 0.00 H new ATOM 0 HE ARG A 43 -5.744 -14.175 -0.901 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -6.999 -11.628 1.205 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -6.657 -12.518 2.692 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -5.303 -15.324 1.012 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -5.695 -14.615 2.582 1.00 0.00 H new ATOM 669 N LYS A 44 -5.146 -13.950 -5.363 1.00 0.00 N ATOM 670 CA LYS A 44 -4.973 -14.242 -6.777 1.00 0.00 C ATOM 671 C LYS A 44 -5.008 -12.947 -7.583 1.00 0.00 C ATOM 672 O LYS A 44 -5.576 -11.947 -7.138 1.00 0.00 O ATOM 673 CB LYS A 44 -6.082 -15.186 -7.257 1.00 0.00 C ATOM 674 CG LYS A 44 -5.894 -15.674 -8.684 1.00 0.00 C ATOM 675 CD LYS A 44 -7.135 -16.375 -9.215 1.00 0.00 C ATOM 676 CE LYS A 44 -7.481 -17.617 -8.410 1.00 0.00 C ATOM 677 NZ LYS A 44 -8.677 -18.316 -8.951 1.00 0.00 N ATOM 0 H LYS A 44 -6.114 -13.986 -5.044 1.00 0.00 H new ATOM 0 HA LYS A 44 -4.008 -14.726 -6.923 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -6.127 -16.048 -6.591 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -7.041 -14.674 -7.181 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -5.652 -14.828 -9.327 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -5.046 -16.358 -8.725 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -7.978 -15.684 -9.194 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -6.976 -16.652 -10.257 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -6.631 -18.299 -8.412 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -7.663 -17.337 -7.372 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -8.878 -19.157 -8.373 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -9.495 -17.674 -8.926 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -8.495 -18.606 -9.933 1.00 0.00 H new ATOM 691 N GLY A 45 -4.398 -12.968 -8.756 1.00 0.00 N ATOM 692 CA GLY A 45 -4.413 -11.821 -9.631 1.00 0.00 C ATOM 693 C GLY A 45 -4.337 -12.231 -11.086 1.00 0.00 C ATOM 694 O GLY A 45 -3.964 -13.360 -11.396 1.00 0.00 O ATOM 0 H GLY A 45 -3.886 -13.772 -9.120 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -5.323 -11.245 -9.461 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -3.573 -11.169 -9.392 1.00 0.00 H new ATOM 698 N VAL A 46 -4.703 -11.326 -11.970 1.00 0.00 N ATOM 699 CA VAL A 46 -4.652 -11.585 -13.404 1.00 0.00 C ATOM 700 C VAL A 46 -3.583 -10.707 -14.055 1.00 0.00 C ATOM 701 O VAL A 46 -3.381 -9.561 -13.650 1.00 0.00 O ATOM 702 CB VAL A 46 -6.035 -11.337 -14.066 1.00 0.00 C ATOM 703 CG1 VAL A 46 -6.481 -9.891 -13.887 1.00 0.00 C ATOM 704 CG2 VAL A 46 -6.016 -11.708 -15.538 1.00 0.00 C ATOM 0 H VAL A 46 -5.042 -10.396 -11.723 1.00 0.00 H new ATOM 0 HA VAL A 46 -4.392 -12.633 -13.555 1.00 0.00 H new ATOM 0 HB VAL A 46 -6.756 -11.981 -13.563 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -7.452 -9.748 -14.361 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -6.559 -9.663 -12.824 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -5.751 -9.225 -14.348 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -6.998 -11.523 -15.973 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -5.271 -11.104 -16.056 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -5.765 -12.763 -15.644 1.00 0.00 H new ATOM 714 N VAL A 47 -2.895 -11.248 -15.052 1.00 0.00 N ATOM 715 CA VAL A 47 -1.800 -10.541 -15.698 1.00 0.00 C ATOM 716 C VAL A 47 -2.310 -9.665 -16.839 1.00 0.00 C ATOM 717 O VAL A 47 -2.864 -10.168 -17.816 1.00 0.00 O ATOM 718 CB VAL A 47 -0.734 -11.521 -16.234 1.00 0.00 C ATOM 719 CG1 VAL A 47 0.465 -10.766 -16.783 1.00 0.00 C ATOM 720 CG2 VAL A 47 -0.298 -12.485 -15.140 1.00 0.00 C ATOM 0 H VAL A 47 -3.078 -12.177 -15.431 1.00 0.00 H new ATOM 0 HA VAL A 47 -1.339 -9.906 -14.942 1.00 0.00 H new ATOM 0 HB VAL A 47 -1.178 -12.096 -17.047 1.00 0.00 H new ATOM 0 HG11 VAL A 47 1.203 -11.476 -17.155 1.00 0.00 H new ATOM 0 HG12 VAL A 47 0.144 -10.116 -17.597 1.00 0.00 H new ATOM 0 HG13 VAL A 47 0.909 -10.163 -15.991 1.00 0.00 H new ATOM 0 HG21 VAL A 47 0.453 -13.168 -15.535 1.00 0.00 H new ATOM 0 HG22 VAL A 47 0.125 -11.923 -14.307 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -1.160 -13.055 -14.793 1.00 0.00 H new ATOM 730 N MET A 48 -2.128 -8.356 -16.704 1.00 0.00 N ATOM 731 CA MET A 48 -2.571 -7.405 -17.716 1.00 0.00 C ATOM 732 C MET A 48 -1.404 -6.959 -18.590 1.00 0.00 C ATOM 733 O MET A 48 -1.595 -6.532 -19.730 1.00 0.00 O ATOM 734 CB MET A 48 -3.227 -6.189 -17.060 1.00 0.00 C ATOM 735 CG MET A 48 -4.515 -6.499 -16.304 1.00 0.00 C ATOM 736 SD MET A 48 -5.967 -6.682 -17.370 1.00 0.00 S ATOM 737 CE MET A 48 -5.755 -8.336 -18.031 1.00 0.00 C ATOM 0 H MET A 48 -1.673 -7.927 -15.898 1.00 0.00 H new ATOM 0 HA MET A 48 -3.306 -7.904 -18.347 1.00 0.00 H new ATOM 0 HB2 MET A 48 -2.515 -5.736 -16.370 1.00 0.00 H new ATOM 0 HB3 MET A 48 -3.441 -5.448 -17.830 1.00 0.00 H new ATOM 0 HG2 MET A 48 -4.377 -7.418 -15.733 1.00 0.00 H new ATOM 0 HG3 MET A 48 -4.703 -5.702 -15.585 1.00 0.00 H new ATOM 0 HE1 MET A 48 -6.712 -8.858 -18.018 1.00 0.00 H new ATOM 0 HE2 MET A 48 -5.389 -8.274 -19.056 1.00 0.00 H new ATOM 0 HE3 MET A 48 -5.035 -8.882 -17.421 1.00 0.00 H new ATOM 747 N GLU A 49 -0.198 -7.046 -18.051 1.00 0.00 N ATOM 748 CA GLU A 49 1.003 -6.746 -18.821 1.00 0.00 C ATOM 749 C GLU A 49 2.007 -7.871 -18.648 1.00 0.00 C ATOM 750 O GLU A 49 2.247 -8.319 -17.524 1.00 0.00 O ATOM 751 CB GLU A 49 1.610 -5.411 -18.388 1.00 0.00 C ATOM 752 CG GLU A 49 2.802 -4.980 -19.227 1.00 0.00 C ATOM 753 CD GLU A 49 2.470 -4.912 -20.702 1.00 0.00 C ATOM 754 OE1 GLU A 49 2.716 -5.905 -21.415 1.00 0.00 O ATOM 755 OE2 GLU A 49 1.949 -3.870 -21.150 1.00 0.00 O ATOM 0 H GLU A 49 -0.023 -7.321 -17.085 1.00 0.00 H new ATOM 0 HA GLU A 49 0.736 -6.662 -19.874 1.00 0.00 H new ATOM 0 HB2 GLU A 49 0.842 -4.639 -18.440 1.00 0.00 H new ATOM 0 HB3 GLU A 49 1.918 -5.484 -17.345 1.00 0.00 H new ATOM 0 HG2 GLU A 49 3.147 -4.003 -18.889 1.00 0.00 H new ATOM 0 HG3 GLU A 49 3.624 -5.679 -19.073 1.00 0.00 H new ATOM 763 N ALA A 50 2.584 -8.310 -19.759 1.00 0.00 N ATOM 764 CA ALA A 50 3.450 -9.483 -19.778 1.00 0.00 C ATOM 765 C ALA A 50 4.598 -9.362 -18.786 1.00 0.00 C ATOM 766 O ALA A 50 5.299 -8.347 -18.741 1.00 0.00 O ATOM 767 CB ALA A 50 3.987 -9.722 -21.180 1.00 0.00 C ATOM 0 H ALA A 50 2.466 -7.865 -20.669 1.00 0.00 H new ATOM 0 HA ALA A 50 2.846 -10.338 -19.475 1.00 0.00 H new ATOM 0 HB1 ALA A 50 4.632 -10.601 -21.178 1.00 0.00 H new ATOM 0 HB2 ALA A 50 3.155 -9.884 -21.866 1.00 0.00 H new ATOM 0 HB3 ALA A 50 4.560 -8.853 -21.503 1.00 0.00 H new ATOM 773 N ILE A 51 4.779 -10.404 -17.992 1.00 0.00 N ATOM 774 CA ILE A 51 5.851 -10.443 -17.017 1.00 0.00 C ATOM 775 C ILE A 51 6.955 -11.362 -17.518 1.00 0.00 C ATOM 776 O ILE A 51 6.772 -12.577 -17.618 1.00 0.00 O ATOM 777 CB ILE A 51 5.357 -10.926 -15.635 1.00 0.00 C ATOM 778 CG1 ILE A 51 4.194 -10.047 -15.152 1.00 0.00 C ATOM 779 CG2 ILE A 51 6.500 -10.911 -14.626 1.00 0.00 C ATOM 780 CD1 ILE A 51 3.622 -10.461 -13.814 1.00 0.00 C ATOM 0 H ILE A 51 4.192 -11.238 -18.006 1.00 0.00 H new ATOM 0 HA ILE A 51 6.231 -9.429 -16.895 1.00 0.00 H new ATOM 0 HB ILE A 51 4.999 -11.951 -15.729 1.00 0.00 H new ATOM 0 HG12 ILE A 51 4.536 -9.014 -15.085 1.00 0.00 H new ATOM 0 HG13 ILE A 51 3.400 -10.072 -15.898 1.00 0.00 H new ATOM 0 HG21 ILE A 51 6.135 -11.254 -13.658 1.00 0.00 H new ATOM 0 HG22 ILE A 51 7.296 -11.572 -14.968 1.00 0.00 H new ATOM 0 HG23 ILE A 51 6.887 -9.897 -14.529 1.00 0.00 H new ATOM 0 HD11 ILE A 51 2.806 -9.791 -13.544 1.00 0.00 H new ATOM 0 HD12 ILE A 51 3.247 -11.482 -13.879 1.00 0.00 H new ATOM 0 HD13 ILE A 51 4.401 -10.409 -13.053 1.00 0.00 H new ATOM 792 N SER A 52 8.091 -10.773 -17.843 1.00 0.00 N ATOM 793 CA SER A 52 9.191 -11.510 -18.436 1.00 0.00 C ATOM 794 C SER A 52 10.354 -11.640 -17.458 1.00 0.00 C ATOM 795 O SER A 52 10.432 -10.908 -16.472 1.00 0.00 O ATOM 796 CB SER A 52 9.650 -10.807 -19.716 1.00 0.00 C ATOM 797 OG SER A 52 9.861 -9.419 -19.491 1.00 0.00 O ATOM 0 H SER A 52 8.276 -9.780 -17.705 1.00 0.00 H new ATOM 0 HA SER A 52 8.845 -12.514 -18.680 1.00 0.00 H new ATOM 0 HB2 SER A 52 10.572 -11.264 -20.075 1.00 0.00 H new ATOM 0 HB3 SER A 52 8.902 -10.942 -20.497 1.00 0.00 H new ATOM 0 HG SER A 52 9.748 -9.221 -18.538 1.00 0.00 H new ATOM 803 N PRO A 53 11.272 -12.580 -17.725 1.00 0.00 N ATOM 804 CA PRO A 53 12.492 -12.747 -16.931 1.00 0.00 C ATOM 805 C PRO A 53 13.350 -11.483 -16.922 1.00 0.00 C ATOM 806 O PRO A 53 14.187 -11.294 -16.041 1.00 0.00 O ATOM 807 CB PRO A 53 13.239 -13.885 -17.637 1.00 0.00 C ATOM 808 CG PRO A 53 12.209 -14.597 -18.444 1.00 0.00 C ATOM 809 CD PRO A 53 11.169 -13.576 -18.806 1.00 0.00 C ATOM 0 HA PRO A 53 12.265 -12.956 -15.886 1.00 0.00 H new ATOM 0 HB2 PRO A 53 14.036 -13.497 -18.272 1.00 0.00 H new ATOM 0 HB3 PRO A 53 13.705 -14.556 -16.915 1.00 0.00 H new ATOM 0 HG2 PRO A 53 12.652 -15.034 -19.339 1.00 0.00 H new ATOM 0 HG3 PRO A 53 11.768 -15.415 -17.875 1.00 0.00 H new ATOM 0 HD2 PRO A 53 11.366 -13.131 -19.781 1.00 0.00 H new ATOM 0 HD3 PRO A 53 10.173 -14.017 -18.852 1.00 0.00 H new ATOM 817 N GLN A 54 13.138 -10.625 -17.915 1.00 0.00 N ATOM 818 CA GLN A 54 13.888 -9.383 -18.027 1.00 0.00 C ATOM 819 C GLN A 54 13.132 -8.227 -17.375 1.00 0.00 C ATOM 820 O GLN A 54 13.621 -7.610 -16.430 1.00 0.00 O ATOM 821 CB GLN A 54 14.167 -9.055 -19.496 1.00 0.00 C ATOM 822 CG GLN A 54 14.955 -7.765 -19.686 1.00 0.00 C ATOM 823 CD GLN A 54 15.110 -7.375 -21.143 1.00 0.00 C ATOM 824 OE1 GLN A 54 15.156 -8.226 -22.030 1.00 0.00 O ATOM 825 NE2 GLN A 54 15.182 -6.077 -21.398 1.00 0.00 N ATOM 0 H GLN A 54 12.451 -10.770 -18.655 1.00 0.00 H new ATOM 0 HA GLN A 54 14.836 -9.518 -17.505 1.00 0.00 H new ATOM 0 HB2 GLN A 54 14.719 -9.880 -19.947 1.00 0.00 H new ATOM 0 HB3 GLN A 54 13.220 -8.976 -20.030 1.00 0.00 H new ATOM 0 HG2 GLN A 54 14.455 -6.958 -19.151 1.00 0.00 H new ATOM 0 HG3 GLN A 54 15.943 -7.880 -19.239 1.00 0.00 H new ATOM 0 HE21 GLN A 54 15.140 -5.404 -20.633 1.00 0.00 H new ATOM 0 HE22 GLN A 54 15.279 -5.751 -22.360 1.00 0.00 H new ATOM 834 N ASN A 55 11.940 -7.938 -17.881 1.00 0.00 N ATOM 835 CA ASN A 55 11.174 -6.792 -17.409 1.00 0.00 C ATOM 836 C ASN A 55 9.905 -7.255 -16.699 1.00 0.00 C ATOM 837 O ASN A 55 9.288 -8.248 -17.096 1.00 0.00 O ATOM 838 CB ASN A 55 10.808 -5.883 -18.587 1.00 0.00 C ATOM 839 CG ASN A 55 10.524 -4.450 -18.167 1.00 0.00 C ATOM 840 OD1 ASN A 55 10.148 -4.179 -17.027 1.00 0.00 O ATOM 841 ND2 ASN A 55 10.677 -3.521 -19.098 1.00 0.00 N ATOM 0 H ASN A 55 11.484 -8.479 -18.616 1.00 0.00 H new ATOM 0 HA ASN A 55 11.787 -6.233 -16.702 1.00 0.00 H new ATOM 0 HB2 ASN A 55 11.624 -5.889 -19.310 1.00 0.00 H new ATOM 0 HB3 ASN A 55 9.931 -6.288 -19.092 1.00 0.00 H new ATOM 0 HD21 ASN A 55 10.481 -2.544 -18.880 1.00 0.00 H new ATOM 0 HD22 ASN A 55 10.991 -3.782 -20.033 1.00 0.00 H new ATOM 848 N SER A 56 9.517 -6.535 -15.658 1.00 0.00 N ATOM 849 CA SER A 56 8.330 -6.873 -14.884 1.00 0.00 C ATOM 850 C SER A 56 7.055 -6.505 -15.646 1.00 0.00 C ATOM 851 O SER A 56 7.113 -5.891 -16.717 1.00 0.00 O ATOM 852 CB SER A 56 8.371 -6.148 -13.540 1.00 0.00 C ATOM 853 OG SER A 56 9.550 -6.476 -12.816 1.00 0.00 O ATOM 0 H SER A 56 10.011 -5.706 -15.327 1.00 0.00 H new ATOM 0 HA SER A 56 8.320 -7.950 -14.714 1.00 0.00 H new ATOM 0 HB2 SER A 56 8.329 -5.071 -13.703 1.00 0.00 H new ATOM 0 HB3 SER A 56 7.493 -6.416 -12.952 1.00 0.00 H new ATOM 0 HG SER A 56 9.316 -6.687 -11.888 1.00 0.00 H new ATOM 859 N GLY A 57 5.907 -6.874 -15.092 1.00 0.00 N ATOM 860 CA GLY A 57 4.646 -6.614 -15.756 1.00 0.00 C ATOM 861 C GLY A 57 3.623 -5.990 -14.830 1.00 0.00 C ATOM 862 O GLY A 57 3.979 -5.400 -13.807 1.00 0.00 O ATOM 0 H GLY A 57 5.828 -7.349 -14.193 1.00 0.00 H new ATOM 0 HA2 GLY A 57 4.815 -5.951 -16.605 1.00 0.00 H new ATOM 0 HA3 GLY A 57 4.249 -7.548 -16.155 1.00 0.00 H new ATOM 866 N LEU A 58 2.353 -6.135 -15.177 1.00 0.00 N ATOM 867 CA LEU A 58 1.270 -5.536 -14.409 1.00 0.00 C ATOM 868 C LEU A 58 0.204 -6.573 -14.091 1.00 0.00 C ATOM 869 O LEU A 58 -0.220 -7.324 -14.972 1.00 0.00 O ATOM 870 CB LEU A 58 0.633 -4.381 -15.188 1.00 0.00 C ATOM 871 CG LEU A 58 1.540 -3.183 -15.462 1.00 0.00 C ATOM 872 CD1 LEU A 58 0.836 -2.182 -16.365 1.00 0.00 C ATOM 873 CD2 LEU A 58 1.954 -2.520 -14.160 1.00 0.00 C ATOM 0 H LEU A 58 2.045 -6.666 -15.991 1.00 0.00 H new ATOM 0 HA LEU A 58 1.690 -5.154 -13.478 1.00 0.00 H new ATOM 0 HB2 LEU A 58 0.273 -4.766 -16.142 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -0.240 -4.033 -14.636 1.00 0.00 H new ATOM 0 HG LEU A 58 2.437 -3.538 -15.969 1.00 0.00 H new ATOM 0 HD11 LEU A 58 1.495 -1.334 -16.551 1.00 0.00 H new ATOM 0 HD12 LEU A 58 0.584 -2.660 -17.311 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -0.076 -1.833 -15.880 1.00 0.00 H new ATOM 0 HD21 LEU A 58 2.600 -1.669 -14.375 1.00 0.00 H new ATOM 0 HD22 LEU A 58 1.067 -2.177 -13.628 1.00 0.00 H new ATOM 0 HD23 LEU A 58 2.493 -3.238 -13.542 1.00 0.00 H new ATOM 885 N VAL A 59 -0.224 -6.613 -12.840 1.00 0.00 N ATOM 886 CA VAL A 59 -1.287 -7.515 -12.427 1.00 0.00 C ATOM 887 C VAL A 59 -2.496 -6.733 -11.938 1.00 0.00 C ATOM 888 O VAL A 59 -2.364 -5.641 -11.380 1.00 0.00 O ATOM 889 CB VAL A 59 -0.836 -8.495 -11.323 1.00 0.00 C ATOM 890 CG1 VAL A 59 0.221 -9.449 -11.853 1.00 0.00 C ATOM 891 CG2 VAL A 59 -0.327 -7.741 -10.100 1.00 0.00 C ATOM 0 H VAL A 59 0.149 -6.030 -12.091 1.00 0.00 H new ATOM 0 HA VAL A 59 -1.554 -8.100 -13.307 1.00 0.00 H new ATOM 0 HB VAL A 59 -1.701 -9.083 -11.016 1.00 0.00 H new ATOM 0 HG11 VAL A 59 0.526 -10.132 -11.060 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -0.189 -10.020 -12.686 1.00 0.00 H new ATOM 0 HG13 VAL A 59 1.086 -8.880 -12.194 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -0.015 -8.454 -9.337 1.00 0.00 H new ATOM 0 HG22 VAL A 59 0.522 -7.119 -10.383 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -1.123 -7.110 -9.704 1.00 0.00 H new ATOM 901 N LYS A 60 -3.666 -7.292 -12.163 1.00 0.00 N ATOM 902 CA LYS A 60 -4.909 -6.664 -11.763 1.00 0.00 C ATOM 903 C LYS A 60 -5.565 -7.475 -10.656 1.00 0.00 C ATOM 904 O LYS A 60 -5.870 -8.657 -10.831 1.00 0.00 O ATOM 905 CB LYS A 60 -5.839 -6.546 -12.971 1.00 0.00 C ATOM 906 CG LYS A 60 -7.115 -5.768 -12.701 1.00 0.00 C ATOM 907 CD LYS A 60 -7.998 -5.721 -13.935 1.00 0.00 C ATOM 908 CE LYS A 60 -9.269 -4.924 -13.693 1.00 0.00 C ATOM 909 NZ LYS A 60 -10.184 -4.988 -14.859 1.00 0.00 N ATOM 0 H LYS A 60 -3.783 -8.193 -12.627 1.00 0.00 H new ATOM 0 HA LYS A 60 -4.705 -5.663 -11.382 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -5.299 -6.064 -13.786 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -6.103 -7.547 -13.312 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -7.659 -6.231 -11.878 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -6.867 -4.754 -12.389 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -7.443 -5.277 -14.762 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -8.258 -6.736 -14.234 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -9.778 -5.309 -12.809 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -9.014 -3.885 -13.487 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -11.041 -4.433 -14.659 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -9.707 -4.598 -15.697 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -10.447 -5.978 -15.040 1.00 0.00 H new ATOM 923 N VAL A 61 -5.750 -6.843 -9.507 1.00 0.00 N ATOM 924 CA VAL A 61 -6.413 -7.473 -8.380 1.00 0.00 C ATOM 925 C VAL A 61 -7.761 -6.803 -8.148 1.00 0.00 C ATOM 926 O VAL A 61 -7.863 -5.832 -7.396 1.00 0.00 O ATOM 927 CB VAL A 61 -5.561 -7.399 -7.093 1.00 0.00 C ATOM 928 CG1 VAL A 61 -6.240 -8.147 -5.953 1.00 0.00 C ATOM 929 CG2 VAL A 61 -4.168 -7.958 -7.340 1.00 0.00 C ATOM 0 H VAL A 61 -5.446 -5.885 -9.332 1.00 0.00 H new ATOM 0 HA VAL A 61 -6.554 -8.527 -8.619 1.00 0.00 H new ATOM 0 HB VAL A 61 -5.467 -6.351 -6.808 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -5.623 -8.082 -5.057 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -7.215 -7.702 -5.755 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -6.369 -9.193 -6.230 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -3.583 -7.897 -6.422 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -4.244 -8.999 -7.653 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -3.677 -7.379 -8.122 1.00 0.00 H new ATOM 939 N ASP A 62 -8.771 -7.307 -8.855 1.00 0.00 N ATOM 940 CA ASP A 62 -10.140 -6.786 -8.795 1.00 0.00 C ATOM 941 C ASP A 62 -10.169 -5.259 -8.854 1.00 0.00 C ATOM 942 O ASP A 62 -10.405 -4.574 -7.856 1.00 0.00 O ATOM 943 CB ASP A 62 -10.861 -7.302 -7.552 1.00 0.00 C ATOM 944 CG ASP A 62 -12.339 -6.970 -7.549 1.00 0.00 C ATOM 945 OD1 ASP A 62 -13.064 -7.458 -8.444 1.00 0.00 O ATOM 946 OD2 ASP A 62 -12.787 -6.239 -6.642 1.00 0.00 O ATOM 0 H ASP A 62 -8.663 -8.096 -9.492 1.00 0.00 H new ATOM 0 HA ASP A 62 -10.670 -7.152 -9.674 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -10.736 -8.383 -7.488 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -10.396 -6.874 -6.664 1.00 0.00 H new ATOM 952 N GLY A 63 -9.896 -4.743 -10.036 1.00 0.00 N ATOM 953 CA GLY A 63 -9.892 -3.308 -10.246 1.00 0.00 C ATOM 954 C GLY A 63 -8.504 -2.702 -10.161 1.00 0.00 C ATOM 955 O GLY A 63 -8.098 -1.945 -11.045 1.00 0.00 O ATOM 0 H GLY A 63 -9.674 -5.295 -10.865 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -10.320 -3.088 -11.224 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -10.535 -2.836 -9.504 1.00 0.00 H new ATOM 959 N GLU A 64 -7.764 -3.055 -9.121 1.00 0.00 N ATOM 960 CA GLU A 64 -6.465 -2.450 -8.865 1.00 0.00 C ATOM 961 C GLU A 64 -5.402 -3.057 -9.768 1.00 0.00 C ATOM 962 O GLU A 64 -5.341 -4.272 -9.927 1.00 0.00 O ATOM 963 CB GLU A 64 -6.066 -2.645 -7.403 1.00 0.00 C ATOM 964 CG GLU A 64 -7.039 -2.032 -6.409 1.00 0.00 C ATOM 965 CD GLU A 64 -7.161 -0.534 -6.581 1.00 0.00 C ATOM 966 OE1 GLU A 64 -8.143 -0.081 -7.202 1.00 0.00 O ATOM 967 OE2 GLU A 64 -6.274 0.200 -6.099 1.00 0.00 O ATOM 0 H GLU A 64 -8.042 -3.760 -8.438 1.00 0.00 H new ATOM 0 HA GLU A 64 -6.541 -1.384 -9.077 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -5.980 -3.712 -7.200 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -5.079 -2.210 -7.245 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -8.020 -2.492 -6.532 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -6.708 -2.254 -5.394 1.00 0.00 H new ATOM 975 N THR A 65 -4.579 -2.214 -10.367 1.00 0.00 N ATOM 976 CA THR A 65 -3.510 -2.683 -11.233 1.00 0.00 C ATOM 977 C THR A 65 -2.151 -2.264 -10.682 1.00 0.00 C ATOM 978 O THR A 65 -1.811 -1.077 -10.657 1.00 0.00 O ATOM 979 CB THR A 65 -3.684 -2.142 -12.658 1.00 0.00 C ATOM 980 OG1 THR A 65 -5.070 -2.213 -13.018 1.00 0.00 O ATOM 981 CG2 THR A 65 -2.852 -2.944 -13.651 1.00 0.00 C ATOM 0 H THR A 65 -4.630 -1.200 -10.270 1.00 0.00 H new ATOM 0 HA THR A 65 -3.558 -3.771 -11.265 1.00 0.00 H new ATOM 0 HB THR A 65 -3.342 -1.108 -12.687 1.00 0.00 H new ATOM 0 HG1 THR A 65 -5.190 -1.867 -13.927 1.00 0.00 H new ATOM 0 HG21 THR A 65 -2.993 -2.540 -14.654 1.00 0.00 H new ATOM 0 HG22 THR A 65 -1.799 -2.879 -13.379 1.00 0.00 H new ATOM 0 HG23 THR A 65 -3.168 -3.987 -13.632 1.00 0.00 H new ATOM 989 N TRP A 66 -1.383 -3.244 -10.242 1.00 0.00 N ATOM 990 CA TRP A 66 -0.104 -2.996 -9.593 1.00 0.00 C ATOM 991 C TRP A 66 1.045 -3.529 -10.442 1.00 0.00 C ATOM 992 O TRP A 66 0.850 -4.418 -11.276 1.00 0.00 O ATOM 993 CB TRP A 66 -0.063 -3.671 -8.214 1.00 0.00 C ATOM 994 CG TRP A 66 -1.156 -3.236 -7.280 1.00 0.00 C ATOM 995 CD1 TRP A 66 -2.381 -3.821 -7.117 1.00 0.00 C ATOM 996 CD2 TRP A 66 -1.118 -2.127 -6.373 1.00 0.00 C ATOM 997 NE1 TRP A 66 -3.106 -3.138 -6.169 1.00 0.00 N ATOM 998 CE2 TRP A 66 -2.352 -2.096 -5.698 1.00 0.00 C ATOM 999 CE3 TRP A 66 -0.162 -1.155 -6.069 1.00 0.00 C ATOM 1000 CZ2 TRP A 66 -2.652 -1.135 -4.735 1.00 0.00 C ATOM 1001 CZ3 TRP A 66 -0.461 -0.202 -5.113 1.00 0.00 C ATOM 1002 CH2 TRP A 66 -1.698 -0.197 -4.458 1.00 0.00 C ATOM 0 H TRP A 66 -1.625 -4.232 -10.323 1.00 0.00 H new ATOM 0 HA TRP A 66 0.007 -1.918 -9.475 1.00 0.00 H new ATOM 0 HB2 TRP A 66 -0.125 -4.751 -8.349 1.00 0.00 H new ATOM 0 HB3 TRP A 66 0.901 -3.463 -7.749 1.00 0.00 H new ATOM 0 HD1 TRP A 66 -2.728 -4.691 -7.654 1.00 0.00 H new ATOM 0 HE1 TRP A 66 -4.052 -3.370 -5.866 1.00 0.00 H new ATOM 0 HE3 TRP A 66 0.794 -1.148 -6.572 1.00 0.00 H new ATOM 0 HZ2 TRP A 66 -3.604 -1.132 -4.226 1.00 0.00 H new ATOM 0 HZ3 TRP A 66 0.273 0.552 -4.867 1.00 0.00 H new ATOM 0 HH2 TRP A 66 -1.902 0.563 -3.719 1.00 0.00 H new ATOM 1013 N ARG A 67 2.237 -2.984 -10.230 1.00 0.00 N ATOM 1014 CA ARG A 67 3.435 -3.504 -10.870 1.00 0.00 C ATOM 1015 C ARG A 67 3.830 -4.811 -10.211 1.00 0.00 C ATOM 1016 O ARG A 67 3.839 -4.917 -8.982 1.00 0.00 O ATOM 1017 CB ARG A 67 4.598 -2.520 -10.775 1.00 0.00 C ATOM 1018 CG ARG A 67 4.557 -1.387 -11.788 1.00 0.00 C ATOM 1019 CD ARG A 67 3.430 -0.412 -11.511 1.00 0.00 C ATOM 1020 NE ARG A 67 3.592 0.831 -12.269 1.00 0.00 N ATOM 1021 CZ ARG A 67 3.510 2.051 -11.738 1.00 0.00 C ATOM 1022 NH1 ARG A 67 3.265 2.208 -10.444 1.00 0.00 N ATOM 1023 NH2 ARG A 67 3.682 3.121 -12.502 1.00 0.00 N ATOM 0 H ARG A 67 2.398 -2.183 -9.620 1.00 0.00 H new ATOM 0 HA ARG A 67 3.211 -3.662 -11.925 1.00 0.00 H new ATOM 0 HB2 ARG A 67 4.613 -2.092 -9.773 1.00 0.00 H new ATOM 0 HB3 ARG A 67 5.531 -3.069 -10.902 1.00 0.00 H new ATOM 0 HG2 ARG A 67 5.508 -0.854 -11.773 1.00 0.00 H new ATOM 0 HG3 ARG A 67 4.439 -1.801 -12.789 1.00 0.00 H new ATOM 0 HD2 ARG A 67 2.477 -0.874 -11.769 1.00 0.00 H new ATOM 0 HD3 ARG A 67 3.397 -0.187 -10.445 1.00 0.00 H new ATOM 0 HE ARG A 67 3.780 0.758 -13.269 1.00 0.00 H new ATOM 0 HH11 ARG A 67 3.138 1.391 -9.846 1.00 0.00 H new ATOM 0 HH12 ARG A 67 3.204 3.145 -10.047 1.00 0.00 H new ATOM 0 HH21 ARG A 67 3.877 3.011 -13.497 1.00 0.00 H new ATOM 0 HH22 ARG A 67 3.619 4.054 -12.095 1.00 0.00 H new ATOM 1037 N ALA A 68 4.167 -5.794 -11.015 1.00 0.00 N ATOM 1038 CA ALA A 68 4.466 -7.114 -10.491 1.00 0.00 C ATOM 1039 C ALA A 68 5.682 -7.729 -11.156 1.00 0.00 C ATOM 1040 O ALA A 68 5.878 -7.612 -12.367 1.00 0.00 O ATOM 1041 CB ALA A 68 3.267 -8.031 -10.652 1.00 0.00 C ATOM 0 H ALA A 68 4.242 -5.709 -12.029 1.00 0.00 H new ATOM 0 HA ALA A 68 4.693 -6.997 -9.431 1.00 0.00 H new ATOM 0 HB1 ALA A 68 3.507 -9.017 -10.254 1.00 0.00 H new ATOM 0 HB2 ALA A 68 2.417 -7.618 -10.109 1.00 0.00 H new ATOM 0 HB3 ALA A 68 3.015 -8.118 -11.709 1.00 0.00 H new ATOM 1047 N THR A 69 6.483 -8.392 -10.348 1.00 0.00 N ATOM 1048 CA THR A 69 7.632 -9.136 -10.817 1.00 0.00 C ATOM 1049 C THR A 69 7.409 -10.617 -10.529 1.00 0.00 C ATOM 1050 O THR A 69 6.540 -10.968 -9.731 1.00 0.00 O ATOM 1051 CB THR A 69 8.916 -8.659 -10.112 1.00 0.00 C ATOM 1052 OG1 THR A 69 8.910 -7.228 -10.010 1.00 0.00 O ATOM 1053 CG2 THR A 69 10.162 -9.092 -10.866 1.00 0.00 C ATOM 0 H THR A 69 6.353 -8.429 -9.337 1.00 0.00 H new ATOM 0 HA THR A 69 7.750 -8.973 -11.888 1.00 0.00 H new ATOM 0 HB THR A 69 8.936 -9.111 -9.121 1.00 0.00 H new ATOM 0 HG1 THR A 69 9.727 -6.929 -9.560 1.00 0.00 H new ATOM 0 HG21 THR A 69 11.048 -8.738 -10.339 1.00 0.00 H new ATOM 0 HG22 THR A 69 10.189 -10.180 -10.930 1.00 0.00 H new ATOM 0 HG23 THR A 69 10.144 -8.670 -11.871 1.00 0.00 H new ATOM 1061 N SER A 70 8.189 -11.474 -11.161 1.00 0.00 N ATOM 1062 CA SER A 70 8.024 -12.908 -11.006 1.00 0.00 C ATOM 1063 C SER A 70 9.294 -13.626 -11.428 1.00 0.00 C ATOM 1064 O SER A 70 10.146 -13.048 -12.109 1.00 0.00 O ATOM 1065 CB SER A 70 6.839 -13.400 -11.848 1.00 0.00 C ATOM 1066 OG SER A 70 6.608 -14.789 -11.660 1.00 0.00 O ATOM 0 H SER A 70 8.945 -11.201 -11.789 1.00 0.00 H new ATOM 0 HA SER A 70 7.824 -13.127 -9.957 1.00 0.00 H new ATOM 0 HB2 SER A 70 5.943 -12.841 -11.578 1.00 0.00 H new ATOM 0 HB3 SER A 70 7.033 -13.202 -12.902 1.00 0.00 H new ATOM 0 HG SER A 70 6.857 -15.041 -10.746 1.00 0.00 H new ATOM 1072 N GLY A 71 9.424 -14.874 -11.010 1.00 0.00 N ATOM 1073 CA GLY A 71 10.535 -15.686 -11.442 1.00 0.00 C ATOM 1074 C GLY A 71 10.123 -16.612 -12.563 1.00 0.00 C ATOM 1075 O GLY A 71 10.906 -17.446 -13.018 1.00 0.00 O ATOM 0 H GLY A 71 8.775 -15.339 -10.376 1.00 0.00 H new ATOM 0 HA2 GLY A 71 11.351 -15.045 -11.776 1.00 0.00 H new ATOM 0 HA3 GLY A 71 10.912 -16.270 -10.602 1.00 0.00 H new ATOM 1079 N THR A 72 8.885 -16.457 -13.011 1.00 0.00 N ATOM 1080 CA THR A 72 8.343 -17.289 -14.068 1.00 0.00 C ATOM 1081 C THR A 72 7.956 -16.427 -15.270 1.00 0.00 C ATOM 1082 O THR A 72 7.885 -15.202 -15.168 1.00 0.00 O ATOM 1083 CB THR A 72 7.100 -18.059 -13.576 1.00 0.00 C ATOM 1084 OG1 THR A 72 7.204 -18.309 -12.165 1.00 0.00 O ATOM 1085 CG2 THR A 72 6.952 -19.387 -14.310 1.00 0.00 C ATOM 0 H THR A 72 8.235 -15.756 -12.654 1.00 0.00 H new ATOM 0 HA THR A 72 9.111 -18.005 -14.361 1.00 0.00 H new ATOM 0 HB THR A 72 6.222 -17.446 -13.780 1.00 0.00 H new ATOM 0 HG1 THR A 72 6.411 -18.797 -11.860 1.00 0.00 H new ATOM 0 HG21 THR A 72 6.068 -19.909 -13.943 1.00 0.00 H new ATOM 0 HG22 THR A 72 6.847 -19.202 -15.379 1.00 0.00 H new ATOM 0 HG23 THR A 72 7.835 -20.001 -14.133 1.00 0.00 H new ATOM 1093 N VAL A 73 7.708 -17.070 -16.400 1.00 0.00 N ATOM 1094 CA VAL A 73 7.283 -16.369 -17.601 1.00 0.00 C ATOM 1095 C VAL A 73 5.765 -16.286 -17.631 1.00 0.00 C ATOM 1096 O VAL A 73 5.083 -17.310 -17.714 1.00 0.00 O ATOM 1097 CB VAL A 73 7.787 -17.075 -18.881 1.00 0.00 C ATOM 1098 CG1 VAL A 73 7.381 -16.295 -20.124 1.00 0.00 C ATOM 1099 CG2 VAL A 73 9.296 -17.258 -18.834 1.00 0.00 C ATOM 0 H VAL A 73 7.794 -18.080 -16.511 1.00 0.00 H new ATOM 0 HA VAL A 73 7.713 -15.368 -17.577 1.00 0.00 H new ATOM 0 HB VAL A 73 7.323 -18.060 -18.930 1.00 0.00 H new ATOM 0 HG11 VAL A 73 7.746 -16.810 -21.012 1.00 0.00 H new ATOM 0 HG12 VAL A 73 6.294 -16.221 -20.168 1.00 0.00 H new ATOM 0 HG13 VAL A 73 7.811 -15.294 -20.082 1.00 0.00 H new ATOM 0 HG21 VAL A 73 9.631 -17.757 -19.744 1.00 0.00 H new ATOM 0 HG22 VAL A 73 9.778 -16.284 -18.756 1.00 0.00 H new ATOM 0 HG23 VAL A 73 9.562 -17.865 -17.969 1.00 0.00 H new ATOM 1109 N LEU A 74 5.237 -15.076 -17.542 1.00 0.00 N ATOM 1110 CA LEU A 74 3.798 -14.880 -17.458 1.00 0.00 C ATOM 1111 C LEU A 74 3.294 -14.039 -18.621 1.00 0.00 C ATOM 1112 O LEU A 74 3.737 -12.908 -18.825 1.00 0.00 O ATOM 1113 CB LEU A 74 3.445 -14.199 -16.138 1.00 0.00 C ATOM 1114 CG LEU A 74 3.975 -14.906 -14.892 1.00 0.00 C ATOM 1115 CD1 LEU A 74 3.743 -14.061 -13.653 1.00 0.00 C ATOM 1116 CD2 LEU A 74 3.323 -16.270 -14.733 1.00 0.00 C ATOM 0 H LEU A 74 5.783 -14.215 -17.526 1.00 0.00 H new ATOM 0 HA LEU A 74 3.316 -15.856 -17.506 1.00 0.00 H new ATOM 0 HB2 LEU A 74 3.835 -13.181 -16.155 1.00 0.00 H new ATOM 0 HB3 LEU A 74 2.360 -14.124 -16.063 1.00 0.00 H new ATOM 0 HG LEU A 74 5.049 -15.048 -15.014 1.00 0.00 H new ATOM 0 HD11 LEU A 74 4.128 -14.585 -12.778 1.00 0.00 H new ATOM 0 HD12 LEU A 74 4.259 -13.107 -13.761 1.00 0.00 H new ATOM 0 HD13 LEU A 74 2.675 -13.884 -13.528 1.00 0.00 H new ATOM 0 HD21 LEU A 74 3.713 -16.758 -13.840 1.00 0.00 H new ATOM 0 HD22 LEU A 74 2.244 -16.149 -14.638 1.00 0.00 H new ATOM 0 HD23 LEU A 74 3.543 -16.883 -15.607 1.00 0.00 H new ATOM 1128 N ASP A 75 2.358 -14.596 -19.369 1.00 0.00 N ATOM 1129 CA ASP A 75 1.790 -13.909 -20.522 1.00 0.00 C ATOM 1130 C ASP A 75 0.581 -13.094 -20.085 1.00 0.00 C ATOM 1131 O ASP A 75 0.170 -13.144 -18.926 1.00 0.00 O ATOM 1132 CB ASP A 75 1.366 -14.922 -21.592 1.00 0.00 C ATOM 1133 CG ASP A 75 1.427 -14.375 -23.011 1.00 0.00 C ATOM 1134 OD1 ASP A 75 0.885 -13.281 -23.273 1.00 0.00 O ATOM 1135 OD2 ASP A 75 2.002 -15.057 -23.883 1.00 0.00 O ATOM 0 H ASP A 75 1.972 -15.525 -19.200 1.00 0.00 H new ATOM 0 HA ASP A 75 2.546 -13.247 -20.944 1.00 0.00 H new ATOM 0 HB2 ASP A 75 2.008 -15.800 -21.523 1.00 0.00 H new ATOM 0 HB3 ASP A 75 0.349 -15.253 -21.383 1.00 0.00 H new ATOM 1141 N VAL A 76 0.000 -12.377 -21.024 1.00 0.00 N ATOM 1142 CA VAL A 76 -1.148 -11.528 -20.746 1.00 0.00 C ATOM 1143 C VAL A 76 -2.422 -12.360 -20.753 1.00 0.00 C ATOM 1144 O VAL A 76 -2.624 -13.185 -21.647 1.00 0.00 O ATOM 1145 CB VAL A 76 -1.275 -10.383 -21.777 1.00 0.00 C ATOM 1146 CG1 VAL A 76 -2.464 -9.485 -21.458 1.00 0.00 C ATOM 1147 CG2 VAL A 76 0.009 -9.570 -21.828 1.00 0.00 C ATOM 0 H VAL A 76 0.305 -12.363 -21.997 1.00 0.00 H new ATOM 0 HA VAL A 76 -0.999 -11.083 -19.762 1.00 0.00 H new ATOM 0 HB VAL A 76 -1.445 -10.829 -22.757 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -2.528 -8.689 -22.200 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -3.381 -10.074 -21.478 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -2.335 -9.048 -20.468 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -0.097 -8.768 -22.559 1.00 0.00 H new ATOM 0 HG22 VAL A 76 0.208 -9.142 -20.846 1.00 0.00 H new ATOM 0 HG23 VAL A 76 0.838 -10.217 -22.117 1.00 0.00 H new ATOM 1157 N GLY A 77 -3.265 -12.158 -19.753 1.00 0.00 N ATOM 1158 CA GLY A 77 -4.504 -12.901 -19.667 1.00 0.00 C ATOM 1159 C GLY A 77 -4.395 -14.085 -18.730 1.00 0.00 C ATOM 1160 O GLY A 77 -5.379 -14.788 -18.491 1.00 0.00 O ATOM 0 H GLY A 77 -3.113 -11.491 -18.997 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -5.299 -12.240 -19.324 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -4.786 -13.250 -20.660 1.00 0.00 H new ATOM 1164 N GLU A 78 -3.194 -14.320 -18.214 1.00 0.00 N ATOM 1165 CA GLU A 78 -2.957 -15.403 -17.282 1.00 0.00 C ATOM 1166 C GLU A 78 -3.340 -15.020 -15.863 1.00 0.00 C ATOM 1167 O GLU A 78 -3.625 -13.859 -15.571 1.00 0.00 O ATOM 1168 CB GLU A 78 -1.493 -15.794 -17.317 1.00 0.00 C ATOM 1169 CG GLU A 78 -1.123 -16.604 -18.536 1.00 0.00 C ATOM 1170 CD GLU A 78 -1.848 -17.932 -18.600 1.00 0.00 C ATOM 1171 OE1 GLU A 78 -1.381 -18.899 -17.964 1.00 0.00 O ATOM 1172 OE2 GLU A 78 -2.877 -18.022 -19.297 1.00 0.00 O ATOM 0 H GLU A 78 -2.366 -13.766 -18.431 1.00 0.00 H new ATOM 0 HA GLU A 78 -3.581 -16.244 -17.585 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -0.882 -14.892 -17.289 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -1.255 -16.368 -16.421 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -1.351 -16.027 -19.433 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -0.048 -16.782 -18.536 1.00 0.00 H new ATOM 1180 N GLU A 79 -3.317 -16.005 -14.981 1.00 0.00 N ATOM 1181 CA GLU A 79 -3.668 -15.789 -13.584 1.00 0.00 C ATOM 1182 C GLU A 79 -2.509 -16.192 -12.681 1.00 0.00 C ATOM 1183 O GLU A 79 -1.882 -17.236 -12.882 1.00 0.00 O ATOM 1184 CB GLU A 79 -4.932 -16.570 -13.219 1.00 0.00 C ATOM 1185 CG GLU A 79 -6.124 -16.230 -14.102 1.00 0.00 C ATOM 1186 CD GLU A 79 -7.420 -16.830 -13.600 1.00 0.00 C ATOM 1187 OE1 GLU A 79 -7.601 -18.058 -13.725 1.00 0.00 O ATOM 1188 OE2 GLU A 79 -8.274 -16.070 -13.090 1.00 0.00 O ATOM 0 H GLU A 79 -3.058 -16.965 -15.207 1.00 0.00 H new ATOM 0 HA GLU A 79 -3.870 -14.728 -13.437 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -4.726 -17.638 -13.294 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -5.189 -16.367 -12.179 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -6.230 -15.147 -14.160 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -5.933 -16.586 -15.114 1.00 0.00 H new ATOM 1196 N VAL A 80 -2.217 -15.348 -11.703 1.00 0.00 N ATOM 1197 CA VAL A 80 -1.091 -15.562 -10.797 1.00 0.00 C ATOM 1198 C VAL A 80 -1.513 -15.309 -9.360 1.00 0.00 C ATOM 1199 O VAL A 80 -2.686 -15.064 -9.083 1.00 0.00 O ATOM 1200 CB VAL A 80 0.090 -14.633 -11.148 1.00 0.00 C ATOM 1201 CG1 VAL A 80 0.641 -14.967 -12.523 1.00 0.00 C ATOM 1202 CG2 VAL A 80 -0.335 -13.175 -11.081 1.00 0.00 C ATOM 0 H VAL A 80 -2.749 -14.499 -11.513 1.00 0.00 H new ATOM 0 HA VAL A 80 -0.770 -16.598 -10.908 1.00 0.00 H new ATOM 0 HB VAL A 80 0.880 -14.792 -10.414 1.00 0.00 H new ATOM 0 HG11 VAL A 80 1.473 -14.302 -12.753 1.00 0.00 H new ATOM 0 HG12 VAL A 80 0.989 -16.000 -12.535 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -0.143 -14.840 -13.270 1.00 0.00 H new ATOM 0 HG21 VAL A 80 0.512 -12.537 -11.332 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -1.144 -12.999 -11.790 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -0.679 -12.942 -10.073 1.00 0.00 H new ATOM 1212 N SER A 81 -0.566 -15.398 -8.449 1.00 0.00 N ATOM 1213 CA SER A 81 -0.832 -15.091 -7.050 1.00 0.00 C ATOM 1214 C SER A 81 0.317 -14.295 -6.443 1.00 0.00 C ATOM 1215 O SER A 81 1.484 -14.537 -6.755 1.00 0.00 O ATOM 1216 CB SER A 81 -1.069 -16.381 -6.266 1.00 0.00 C ATOM 1217 OG SER A 81 -2.184 -17.084 -6.788 1.00 0.00 O ATOM 0 H SER A 81 0.394 -15.679 -8.647 1.00 0.00 H new ATOM 0 HA SER A 81 -1.732 -14.478 -6.994 1.00 0.00 H new ATOM 0 HB2 SER A 81 -0.180 -17.010 -6.314 1.00 0.00 H new ATOM 0 HB3 SER A 81 -1.239 -16.148 -5.215 1.00 0.00 H new ATOM 0 HG SER A 81 -2.399 -17.838 -6.201 1.00 0.00 H new ATOM 1223 N VAL A 82 -0.026 -13.336 -5.591 1.00 0.00 N ATOM 1224 CA VAL A 82 0.965 -12.488 -4.942 1.00 0.00 C ATOM 1225 C VAL A 82 1.497 -13.170 -3.687 1.00 0.00 C ATOM 1226 O VAL A 82 0.753 -13.392 -2.730 1.00 0.00 O ATOM 1227 CB VAL A 82 0.364 -11.117 -4.558 1.00 0.00 C ATOM 1228 CG1 VAL A 82 1.442 -10.186 -4.030 1.00 0.00 C ATOM 1229 CG2 VAL A 82 -0.361 -10.490 -5.743 1.00 0.00 C ATOM 0 H VAL A 82 -0.990 -13.126 -5.333 1.00 0.00 H new ATOM 0 HA VAL A 82 1.778 -12.327 -5.650 1.00 0.00 H new ATOM 0 HB VAL A 82 -0.365 -11.278 -3.764 1.00 0.00 H new ATOM 0 HG11 VAL A 82 0.997 -9.227 -3.766 1.00 0.00 H new ATOM 0 HG12 VAL A 82 1.903 -10.628 -3.147 1.00 0.00 H new ATOM 0 HG13 VAL A 82 2.200 -10.035 -4.798 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -0.775 -9.526 -5.448 1.00 0.00 H new ATOM 0 HG22 VAL A 82 0.341 -10.347 -6.565 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -1.168 -11.148 -6.065 1.00 0.00 H new ATOM 1239 N LYS A 83 2.778 -13.508 -3.692 1.00 0.00 N ATOM 1240 CA LYS A 83 3.371 -14.251 -2.603 1.00 0.00 C ATOM 1241 C LYS A 83 4.245 -13.378 -1.709 1.00 0.00 C ATOM 1242 O LYS A 83 4.390 -13.649 -0.512 1.00 0.00 O ATOM 1243 CB LYS A 83 4.174 -15.399 -3.176 1.00 0.00 C ATOM 1244 CG LYS A 83 3.295 -16.522 -3.686 1.00 0.00 C ATOM 1245 CD LYS A 83 4.123 -17.664 -4.220 1.00 0.00 C ATOM 1246 CE LYS A 83 3.251 -18.799 -4.733 1.00 0.00 C ATOM 1247 NZ LYS A 83 2.409 -19.383 -3.653 1.00 0.00 N ATOM 0 H LYS A 83 3.425 -13.275 -4.445 1.00 0.00 H new ATOM 0 HA LYS A 83 2.568 -14.631 -1.971 1.00 0.00 H new ATOM 0 HB2 LYS A 83 4.798 -15.031 -3.991 1.00 0.00 H new ATOM 0 HB3 LYS A 83 4.846 -15.787 -2.410 1.00 0.00 H new ATOM 0 HG2 LYS A 83 2.654 -16.880 -2.880 1.00 0.00 H new ATOM 0 HG3 LYS A 83 2.640 -16.146 -4.472 1.00 0.00 H new ATOM 0 HD2 LYS A 83 4.763 -17.304 -5.026 1.00 0.00 H new ATOM 0 HD3 LYS A 83 4.780 -18.036 -3.434 1.00 0.00 H new ATOM 0 HE2 LYS A 83 2.610 -18.431 -5.534 1.00 0.00 H new ATOM 0 HE3 LYS A 83 3.883 -19.577 -5.162 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 2.013 -20.290 -3.973 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 2.991 -19.540 -2.805 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 1.634 -18.728 -3.425 1.00 0.00 H new ATOM 1261 N ALA A 84 4.825 -12.331 -2.287 1.00 0.00 N ATOM 1262 CA ALA A 84 5.717 -11.448 -1.541 1.00 0.00 C ATOM 1263 C ALA A 84 5.700 -10.031 -2.106 1.00 0.00 C ATOM 1264 O ALA A 84 5.054 -9.766 -3.120 1.00 0.00 O ATOM 1265 CB ALA A 84 7.135 -11.994 -1.555 1.00 0.00 C ATOM 0 H ALA A 84 4.695 -12.073 -3.265 1.00 0.00 H new ATOM 0 HA ALA A 84 5.358 -11.407 -0.513 1.00 0.00 H new ATOM 0 HB1 ALA A 84 7.788 -11.325 -0.995 1.00 0.00 H new ATOM 0 HB2 ALA A 84 7.149 -12.983 -1.096 1.00 0.00 H new ATOM 0 HB3 ALA A 84 7.487 -12.067 -2.584 1.00 0.00 H new ATOM 1271 N ILE A 85 6.413 -9.127 -1.440 1.00 0.00 N ATOM 1272 CA ILE A 85 6.508 -7.737 -1.877 1.00 0.00 C ATOM 1273 C ILE A 85 7.970 -7.309 -1.946 1.00 0.00 C ATOM 1274 O ILE A 85 8.767 -7.658 -1.073 1.00 0.00 O ATOM 1275 CB ILE A 85 5.756 -6.788 -0.912 1.00 0.00 C ATOM 1276 CG1 ILE A 85 4.330 -7.286 -0.685 1.00 0.00 C ATOM 1277 CG2 ILE A 85 5.738 -5.365 -1.467 1.00 0.00 C ATOM 1278 CD1 ILE A 85 3.540 -6.448 0.298 1.00 0.00 C ATOM 0 H ILE A 85 6.937 -9.334 -0.590 1.00 0.00 H new ATOM 0 HA ILE A 85 6.049 -7.671 -2.864 1.00 0.00 H new ATOM 0 HB ILE A 85 6.280 -6.780 0.044 1.00 0.00 H new ATOM 0 HG12 ILE A 85 3.804 -7.302 -1.640 1.00 0.00 H new ATOM 0 HG13 ILE A 85 4.367 -8.314 -0.324 1.00 0.00 H new ATOM 0 HG21 ILE A 85 5.205 -4.712 -0.776 1.00 0.00 H new ATOM 0 HG22 ILE A 85 6.761 -5.009 -1.588 1.00 0.00 H new ATOM 0 HG23 ILE A 85 5.235 -5.358 -2.434 1.00 0.00 H new ATOM 0 HD11 ILE A 85 2.538 -6.863 0.407 1.00 0.00 H new ATOM 0 HD12 ILE A 85 4.042 -6.452 1.266 1.00 0.00 H new ATOM 0 HD13 ILE A 85 3.470 -5.424 -0.070 1.00 0.00 H new ATOM 1290 N GLU A 86 8.328 -6.560 -2.980 1.00 0.00 N ATOM 1291 CA GLU A 86 9.681 -6.042 -3.100 1.00 0.00 C ATOM 1292 C GLU A 86 9.652 -4.588 -3.559 1.00 0.00 C ATOM 1293 O GLU A 86 9.489 -4.299 -4.747 1.00 0.00 O ATOM 1294 CB GLU A 86 10.519 -6.895 -4.060 1.00 0.00 C ATOM 1295 CG GLU A 86 11.987 -6.496 -4.091 1.00 0.00 C ATOM 1296 CD GLU A 86 12.838 -7.406 -4.953 1.00 0.00 C ATOM 1297 OE1 GLU A 86 13.274 -8.467 -4.457 1.00 0.00 O ATOM 1298 OE2 GLU A 86 13.103 -7.053 -6.119 1.00 0.00 O ATOM 0 H GLU A 86 7.703 -6.299 -3.743 1.00 0.00 H new ATOM 0 HA GLU A 86 10.150 -6.090 -2.117 1.00 0.00 H new ATOM 0 HB2 GLU A 86 10.440 -7.942 -3.768 1.00 0.00 H new ATOM 0 HB3 GLU A 86 10.105 -6.812 -5.065 1.00 0.00 H new ATOM 0 HG2 GLU A 86 12.071 -5.474 -4.461 1.00 0.00 H new ATOM 0 HG3 GLU A 86 12.379 -6.500 -3.074 1.00 0.00 H new ATOM 1306 N GLY A 87 9.789 -3.677 -2.607 1.00 0.00 N ATOM 1307 CA GLY A 87 9.776 -2.267 -2.928 1.00 0.00 C ATOM 1308 C GLY A 87 8.396 -1.785 -3.309 1.00 0.00 C ATOM 1309 O GLY A 87 7.459 -1.878 -2.519 1.00 0.00 O ATOM 0 H GLY A 87 9.909 -3.891 -1.617 1.00 0.00 H new ATOM 0 HA2 GLY A 87 10.135 -1.697 -2.071 1.00 0.00 H new ATOM 0 HA3 GLY A 87 10.466 -2.076 -3.750 1.00 0.00 H new ATOM 1313 N VAL A 88 8.270 -1.287 -4.528 1.00 0.00 N ATOM 1314 CA VAL A 88 6.997 -0.777 -5.018 1.00 0.00 C ATOM 1315 C VAL A 88 6.338 -1.810 -5.934 1.00 0.00 C ATOM 1316 O VAL A 88 5.256 -1.591 -6.480 1.00 0.00 O ATOM 1317 CB VAL A 88 7.186 0.553 -5.786 1.00 0.00 C ATOM 1318 CG1 VAL A 88 5.854 1.259 -6.009 1.00 0.00 C ATOM 1319 CG2 VAL A 88 8.159 1.471 -5.059 1.00 0.00 C ATOM 0 H VAL A 88 9.035 -1.224 -5.199 1.00 0.00 H new ATOM 0 HA VAL A 88 6.355 -0.589 -4.157 1.00 0.00 H new ATOM 0 HB VAL A 88 7.607 0.309 -6.761 1.00 0.00 H new ATOM 0 HG11 VAL A 88 6.022 2.190 -6.551 1.00 0.00 H new ATOM 0 HG12 VAL A 88 5.194 0.615 -6.590 1.00 0.00 H new ATOM 0 HG13 VAL A 88 5.393 1.478 -5.046 1.00 0.00 H new ATOM 0 HG21 VAL A 88 8.273 2.398 -5.621 1.00 0.00 H new ATOM 0 HG22 VAL A 88 7.774 1.695 -4.064 1.00 0.00 H new ATOM 0 HG23 VAL A 88 9.127 0.978 -4.971 1.00 0.00 H new ATOM 1329 N LYS A 89 7.000 -2.945 -6.094 1.00 0.00 N ATOM 1330 CA LYS A 89 6.496 -4.005 -6.949 1.00 0.00 C ATOM 1331 C LYS A 89 6.102 -5.221 -6.130 1.00 0.00 C ATOM 1332 O LYS A 89 6.586 -5.419 -5.012 1.00 0.00 O ATOM 1333 CB LYS A 89 7.544 -4.402 -7.990 1.00 0.00 C ATOM 1334 CG LYS A 89 7.704 -3.392 -9.119 1.00 0.00 C ATOM 1335 CD LYS A 89 8.768 -3.833 -10.107 1.00 0.00 C ATOM 1336 CE LYS A 89 10.157 -3.722 -9.514 1.00 0.00 C ATOM 1337 NZ LYS A 89 10.598 -2.306 -9.416 1.00 0.00 N ATOM 0 H LYS A 89 7.890 -3.155 -5.641 1.00 0.00 H new ATOM 0 HA LYS A 89 5.612 -3.627 -7.461 1.00 0.00 H new ATOM 0 HB2 LYS A 89 8.505 -4.532 -7.493 1.00 0.00 H new ATOM 0 HB3 LYS A 89 7.272 -5.368 -8.415 1.00 0.00 H new ATOM 0 HG2 LYS A 89 6.753 -3.269 -9.637 1.00 0.00 H new ATOM 0 HG3 LYS A 89 7.970 -2.420 -8.705 1.00 0.00 H new ATOM 0 HD2 LYS A 89 8.581 -4.864 -10.408 1.00 0.00 H new ATOM 0 HD3 LYS A 89 8.706 -3.222 -11.007 1.00 0.00 H new ATOM 0 HE2 LYS A 89 10.168 -4.177 -8.523 1.00 0.00 H new ATOM 0 HE3 LYS A 89 10.862 -4.282 -10.129 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 11.611 -2.273 -9.184 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 10.435 -1.828 -10.325 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 10.057 -1.825 -8.670 1.00 0.00 H new ATOM 1351 N LEU A 90 5.232 -6.037 -6.693 1.00 0.00 N ATOM 1352 CA LEU A 90 4.775 -7.236 -6.020 1.00 0.00 C ATOM 1353 C LEU A 90 5.505 -8.441 -6.571 1.00 0.00 C ATOM 1354 O LEU A 90 5.914 -8.451 -7.727 1.00 0.00 O ATOM 1355 CB LEU A 90 3.269 -7.428 -6.197 1.00 0.00 C ATOM 1356 CG LEU A 90 2.391 -6.356 -5.562 1.00 0.00 C ATOM 1357 CD1 LEU A 90 0.927 -6.611 -5.883 1.00 0.00 C ATOM 1358 CD2 LEU A 90 2.610 -6.322 -4.059 1.00 0.00 C ATOM 0 H LEU A 90 4.827 -5.890 -7.618 1.00 0.00 H new ATOM 0 HA LEU A 90 4.986 -7.129 -4.956 1.00 0.00 H new ATOM 0 HB2 LEU A 90 3.049 -7.468 -7.264 1.00 0.00 H new ATOM 0 HB3 LEU A 90 2.992 -8.395 -5.777 1.00 0.00 H new ATOM 0 HG LEU A 90 2.668 -5.386 -5.975 1.00 0.00 H new ATOM 0 HD11 LEU A 90 0.313 -5.837 -5.422 1.00 0.00 H new ATOM 0 HD12 LEU A 90 0.783 -6.593 -6.963 1.00 0.00 H new ATOM 0 HD13 LEU A 90 0.634 -7.586 -5.494 1.00 0.00 H new ATOM 0 HD21 LEU A 90 1.978 -5.552 -3.616 1.00 0.00 H new ATOM 0 HD22 LEU A 90 2.354 -7.292 -3.632 1.00 0.00 H new ATOM 0 HD23 LEU A 90 3.656 -6.097 -3.849 1.00 0.00 H new ATOM 1370 N VAL A 91 5.670 -9.443 -5.741 1.00 0.00 N ATOM 1371 CA VAL A 91 6.268 -10.690 -6.170 1.00 0.00 C ATOM 1372 C VAL A 91 5.169 -11.713 -6.403 1.00 0.00 C ATOM 1373 O VAL A 91 4.606 -12.271 -5.452 1.00 0.00 O ATOM 1374 CB VAL A 91 7.285 -11.232 -5.140 1.00 0.00 C ATOM 1375 CG1 VAL A 91 7.911 -12.533 -5.627 1.00 0.00 C ATOM 1376 CG2 VAL A 91 8.365 -10.198 -4.861 1.00 0.00 C ATOM 0 H VAL A 91 5.398 -9.421 -4.758 1.00 0.00 H new ATOM 0 HA VAL A 91 6.814 -10.504 -7.095 1.00 0.00 H new ATOM 0 HB VAL A 91 6.750 -11.436 -4.213 1.00 0.00 H new ATOM 0 HG11 VAL A 91 8.623 -12.894 -4.885 1.00 0.00 H new ATOM 0 HG12 VAL A 91 7.131 -13.279 -5.775 1.00 0.00 H new ATOM 0 HG13 VAL A 91 8.428 -12.357 -6.570 1.00 0.00 H new ATOM 0 HG21 VAL A 91 9.072 -10.597 -4.134 1.00 0.00 H new ATOM 0 HG22 VAL A 91 8.891 -9.962 -5.786 1.00 0.00 H new ATOM 0 HG23 VAL A 91 7.907 -9.292 -4.463 1.00 0.00 H new ATOM 1386 N VAL A 92 4.848 -11.936 -7.662 1.00 0.00 N ATOM 1387 CA VAL A 92 3.804 -12.869 -8.026 1.00 0.00 C ATOM 1388 C VAL A 92 4.427 -14.086 -8.668 1.00 0.00 C ATOM 1389 O VAL A 92 5.576 -14.037 -9.103 1.00 0.00 O ATOM 1390 CB VAL A 92 2.770 -12.246 -8.994 1.00 0.00 C ATOM 1391 CG1 VAL A 92 2.103 -11.037 -8.359 1.00 0.00 C ATOM 1392 CG2 VAL A 92 3.417 -11.861 -10.319 1.00 0.00 C ATOM 0 H VAL A 92 5.300 -11.479 -8.454 1.00 0.00 H new ATOM 0 HA VAL A 92 3.273 -13.145 -7.115 1.00 0.00 H new ATOM 0 HB VAL A 92 2.008 -12.998 -9.197 1.00 0.00 H new ATOM 0 HG11 VAL A 92 1.379 -10.613 -9.055 1.00 0.00 H new ATOM 0 HG12 VAL A 92 1.592 -11.341 -7.445 1.00 0.00 H new ATOM 0 HG13 VAL A 92 2.858 -10.288 -8.120 1.00 0.00 H new ATOM 0 HG21 VAL A 92 2.666 -11.426 -10.978 1.00 0.00 H new ATOM 0 HG22 VAL A 92 4.208 -11.133 -10.140 1.00 0.00 H new ATOM 0 HG23 VAL A 92 3.841 -12.749 -10.788 1.00 0.00 H new ATOM 1402 N GLU A 93 3.683 -15.173 -8.720 1.00 0.00 N ATOM 1403 CA GLU A 93 4.181 -16.412 -9.278 1.00 0.00 C ATOM 1404 C GLU A 93 3.044 -17.120 -9.968 1.00 0.00 C ATOM 1405 O GLU A 93 1.883 -16.729 -9.817 1.00 0.00 O ATOM 1406 CB GLU A 93 4.783 -17.313 -8.191 1.00 0.00 C ATOM 1407 CG GLU A 93 6.089 -16.793 -7.604 1.00 0.00 C ATOM 1408 CD GLU A 93 7.275 -16.977 -8.535 1.00 0.00 C ATOM 1409 OE1 GLU A 93 7.991 -17.992 -8.394 1.00 0.00 O ATOM 1410 OE2 GLU A 93 7.517 -16.102 -9.395 1.00 0.00 O ATOM 0 H GLU A 93 2.723 -15.222 -8.379 1.00 0.00 H new ATOM 0 HA GLU A 93 4.974 -16.187 -9.991 1.00 0.00 H new ATOM 0 HB2 GLU A 93 4.056 -17.429 -7.387 1.00 0.00 H new ATOM 0 HB3 GLU A 93 4.955 -18.304 -8.610 1.00 0.00 H new ATOM 0 HG2 GLU A 93 5.979 -15.734 -7.370 1.00 0.00 H new ATOM 0 HG3 GLU A 93 6.289 -17.308 -6.664 1.00 0.00 H new ATOM 1418 N LYS A 94 3.360 -18.155 -10.715 1.00 0.00 N ATOM 1419 CA LYS A 94 2.354 -18.868 -11.457 1.00 0.00 C ATOM 1420 C LYS A 94 1.414 -19.586 -10.508 1.00 0.00 C ATOM 1421 O LYS A 94 1.837 -20.357 -9.646 1.00 0.00 O ATOM 1422 CB LYS A 94 3.012 -19.853 -12.413 1.00 0.00 C ATOM 1423 CG LYS A 94 2.542 -19.734 -13.854 1.00 0.00 C ATOM 1424 CD LYS A 94 1.046 -19.949 -13.988 1.00 0.00 C ATOM 1425 CE LYS A 94 0.593 -19.745 -15.423 1.00 0.00 C ATOM 1426 NZ LYS A 94 -0.867 -19.954 -15.585 1.00 0.00 N ATOM 0 H LYS A 94 4.307 -18.519 -10.822 1.00 0.00 H new ATOM 0 HA LYS A 94 1.771 -18.156 -12.042 1.00 0.00 H new ATOM 0 HB2 LYS A 94 4.092 -19.706 -12.382 1.00 0.00 H new ATOM 0 HB3 LYS A 94 2.818 -20.867 -12.062 1.00 0.00 H new ATOM 0 HG2 LYS A 94 2.802 -18.748 -14.239 1.00 0.00 H new ATOM 0 HG3 LYS A 94 3.069 -20.465 -14.468 1.00 0.00 H new ATOM 0 HD2 LYS A 94 0.789 -20.957 -13.662 1.00 0.00 H new ATOM 0 HD3 LYS A 94 0.516 -19.257 -13.334 1.00 0.00 H new ATOM 0 HE2 LYS A 94 0.852 -18.736 -15.744 1.00 0.00 H new ATOM 0 HE3 LYS A 94 1.131 -20.434 -16.074 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -1.171 -19.580 -16.507 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -1.080 -20.971 -15.536 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -1.375 -19.457 -14.826 1.00 0.00 H new ATOM 1440 N LEU A 95 0.143 -19.295 -10.670 1.00 0.00 N ATOM 1441 CA LEU A 95 -0.902 -19.876 -9.846 1.00 0.00 C ATOM 1442 C LEU A 95 -0.914 -21.394 -9.982 1.00 0.00 C ATOM 1443 O LEU A 95 -0.622 -21.939 -11.052 1.00 0.00 O ATOM 1444 CB LEU A 95 -2.257 -19.292 -10.254 1.00 0.00 C ATOM 1445 CG LEU A 95 -3.476 -19.893 -9.559 1.00 0.00 C ATOM 1446 CD1 LEU A 95 -3.460 -19.605 -8.067 1.00 0.00 C ATOM 1447 CD2 LEU A 95 -4.755 -19.373 -10.193 1.00 0.00 C ATOM 0 H LEU A 95 -0.200 -18.647 -11.379 1.00 0.00 H new ATOM 0 HA LEU A 95 -0.706 -19.633 -8.802 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -2.243 -18.220 -10.059 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -2.377 -19.418 -11.330 1.00 0.00 H new ATOM 0 HG LEU A 95 -3.438 -20.975 -9.687 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -4.341 -20.046 -7.602 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -2.562 -20.034 -7.623 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -3.465 -18.527 -7.904 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -5.616 -19.810 -9.687 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -4.792 -18.288 -10.100 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -4.776 -19.648 -11.248 1.00 0.00 H new ATOM 1459 N GLU A 96 -1.232 -22.068 -8.892 1.00 0.00 N ATOM 1460 CA GLU A 96 -1.347 -23.513 -8.898 1.00 0.00 C ATOM 1461 C GLU A 96 -2.683 -23.915 -9.508 1.00 0.00 C ATOM 1462 O GLU A 96 -3.719 -23.931 -8.844 1.00 0.00 O ATOM 1463 CB GLU A 96 -1.172 -24.088 -7.488 1.00 0.00 C ATOM 1464 CG GLU A 96 -1.988 -23.384 -6.415 1.00 0.00 C ATOM 1465 CD GLU A 96 -1.721 -23.942 -5.033 1.00 0.00 C ATOM 1466 OE1 GLU A 96 -2.549 -24.733 -4.537 1.00 0.00 O ATOM 1467 OE2 GLU A 96 -0.667 -23.612 -4.450 1.00 0.00 O ATOM 0 H GLU A 96 -1.416 -21.634 -7.987 1.00 0.00 H new ATOM 0 HA GLU A 96 -0.548 -23.931 -9.510 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -1.447 -25.143 -7.503 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -0.118 -24.037 -7.217 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -1.756 -22.319 -6.426 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -3.049 -23.482 -6.645 1.00 0.00 H new ATOM 1475 N GLU A 97 -2.644 -24.214 -10.793 1.00 0.00 N ATOM 1476 CA GLU A 97 -3.835 -24.535 -11.558 1.00 0.00 C ATOM 1477 C GLU A 97 -4.174 -26.014 -11.443 1.00 0.00 C ATOM 1478 O GLU A 97 -4.951 -26.550 -12.233 1.00 0.00 O ATOM 1479 CB GLU A 97 -3.608 -24.141 -13.011 1.00 0.00 C ATOM 1480 CG GLU A 97 -3.317 -22.659 -13.183 1.00 0.00 C ATOM 1481 CD GLU A 97 -2.828 -22.320 -14.570 1.00 0.00 C ATOM 1482 OE1 GLU A 97 -1.599 -22.311 -14.780 1.00 0.00 O ATOM 1483 OE2 GLU A 97 -3.668 -22.074 -15.456 1.00 0.00 O ATOM 0 H GLU A 97 -1.782 -24.241 -11.338 1.00 0.00 H new ATOM 0 HA GLU A 97 -4.682 -23.977 -11.159 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -2.776 -24.719 -13.413 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -4.490 -24.403 -13.595 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -4.221 -22.088 -12.971 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -2.568 -22.353 -12.453 1.00 0.00 H new ATOM 1491 N GLN A 98 -3.578 -26.666 -10.454 1.00 0.00 N ATOM 1492 CA GLN A 98 -3.843 -28.068 -10.185 1.00 0.00 C ATOM 1493 C GLN A 98 -5.301 -28.262 -9.788 1.00 0.00 C ATOM 1494 O GLN A 98 -5.706 -27.924 -8.672 1.00 0.00 O ATOM 1495 CB GLN A 98 -2.928 -28.578 -9.072 1.00 0.00 C ATOM 1496 CG GLN A 98 -3.143 -30.042 -8.718 1.00 0.00 C ATOM 1497 CD GLN A 98 -2.174 -30.532 -7.661 1.00 0.00 C ATOM 1498 OE1 GLN A 98 -2.446 -30.454 -6.462 1.00 0.00 O ATOM 1499 NE2 GLN A 98 -1.035 -31.044 -8.096 1.00 0.00 N ATOM 0 H GLN A 98 -2.902 -26.239 -9.821 1.00 0.00 H new ATOM 0 HA GLN A 98 -3.644 -28.638 -11.093 1.00 0.00 H new ATOM 0 HB2 GLN A 98 -1.891 -28.436 -9.375 1.00 0.00 H new ATOM 0 HB3 GLN A 98 -3.085 -27.972 -8.180 1.00 0.00 H new ATOM 0 HG2 GLN A 98 -4.164 -30.180 -8.362 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -3.033 -30.650 -9.616 1.00 0.00 H new ATOM 0 HE21 GLN A 98 -0.847 -31.091 -9.097 1.00 0.00 H new ATOM 0 HE22 GLN A 98 -0.345 -31.392 -7.430 1.00 0.00 H new ATOM 1508 N LYS A 99 -6.086 -28.776 -10.717 1.00 0.00 N ATOM 1509 CA LYS A 99 -7.492 -29.033 -10.473 1.00 0.00 C ATOM 1510 C LYS A 99 -7.658 -30.328 -9.687 1.00 0.00 C ATOM 1511 O LYS A 99 -7.441 -31.421 -10.210 1.00 0.00 O ATOM 1512 CB LYS A 99 -8.257 -29.080 -11.797 1.00 0.00 C ATOM 1513 CG LYS A 99 -8.302 -27.731 -12.500 1.00 0.00 C ATOM 1514 CD LYS A 99 -8.874 -27.834 -13.904 1.00 0.00 C ATOM 1515 CE LYS A 99 -9.039 -26.459 -14.535 1.00 0.00 C ATOM 1516 NZ LYS A 99 -9.448 -26.545 -15.962 1.00 0.00 N ATOM 0 H LYS A 99 -5.770 -29.025 -11.654 1.00 0.00 H new ATOM 0 HA LYS A 99 -7.908 -28.222 -9.876 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -7.790 -29.812 -12.455 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -9.275 -29.422 -11.611 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -8.905 -27.038 -11.914 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -7.296 -27.315 -12.549 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -8.217 -28.444 -14.523 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -9.839 -28.339 -13.870 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -9.785 -25.892 -13.978 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -8.100 -25.911 -14.460 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -9.549 -25.586 -16.353 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -8.725 -27.064 -16.500 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -10.357 -27.045 -16.033 1.00 0.00 H new ATOM 1530 N GLY A 100 -8.016 -30.181 -8.420 1.00 0.00 N ATOM 1531 CA GLY A 100 -8.150 -31.313 -7.532 1.00 0.00 C ATOM 1532 C GLY A 100 -8.026 -30.887 -6.085 1.00 0.00 C ATOM 1533 O GLY A 100 -8.394 -29.763 -5.735 1.00 0.00 O ATOM 0 H GLY A 100 -8.219 -29.280 -7.987 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -9.116 -31.792 -7.692 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -7.384 -32.054 -7.763 1.00 0.00 H new ATOM 1537 N SER A 101 -7.505 -31.761 -5.244 1.00 0.00 N ATOM 1538 CA SER A 101 -7.323 -31.441 -3.840 1.00 0.00 C ATOM 1539 C SER A 101 -5.854 -31.144 -3.546 1.00 0.00 C ATOM 1540 O SER A 101 -5.456 -29.961 -3.636 1.00 0.00 O ATOM 1541 CB SER A 101 -7.832 -32.590 -2.969 1.00 0.00 C ATOM 1542 OG SER A 101 -9.198 -32.868 -3.246 1.00 0.00 O ATOM 1543 OXT SER A 101 -5.100 -32.086 -3.237 1.00 0.00 O ATOM 0 H SER A 101 -7.200 -32.698 -5.508 1.00 0.00 H new ATOM 0 HA SER A 101 -7.902 -30.548 -3.604 1.00 0.00 H new ATOM 0 HB2 SER A 101 -7.231 -33.482 -3.148 1.00 0.00 H new ATOM 0 HB3 SER A 101 -7.715 -32.333 -1.916 1.00 0.00 H new ATOM 0 HG SER A 101 -9.503 -33.607 -2.679 1.00 0.00 H new TER 1549 SER A 101