USER MOD reduce.3.24.130724 H: found=0, std=0, add=1104, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1104 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 52 TYR OH : rot 132:sc= -1.45 USER MOD Set 1.2: A 83 SER OG : rot -3:sc= -5.79! USER MOD Set 2.1: A 32 TYR OH : rot -171:sc= 0.46 USER MOD Set 2.2: A 34 SER OG : rot 96:sc= -0.856! USER MOD Set 2.3: A 36 HIS : no HD1:sc= -2.27! C(o=-21!,f=-31!) USER MOD Set 2.4: A 45 THR OG1 : rot 173:sc= -0.279! USER MOD Set 2.5: A 79 TYR OH : rot 60:sc= -0.752! USER MOD Set 2.6: A 84 HIS : no HE2:sc= -17.4! C(o=-21!,f=-24!) USER MOD Single : A 1 MET CE :methyl 154:sc= -0.164 (180deg=-1.07) USER MOD Single : A 1 MET N :NH3+ 177:sc= -1.04 (180deg=-1.15) USER MOD Single : A 5 GLN : amide:sc= -0.109 K(o=-0.11,f=-8.2!) USER MOD Single : A 8 LYS NZ :NH3+ -155:sc= -0.196 (180deg=-1.04) USER MOD Single : A 11 LYS NZ :NH3+ 161:sc= 0 (180deg=-0.0666) USER MOD Single : A 12 LYS NZ :NH3+ -158:sc= -1.12 (180deg=-1.99!) USER MOD Single : A 13 ASN : amide:sc= -5.2! C(o=-5.2!,f=-2.5!) USER MOD Single : A 15 CYS SG : rot 180:sc= 0 USER MOD Single : A 18 ASN : amide:sc= -0.166 X(o=-0.17,f=-0.02) USER MOD Single : A 20 ASN : amide:sc= -7.08! K(o=-7.1!,f=-1.7) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 CYS SG : rot 180:sc= -2.71! USER MOD Single : A 41 CYS SG : rot -56:sc= 0.469 USER MOD Single : A 51 MET CE :methyl -116:sc= -2.07 (180deg=-8.54!) USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 56:sc= 0.752 USER MOD Single : A 68 SER OG : rot 80:sc= -1.5 USER MOD Single : A 69 SER OG : rot 180:sc= 0.0841 USER MOD Single : A 72 SER OG : rot -145:sc= -0.0482! USER MOD Single : A 76 MET CE :methyl -135:sc= -0.58 (180deg=-2.05) USER MOD Single : A 78 GLN : amide:sc= -0.0364 X(o=-0.036,f=-0.16) USER MOD Single : A 80 MET CE :methyl 164:sc= -0.663 (180deg=-1.37) USER MOD Single : A 81 MET CE :methyl -149:sc= -0.71 (180deg=-2.85!) USER MOD Single : A 92 TYR OH : rot -44:sc= 0.315 USER MOD Single : A 94 SER OG : rot -75:sc= 0.293 USER MOD Single : A 98 SER OG : rot 180:sc= 0.111 USER MOD Single : A 99 ASN : amide:sc= -0.338 X(o=-0.34,f=-0.11) USER MOD Single : A 101 THR OG1 : rot 180:sc= 0.0445 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot -70:sc= 0.601 USER MOD Single : A 116 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0272) USER MOD Single : A 117 LYS NZ :NH3+ -153:sc= 0 (180deg=-0.0149) USER MOD Single : A 120 THR OG1 : rot 160:sc= -1.02 USER MOD Single : A 123 SER OG : rot 180:sc= -0.275 USER MOD Single : A 124 MET CE :methyl 156:sc= -13.2! (180deg=-16.6!) USER MOD Single : A 125 ASN : amide:sc= -1.25 K(o=-1.3,f=-0.1) USER MOD Single : A 131 GLN : amide:sc= -15.1! C(o=-15!,f=-6.7!) USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 139 GLN : amide:sc= -0.0611 K(o=-0.061,f=-0.93) USER MOD Single : A 140 ASN : amide:sc= -3.59! K(o=-3.6!,f=-0.0024) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 102.192 -18.347 -0.637 1.00 0.00 N ATOM 2 CA MET A 1 101.118 -17.394 -0.235 1.00 0.00 C ATOM 3 C MET A 1 101.711 -15.998 -0.084 1.00 0.00 C ATOM 4 O MET A 1 102.911 -15.845 0.148 1.00 0.00 O ATOM 5 CB MET A 1 100.506 -17.850 1.091 1.00 0.00 C ATOM 6 CG MET A 1 101.365 -18.964 1.693 1.00 0.00 C ATOM 7 SD MET A 1 100.691 -19.440 3.305 1.00 0.00 S ATOM 8 CE MET A 1 99.156 -20.183 2.699 1.00 0.00 C ATOM 0 H1 MET A 1 101.800 -19.309 -0.691 1.00 0.00 H new ATOM 0 H2 MET A 1 102.568 -18.074 -1.567 1.00 0.00 H new ATOM 0 H3 MET A 1 102.958 -18.324 0.067 1.00 0.00 H new ATOM 0 HA MET A 1 100.340 -17.371 -0.998 1.00 0.00 H new ATOM 0 HB2 MET A 1 100.444 -17.010 1.783 1.00 0.00 H new ATOM 0 HB3 MET A 1 99.489 -18.207 0.931 1.00 0.00 H new ATOM 0 HG2 MET A 1 101.383 -19.825 1.025 1.00 0.00 H new ATOM 0 HG3 MET A 1 102.395 -18.625 1.803 1.00 0.00 H new ATOM 0 HE1 MET A 1 98.806 -20.928 3.413 1.00 0.00 H new ATOM 0 HE2 MET A 1 98.398 -19.408 2.582 1.00 0.00 H new ATOM 0 HE3 MET A 1 99.338 -20.660 1.736 1.00 0.00 H new ATOM 20 N GLU A 2 100.864 -14.983 -0.214 1.00 0.00 N ATOM 21 CA GLU A 2 101.316 -13.602 -0.088 1.00 0.00 C ATOM 22 C GLU A 2 102.522 -13.516 0.841 1.00 0.00 C ATOM 23 O GLU A 2 102.581 -14.198 1.863 1.00 0.00 O ATOM 24 CB GLU A 2 100.185 -12.730 0.459 1.00 0.00 C ATOM 25 CG GLU A 2 98.844 -13.238 -0.076 1.00 0.00 C ATOM 26 CD GLU A 2 99.002 -13.709 -1.518 1.00 0.00 C ATOM 27 OE1 GLU A 2 99.685 -13.033 -2.269 1.00 0.00 O ATOM 28 OE2 GLU A 2 98.438 -14.738 -1.850 1.00 0.00 O ATOM 0 H GLU A 2 99.868 -15.089 -0.405 1.00 0.00 H new ATOM 0 HA GLU A 2 101.606 -13.243 -1.075 1.00 0.00 H new ATOM 0 HB2 GLU A 2 100.187 -12.755 1.549 1.00 0.00 H new ATOM 0 HB3 GLU A 2 100.337 -11.692 0.164 1.00 0.00 H new ATOM 0 HG2 GLU A 2 98.482 -14.057 0.545 1.00 0.00 H new ATOM 0 HG3 GLU A 2 98.098 -12.445 -0.024 1.00 0.00 H new ATOM 35 N PHE A 3 103.484 -12.672 0.477 1.00 0.00 N ATOM 36 CA PHE A 3 104.685 -12.504 1.287 1.00 0.00 C ATOM 37 C PHE A 3 104.931 -11.028 1.580 1.00 0.00 C ATOM 38 O PHE A 3 104.453 -10.496 2.582 1.00 0.00 O ATOM 39 CB PHE A 3 105.893 -13.090 0.555 1.00 0.00 C ATOM 40 CG PHE A 3 105.673 -14.565 0.320 1.00 0.00 C ATOM 41 CD1 PHE A 3 105.895 -15.480 1.356 1.00 0.00 C ATOM 42 CD2 PHE A 3 105.247 -15.018 -0.935 1.00 0.00 C ATOM 43 CE1 PHE A 3 105.691 -16.848 1.138 1.00 0.00 C ATOM 44 CE2 PHE A 3 105.043 -16.386 -1.152 1.00 0.00 C ATOM 45 CZ PHE A 3 105.264 -17.301 -0.117 1.00 0.00 C ATOM 0 H PHE A 3 103.456 -12.099 -0.366 1.00 0.00 H new ATOM 0 HA PHE A 3 104.542 -13.030 2.231 1.00 0.00 H new ATOM 0 HB2 PHE A 3 106.039 -12.577 -0.396 1.00 0.00 H new ATOM 0 HB3 PHE A 3 106.798 -12.936 1.143 1.00 0.00 H new ATOM 0 HD1 PHE A 3 106.224 -15.131 2.324 1.00 0.00 H new ATOM 0 HD2 PHE A 3 105.076 -14.313 -1.735 1.00 0.00 H new ATOM 0 HE1 PHE A 3 105.863 -17.554 1.937 1.00 0.00 H new ATOM 0 HE2 PHE A 3 104.715 -16.735 -2.120 1.00 0.00 H new ATOM 0 HZ PHE A 3 105.106 -18.356 -0.285 1.00 0.00 H new ATOM 55 N ILE A 4 105.681 -10.372 0.700 1.00 0.00 N ATOM 56 CA ILE A 4 105.985 -8.957 0.876 1.00 0.00 C ATOM 57 C ILE A 4 104.921 -8.093 0.205 1.00 0.00 C ATOM 58 O ILE A 4 104.568 -7.025 0.704 1.00 0.00 O ATOM 59 CB ILE A 4 107.356 -8.638 0.276 1.00 0.00 C ATOM 60 CG1 ILE A 4 107.626 -9.577 -0.901 1.00 0.00 C ATOM 61 CG2 ILE A 4 108.438 -8.830 1.340 1.00 0.00 C ATOM 62 CD1 ILE A 4 108.667 -8.946 -1.829 1.00 0.00 C ATOM 0 H ILE A 4 106.086 -10.794 -0.136 1.00 0.00 H new ATOM 0 HA ILE A 4 105.996 -8.737 1.944 1.00 0.00 H new ATOM 0 HB ILE A 4 107.369 -7.605 -0.071 1.00 0.00 H new ATOM 0 HG12 ILE A 4 107.984 -10.540 -0.537 1.00 0.00 H new ATOM 0 HG13 ILE A 4 106.703 -9.766 -1.448 1.00 0.00 H new ATOM 0 HG21 ILE A 4 109.414 -8.603 0.912 1.00 0.00 H new ATOM 0 HG22 ILE A 4 108.246 -8.162 2.179 1.00 0.00 H new ATOM 0 HG23 ILE A 4 108.426 -9.863 1.688 1.00 0.00 H new ATOM 0 HD11 ILE A 4 108.860 -9.615 -2.668 1.00 0.00 H new ATOM 0 HD12 ILE A 4 108.291 -7.994 -2.203 1.00 0.00 H new ATOM 0 HD13 ILE A 4 109.592 -8.780 -1.278 1.00 0.00 H new ATOM 74 N GLN A 5 104.416 -8.564 -0.929 1.00 0.00 N ATOM 75 CA GLN A 5 103.393 -7.827 -1.664 1.00 0.00 C ATOM 76 C GLN A 5 102.476 -7.078 -0.702 1.00 0.00 C ATOM 77 O GLN A 5 101.757 -7.689 0.088 1.00 0.00 O ATOM 78 CB GLN A 5 102.566 -8.791 -2.515 1.00 0.00 C ATOM 79 CG GLN A 5 103.359 -9.181 -3.764 1.00 0.00 C ATOM 80 CD GLN A 5 104.470 -10.158 -3.391 1.00 0.00 C ATOM 81 OE1 GLN A 5 104.515 -10.647 -2.262 1.00 0.00 O ATOM 82 NE2 GLN A 5 105.374 -10.473 -4.278 1.00 0.00 N ATOM 0 H GLN A 5 104.695 -9.446 -1.358 1.00 0.00 H new ATOM 0 HA GLN A 5 103.888 -7.104 -2.312 1.00 0.00 H new ATOM 0 HB2 GLN A 5 102.317 -9.681 -1.937 1.00 0.00 H new ATOM 0 HB3 GLN A 5 101.624 -8.323 -2.801 1.00 0.00 H new ATOM 0 HG2 GLN A 5 102.695 -9.636 -4.499 1.00 0.00 H new ATOM 0 HG3 GLN A 5 103.786 -8.291 -4.227 1.00 0.00 H new ATOM 0 HE21 GLN A 5 105.335 -10.067 -5.213 1.00 0.00 H new ATOM 0 HE22 GLN A 5 106.120 -11.126 -4.037 1.00 0.00 H new ATOM 91 N GLY A 6 102.507 -5.751 -0.777 1.00 0.00 N ATOM 92 CA GLY A 6 101.673 -4.927 0.091 1.00 0.00 C ATOM 93 C GLY A 6 102.516 -3.912 0.853 1.00 0.00 C ATOM 94 O GLY A 6 101.983 -3.028 1.524 1.00 0.00 O ATOM 0 H GLY A 6 103.096 -5.227 -1.424 1.00 0.00 H new ATOM 0 HA2 GLY A 6 100.923 -4.408 -0.505 1.00 0.00 H new ATOM 0 HA3 GLY A 6 101.136 -5.562 0.796 1.00 0.00 H new ATOM 98 N ILE A 7 103.834 -4.045 0.748 1.00 0.00 N ATOM 99 CA ILE A 7 104.741 -3.139 1.429 1.00 0.00 C ATOM 100 C ILE A 7 105.280 -2.090 0.462 1.00 0.00 C ATOM 101 O ILE A 7 104.988 -2.125 -0.734 1.00 0.00 O ATOM 102 CB ILE A 7 105.901 -3.934 2.018 1.00 0.00 C ATOM 103 CG1 ILE A 7 106.635 -4.673 0.896 1.00 0.00 C ATOM 104 CG2 ILE A 7 105.367 -4.946 3.034 1.00 0.00 C ATOM 105 CD1 ILE A 7 107.822 -5.440 1.481 1.00 0.00 C ATOM 0 H ILE A 7 104.294 -4.771 0.198 1.00 0.00 H new ATOM 0 HA ILE A 7 104.197 -2.631 2.225 1.00 0.00 H new ATOM 0 HB ILE A 7 106.591 -3.253 2.516 1.00 0.00 H new ATOM 0 HG12 ILE A 7 105.955 -5.362 0.394 1.00 0.00 H new ATOM 0 HG13 ILE A 7 106.982 -3.963 0.145 1.00 0.00 H new ATOM 0 HG21 ILE A 7 106.198 -5.513 3.454 1.00 0.00 H new ATOM 0 HG22 ILE A 7 104.847 -4.419 3.834 1.00 0.00 H new ATOM 0 HG23 ILE A 7 104.675 -5.628 2.539 1.00 0.00 H new ATOM 0 HD11 ILE A 7 108.345 -5.966 0.682 1.00 0.00 H new ATOM 0 HD12 ILE A 7 108.505 -4.741 1.963 1.00 0.00 H new ATOM 0 HD13 ILE A 7 107.463 -6.161 2.216 1.00 0.00 H new ATOM 117 N LYS A 8 106.070 -1.161 0.988 1.00 0.00 N ATOM 118 CA LYS A 8 106.649 -0.107 0.163 1.00 0.00 C ATOM 119 C LYS A 8 107.977 -0.567 -0.431 1.00 0.00 C ATOM 120 O LYS A 8 108.516 -1.599 -0.038 1.00 0.00 O ATOM 121 CB LYS A 8 106.870 1.153 1.002 1.00 0.00 C ATOM 122 CG LYS A 8 105.641 1.408 1.877 1.00 0.00 C ATOM 123 CD LYS A 8 105.762 0.615 3.180 1.00 0.00 C ATOM 124 CE LYS A 8 105.955 1.581 4.351 1.00 0.00 C ATOM 125 NZ LYS A 8 107.078 2.512 4.046 1.00 0.00 N ATOM 0 H LYS A 8 106.323 -1.116 1.975 1.00 0.00 H new ATOM 0 HA LYS A 8 105.957 0.118 -0.649 1.00 0.00 H new ATOM 0 HB2 LYS A 8 107.756 1.036 1.626 1.00 0.00 H new ATOM 0 HB3 LYS A 8 107.050 2.009 0.351 1.00 0.00 H new ATOM 0 HG2 LYS A 8 105.552 2.472 2.095 1.00 0.00 H new ATOM 0 HG3 LYS A 8 104.736 1.115 1.344 1.00 0.00 H new ATOM 0 HD2 LYS A 8 104.867 0.013 3.336 1.00 0.00 H new ATOM 0 HD3 LYS A 8 106.604 -0.075 3.121 1.00 0.00 H new ATOM 0 HE2 LYS A 8 105.039 2.144 4.527 1.00 0.00 H new ATOM 0 HE3 LYS A 8 106.167 1.025 5.264 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 107.489 2.863 4.935 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 107.808 2.009 3.502 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 106.722 3.315 3.488 1.00 0.00 H new ATOM 139 N LEU A 9 108.500 0.210 -1.374 1.00 0.00 N ATOM 140 CA LEU A 9 109.770 -0.126 -2.009 1.00 0.00 C ATOM 141 C LEU A 9 110.402 1.120 -2.623 1.00 0.00 C ATOM 142 O LEU A 9 109.718 2.115 -2.863 1.00 0.00 O ATOM 143 CB LEU A 9 109.553 -1.183 -3.094 1.00 0.00 C ATOM 144 CG LEU A 9 110.416 -2.409 -2.788 1.00 0.00 C ATOM 145 CD1 LEU A 9 109.797 -3.194 -1.629 1.00 0.00 C ATOM 146 CD2 LEU A 9 110.486 -3.306 -4.027 1.00 0.00 C ATOM 0 H LEU A 9 108.069 1.070 -1.713 1.00 0.00 H new ATOM 0 HA LEU A 9 110.442 -0.526 -1.249 1.00 0.00 H new ATOM 0 HB2 LEU A 9 108.501 -1.466 -3.136 1.00 0.00 H new ATOM 0 HB3 LEU A 9 109.813 -0.776 -4.071 1.00 0.00 H new ATOM 0 HG LEU A 9 111.420 -2.085 -2.514 1.00 0.00 H new ATOM 0 HD11 LEU A 9 110.412 -4.067 -1.411 1.00 0.00 H new ATOM 0 HD12 LEU A 9 109.745 -2.558 -0.746 1.00 0.00 H new ATOM 0 HD13 LEU A 9 108.793 -3.517 -1.904 1.00 0.00 H new ATOM 0 HD21 LEU A 9 111.101 -4.179 -3.810 1.00 0.00 H new ATOM 0 HD22 LEU A 9 109.481 -3.628 -4.300 1.00 0.00 H new ATOM 0 HD23 LEU A 9 110.926 -2.750 -4.855 1.00 0.00 H new ATOM 158 N VAL A 10 111.709 1.067 -2.871 1.00 0.00 N ATOM 159 CA VAL A 10 112.401 2.212 -3.450 1.00 0.00 C ATOM 160 C VAL A 10 113.027 1.850 -4.793 1.00 0.00 C ATOM 161 O VAL A 10 113.656 0.801 -4.935 1.00 0.00 O ATOM 162 CB VAL A 10 113.489 2.702 -2.494 1.00 0.00 C ATOM 163 CG1 VAL A 10 114.322 3.788 -3.180 1.00 0.00 C ATOM 164 CG2 VAL A 10 112.837 3.281 -1.237 1.00 0.00 C ATOM 0 H VAL A 10 112.300 0.257 -2.683 1.00 0.00 H new ATOM 0 HA VAL A 10 111.670 3.005 -3.610 1.00 0.00 H new ATOM 0 HB VAL A 10 114.135 1.868 -2.220 1.00 0.00 H new ATOM 0 HG11 VAL A 10 115.097 4.137 -2.498 1.00 0.00 H new ATOM 0 HG12 VAL A 10 114.786 3.378 -4.077 1.00 0.00 H new ATOM 0 HG13 VAL A 10 113.677 4.623 -3.454 1.00 0.00 H new ATOM 0 HG21 VAL A 10 113.611 3.631 -0.554 1.00 0.00 H new ATOM 0 HG22 VAL A 10 112.192 4.115 -1.513 1.00 0.00 H new ATOM 0 HG23 VAL A 10 112.243 2.510 -0.747 1.00 0.00 H new ATOM 174 N LYS A 11 112.853 2.730 -5.774 1.00 0.00 N ATOM 175 CA LYS A 11 113.408 2.501 -7.104 1.00 0.00 C ATOM 176 C LYS A 11 114.754 3.202 -7.243 1.00 0.00 C ATOM 177 O LYS A 11 114.953 4.296 -6.709 1.00 0.00 O ATOM 178 CB LYS A 11 112.444 3.025 -8.170 1.00 0.00 C ATOM 179 CG LYS A 11 111.104 3.373 -7.520 1.00 0.00 C ATOM 180 CD LYS A 11 110.137 3.889 -8.587 1.00 0.00 C ATOM 181 CE LYS A 11 110.030 2.865 -9.719 1.00 0.00 C ATOM 182 NZ LYS A 11 108.738 3.051 -10.437 1.00 0.00 N ATOM 0 H LYS A 11 112.335 3.603 -5.675 1.00 0.00 H new ATOM 0 HA LYS A 11 113.550 1.429 -7.242 1.00 0.00 H new ATOM 0 HB2 LYS A 11 112.865 3.906 -8.654 1.00 0.00 H new ATOM 0 HB3 LYS A 11 112.299 2.273 -8.946 1.00 0.00 H new ATOM 0 HG2 LYS A 11 110.686 2.493 -7.030 1.00 0.00 H new ATOM 0 HG3 LYS A 11 111.248 4.129 -6.748 1.00 0.00 H new ATOM 0 HD2 LYS A 11 109.155 4.065 -8.148 1.00 0.00 H new ATOM 0 HD3 LYS A 11 110.487 4.844 -8.979 1.00 0.00 H new ATOM 0 HE2 LYS A 11 110.863 2.984 -10.411 1.00 0.00 H new ATOM 0 HE3 LYS A 11 110.092 1.854 -9.316 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 108.793 2.601 -11.373 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 107.970 2.615 -9.888 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 108.548 4.067 -10.552 1.00 0.00 H new ATOM 196 N LYS A 12 115.674 2.565 -7.962 1.00 0.00 N ATOM 197 CA LYS A 12 117.003 3.132 -8.164 1.00 0.00 C ATOM 198 C LYS A 12 116.908 4.627 -8.445 1.00 0.00 C ATOM 199 O LYS A 12 117.825 5.386 -8.131 1.00 0.00 O ATOM 200 CB LYS A 12 117.698 2.434 -9.334 1.00 0.00 C ATOM 201 CG LYS A 12 116.648 1.798 -10.247 1.00 0.00 C ATOM 202 CD LYS A 12 117.264 1.520 -11.619 1.00 0.00 C ATOM 203 CE LYS A 12 116.336 0.608 -12.422 1.00 0.00 C ATOM 204 NZ LYS A 12 115.857 -0.503 -11.551 1.00 0.00 N ATOM 0 H LYS A 12 115.525 1.662 -8.412 1.00 0.00 H new ATOM 0 HA LYS A 12 117.585 2.980 -7.255 1.00 0.00 H new ATOM 0 HB2 LYS A 12 118.297 3.151 -9.895 1.00 0.00 H new ATOM 0 HB3 LYS A 12 118.381 1.671 -8.962 1.00 0.00 H new ATOM 0 HG2 LYS A 12 116.282 0.871 -9.807 1.00 0.00 H new ATOM 0 HG3 LYS A 12 115.790 2.462 -10.350 1.00 0.00 H new ATOM 0 HD2 LYS A 12 117.423 2.456 -12.154 1.00 0.00 H new ATOM 0 HD3 LYS A 12 118.241 1.050 -11.502 1.00 0.00 H new ATOM 0 HE2 LYS A 12 115.488 1.178 -12.802 1.00 0.00 H new ATOM 0 HE3 LYS A 12 116.863 0.205 -13.287 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 115.552 -1.302 -12.143 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 116.629 -0.811 -10.925 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 115.056 -0.173 -10.976 1.00 0.00 H new ATOM 218 N ASN A 13 115.792 5.046 -9.030 1.00 0.00 N ATOM 219 CA ASN A 13 115.590 6.455 -9.337 1.00 0.00 C ATOM 220 C ASN A 13 115.335 7.237 -8.055 1.00 0.00 C ATOM 221 O ASN A 13 114.807 8.349 -8.087 1.00 0.00 O ATOM 222 CB ASN A 13 114.403 6.620 -10.287 1.00 0.00 C ATOM 223 CG ASN A 13 114.311 8.067 -10.761 1.00 0.00 C ATOM 224 OD1 ASN A 13 113.460 8.398 -11.587 1.00 0.00 O ATOM 225 ND2 ASN A 13 115.142 8.953 -10.284 1.00 0.00 N ATOM 0 H ASN A 13 115.020 4.436 -9.299 1.00 0.00 H new ATOM 0 HA ASN A 13 116.488 6.842 -9.818 1.00 0.00 H new ATOM 0 HB2 ASN A 13 114.517 5.955 -11.143 1.00 0.00 H new ATOM 0 HB3 ASN A 13 113.480 6.335 -9.782 1.00 0.00 H new ATOM 0 HD21 ASN A 13 115.088 9.923 -10.595 1.00 0.00 H new ATOM 0 HD22 ASN A 13 115.846 8.676 -9.600 1.00 0.00 H new ATOM 232 N ARG A 14 115.708 6.643 -6.926 1.00 0.00 N ATOM 233 CA ARG A 14 115.512 7.286 -5.633 1.00 0.00 C ATOM 234 C ARG A 14 114.034 7.578 -5.407 1.00 0.00 C ATOM 235 O ARG A 14 113.678 8.518 -4.697 1.00 0.00 O ATOM 236 CB ARG A 14 116.309 8.591 -5.571 1.00 0.00 C ATOM 237 CG ARG A 14 117.654 8.336 -4.888 1.00 0.00 C ATOM 238 CD ARG A 14 118.429 9.651 -4.783 1.00 0.00 C ATOM 239 NE ARG A 14 119.462 9.546 -3.759 1.00 0.00 N ATOM 240 CZ ARG A 14 120.699 9.169 -4.066 1.00 0.00 C ATOM 241 NH1 ARG A 14 121.007 8.884 -5.302 1.00 0.00 N ATOM 242 NH2 ARG A 14 121.606 9.083 -3.131 1.00 0.00 N ATOM 0 H ARG A 14 116.145 5.723 -6.881 1.00 0.00 H new ATOM 0 HA ARG A 14 115.864 6.612 -4.852 1.00 0.00 H new ATOM 0 HB2 ARG A 14 116.468 8.981 -6.577 1.00 0.00 H new ATOM 0 HB3 ARG A 14 115.748 9.347 -5.021 1.00 0.00 H new ATOM 0 HG2 ARG A 14 117.496 7.914 -3.895 1.00 0.00 H new ATOM 0 HG3 ARG A 14 118.230 7.606 -5.456 1.00 0.00 H new ATOM 0 HD2 ARG A 14 118.883 9.892 -5.744 1.00 0.00 H new ATOM 0 HD3 ARG A 14 117.747 10.465 -4.539 1.00 0.00 H new ATOM 0 HE ARG A 14 119.231 9.766 -2.790 1.00 0.00 H new ATOM 0 HH11 ARG A 14 120.298 8.951 -6.033 1.00 0.00 H new ATOM 0 HH12 ARG A 14 121.956 8.595 -5.537 1.00 0.00 H new ATOM 0 HH21 ARG A 14 121.365 9.305 -2.165 1.00 0.00 H new ATOM 0 HH22 ARG A 14 122.555 8.794 -3.366 1.00 0.00 H new ATOM 256 N CYS A 15 113.176 6.771 -6.024 1.00 0.00 N ATOM 257 CA CYS A 15 111.737 6.959 -5.889 1.00 0.00 C ATOM 258 C CYS A 15 111.133 5.893 -4.980 1.00 0.00 C ATOM 259 O CYS A 15 111.804 4.935 -4.600 1.00 0.00 O ATOM 260 CB CYS A 15 111.072 6.894 -7.266 1.00 0.00 C ATOM 261 SG CYS A 15 110.468 8.538 -7.722 1.00 0.00 S ATOM 0 H CYS A 15 113.450 5.988 -6.617 1.00 0.00 H new ATOM 0 HA CYS A 15 111.560 7.938 -5.443 1.00 0.00 H new ATOM 0 HB2 CYS A 15 111.785 6.538 -8.010 1.00 0.00 H new ATOM 0 HB3 CYS A 15 110.246 6.183 -7.250 1.00 0.00 H new ATOM 0 HG CYS A 15 109.905 8.484 -8.893 1.00 0.00 H new ATOM 267 N GLU A 16 109.860 6.069 -4.637 1.00 0.00 N ATOM 268 CA GLU A 16 109.169 5.118 -3.775 1.00 0.00 C ATOM 269 C GLU A 16 107.927 4.570 -4.471 1.00 0.00 C ATOM 270 O GLU A 16 107.235 5.294 -5.187 1.00 0.00 O ATOM 271 CB GLU A 16 108.768 5.795 -2.463 1.00 0.00 C ATOM 272 CG GLU A 16 107.938 7.043 -2.768 1.00 0.00 C ATOM 273 CD GLU A 16 107.598 7.772 -1.472 1.00 0.00 C ATOM 274 OE1 GLU A 16 107.574 7.124 -0.439 1.00 0.00 O ATOM 275 OE2 GLU A 16 107.368 8.969 -1.533 1.00 0.00 O ATOM 0 H GLU A 16 109.289 6.858 -4.942 1.00 0.00 H new ATOM 0 HA GLU A 16 109.846 4.291 -3.561 1.00 0.00 H new ATOM 0 HB2 GLU A 16 108.193 5.105 -1.846 1.00 0.00 H new ATOM 0 HB3 GLU A 16 109.657 6.066 -1.894 1.00 0.00 H new ATOM 0 HG2 GLU A 16 108.493 7.705 -3.433 1.00 0.00 H new ATOM 0 HG3 GLU A 16 107.022 6.763 -3.288 1.00 0.00 H new ATOM 282 N VAL A 17 107.655 3.286 -4.261 1.00 0.00 N ATOM 283 CA VAL A 17 106.496 2.648 -4.877 1.00 0.00 C ATOM 284 C VAL A 17 106.017 1.469 -4.035 1.00 0.00 C ATOM 285 O VAL A 17 106.665 1.083 -3.063 1.00 0.00 O ATOM 286 CB VAL A 17 106.839 2.167 -6.288 1.00 0.00 C ATOM 287 CG1 VAL A 17 106.226 3.120 -7.315 1.00 0.00 C ATOM 288 CG2 VAL A 17 108.359 2.136 -6.471 1.00 0.00 C ATOM 0 H VAL A 17 108.217 2.670 -3.673 1.00 0.00 H new ATOM 0 HA VAL A 17 105.696 3.386 -4.935 1.00 0.00 H new ATOM 0 HB VAL A 17 106.437 1.164 -6.432 1.00 0.00 H new ATOM 0 HG11 VAL A 17 106.470 2.777 -8.321 1.00 0.00 H new ATOM 0 HG12 VAL A 17 105.143 3.140 -7.192 1.00 0.00 H new ATOM 0 HG13 VAL A 17 106.627 4.123 -7.166 1.00 0.00 H new ATOM 0 HG21 VAL A 17 108.597 1.793 -7.478 1.00 0.00 H new ATOM 0 HG22 VAL A 17 108.764 3.137 -6.324 1.00 0.00 H new ATOM 0 HG23 VAL A 17 108.799 1.456 -5.742 1.00 0.00 H new ATOM 298 N ASN A 18 104.878 0.901 -4.419 1.00 0.00 N ATOM 299 CA ASN A 18 104.319 -0.235 -3.696 1.00 0.00 C ATOM 300 C ASN A 18 104.797 -1.548 -4.311 1.00 0.00 C ATOM 301 O ASN A 18 104.403 -1.905 -5.421 1.00 0.00 O ATOM 302 CB ASN A 18 102.790 -0.179 -3.736 1.00 0.00 C ATOM 303 CG ASN A 18 102.250 0.254 -2.376 1.00 0.00 C ATOM 304 OD1 ASN A 18 101.264 -0.303 -1.893 1.00 0.00 O ATOM 305 ND2 ASN A 18 102.840 1.220 -1.728 1.00 0.00 N ATOM 0 H ASN A 18 104.327 1.207 -5.221 1.00 0.00 H new ATOM 0 HA ASN A 18 104.657 -0.185 -2.661 1.00 0.00 H new ATOM 0 HB2 ASN A 18 102.463 0.520 -4.506 1.00 0.00 H new ATOM 0 HB3 ASN A 18 102.388 -1.157 -4.002 1.00 0.00 H new ATOM 0 HD21 ASN A 18 102.485 1.516 -0.819 1.00 0.00 H new ATOM 0 HD22 ASN A 18 103.657 1.680 -2.130 1.00 0.00 H new ATOM 312 N ALA A 19 105.652 -2.260 -3.583 1.00 0.00 N ATOM 313 CA ALA A 19 106.184 -3.531 -4.066 1.00 0.00 C ATOM 314 C ALA A 19 105.087 -4.376 -4.707 1.00 0.00 C ATOM 315 O ALA A 19 105.365 -5.232 -5.546 1.00 0.00 O ATOM 316 CB ALA A 19 106.815 -4.305 -2.906 1.00 0.00 C ATOM 0 H ALA A 19 105.990 -1.981 -2.662 1.00 0.00 H new ATOM 0 HA ALA A 19 106.941 -3.318 -4.820 1.00 0.00 H new ATOM 0 HB1 ALA A 19 107.210 -5.252 -3.273 1.00 0.00 H new ATOM 0 HB2 ALA A 19 107.625 -3.717 -2.474 1.00 0.00 H new ATOM 0 HB3 ALA A 19 106.060 -4.498 -2.144 1.00 0.00 H new ATOM 322 N ASN A 20 103.842 -4.136 -4.311 1.00 0.00 N ATOM 323 CA ASN A 20 102.724 -4.889 -4.863 1.00 0.00 C ATOM 324 C ASN A 20 102.798 -4.898 -6.384 1.00 0.00 C ATOM 325 O ASN A 20 102.861 -5.955 -7.010 1.00 0.00 O ATOM 326 CB ASN A 20 101.400 -4.266 -4.417 1.00 0.00 C ATOM 327 CG ASN A 20 100.474 -5.347 -3.869 1.00 0.00 C ATOM 328 OD1 ASN A 20 99.338 -5.482 -4.323 1.00 0.00 O ATOM 329 ND2 ASN A 20 100.894 -6.129 -2.912 1.00 0.00 N ATOM 0 H ASN A 20 103.584 -3.434 -3.618 1.00 0.00 H new ATOM 0 HA ASN A 20 102.779 -5.914 -4.497 1.00 0.00 H new ATOM 0 HB2 ASN A 20 101.583 -3.511 -3.653 1.00 0.00 H new ATOM 0 HB3 ASN A 20 100.925 -3.760 -5.258 1.00 0.00 H new ATOM 0 HD21 ASN A 20 100.280 -6.854 -2.539 1.00 0.00 H new ATOM 0 HD22 ASN A 20 101.836 -6.016 -2.537 1.00 0.00 H new ATOM 336 N GLU A 21 102.797 -3.707 -6.969 1.00 0.00 N ATOM 337 CA GLU A 21 102.871 -3.575 -8.418 1.00 0.00 C ATOM 338 C GLU A 21 104.309 -3.321 -8.858 1.00 0.00 C ATOM 339 O GLU A 21 104.689 -3.630 -9.987 1.00 0.00 O ATOM 340 CB GLU A 21 101.980 -2.422 -8.885 1.00 0.00 C ATOM 341 CG GLU A 21 100.646 -2.472 -8.138 1.00 0.00 C ATOM 342 CD GLU A 21 99.507 -2.097 -9.079 1.00 0.00 C ATOM 343 OE1 GLU A 21 99.507 -0.977 -9.561 1.00 0.00 O ATOM 344 OE2 GLU A 21 98.649 -2.935 -9.305 1.00 0.00 O ATOM 0 H GLU A 21 102.746 -2.822 -6.465 1.00 0.00 H new ATOM 0 HA GLU A 21 102.524 -4.505 -8.868 1.00 0.00 H new ATOM 0 HB2 GLU A 21 102.476 -1.469 -8.702 1.00 0.00 H new ATOM 0 HB3 GLU A 21 101.810 -2.492 -9.959 1.00 0.00 H new ATOM 0 HG2 GLU A 21 100.482 -3.472 -7.736 1.00 0.00 H new ATOM 0 HG3 GLU A 21 100.669 -1.787 -7.290 1.00 0.00 H new ATOM 351 N ALA A 22 105.100 -2.748 -7.957 1.00 0.00 N ATOM 352 CA ALA A 22 106.495 -2.444 -8.256 1.00 0.00 C ATOM 353 C ALA A 22 107.288 -3.720 -8.517 1.00 0.00 C ATOM 354 O ALA A 22 108.068 -3.794 -9.467 1.00 0.00 O ATOM 355 CB ALA A 22 107.118 -1.683 -7.086 1.00 0.00 C ATOM 0 H ALA A 22 104.801 -2.486 -7.018 1.00 0.00 H new ATOM 0 HA ALA A 22 106.527 -1.828 -9.155 1.00 0.00 H new ATOM 0 HB1 ALA A 22 108.160 -1.457 -7.312 1.00 0.00 H new ATOM 0 HB2 ALA A 22 106.572 -0.753 -6.925 1.00 0.00 H new ATOM 0 HB3 ALA A 22 107.067 -2.295 -6.185 1.00 0.00 H new ATOM 361 N LEU A 23 107.085 -4.720 -7.671 1.00 0.00 N ATOM 362 CA LEU A 23 107.790 -5.988 -7.820 1.00 0.00 C ATOM 363 C LEU A 23 107.285 -6.736 -9.048 1.00 0.00 C ATOM 364 O LEU A 23 107.422 -7.955 -9.142 1.00 0.00 O ATOM 365 CB LEU A 23 107.591 -6.851 -6.572 1.00 0.00 C ATOM 366 CG LEU A 23 108.912 -7.523 -6.200 1.00 0.00 C ATOM 367 CD1 LEU A 23 109.858 -6.489 -5.588 1.00 0.00 C ATOM 368 CD2 LEU A 23 108.648 -8.635 -5.183 1.00 0.00 C ATOM 0 H LEU A 23 106.443 -4.680 -6.879 1.00 0.00 H new ATOM 0 HA LEU A 23 108.852 -5.780 -7.946 1.00 0.00 H new ATOM 0 HB2 LEU A 23 107.238 -6.236 -5.744 1.00 0.00 H new ATOM 0 HB3 LEU A 23 106.826 -7.606 -6.757 1.00 0.00 H new ATOM 0 HG LEU A 23 109.368 -7.947 -7.095 1.00 0.00 H new ATOM 0 HD11 LEU A 23 110.800 -6.969 -5.323 1.00 0.00 H new ATOM 0 HD12 LEU A 23 110.046 -5.695 -6.311 1.00 0.00 H new ATOM 0 HD13 LEU A 23 109.403 -6.064 -4.693 1.00 0.00 H new ATOM 0 HD21 LEU A 23 109.589 -9.115 -4.917 1.00 0.00 H new ATOM 0 HD22 LEU A 23 108.192 -8.210 -4.289 1.00 0.00 H new ATOM 0 HD23 LEU A 23 107.974 -9.373 -5.618 1.00 0.00 H new ATOM 380 N LYS A 24 106.700 -5.990 -9.980 1.00 0.00 N ATOM 381 CA LYS A 24 106.170 -6.573 -11.210 1.00 0.00 C ATOM 382 C LYS A 24 106.434 -8.075 -11.267 1.00 0.00 C ATOM 383 O LYS A 24 105.872 -8.842 -10.485 1.00 0.00 O ATOM 384 CB LYS A 24 106.809 -5.895 -12.423 1.00 0.00 C ATOM 385 CG LYS A 24 106.100 -6.355 -13.699 1.00 0.00 C ATOM 386 CD LYS A 24 106.972 -6.032 -14.913 1.00 0.00 C ATOM 387 CE LYS A 24 107.655 -7.309 -15.405 1.00 0.00 C ATOM 388 NZ LYS A 24 108.472 -7.002 -16.614 1.00 0.00 N ATOM 0 H LYS A 24 106.580 -4.980 -9.908 1.00 0.00 H new ATOM 0 HA LYS A 24 105.092 -6.413 -11.223 1.00 0.00 H new ATOM 0 HB2 LYS A 24 106.739 -4.812 -12.326 1.00 0.00 H new ATOM 0 HB3 LYS A 24 107.869 -6.142 -12.474 1.00 0.00 H new ATOM 0 HG2 LYS A 24 105.905 -7.426 -13.653 1.00 0.00 H new ATOM 0 HG3 LYS A 24 105.134 -5.859 -13.790 1.00 0.00 H new ATOM 0 HD2 LYS A 24 106.362 -5.604 -15.708 1.00 0.00 H new ATOM 0 HD3 LYS A 24 107.721 -5.285 -14.648 1.00 0.00 H new ATOM 0 HE2 LYS A 24 108.289 -7.721 -14.620 1.00 0.00 H new ATOM 0 HE3 LYS A 24 106.907 -8.066 -15.641 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 108.937 -7.870 -16.949 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 107.856 -6.628 -17.364 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 109.194 -6.293 -16.374 1.00 0.00 H new ATOM 402 N ASP A 25 107.287 -8.491 -12.201 1.00 0.00 N ATOM 403 CA ASP A 25 107.608 -9.908 -12.349 1.00 0.00 C ATOM 404 C ASP A 25 106.384 -10.675 -12.833 1.00 0.00 C ATOM 405 O ASP A 25 106.406 -11.283 -13.904 1.00 0.00 O ATOM 406 CB ASP A 25 108.088 -10.478 -11.011 1.00 0.00 C ATOM 407 CG ASP A 25 107.335 -11.762 -10.680 1.00 0.00 C ATOM 408 OD1 ASP A 25 106.211 -11.662 -10.216 1.00 0.00 O ATOM 409 OD2 ASP A 25 107.892 -12.825 -10.895 1.00 0.00 O ATOM 0 H ASP A 25 107.763 -7.875 -12.860 1.00 0.00 H new ATOM 0 HA ASP A 25 108.404 -10.014 -13.086 1.00 0.00 H new ATOM 0 HB2 ASP A 25 109.159 -10.678 -11.057 1.00 0.00 H new ATOM 0 HB3 ASP A 25 107.934 -9.744 -10.220 1.00 0.00 H new ATOM 414 N LYS A 26 105.317 -10.645 -12.040 1.00 0.00 N ATOM 415 CA LYS A 26 104.094 -11.347 -12.404 1.00 0.00 C ATOM 416 C LYS A 26 104.433 -12.686 -13.043 1.00 0.00 C ATOM 417 O LYS A 26 103.585 -13.325 -13.666 1.00 0.00 O ATOM 418 CB LYS A 26 103.275 -10.502 -13.382 1.00 0.00 C ATOM 419 CG LYS A 26 102.000 -10.011 -12.694 1.00 0.00 C ATOM 420 CD LYS A 26 101.131 -9.260 -13.705 1.00 0.00 C ATOM 421 CE LYS A 26 100.268 -10.259 -14.478 1.00 0.00 C ATOM 422 NZ LYS A 26 99.760 -9.616 -15.724 1.00 0.00 N ATOM 0 H LYS A 26 105.275 -10.147 -11.151 1.00 0.00 H new ATOM 0 HA LYS A 26 103.506 -11.519 -11.502 1.00 0.00 H new ATOM 0 HB2 LYS A 26 103.865 -9.652 -13.726 1.00 0.00 H new ATOM 0 HB3 LYS A 26 103.021 -11.091 -14.263 1.00 0.00 H new ATOM 0 HG2 LYS A 26 101.449 -10.856 -12.281 1.00 0.00 H new ATOM 0 HG3 LYS A 26 102.253 -9.357 -11.859 1.00 0.00 H new ATOM 0 HD2 LYS A 26 100.497 -8.538 -13.190 1.00 0.00 H new ATOM 0 HD3 LYS A 26 101.760 -8.697 -14.394 1.00 0.00 H new ATOM 0 HE2 LYS A 26 100.852 -11.145 -14.725 1.00 0.00 H new ATOM 0 HE3 LYS A 26 99.433 -10.589 -13.860 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 99.173 -10.294 -16.250 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 99.189 -8.783 -15.477 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 100.563 -9.322 -16.315 1.00 0.00 H new ATOM 436 N ASP A 27 105.685 -13.103 -12.884 1.00 0.00 N ATOM 437 CA ASP A 27 106.140 -14.365 -13.448 1.00 0.00 C ATOM 438 C ASP A 27 107.166 -15.022 -12.531 1.00 0.00 C ATOM 439 O ASP A 27 106.897 -16.061 -11.931 1.00 0.00 O ATOM 440 CB ASP A 27 106.762 -14.128 -14.826 1.00 0.00 C ATOM 441 CG ASP A 27 107.360 -15.425 -15.357 1.00 0.00 C ATOM 442 OD1 ASP A 27 107.110 -16.460 -14.761 1.00 0.00 O ATOM 443 OD2 ASP A 27 108.063 -15.366 -16.354 1.00 0.00 O ATOM 0 H ASP A 27 106.399 -12.586 -12.371 1.00 0.00 H new ATOM 0 HA ASP A 27 105.280 -15.028 -13.547 1.00 0.00 H new ATOM 0 HB2 ASP A 27 106.005 -13.757 -15.517 1.00 0.00 H new ATOM 0 HB3 ASP A 27 107.535 -13.362 -14.759 1.00 0.00 H new ATOM 448 N ILE A 28 108.348 -14.417 -12.433 1.00 0.00 N ATOM 449 CA ILE A 28 109.407 -14.963 -11.592 1.00 0.00 C ATOM 450 C ILE A 28 110.123 -13.847 -10.837 1.00 0.00 C ATOM 451 O ILE A 28 110.123 -12.695 -11.269 1.00 0.00 O ATOM 452 CB ILE A 28 110.401 -15.721 -12.470 1.00 0.00 C ATOM 453 CG1 ILE A 28 109.706 -16.954 -13.053 1.00 0.00 C ATOM 454 CG2 ILE A 28 111.617 -16.143 -11.639 1.00 0.00 C ATOM 455 CD1 ILE A 28 110.600 -18.186 -12.890 1.00 0.00 C ATOM 0 H ILE A 28 108.594 -13.556 -12.922 1.00 0.00 H new ATOM 0 HA ILE A 28 108.968 -15.642 -10.861 1.00 0.00 H new ATOM 0 HB ILE A 28 110.743 -15.077 -13.280 1.00 0.00 H new ATOM 0 HG12 ILE A 28 108.753 -17.117 -12.549 1.00 0.00 H new ATOM 0 HG13 ILE A 28 109.485 -16.792 -14.108 1.00 0.00 H new ATOM 0 HG21 ILE A 28 112.321 -16.683 -12.272 1.00 0.00 H new ATOM 0 HG22 ILE A 28 112.103 -15.257 -11.229 1.00 0.00 H new ATOM 0 HG23 ILE A 28 111.294 -16.789 -10.823 1.00 0.00 H new ATOM 0 HD11 ILE A 28 110.097 -19.058 -13.308 1.00 0.00 H new ATOM 0 HD12 ILE A 28 111.542 -18.024 -13.415 1.00 0.00 H new ATOM 0 HD13 ILE A 28 110.799 -18.354 -11.831 1.00 0.00 H new ATOM 467 N ILE A 29 110.733 -14.191 -9.704 1.00 0.00 N ATOM 468 CA ILE A 29 111.445 -13.199 -8.907 1.00 0.00 C ATOM 469 C ILE A 29 112.788 -13.745 -8.437 1.00 0.00 C ATOM 470 O ILE A 29 112.986 -14.957 -8.355 1.00 0.00 O ATOM 471 CB ILE A 29 110.601 -12.796 -7.694 1.00 0.00 C ATOM 472 CG1 ILE A 29 109.590 -11.719 -8.104 1.00 0.00 C ATOM 473 CG2 ILE A 29 111.514 -12.243 -6.599 1.00 0.00 C ATOM 474 CD1 ILE A 29 108.173 -12.288 -8.012 1.00 0.00 C ATOM 0 H ILE A 29 110.748 -15.137 -9.323 1.00 0.00 H new ATOM 0 HA ILE A 29 111.623 -12.324 -9.532 1.00 0.00 H new ATOM 0 HB ILE A 29 110.068 -13.670 -7.319 1.00 0.00 H new ATOM 0 HG12 ILE A 29 109.687 -10.849 -7.455 1.00 0.00 H new ATOM 0 HG13 ILE A 29 109.793 -11.383 -9.121 1.00 0.00 H new ATOM 0 HG21 ILE A 29 110.914 -11.956 -5.735 1.00 0.00 H new ATOM 0 HG22 ILE A 29 112.232 -13.008 -6.304 1.00 0.00 H new ATOM 0 HG23 ILE A 29 112.047 -11.371 -6.976 1.00 0.00 H new ATOM 0 HD11 ILE A 29 107.454 -11.522 -8.303 1.00 0.00 H new ATOM 0 HD12 ILE A 29 108.081 -13.145 -8.679 1.00 0.00 H new ATOM 0 HD13 ILE A 29 107.973 -12.602 -6.988 1.00 0.00 H new ATOM 486 N GLY A 30 113.706 -12.837 -8.128 1.00 0.00 N ATOM 487 CA GLY A 30 115.032 -13.224 -7.664 1.00 0.00 C ATOM 488 C GLY A 30 115.389 -12.482 -6.384 1.00 0.00 C ATOM 489 O GLY A 30 114.950 -11.352 -6.168 1.00 0.00 O ATOM 0 H GLY A 30 113.557 -11.830 -8.190 1.00 0.00 H new ATOM 0 HA2 GLY A 30 115.062 -14.299 -7.488 1.00 0.00 H new ATOM 0 HA3 GLY A 30 115.771 -13.006 -8.435 1.00 0.00 H new ATOM 493 N PHE A 31 116.184 -13.120 -5.537 1.00 0.00 N ATOM 494 CA PHE A 31 116.588 -12.505 -4.279 1.00 0.00 C ATOM 495 C PHE A 31 118.104 -12.536 -4.128 1.00 0.00 C ATOM 496 O PHE A 31 118.711 -13.605 -4.078 1.00 0.00 O ATOM 497 CB PHE A 31 115.947 -13.245 -3.105 1.00 0.00 C ATOM 498 CG PHE A 31 114.486 -12.874 -3.002 1.00 0.00 C ATOM 499 CD1 PHE A 31 113.535 -13.555 -3.770 1.00 0.00 C ATOM 500 CD2 PHE A 31 114.083 -11.853 -2.132 1.00 0.00 C ATOM 501 CE1 PHE A 31 112.181 -13.215 -3.670 1.00 0.00 C ATOM 502 CE2 PHE A 31 112.728 -11.514 -2.031 1.00 0.00 C ATOM 503 CZ PHE A 31 111.777 -12.195 -2.800 1.00 0.00 C ATOM 0 H PHE A 31 116.560 -14.055 -5.695 1.00 0.00 H new ATOM 0 HA PHE A 31 116.254 -11.467 -4.283 1.00 0.00 H new ATOM 0 HB2 PHE A 31 116.049 -14.321 -3.242 1.00 0.00 H new ATOM 0 HB3 PHE A 31 116.462 -12.991 -2.179 1.00 0.00 H new ATOM 0 HD1 PHE A 31 113.846 -14.343 -4.440 1.00 0.00 H new ATOM 0 HD2 PHE A 31 114.817 -11.327 -1.539 1.00 0.00 H new ATOM 0 HE1 PHE A 31 111.447 -13.740 -4.264 1.00 0.00 H new ATOM 0 HE2 PHE A 31 112.417 -10.727 -1.360 1.00 0.00 H new ATOM 0 HZ PHE A 31 110.732 -11.934 -2.722 1.00 0.00 H new ATOM 513 N TYR A 32 118.710 -11.357 -4.047 1.00 0.00 N ATOM 514 CA TYR A 32 120.157 -11.268 -3.891 1.00 0.00 C ATOM 515 C TYR A 32 120.508 -10.917 -2.449 1.00 0.00 C ATOM 516 O TYR A 32 120.110 -9.867 -1.946 1.00 0.00 O ATOM 517 CB TYR A 32 120.721 -10.201 -4.832 1.00 0.00 C ATOM 518 CG TYR A 32 122.230 -10.279 -4.835 1.00 0.00 C ATOM 519 CD1 TYR A 32 122.872 -11.378 -5.417 1.00 0.00 C ATOM 520 CD2 TYR A 32 122.985 -9.253 -4.256 1.00 0.00 C ATOM 521 CE1 TYR A 32 124.270 -11.450 -5.421 1.00 0.00 C ATOM 522 CE2 TYR A 32 124.382 -9.325 -4.259 1.00 0.00 C ATOM 523 CZ TYR A 32 125.025 -10.424 -4.842 1.00 0.00 C ATOM 524 OH TYR A 32 126.404 -10.495 -4.845 1.00 0.00 O ATOM 0 H TYR A 32 118.228 -10.459 -4.086 1.00 0.00 H new ATOM 0 HA TYR A 32 120.596 -12.234 -4.140 1.00 0.00 H new ATOM 0 HB2 TYR A 32 120.336 -10.351 -5.841 1.00 0.00 H new ATOM 0 HB3 TYR A 32 120.398 -9.211 -4.511 1.00 0.00 H new ATOM 0 HD1 TYR A 32 122.289 -12.170 -5.863 1.00 0.00 H new ATOM 0 HD2 TYR A 32 122.489 -8.405 -3.807 1.00 0.00 H new ATOM 0 HE1 TYR A 32 124.766 -12.297 -5.871 1.00 0.00 H new ATOM 0 HE2 TYR A 32 124.965 -8.533 -3.812 1.00 0.00 H new ATOM 0 HH TYR A 32 126.770 -9.781 -4.282 1.00 0.00 H new ATOM 534 N PHE A 33 121.252 -11.798 -1.785 1.00 0.00 N ATOM 535 CA PHE A 33 121.640 -11.555 -0.401 1.00 0.00 C ATOM 536 C PHE A 33 123.149 -11.382 -0.288 1.00 0.00 C ATOM 537 O PHE A 33 123.914 -12.317 -0.533 1.00 0.00 O ATOM 538 CB PHE A 33 121.190 -12.720 0.485 1.00 0.00 C ATOM 539 CG PHE A 33 119.694 -12.907 0.370 1.00 0.00 C ATOM 540 CD1 PHE A 33 118.838 -11.798 0.424 1.00 0.00 C ATOM 541 CD2 PHE A 33 119.163 -14.191 0.209 1.00 0.00 C ATOM 542 CE1 PHE A 33 117.454 -11.977 0.317 1.00 0.00 C ATOM 543 CE2 PHE A 33 117.778 -14.368 0.101 1.00 0.00 C ATOM 544 CZ PHE A 33 116.924 -13.261 0.155 1.00 0.00 C ATOM 0 H PHE A 33 121.594 -12.675 -2.178 1.00 0.00 H new ATOM 0 HA PHE A 33 121.155 -10.638 -0.067 1.00 0.00 H new ATOM 0 HB2 PHE A 33 121.703 -13.634 0.187 1.00 0.00 H new ATOM 0 HB3 PHE A 33 121.462 -12.525 1.522 1.00 0.00 H new ATOM 0 HD1 PHE A 33 119.246 -10.806 0.548 1.00 0.00 H new ATOM 0 HD2 PHE A 33 119.821 -15.046 0.168 1.00 0.00 H new ATOM 0 HE1 PHE A 33 116.795 -11.123 0.360 1.00 0.00 H new ATOM 0 HE2 PHE A 33 117.369 -15.360 -0.024 1.00 0.00 H new ATOM 0 HZ PHE A 33 115.856 -13.398 0.072 1.00 0.00 H new ATOM 554 N SER A 34 123.568 -10.177 0.086 1.00 0.00 N ATOM 555 CA SER A 34 124.986 -9.878 0.233 1.00 0.00 C ATOM 556 C SER A 34 125.253 -8.401 -0.041 1.00 0.00 C ATOM 557 O SER A 34 125.556 -8.018 -1.171 1.00 0.00 O ATOM 558 CB SER A 34 125.802 -10.733 -0.735 1.00 0.00 C ATOM 559 OG SER A 34 125.064 -10.917 -1.937 1.00 0.00 O ATOM 0 H SER A 34 122.947 -9.395 0.292 1.00 0.00 H new ATOM 0 HA SER A 34 125.282 -10.106 1.257 1.00 0.00 H new ATOM 0 HB2 SER A 34 126.755 -10.250 -0.950 1.00 0.00 H new ATOM 0 HB3 SER A 34 126.029 -11.698 -0.283 1.00 0.00 H new ATOM 0 HG SER A 34 125.345 -10.250 -2.598 1.00 0.00 H new ATOM 565 N ALA A 35 125.140 -7.579 0.999 1.00 0.00 N ATOM 566 CA ALA A 35 125.373 -6.143 0.863 1.00 0.00 C ATOM 567 C ALA A 35 126.176 -5.845 -0.395 1.00 0.00 C ATOM 568 O ALA A 35 125.710 -5.138 -1.289 1.00 0.00 O ATOM 569 CB ALA A 35 126.128 -5.622 2.087 1.00 0.00 C ATOM 0 H ALA A 35 124.890 -7.880 1.941 1.00 0.00 H new ATOM 0 HA ALA A 35 124.407 -5.643 0.788 1.00 0.00 H new ATOM 0 HB1 ALA A 35 126.299 -4.551 1.980 1.00 0.00 H new ATOM 0 HB2 ALA A 35 125.538 -5.808 2.985 1.00 0.00 H new ATOM 0 HB3 ALA A 35 127.086 -6.136 2.170 1.00 0.00 H new ATOM 575 N HIS A 36 127.379 -6.392 -0.457 1.00 0.00 N ATOM 576 CA HIS A 36 128.243 -6.184 -1.611 1.00 0.00 C ATOM 577 C HIS A 36 128.890 -4.805 -1.561 1.00 0.00 C ATOM 578 O HIS A 36 129.956 -4.594 -2.137 1.00 0.00 O ATOM 579 CB HIS A 36 127.433 -6.319 -2.902 1.00 0.00 C ATOM 580 CG HIS A 36 128.199 -7.153 -3.892 1.00 0.00 C ATOM 581 ND1 HIS A 36 127.581 -8.093 -4.701 1.00 0.00 N ATOM 582 CD2 HIS A 36 129.533 -7.200 -4.214 1.00 0.00 C ATOM 583 CE1 HIS A 36 128.533 -8.661 -5.463 1.00 0.00 C ATOM 584 NE2 HIS A 36 129.742 -8.153 -5.207 1.00 0.00 N ATOM 0 H HIS A 36 127.779 -6.981 0.273 1.00 0.00 H new ATOM 0 HA HIS A 36 129.027 -6.941 -1.590 1.00 0.00 H new ATOM 0 HB2 HIS A 36 126.468 -6.781 -2.692 1.00 0.00 H new ATOM 0 HB3 HIS A 36 127.230 -5.333 -3.321 1.00 0.00 H new ATOM 0 HD2 HIS A 36 130.303 -6.590 -3.765 1.00 0.00 H new ATOM 0 HE1 HIS A 36 128.343 -9.434 -6.193 1.00 0.00 H new ATOM 0 HE2 HIS A 36 130.627 -8.408 -5.645 1.00 0.00 H new ATOM 593 N TRP A 37 128.242 -3.864 -0.876 1.00 0.00 N ATOM 594 CA TRP A 37 128.786 -2.515 -0.782 1.00 0.00 C ATOM 595 C TRP A 37 129.741 -2.394 0.401 1.00 0.00 C ATOM 596 O TRP A 37 130.834 -1.839 0.271 1.00 0.00 O ATOM 597 CB TRP A 37 127.651 -1.499 -0.652 1.00 0.00 C ATOM 598 CG TRP A 37 127.360 -1.234 0.788 1.00 0.00 C ATOM 599 CD1 TRP A 37 126.280 -1.696 1.457 1.00 0.00 C ATOM 600 CD2 TRP A 37 128.132 -0.452 1.744 1.00 0.00 C ATOM 601 NE1 TRP A 37 126.335 -1.240 2.762 1.00 0.00 N ATOM 602 CE2 TRP A 37 127.460 -0.473 2.988 1.00 0.00 C ATOM 603 CE3 TRP A 37 129.337 0.268 1.654 1.00 0.00 C ATOM 604 CZ2 TRP A 37 127.964 0.194 4.103 1.00 0.00 C ATOM 605 CZ3 TRP A 37 129.848 0.941 2.775 1.00 0.00 C ATOM 606 CH2 TRP A 37 129.162 0.903 3.997 1.00 0.00 C ATOM 0 H TRP A 37 127.358 -4.008 -0.388 1.00 0.00 H new ATOM 0 HA TRP A 37 129.346 -2.307 -1.694 1.00 0.00 H new ATOM 0 HB2 TRP A 37 127.925 -0.570 -1.152 1.00 0.00 H new ATOM 0 HB3 TRP A 37 126.757 -1.876 -1.148 1.00 0.00 H new ATOM 0 HD1 TRP A 37 125.502 -2.319 1.041 1.00 0.00 H new ATOM 0 HE1 TRP A 37 125.630 -1.445 3.470 1.00 0.00 H new ATOM 0 HE3 TRP A 37 129.872 0.303 0.717 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 127.432 0.163 5.042 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 130.774 1.491 2.696 1.00 0.00 H new ATOM 0 HH2 TRP A 37 129.560 1.422 4.856 1.00 0.00 H new ATOM 617 N CYS A 38 129.334 -2.915 1.553 1.00 0.00 N ATOM 618 CA CYS A 38 130.178 -2.855 2.741 1.00 0.00 C ATOM 619 C CYS A 38 131.226 -3.967 2.705 1.00 0.00 C ATOM 620 O CYS A 38 132.418 -3.715 2.872 1.00 0.00 O ATOM 621 CB CYS A 38 129.319 -2.979 4.005 1.00 0.00 C ATOM 622 SG CYS A 38 129.984 -4.280 5.075 1.00 0.00 S ATOM 0 H CYS A 38 128.436 -3.379 1.690 1.00 0.00 H new ATOM 0 HA CYS A 38 130.691 -1.893 2.757 1.00 0.00 H new ATOM 0 HB2 CYS A 38 129.303 -2.029 4.539 1.00 0.00 H new ATOM 0 HB3 CYS A 38 128.289 -3.210 3.734 1.00 0.00 H new ATOM 0 HG CYS A 38 129.252 -4.378 6.145 1.00 0.00 H new ATOM 628 N PRO A 39 130.798 -5.183 2.490 1.00 0.00 N ATOM 629 CA PRO A 39 131.703 -6.362 2.426 1.00 0.00 C ATOM 630 C PRO A 39 132.292 -6.565 1.029 1.00 0.00 C ATOM 631 O PRO A 39 131.653 -6.249 0.025 1.00 0.00 O ATOM 632 CB PRO A 39 130.778 -7.518 2.797 1.00 0.00 C ATOM 633 CG PRO A 39 129.423 -7.108 2.310 1.00 0.00 C ATOM 634 CD PRO A 39 129.396 -5.573 2.284 1.00 0.00 C ATOM 0 HA PRO A 39 132.569 -6.260 3.081 1.00 0.00 H new ATOM 0 HB2 PRO A 39 131.101 -8.447 2.327 1.00 0.00 H new ATOM 0 HB3 PRO A 39 130.774 -7.690 3.873 1.00 0.00 H new ATOM 0 HG2 PRO A 39 129.232 -7.513 1.316 1.00 0.00 H new ATOM 0 HG3 PRO A 39 128.644 -7.496 2.967 1.00 0.00 H new ATOM 0 HD2 PRO A 39 129.014 -5.198 1.335 1.00 0.00 H new ATOM 0 HD3 PRO A 39 128.752 -5.173 3.067 1.00 0.00 H new ATOM 642 N PRO A 40 133.486 -7.087 0.953 1.00 0.00 N ATOM 643 CA PRO A 40 134.175 -7.343 -0.345 1.00 0.00 C ATOM 644 C PRO A 40 133.627 -8.580 -1.052 1.00 0.00 C ATOM 645 O PRO A 40 133.440 -9.628 -0.435 1.00 0.00 O ATOM 646 CB PRO A 40 135.634 -7.551 0.062 1.00 0.00 C ATOM 647 CG PRO A 40 135.581 -8.067 1.462 1.00 0.00 C ATOM 648 CD PRO A 40 134.316 -7.489 2.101 1.00 0.00 C ATOM 0 HA PRO A 40 134.035 -6.527 -1.054 1.00 0.00 H new ATOM 0 HB2 PRO A 40 136.130 -8.260 -0.600 1.00 0.00 H new ATOM 0 HB3 PRO A 40 136.195 -6.618 0.007 1.00 0.00 H new ATOM 0 HG2 PRO A 40 135.555 -9.157 1.471 1.00 0.00 H new ATOM 0 HG3 PRO A 40 136.468 -7.765 2.019 1.00 0.00 H new ATOM 0 HD2 PRO A 40 133.809 -8.229 2.720 1.00 0.00 H new ATOM 0 HD3 PRO A 40 134.546 -6.639 2.744 1.00 0.00 H new ATOM 656 N CYS A 41 133.372 -8.451 -2.351 1.00 0.00 N ATOM 657 CA CYS A 41 132.847 -9.567 -3.134 1.00 0.00 C ATOM 658 C CYS A 41 132.573 -9.132 -4.570 1.00 0.00 C ATOM 659 O CYS A 41 131.583 -9.541 -5.177 1.00 0.00 O ATOM 660 CB CYS A 41 131.553 -10.086 -2.502 1.00 0.00 C ATOM 661 SG CYS A 41 130.819 -11.344 -3.576 1.00 0.00 S ATOM 0 H CYS A 41 133.519 -7.592 -2.881 1.00 0.00 H new ATOM 0 HA CYS A 41 133.592 -10.362 -3.142 1.00 0.00 H new ATOM 0 HB2 CYS A 41 131.760 -10.508 -1.519 1.00 0.00 H new ATOM 0 HB3 CYS A 41 130.852 -9.264 -2.355 1.00 0.00 H new ATOM 0 HG CYS A 41 130.628 -10.845 -4.761 1.00 0.00 H new ATOM 667 N ARG A 42 133.457 -8.297 -5.108 1.00 0.00 N ATOM 668 CA ARG A 42 133.302 -7.808 -6.474 1.00 0.00 C ATOM 669 C ARG A 42 133.809 -8.836 -7.482 1.00 0.00 C ATOM 670 O ARG A 42 134.729 -9.603 -7.194 1.00 0.00 O ATOM 671 CB ARG A 42 134.074 -6.499 -6.649 1.00 0.00 C ATOM 672 CG ARG A 42 135.575 -6.791 -6.682 1.00 0.00 C ATOM 673 CD ARG A 42 136.353 -5.478 -6.582 1.00 0.00 C ATOM 674 NE ARG A 42 136.061 -4.814 -5.317 1.00 0.00 N ATOM 675 CZ ARG A 42 136.836 -3.835 -4.860 1.00 0.00 C ATOM 676 NH1 ARG A 42 137.879 -3.454 -5.546 1.00 0.00 N ATOM 677 NH2 ARG A 42 136.555 -3.256 -3.725 1.00 0.00 N ATOM 0 H ARG A 42 134.283 -7.947 -4.623 1.00 0.00 H new ATOM 0 HA ARG A 42 132.241 -7.636 -6.656 1.00 0.00 H new ATOM 0 HB2 ARG A 42 133.769 -6.005 -7.572 1.00 0.00 H new ATOM 0 HB3 ARG A 42 133.844 -5.817 -5.831 1.00 0.00 H new ATOM 0 HG2 ARG A 42 135.846 -7.450 -5.857 1.00 0.00 H new ATOM 0 HG3 ARG A 42 135.835 -7.311 -7.604 1.00 0.00 H new ATOM 0 HD2 ARG A 42 137.422 -5.674 -6.660 1.00 0.00 H new ATOM 0 HD3 ARG A 42 136.087 -4.825 -7.413 1.00 0.00 H new ATOM 0 HE ARG A 42 135.249 -5.105 -4.774 1.00 0.00 H new ATOM 0 HH11 ARG A 42 138.100 -3.907 -6.433 1.00 0.00 H new ATOM 0 HH12 ARG A 42 138.473 -2.703 -5.195 1.00 0.00 H new ATOM 0 HH21 ARG A 42 135.741 -3.554 -3.188 1.00 0.00 H new ATOM 0 HH22 ARG A 42 137.150 -2.505 -3.375 1.00 0.00 H new ATOM 691 N GLY A 43 133.205 -8.841 -8.667 1.00 0.00 N ATOM 692 CA GLY A 43 133.602 -9.772 -9.718 1.00 0.00 C ATOM 693 C GLY A 43 132.419 -10.616 -10.181 1.00 0.00 C ATOM 694 O GLY A 43 132.296 -10.931 -11.365 1.00 0.00 O ATOM 0 H GLY A 43 132.442 -8.214 -8.923 1.00 0.00 H new ATOM 0 HA2 GLY A 43 134.010 -9.218 -10.563 1.00 0.00 H new ATOM 0 HA3 GLY A 43 134.395 -10.423 -9.351 1.00 0.00 H new ATOM 698 N PHE A 44 131.546 -10.976 -9.246 1.00 0.00 N ATOM 699 CA PHE A 44 130.374 -11.778 -9.579 1.00 0.00 C ATOM 700 C PHE A 44 129.227 -10.880 -10.033 1.00 0.00 C ATOM 701 O PHE A 44 128.349 -11.303 -10.785 1.00 0.00 O ATOM 702 CB PHE A 44 129.935 -12.599 -8.364 1.00 0.00 C ATOM 703 CG PHE A 44 129.762 -14.044 -8.770 1.00 0.00 C ATOM 704 CD1 PHE A 44 130.878 -14.811 -9.122 1.00 0.00 C ATOM 705 CD2 PHE A 44 128.484 -14.616 -8.795 1.00 0.00 C ATOM 706 CE1 PHE A 44 130.717 -16.149 -9.500 1.00 0.00 C ATOM 707 CE2 PHE A 44 128.323 -15.955 -9.172 1.00 0.00 C ATOM 708 CZ PHE A 44 129.440 -16.721 -9.525 1.00 0.00 C ATOM 0 H PHE A 44 131.626 -10.728 -8.260 1.00 0.00 H new ATOM 0 HA PHE A 44 130.638 -12.454 -10.392 1.00 0.00 H new ATOM 0 HB2 PHE A 44 130.678 -12.519 -7.570 1.00 0.00 H new ATOM 0 HB3 PHE A 44 128.999 -12.207 -7.966 1.00 0.00 H new ATOM 0 HD1 PHE A 44 131.864 -14.371 -9.102 1.00 0.00 H new ATOM 0 HD2 PHE A 44 127.622 -14.024 -8.523 1.00 0.00 H new ATOM 0 HE1 PHE A 44 131.579 -16.740 -9.773 1.00 0.00 H new ATOM 0 HE2 PHE A 44 127.337 -16.396 -9.190 1.00 0.00 H new ATOM 0 HZ PHE A 44 129.316 -17.753 -9.817 1.00 0.00 H new ATOM 718 N THR A 45 129.240 -9.640 -9.557 1.00 0.00 N ATOM 719 CA THR A 45 128.195 -8.684 -9.906 1.00 0.00 C ATOM 720 C THR A 45 128.114 -8.486 -11.417 1.00 0.00 C ATOM 721 O THR A 45 127.078 -8.749 -12.026 1.00 0.00 O ATOM 722 CB THR A 45 128.447 -7.342 -9.214 1.00 0.00 C ATOM 723 OG1 THR A 45 127.925 -7.390 -7.894 1.00 0.00 O ATOM 724 CG2 THR A 45 127.759 -6.219 -9.995 1.00 0.00 C ATOM 0 H THR A 45 129.958 -9.274 -8.932 1.00 0.00 H new ATOM 0 HA THR A 45 127.243 -9.088 -9.562 1.00 0.00 H new ATOM 0 HB THR A 45 129.519 -7.149 -9.178 1.00 0.00 H new ATOM 0 HG1 THR A 45 128.186 -6.579 -7.409 1.00 0.00 H new ATOM 0 HG21 THR A 45 127.941 -5.266 -9.498 1.00 0.00 H new ATOM 0 HG22 THR A 45 128.159 -6.183 -11.008 1.00 0.00 H new ATOM 0 HG23 THR A 45 126.686 -6.408 -10.035 1.00 0.00 H new ATOM 732 N PRO A 46 129.173 -8.028 -12.028 1.00 0.00 N ATOM 733 CA PRO A 46 129.205 -7.795 -13.497 1.00 0.00 C ATOM 734 C PRO A 46 128.718 -9.012 -14.274 1.00 0.00 C ATOM 735 O PRO A 46 128.458 -8.932 -15.475 1.00 0.00 O ATOM 736 CB PRO A 46 130.679 -7.493 -13.808 1.00 0.00 C ATOM 737 CG PRO A 46 131.443 -7.792 -12.555 1.00 0.00 C ATOM 738 CD PRO A 46 130.451 -7.687 -11.401 1.00 0.00 C ATOM 0 HA PRO A 46 128.542 -6.982 -13.792 1.00 0.00 H new ATOM 0 HB2 PRO A 46 131.035 -8.106 -14.636 1.00 0.00 H new ATOM 0 HB3 PRO A 46 130.809 -6.452 -14.103 1.00 0.00 H new ATOM 0 HG2 PRO A 46 131.882 -8.789 -12.598 1.00 0.00 H new ATOM 0 HG3 PRO A 46 132.264 -7.087 -12.425 1.00 0.00 H new ATOM 0 HD2 PRO A 46 130.699 -8.375 -10.593 1.00 0.00 H new ATOM 0 HD3 PRO A 46 130.435 -6.685 -10.973 1.00 0.00 H new ATOM 746 N ILE A 47 128.582 -10.135 -13.578 1.00 0.00 N ATOM 747 CA ILE A 47 128.110 -11.354 -14.215 1.00 0.00 C ATOM 748 C ILE A 47 126.590 -11.394 -14.179 1.00 0.00 C ATOM 749 O ILE A 47 125.936 -11.604 -15.202 1.00 0.00 O ATOM 750 CB ILE A 47 128.681 -12.575 -13.497 1.00 0.00 C ATOM 751 CG1 ILE A 47 130.197 -12.415 -13.360 1.00 0.00 C ATOM 752 CG2 ILE A 47 128.372 -13.832 -14.311 1.00 0.00 C ATOM 753 CD1 ILE A 47 130.860 -13.793 -13.359 1.00 0.00 C ATOM 0 H ILE A 47 128.790 -10.225 -12.583 1.00 0.00 H new ATOM 0 HA ILE A 47 128.445 -11.368 -15.252 1.00 0.00 H new ATOM 0 HB ILE A 47 128.232 -12.664 -12.508 1.00 0.00 H new ATOM 0 HG12 ILE A 47 130.585 -11.814 -14.182 1.00 0.00 H new ATOM 0 HG13 ILE A 47 130.435 -11.885 -12.438 1.00 0.00 H new ATOM 0 HG21 ILE A 47 128.779 -14.705 -13.801 1.00 0.00 H new ATOM 0 HG22 ILE A 47 127.293 -13.942 -14.415 1.00 0.00 H new ATOM 0 HG23 ILE A 47 128.824 -13.746 -15.299 1.00 0.00 H new ATOM 0 HD11 ILE A 47 131.939 -13.677 -13.261 1.00 0.00 H new ATOM 0 HD12 ILE A 47 130.481 -14.379 -12.522 1.00 0.00 H new ATOM 0 HD13 ILE A 47 130.633 -14.307 -14.293 1.00 0.00 H new ATOM 765 N LEU A 48 126.031 -11.172 -12.995 1.00 0.00 N ATOM 766 CA LEU A 48 124.587 -11.167 -12.840 1.00 0.00 C ATOM 767 C LEU A 48 123.996 -9.995 -13.615 1.00 0.00 C ATOM 768 O LEU A 48 122.890 -10.084 -14.147 1.00 0.00 O ATOM 769 CB LEU A 48 124.219 -11.079 -11.353 1.00 0.00 C ATOM 770 CG LEU A 48 123.337 -9.855 -11.094 1.00 0.00 C ATOM 771 CD1 LEU A 48 121.993 -10.029 -11.801 1.00 0.00 C ATOM 772 CD2 LEU A 48 123.100 -9.710 -9.589 1.00 0.00 C ATOM 0 H LEU A 48 126.553 -10.995 -12.137 1.00 0.00 H new ATOM 0 HA LEU A 48 124.174 -12.094 -13.239 1.00 0.00 H new ATOM 0 HB2 LEU A 48 123.695 -11.984 -11.047 1.00 0.00 H new ATOM 0 HB3 LEU A 48 125.125 -11.016 -10.750 1.00 0.00 H new ATOM 0 HG LEU A 48 123.835 -8.964 -11.477 1.00 0.00 H new ATOM 0 HD11 LEU A 48 121.368 -9.156 -11.614 1.00 0.00 H new ATOM 0 HD12 LEU A 48 122.157 -10.135 -12.873 1.00 0.00 H new ATOM 0 HD13 LEU A 48 121.494 -10.920 -11.420 1.00 0.00 H new ATOM 0 HD21 LEU A 48 122.472 -8.839 -9.402 1.00 0.00 H new ATOM 0 HD22 LEU A 48 122.603 -10.604 -9.211 1.00 0.00 H new ATOM 0 HD23 LEU A 48 124.056 -9.584 -9.081 1.00 0.00 H new ATOM 784 N ALA A 49 124.748 -8.897 -13.690 1.00 0.00 N ATOM 785 CA ALA A 49 124.287 -7.723 -14.420 1.00 0.00 C ATOM 786 C ALA A 49 124.199 -8.032 -15.910 1.00 0.00 C ATOM 787 O ALA A 49 123.381 -7.459 -16.628 1.00 0.00 O ATOM 788 CB ALA A 49 125.246 -6.553 -14.190 1.00 0.00 C ATOM 0 H ALA A 49 125.667 -8.799 -13.259 1.00 0.00 H new ATOM 0 HA ALA A 49 123.297 -7.450 -14.055 1.00 0.00 H new ATOM 0 HB1 ALA A 49 124.893 -5.680 -14.739 1.00 0.00 H new ATOM 0 HB2 ALA A 49 125.287 -6.320 -13.126 1.00 0.00 H new ATOM 0 HB3 ALA A 49 126.242 -6.824 -14.541 1.00 0.00 H new ATOM 794 N ASP A 50 125.034 -8.954 -16.368 1.00 0.00 N ATOM 795 CA ASP A 50 125.015 -9.339 -17.770 1.00 0.00 C ATOM 796 C ASP A 50 123.861 -10.300 -18.006 1.00 0.00 C ATOM 797 O ASP A 50 123.292 -10.356 -19.097 1.00 0.00 O ATOM 798 CB ASP A 50 126.337 -10.006 -18.155 1.00 0.00 C ATOM 799 CG ASP A 50 127.205 -9.028 -18.939 1.00 0.00 C ATOM 800 OD1 ASP A 50 127.331 -7.896 -18.502 1.00 0.00 O ATOM 801 OD2 ASP A 50 127.732 -9.425 -19.965 1.00 0.00 O ATOM 0 H ASP A 50 125.724 -9.443 -15.798 1.00 0.00 H new ATOM 0 HA ASP A 50 124.884 -8.450 -18.387 1.00 0.00 H new ATOM 0 HB2 ASP A 50 126.863 -10.334 -17.258 1.00 0.00 H new ATOM 0 HB3 ASP A 50 126.144 -10.895 -18.755 1.00 0.00 H new ATOM 806 N MET A 51 123.515 -11.044 -16.962 1.00 0.00 N ATOM 807 CA MET A 51 122.419 -11.997 -17.042 1.00 0.00 C ATOM 808 C MET A 51 121.082 -11.270 -17.015 1.00 0.00 C ATOM 809 O MET A 51 120.253 -11.443 -17.908 1.00 0.00 O ATOM 810 CB MET A 51 122.500 -12.981 -15.875 1.00 0.00 C ATOM 811 CG MET A 51 121.909 -14.324 -16.302 1.00 0.00 C ATOM 812 SD MET A 51 120.104 -14.209 -16.304 1.00 0.00 S ATOM 813 CE MET A 51 119.864 -14.482 -14.534 1.00 0.00 C ATOM 0 H MET A 51 123.977 -11.005 -16.054 1.00 0.00 H new ATOM 0 HA MET A 51 122.500 -12.546 -17.980 1.00 0.00 H new ATOM 0 HB2 MET A 51 123.537 -13.110 -15.565 1.00 0.00 H new ATOM 0 HB3 MET A 51 121.956 -12.589 -15.016 1.00 0.00 H new ATOM 0 HG2 MET A 51 122.269 -14.593 -17.295 1.00 0.00 H new ATOM 0 HG3 MET A 51 122.234 -15.110 -15.621 1.00 0.00 H new ATOM 0 HE1 MET A 51 119.312 -15.410 -14.380 1.00 0.00 H new ATOM 0 HE2 MET A 51 120.834 -14.551 -14.042 1.00 0.00 H new ATOM 0 HE3 MET A 51 119.301 -13.650 -14.111 1.00 0.00 H new ATOM 823 N TYR A 52 120.879 -10.453 -15.989 1.00 0.00 N ATOM 824 CA TYR A 52 119.634 -9.705 -15.874 1.00 0.00 C ATOM 825 C TYR A 52 119.542 -8.681 -16.998 1.00 0.00 C ATOM 826 O TYR A 52 118.451 -8.275 -17.394 1.00 0.00 O ATOM 827 CB TYR A 52 119.547 -9.008 -14.512 1.00 0.00 C ATOM 828 CG TYR A 52 119.940 -7.559 -14.659 1.00 0.00 C ATOM 829 CD1 TYR A 52 121.150 -7.231 -15.273 1.00 0.00 C ATOM 830 CD2 TYR A 52 119.096 -6.547 -14.187 1.00 0.00 C ATOM 831 CE1 TYR A 52 121.521 -5.889 -15.419 1.00 0.00 C ATOM 832 CE2 TYR A 52 119.467 -5.203 -14.330 1.00 0.00 C ATOM 833 CZ TYR A 52 120.680 -4.875 -14.947 1.00 0.00 C ATOM 834 OH TYR A 52 121.045 -3.552 -15.091 1.00 0.00 O ATOM 0 H TYR A 52 121.548 -10.293 -15.236 1.00 0.00 H new ATOM 0 HA TYR A 52 118.799 -10.400 -15.956 1.00 0.00 H new ATOM 0 HB2 TYR A 52 118.533 -9.082 -14.118 1.00 0.00 H new ATOM 0 HB3 TYR A 52 120.204 -9.503 -13.796 1.00 0.00 H new ATOM 0 HD1 TYR A 52 121.800 -8.013 -15.636 1.00 0.00 H new ATOM 0 HD2 TYR A 52 118.160 -6.802 -13.713 1.00 0.00 H new ATOM 0 HE1 TYR A 52 122.456 -5.636 -15.896 1.00 0.00 H new ATOM 0 HE2 TYR A 52 118.818 -4.421 -13.965 1.00 0.00 H new ATOM 0 HH TYR A 52 120.291 -3.043 -15.456 1.00 0.00 H new ATOM 844 N SER A 53 120.700 -8.272 -17.518 1.00 0.00 N ATOM 845 CA SER A 53 120.729 -7.302 -18.603 1.00 0.00 C ATOM 846 C SER A 53 120.214 -7.934 -19.888 1.00 0.00 C ATOM 847 O SER A 53 119.439 -7.324 -20.623 1.00 0.00 O ATOM 848 CB SER A 53 122.153 -6.789 -18.814 1.00 0.00 C ATOM 849 OG SER A 53 122.241 -6.158 -20.084 1.00 0.00 O ATOM 0 H SER A 53 121.617 -8.595 -17.208 1.00 0.00 H new ATOM 0 HA SER A 53 120.085 -6.464 -18.337 1.00 0.00 H new ATOM 0 HB2 SER A 53 122.419 -6.084 -18.026 1.00 0.00 H new ATOM 0 HB3 SER A 53 122.862 -7.615 -18.755 1.00 0.00 H new ATOM 0 HG SER A 53 123.153 -5.826 -20.222 1.00 0.00 H new ATOM 855 N GLU A 54 120.635 -9.168 -20.146 1.00 0.00 N ATOM 856 CA GLU A 54 120.188 -9.869 -21.339 1.00 0.00 C ATOM 857 C GLU A 54 118.708 -10.201 -21.203 1.00 0.00 C ATOM 858 O GLU A 54 117.906 -9.915 -22.095 1.00 0.00 O ATOM 859 CB GLU A 54 121.013 -11.146 -21.532 1.00 0.00 C ATOM 860 CG GLU A 54 120.089 -12.332 -21.810 1.00 0.00 C ATOM 861 CD GLU A 54 119.234 -12.054 -23.042 1.00 0.00 C ATOM 862 OE1 GLU A 54 119.805 -11.780 -24.085 1.00 0.00 O ATOM 863 OE2 GLU A 54 118.022 -12.120 -22.925 1.00 0.00 O ATOM 0 H GLU A 54 121.276 -9.695 -19.553 1.00 0.00 H new ATOM 0 HA GLU A 54 120.329 -9.234 -22.214 1.00 0.00 H new ATOM 0 HB2 GLU A 54 121.710 -11.016 -22.360 1.00 0.00 H new ATOM 0 HB3 GLU A 54 121.610 -11.341 -20.641 1.00 0.00 H new ATOM 0 HG2 GLU A 54 120.680 -13.235 -21.964 1.00 0.00 H new ATOM 0 HG3 GLU A 54 119.449 -12.514 -20.947 1.00 0.00 H new ATOM 870 N LEU A 55 118.353 -10.790 -20.069 1.00 0.00 N ATOM 871 CA LEU A 55 116.966 -11.142 -19.812 1.00 0.00 C ATOM 872 C LEU A 55 116.088 -9.903 -19.913 1.00 0.00 C ATOM 873 O LEU A 55 114.995 -9.954 -20.475 1.00 0.00 O ATOM 874 CB LEU A 55 116.831 -11.767 -18.421 1.00 0.00 C ATOM 875 CG LEU A 55 116.834 -13.291 -18.545 1.00 0.00 C ATOM 876 CD1 LEU A 55 116.720 -13.918 -17.153 1.00 0.00 C ATOM 877 CD2 LEU A 55 115.644 -13.738 -19.400 1.00 0.00 C ATOM 0 H LEU A 55 119.001 -11.032 -19.319 1.00 0.00 H new ATOM 0 HA LEU A 55 116.642 -11.868 -20.558 1.00 0.00 H new ATOM 0 HB2 LEU A 55 117.653 -11.442 -17.783 1.00 0.00 H new ATOM 0 HB3 LEU A 55 115.908 -11.432 -17.948 1.00 0.00 H new ATOM 0 HG LEU A 55 117.763 -13.613 -19.016 1.00 0.00 H new ATOM 0 HD11 LEU A 55 116.722 -15.004 -17.242 1.00 0.00 H new ATOM 0 HD12 LEU A 55 117.565 -13.602 -16.541 1.00 0.00 H new ATOM 0 HD13 LEU A 55 115.791 -13.594 -16.683 1.00 0.00 H new ATOM 0 HD21 LEU A 55 115.647 -14.824 -19.488 1.00 0.00 H new ATOM 0 HD22 LEU A 55 114.716 -13.414 -18.929 1.00 0.00 H new ATOM 0 HD23 LEU A 55 115.722 -13.294 -20.392 1.00 0.00 H new ATOM 889 N VAL A 56 116.576 -8.785 -19.379 1.00 0.00 N ATOM 890 CA VAL A 56 115.821 -7.537 -19.432 1.00 0.00 C ATOM 891 C VAL A 56 115.520 -7.186 -20.875 1.00 0.00 C ATOM 892 O VAL A 56 114.377 -6.897 -21.232 1.00 0.00 O ATOM 893 CB VAL A 56 116.614 -6.410 -18.769 1.00 0.00 C ATOM 894 CG1 VAL A 56 115.968 -5.065 -19.107 1.00 0.00 C ATOM 895 CG2 VAL A 56 116.607 -6.609 -17.252 1.00 0.00 C ATOM 0 H VAL A 56 117.480 -8.718 -18.910 1.00 0.00 H new ATOM 0 HA VAL A 56 114.883 -7.664 -18.891 1.00 0.00 H new ATOM 0 HB VAL A 56 117.641 -6.423 -19.135 1.00 0.00 H new ATOM 0 HG11 VAL A 56 116.533 -4.261 -18.635 1.00 0.00 H new ATOM 0 HG12 VAL A 56 115.968 -4.922 -20.188 1.00 0.00 H new ATOM 0 HG13 VAL A 56 114.942 -5.052 -18.740 1.00 0.00 H new ATOM 0 HG21 VAL A 56 117.172 -5.807 -16.777 1.00 0.00 H new ATOM 0 HG22 VAL A 56 115.580 -6.594 -16.888 1.00 0.00 H new ATOM 0 HG23 VAL A 56 117.065 -7.568 -17.009 1.00 0.00 H new ATOM 905 N ASP A 57 116.545 -7.243 -21.708 1.00 0.00 N ATOM 906 CA ASP A 57 116.371 -6.961 -23.119 1.00 0.00 C ATOM 907 C ASP A 57 115.245 -7.829 -23.658 1.00 0.00 C ATOM 908 O ASP A 57 114.499 -7.428 -24.551 1.00 0.00 O ATOM 909 CB ASP A 57 117.666 -7.270 -23.864 1.00 0.00 C ATOM 910 CG ASP A 57 117.703 -6.514 -25.189 1.00 0.00 C ATOM 911 OD1 ASP A 57 117.714 -5.295 -25.152 1.00 0.00 O ATOM 912 OD2 ASP A 57 117.721 -7.166 -26.220 1.00 0.00 O ATOM 0 H ASP A 57 117.498 -7.480 -21.433 1.00 0.00 H new ATOM 0 HA ASP A 57 116.123 -5.909 -23.261 1.00 0.00 H new ATOM 0 HB2 ASP A 57 118.523 -6.988 -23.252 1.00 0.00 H new ATOM 0 HB3 ASP A 57 117.743 -8.342 -24.046 1.00 0.00 H new ATOM 917 N ASP A 58 115.132 -9.025 -23.089 1.00 0.00 N ATOM 918 CA ASP A 58 114.095 -9.965 -23.486 1.00 0.00 C ATOM 919 C ASP A 58 112.862 -9.785 -22.616 1.00 0.00 C ATOM 920 O ASP A 58 112.040 -10.692 -22.485 1.00 0.00 O ATOM 921 CB ASP A 58 114.613 -11.396 -23.340 1.00 0.00 C ATOM 922 CG ASP A 58 114.742 -12.049 -24.712 1.00 0.00 C ATOM 923 OD1 ASP A 58 115.517 -11.551 -25.513 1.00 0.00 O ATOM 924 OD2 ASP A 58 114.066 -13.038 -24.941 1.00 0.00 O ATOM 0 H ASP A 58 115.748 -9.365 -22.350 1.00 0.00 H new ATOM 0 HA ASP A 58 113.829 -9.775 -24.526 1.00 0.00 H new ATOM 0 HB2 ASP A 58 115.581 -11.391 -22.838 1.00 0.00 H new ATOM 0 HB3 ASP A 58 113.933 -11.975 -22.715 1.00 0.00 H new ATOM 929 N SER A 59 112.752 -8.613 -22.009 1.00 0.00 N ATOM 930 CA SER A 59 111.626 -8.325 -21.132 1.00 0.00 C ATOM 931 C SER A 59 111.770 -9.131 -19.850 1.00 0.00 C ATOM 932 O SER A 59 110.796 -9.396 -19.146 1.00 0.00 O ATOM 933 CB SER A 59 110.309 -8.677 -21.823 1.00 0.00 C ATOM 934 OG SER A 59 109.631 -9.669 -21.064 1.00 0.00 O ATOM 0 H SER A 59 113.423 -7.851 -22.106 1.00 0.00 H new ATOM 0 HA SER A 59 111.619 -7.261 -20.897 1.00 0.00 H new ATOM 0 HB2 SER A 59 109.686 -7.788 -21.919 1.00 0.00 H new ATOM 0 HB3 SER A 59 110.501 -9.042 -22.832 1.00 0.00 H new ATOM 0 HG SER A 59 109.507 -9.350 -20.146 1.00 0.00 H new ATOM 940 N ALA A 60 113.008 -9.512 -19.570 1.00 0.00 N ATOM 941 CA ALA A 60 113.334 -10.292 -18.383 1.00 0.00 C ATOM 942 C ALA A 60 112.075 -10.761 -17.662 1.00 0.00 C ATOM 943 O ALA A 60 111.533 -10.057 -16.810 1.00 0.00 O ATOM 944 CB ALA A 60 114.184 -9.451 -17.436 1.00 0.00 C ATOM 0 H ALA A 60 113.813 -9.291 -20.156 1.00 0.00 H new ATOM 0 HA ALA A 60 113.891 -11.174 -18.699 1.00 0.00 H new ATOM 0 HB1 ALA A 60 114.427 -10.036 -16.549 1.00 0.00 H new ATOM 0 HB2 ALA A 60 115.105 -9.155 -17.939 1.00 0.00 H new ATOM 0 HB3 ALA A 60 113.629 -8.560 -17.143 1.00 0.00 H new ATOM 950 N PRO A 61 111.613 -11.935 -17.991 1.00 0.00 N ATOM 951 CA PRO A 61 110.393 -12.535 -17.370 1.00 0.00 C ATOM 952 C PRO A 61 110.551 -12.746 -15.865 1.00 0.00 C ATOM 953 O PRO A 61 110.061 -13.735 -15.318 1.00 0.00 O ATOM 954 CB PRO A 61 110.234 -13.883 -18.086 1.00 0.00 C ATOM 955 CG PRO A 61 111.074 -13.799 -19.317 1.00 0.00 C ATOM 956 CD PRO A 61 112.202 -12.823 -19.001 1.00 0.00 C ATOM 0 HA PRO A 61 109.527 -11.882 -17.479 1.00 0.00 H new ATOM 0 HB2 PRO A 61 110.559 -14.704 -17.447 1.00 0.00 H new ATOM 0 HB3 PRO A 61 109.190 -14.070 -18.338 1.00 0.00 H new ATOM 0 HG2 PRO A 61 111.471 -14.778 -19.584 1.00 0.00 H new ATOM 0 HG3 PRO A 61 110.486 -13.451 -20.166 1.00 0.00 H new ATOM 0 HD2 PRO A 61 113.083 -13.338 -18.618 1.00 0.00 H new ATOM 0 HD3 PRO A 61 112.515 -12.271 -19.887 1.00 0.00 H new ATOM 964 N PHE A 62 111.225 -11.815 -15.198 1.00 0.00 N ATOM 965 CA PHE A 62 111.416 -11.928 -13.759 1.00 0.00 C ATOM 966 C PHE A 62 112.039 -10.660 -13.171 1.00 0.00 C ATOM 967 O PHE A 62 112.719 -9.905 -13.866 1.00 0.00 O ATOM 968 CB PHE A 62 112.279 -13.149 -13.452 1.00 0.00 C ATOM 969 CG PHE A 62 113.734 -12.771 -13.430 1.00 0.00 C ATOM 970 CD1 PHE A 62 114.264 -11.959 -14.436 1.00 0.00 C ATOM 971 CD2 PHE A 62 114.558 -13.250 -12.407 1.00 0.00 C ATOM 972 CE1 PHE A 62 115.620 -11.624 -14.418 1.00 0.00 C ATOM 973 CE2 PHE A 62 115.912 -12.914 -12.386 1.00 0.00 C ATOM 974 CZ PHE A 62 116.447 -12.100 -13.393 1.00 0.00 C ATOM 0 H PHE A 62 111.642 -10.987 -15.623 1.00 0.00 H new ATOM 0 HA PHE A 62 110.439 -12.051 -13.291 1.00 0.00 H new ATOM 0 HB2 PHE A 62 111.992 -13.572 -12.489 1.00 0.00 H new ATOM 0 HB3 PHE A 62 112.109 -13.921 -14.203 1.00 0.00 H new ATOM 0 HD1 PHE A 62 113.626 -11.591 -15.226 1.00 0.00 H new ATOM 0 HD2 PHE A 62 114.146 -13.880 -11.633 1.00 0.00 H new ATOM 0 HE1 PHE A 62 116.031 -10.997 -15.195 1.00 0.00 H new ATOM 0 HE2 PHE A 62 116.547 -13.281 -11.594 1.00 0.00 H new ATOM 0 HZ PHE A 62 117.495 -11.840 -13.379 1.00 0.00 H new ATOM 984 N GLU A 63 111.780 -10.436 -11.884 1.00 0.00 N ATOM 985 CA GLU A 63 112.290 -9.255 -11.185 1.00 0.00 C ATOM 986 C GLU A 63 113.302 -9.647 -10.112 1.00 0.00 C ATOM 987 O GLU A 63 113.204 -10.715 -9.511 1.00 0.00 O ATOM 988 CB GLU A 63 111.124 -8.511 -10.533 1.00 0.00 C ATOM 989 CG GLU A 63 111.611 -7.166 -9.995 1.00 0.00 C ATOM 990 CD GLU A 63 111.345 -7.077 -8.496 1.00 0.00 C ATOM 991 OE1 GLU A 63 111.445 -8.097 -7.835 1.00 0.00 O ATOM 992 OE2 GLU A 63 111.047 -5.989 -8.031 1.00 0.00 O ATOM 0 H GLU A 63 111.219 -11.058 -11.302 1.00 0.00 H new ATOM 0 HA GLU A 63 112.789 -8.613 -11.911 1.00 0.00 H new ATOM 0 HB2 GLU A 63 110.326 -8.356 -11.260 1.00 0.00 H new ATOM 0 HB3 GLU A 63 110.706 -9.108 -9.723 1.00 0.00 H new ATOM 0 HG2 GLU A 63 112.677 -7.051 -10.191 1.00 0.00 H new ATOM 0 HG3 GLU A 63 111.102 -6.352 -10.512 1.00 0.00 H new ATOM 999 N ILE A 64 114.269 -8.764 -9.874 1.00 0.00 N ATOM 1000 CA ILE A 64 115.293 -9.016 -8.864 1.00 0.00 C ATOM 1001 C ILE A 64 114.995 -8.225 -7.593 1.00 0.00 C ATOM 1002 O ILE A 64 114.527 -7.088 -7.652 1.00 0.00 O ATOM 1003 CB ILE A 64 116.675 -8.621 -9.402 1.00 0.00 C ATOM 1004 CG1 ILE A 64 117.478 -9.881 -9.727 1.00 0.00 C ATOM 1005 CG2 ILE A 64 117.430 -7.806 -8.347 1.00 0.00 C ATOM 1006 CD1 ILE A 64 116.732 -10.707 -10.776 1.00 0.00 C ATOM 0 H ILE A 64 114.365 -7.874 -10.363 1.00 0.00 H new ATOM 0 HA ILE A 64 115.289 -10.080 -8.629 1.00 0.00 H new ATOM 0 HB ILE A 64 116.547 -8.022 -10.303 1.00 0.00 H new ATOM 0 HG12 ILE A 64 118.466 -9.609 -10.098 1.00 0.00 H new ATOM 0 HG13 ILE A 64 117.629 -10.472 -8.824 1.00 0.00 H new ATOM 0 HG21 ILE A 64 118.410 -7.528 -8.735 1.00 0.00 H new ATOM 0 HG22 ILE A 64 116.865 -6.905 -8.111 1.00 0.00 H new ATOM 0 HG23 ILE A 64 117.553 -8.404 -7.444 1.00 0.00 H new ATOM 0 HD11 ILE A 64 117.305 -11.605 -11.007 1.00 0.00 H new ATOM 0 HD12 ILE A 64 115.754 -10.991 -10.387 1.00 0.00 H new ATOM 0 HD13 ILE A 64 116.605 -10.115 -11.682 1.00 0.00 H new ATOM 1018 N ILE A 65 115.278 -8.833 -6.447 1.00 0.00 N ATOM 1019 CA ILE A 65 115.047 -8.175 -5.166 1.00 0.00 C ATOM 1020 C ILE A 65 116.377 -7.746 -4.553 1.00 0.00 C ATOM 1021 O ILE A 65 117.358 -8.492 -4.598 1.00 0.00 O ATOM 1022 CB ILE A 65 114.323 -9.122 -4.208 1.00 0.00 C ATOM 1023 CG1 ILE A 65 113.212 -9.868 -4.958 1.00 0.00 C ATOM 1024 CG2 ILE A 65 113.717 -8.317 -3.056 1.00 0.00 C ATOM 1025 CD1 ILE A 65 111.853 -9.248 -4.626 1.00 0.00 C ATOM 0 H ILE A 65 115.665 -9.774 -6.378 1.00 0.00 H new ATOM 0 HA ILE A 65 114.426 -7.295 -5.333 1.00 0.00 H new ATOM 0 HB ILE A 65 115.034 -9.846 -3.810 1.00 0.00 H new ATOM 0 HG12 ILE A 65 113.391 -9.820 -6.032 1.00 0.00 H new ATOM 0 HG13 ILE A 65 113.218 -10.922 -4.681 1.00 0.00 H new ATOM 0 HG21 ILE A 65 113.201 -8.991 -2.373 1.00 0.00 H new ATOM 0 HG22 ILE A 65 114.510 -7.795 -2.520 1.00 0.00 H new ATOM 0 HG23 ILE A 65 113.008 -7.590 -3.453 1.00 0.00 H new ATOM 0 HD11 ILE A 65 111.069 -9.782 -5.162 1.00 0.00 H new ATOM 0 HD12 ILE A 65 111.673 -9.319 -3.553 1.00 0.00 H new ATOM 0 HD13 ILE A 65 111.848 -8.200 -4.926 1.00 0.00 H new ATOM 1037 N PHE A 66 116.407 -6.545 -3.980 1.00 0.00 N ATOM 1038 CA PHE A 66 117.631 -6.038 -3.368 1.00 0.00 C ATOM 1039 C PHE A 66 117.524 -6.045 -1.846 1.00 0.00 C ATOM 1040 O PHE A 66 116.827 -5.220 -1.257 1.00 0.00 O ATOM 1041 CB PHE A 66 117.903 -4.614 -3.853 1.00 0.00 C ATOM 1042 CG PHE A 66 119.386 -4.431 -4.067 1.00 0.00 C ATOM 1043 CD1 PHE A 66 119.967 -4.786 -5.291 1.00 0.00 C ATOM 1044 CD2 PHE A 66 120.182 -3.905 -3.042 1.00 0.00 C ATOM 1045 CE1 PHE A 66 121.341 -4.616 -5.490 1.00 0.00 C ATOM 1046 CE2 PHE A 66 121.557 -3.734 -3.241 1.00 0.00 C ATOM 1047 CZ PHE A 66 122.137 -4.090 -4.465 1.00 0.00 C ATOM 0 H PHE A 66 115.609 -5.912 -3.927 1.00 0.00 H new ATOM 0 HA PHE A 66 118.454 -6.690 -3.662 1.00 0.00 H new ATOM 0 HB2 PHE A 66 117.365 -4.425 -4.782 1.00 0.00 H new ATOM 0 HB3 PHE A 66 117.538 -3.893 -3.121 1.00 0.00 H new ATOM 0 HD1 PHE A 66 119.353 -5.191 -6.082 1.00 0.00 H new ATOM 0 HD2 PHE A 66 119.735 -3.631 -2.098 1.00 0.00 H new ATOM 0 HE1 PHE A 66 121.788 -4.890 -6.434 1.00 0.00 H new ATOM 0 HE2 PHE A 66 122.171 -3.328 -2.451 1.00 0.00 H new ATOM 0 HZ PHE A 66 123.198 -3.959 -4.618 1.00 0.00 H new ATOM 1057 N VAL A 67 118.231 -6.978 -1.216 1.00 0.00 N ATOM 1058 CA VAL A 67 118.221 -7.084 0.240 1.00 0.00 C ATOM 1059 C VAL A 67 119.648 -7.230 0.761 1.00 0.00 C ATOM 1060 O VAL A 67 120.608 -7.107 0.000 1.00 0.00 O ATOM 1061 CB VAL A 67 117.387 -8.288 0.677 1.00 0.00 C ATOM 1062 CG1 VAL A 67 116.466 -7.881 1.829 1.00 0.00 C ATOM 1063 CG2 VAL A 67 116.539 -8.779 -0.499 1.00 0.00 C ATOM 0 H VAL A 67 118.815 -7.668 -1.687 1.00 0.00 H new ATOM 0 HA VAL A 67 117.778 -6.178 0.654 1.00 0.00 H new ATOM 0 HB VAL A 67 118.052 -9.087 1.005 1.00 0.00 H new ATOM 0 HG11 VAL A 67 115.871 -8.740 2.140 1.00 0.00 H new ATOM 0 HG12 VAL A 67 117.067 -7.532 2.669 1.00 0.00 H new ATOM 0 HG13 VAL A 67 115.803 -7.081 1.500 1.00 0.00 H new ATOM 0 HG21 VAL A 67 115.945 -9.638 -0.186 1.00 0.00 H new ATOM 0 HG22 VAL A 67 115.876 -7.979 -0.828 1.00 0.00 H new ATOM 0 HG23 VAL A 67 117.192 -9.070 -1.322 1.00 0.00 H new ATOM 1073 N SER A 68 119.785 -7.493 2.057 1.00 0.00 N ATOM 1074 CA SER A 68 121.108 -7.652 2.654 1.00 0.00 C ATOM 1075 C SER A 68 121.626 -6.314 3.168 1.00 0.00 C ATOM 1076 O SER A 68 121.289 -5.262 2.628 1.00 0.00 O ATOM 1077 CB SER A 68 122.083 -8.215 1.623 1.00 0.00 C ATOM 1078 OG SER A 68 123.059 -9.009 2.285 1.00 0.00 O ATOM 0 H SER A 68 119.007 -7.600 2.708 1.00 0.00 H new ATOM 0 HA SER A 68 121.027 -8.345 3.491 1.00 0.00 H new ATOM 0 HB2 SER A 68 121.547 -8.815 0.888 1.00 0.00 H new ATOM 0 HB3 SER A 68 122.566 -7.402 1.080 1.00 0.00 H new ATOM 0 HG SER A 68 122.684 -9.893 2.480 1.00 0.00 H new ATOM 1084 N SER A 69 122.444 -6.364 4.216 1.00 0.00 N ATOM 1085 CA SER A 69 123.003 -5.150 4.804 1.00 0.00 C ATOM 1086 C SER A 69 123.323 -4.118 3.725 1.00 0.00 C ATOM 1087 O SER A 69 124.486 -3.889 3.391 1.00 0.00 O ATOM 1088 CB SER A 69 124.277 -5.486 5.580 1.00 0.00 C ATOM 1089 OG SER A 69 124.725 -6.783 5.208 1.00 0.00 O ATOM 0 H SER A 69 122.734 -7.228 4.674 1.00 0.00 H new ATOM 0 HA SER A 69 122.261 -4.728 5.481 1.00 0.00 H new ATOM 0 HB2 SER A 69 125.050 -4.747 5.370 1.00 0.00 H new ATOM 0 HB3 SER A 69 124.084 -5.449 6.652 1.00 0.00 H new ATOM 0 HG SER A 69 125.543 -7.001 5.702 1.00 0.00 H new ATOM 1095 N ASP A 70 122.280 -3.493 3.192 1.00 0.00 N ATOM 1096 CA ASP A 70 122.442 -2.480 2.157 1.00 0.00 C ATOM 1097 C ASP A 70 121.997 -1.127 2.685 1.00 0.00 C ATOM 1098 O ASP A 70 121.844 -0.173 1.924 1.00 0.00 O ATOM 1099 CB ASP A 70 121.616 -2.834 0.924 1.00 0.00 C ATOM 1100 CG ASP A 70 122.126 -4.134 0.308 1.00 0.00 C ATOM 1101 OD1 ASP A 70 123.199 -4.111 -0.271 1.00 0.00 O ATOM 1102 OD2 ASP A 70 121.434 -5.131 0.424 1.00 0.00 O ATOM 0 H ASP A 70 121.312 -3.670 3.460 1.00 0.00 H new ATOM 0 HA ASP A 70 123.495 -2.439 1.879 1.00 0.00 H new ATOM 0 HB2 ASP A 70 120.566 -2.939 1.198 1.00 0.00 H new ATOM 0 HB3 ASP A 70 121.676 -2.028 0.193 1.00 0.00 H new ATOM 1107 N ARG A 71 121.771 -1.067 3.992 1.00 0.00 N ATOM 1108 CA ARG A 71 121.323 0.163 4.636 1.00 0.00 C ATOM 1109 C ARG A 71 121.880 1.394 3.930 1.00 0.00 C ATOM 1110 O ARG A 71 121.461 2.517 4.209 1.00 0.00 O ATOM 1111 CB ARG A 71 121.760 0.172 6.102 1.00 0.00 C ATOM 1112 CG ARG A 71 123.288 0.199 6.180 1.00 0.00 C ATOM 1113 CD ARG A 71 123.761 1.629 6.442 1.00 0.00 C ATOM 1114 NE ARG A 71 123.270 2.095 7.734 1.00 0.00 N ATOM 1115 CZ ARG A 71 123.747 1.597 8.870 1.00 0.00 C ATOM 1116 NH1 ARG A 71 124.670 0.675 8.842 1.00 0.00 N ATOM 1117 NH2 ARG A 71 123.291 2.030 10.014 1.00 0.00 N ATOM 0 H ARG A 71 121.891 -1.856 4.627 1.00 0.00 H new ATOM 0 HA ARG A 71 120.235 0.197 4.575 1.00 0.00 H new ATOM 0 HB2 ARG A 71 121.344 1.042 6.611 1.00 0.00 H new ATOM 0 HB3 ARG A 71 121.375 -0.711 6.613 1.00 0.00 H new ATOM 0 HG2 ARG A 71 123.634 -0.461 6.976 1.00 0.00 H new ATOM 0 HG3 ARG A 71 123.717 -0.172 5.249 1.00 0.00 H new ATOM 0 HD2 ARG A 71 124.850 1.668 6.423 1.00 0.00 H new ATOM 0 HD3 ARG A 71 123.405 2.288 5.650 1.00 0.00 H new ATOM 0 HE ARG A 71 122.548 2.815 7.766 1.00 0.00 H new ATOM 0 HH11 ARG A 71 125.026 0.336 7.948 1.00 0.00 H new ATOM 0 HH12 ARG A 71 125.036 0.293 9.714 1.00 0.00 H new ATOM 0 HH21 ARG A 71 122.569 2.750 10.036 1.00 0.00 H new ATOM 0 HH22 ARG A 71 123.657 1.648 10.886 1.00 0.00 H new ATOM 1131 N SER A 72 122.811 1.186 3.005 1.00 0.00 N ATOM 1132 CA SER A 72 123.382 2.302 2.271 1.00 0.00 C ATOM 1133 C SER A 72 122.431 2.718 1.157 1.00 0.00 C ATOM 1134 O SER A 72 122.232 1.979 0.193 1.00 0.00 O ATOM 1135 CB SER A 72 124.733 1.904 1.676 1.00 0.00 C ATOM 1136 OG SER A 72 124.775 0.492 1.512 1.00 0.00 O ATOM 0 H SER A 72 123.179 0.270 2.751 1.00 0.00 H new ATOM 0 HA SER A 72 123.531 3.139 2.953 1.00 0.00 H new ATOM 0 HB2 SER A 72 124.880 2.398 0.716 1.00 0.00 H new ATOM 0 HB3 SER A 72 125.542 2.230 2.330 1.00 0.00 H new ATOM 0 HG SER A 72 125.686 0.170 1.677 1.00 0.00 H new ATOM 1142 N GLU A 73 121.843 3.899 1.297 1.00 0.00 N ATOM 1143 CA GLU A 73 120.911 4.393 0.293 1.00 0.00 C ATOM 1144 C GLU A 73 121.641 4.673 -1.011 1.00 0.00 C ATOM 1145 O GLU A 73 121.065 4.568 -2.095 1.00 0.00 O ATOM 1146 CB GLU A 73 120.232 5.672 0.789 1.00 0.00 C ATOM 1147 CG GLU A 73 119.028 5.307 1.658 1.00 0.00 C ATOM 1148 CD GLU A 73 119.425 4.249 2.682 1.00 0.00 C ATOM 1149 OE1 GLU A 73 119.883 3.195 2.269 1.00 0.00 O ATOM 1150 OE2 GLU A 73 119.266 4.506 3.864 1.00 0.00 O ATOM 0 H GLU A 73 121.993 4.527 2.087 1.00 0.00 H new ATOM 0 HA GLU A 73 120.152 3.630 0.118 1.00 0.00 H new ATOM 0 HB2 GLU A 73 120.939 6.273 1.362 1.00 0.00 H new ATOM 0 HB3 GLU A 73 119.912 6.278 -0.058 1.00 0.00 H new ATOM 0 HG2 GLU A 73 118.654 6.195 2.167 1.00 0.00 H new ATOM 0 HG3 GLU A 73 118.218 4.933 1.032 1.00 0.00 H new ATOM 1157 N ASP A 74 122.916 5.024 -0.898 1.00 0.00 N ATOM 1158 CA ASP A 74 123.716 5.311 -2.079 1.00 0.00 C ATOM 1159 C ASP A 74 124.142 4.016 -2.753 1.00 0.00 C ATOM 1160 O ASP A 74 124.038 3.882 -3.970 1.00 0.00 O ATOM 1161 CB ASP A 74 124.951 6.129 -1.697 1.00 0.00 C ATOM 1162 CG ASP A 74 125.775 6.440 -2.942 1.00 0.00 C ATOM 1163 OD1 ASP A 74 126.593 5.613 -3.308 1.00 0.00 O ATOM 1164 OD2 ASP A 74 125.578 7.502 -3.509 1.00 0.00 O ATOM 0 H ASP A 74 123.412 5.116 -0.012 1.00 0.00 H new ATOM 0 HA ASP A 74 123.110 5.890 -2.776 1.00 0.00 H new ATOM 0 HB2 ASP A 74 124.647 7.056 -1.211 1.00 0.00 H new ATOM 0 HB3 ASP A 74 125.556 5.576 -0.979 1.00 0.00 H new ATOM 1169 N ASP A 75 124.612 3.059 -1.960 1.00 0.00 N ATOM 1170 CA ASP A 75 125.031 1.783 -2.515 1.00 0.00 C ATOM 1171 C ASP A 75 123.829 1.065 -3.106 1.00 0.00 C ATOM 1172 O ASP A 75 123.963 0.238 -4.008 1.00 0.00 O ATOM 1173 CB ASP A 75 125.666 0.915 -1.430 1.00 0.00 C ATOM 1174 CG ASP A 75 126.846 1.646 -0.800 1.00 0.00 C ATOM 1175 OD1 ASP A 75 127.574 2.294 -1.533 1.00 0.00 O ATOM 1176 OD2 ASP A 75 127.005 1.545 0.405 1.00 0.00 O ATOM 0 H ASP A 75 124.710 3.142 -0.948 1.00 0.00 H new ATOM 0 HA ASP A 75 125.769 1.964 -3.297 1.00 0.00 H new ATOM 0 HB2 ASP A 75 124.927 0.675 -0.666 1.00 0.00 H new ATOM 0 HB3 ASP A 75 126.000 -0.030 -1.858 1.00 0.00 H new ATOM 1181 N MET A 76 122.647 1.393 -2.595 1.00 0.00 N ATOM 1182 CA MET A 76 121.424 0.780 -3.084 1.00 0.00 C ATOM 1183 C MET A 76 121.113 1.276 -4.489 1.00 0.00 C ATOM 1184 O MET A 76 121.043 0.489 -5.432 1.00 0.00 O ATOM 1185 CB MET A 76 120.257 1.112 -2.152 1.00 0.00 C ATOM 1186 CG MET A 76 119.384 -0.130 -1.966 1.00 0.00 C ATOM 1187 SD MET A 76 117.863 0.327 -1.100 1.00 0.00 S ATOM 1188 CE MET A 76 118.641 0.935 0.416 1.00 0.00 C ATOM 0 H MET A 76 122.513 2.075 -1.848 1.00 0.00 H new ATOM 0 HA MET A 76 121.564 -0.301 -3.109 1.00 0.00 H new ATOM 0 HB2 MET A 76 120.633 1.453 -1.188 1.00 0.00 H new ATOM 0 HB3 MET A 76 119.665 1.927 -2.569 1.00 0.00 H new ATOM 0 HG2 MET A 76 119.146 -0.569 -2.935 1.00 0.00 H new ATOM 0 HG3 MET A 76 119.925 -0.887 -1.398 1.00 0.00 H new ATOM 0 HE1 MET A 76 118.105 0.545 1.282 1.00 0.00 H new ATOM 0 HE2 MET A 76 119.678 0.603 0.451 1.00 0.00 H new ATOM 0 HE3 MET A 76 118.608 2.024 0.430 1.00 0.00 H new ATOM 1198 N PHE A 77 120.923 2.586 -4.627 1.00 0.00 N ATOM 1199 CA PHE A 77 120.613 3.161 -5.930 1.00 0.00 C ATOM 1200 C PHE A 77 121.846 3.174 -6.825 1.00 0.00 C ATOM 1201 O PHE A 77 121.732 3.200 -8.051 1.00 0.00 O ATOM 1202 CB PHE A 77 120.085 4.586 -5.756 1.00 0.00 C ATOM 1203 CG PHE A 77 119.356 4.694 -4.437 1.00 0.00 C ATOM 1204 CD1 PHE A 77 118.593 3.617 -3.969 1.00 0.00 C ATOM 1205 CD2 PHE A 77 119.444 5.869 -3.683 1.00 0.00 C ATOM 1206 CE1 PHE A 77 117.918 3.717 -2.746 1.00 0.00 C ATOM 1207 CE2 PHE A 77 118.769 5.969 -2.460 1.00 0.00 C ATOM 1208 CZ PHE A 77 118.005 4.893 -1.993 1.00 0.00 C ATOM 0 H PHE A 77 120.977 3.260 -3.863 1.00 0.00 H new ATOM 0 HA PHE A 77 119.849 2.545 -6.404 1.00 0.00 H new ATOM 0 HB2 PHE A 77 120.910 5.298 -5.787 1.00 0.00 H new ATOM 0 HB3 PHE A 77 119.414 4.840 -6.577 1.00 0.00 H new ATOM 0 HD1 PHE A 77 118.525 2.710 -4.551 1.00 0.00 H new ATOM 0 HD2 PHE A 77 120.033 6.699 -4.044 1.00 0.00 H new ATOM 0 HE1 PHE A 77 117.330 2.886 -2.384 1.00 0.00 H new ATOM 0 HE2 PHE A 77 118.838 6.876 -1.877 1.00 0.00 H new ATOM 0 HZ PHE A 77 117.482 4.971 -1.051 1.00 0.00 H new ATOM 1218 N GLN A 78 123.023 3.151 -6.211 1.00 0.00 N ATOM 1219 CA GLN A 78 124.264 3.158 -6.973 1.00 0.00 C ATOM 1220 C GLN A 78 124.541 1.774 -7.541 1.00 0.00 C ATOM 1221 O GLN A 78 124.699 1.607 -8.751 1.00 0.00 O ATOM 1222 CB GLN A 78 125.428 3.593 -6.081 1.00 0.00 C ATOM 1223 CG GLN A 78 126.720 3.611 -6.901 1.00 0.00 C ATOM 1224 CD GLN A 78 127.530 4.858 -6.567 1.00 0.00 C ATOM 1225 OE1 GLN A 78 127.014 5.974 -6.640 1.00 0.00 O ATOM 1226 NE2 GLN A 78 128.778 4.737 -6.205 1.00 0.00 N ATOM 0 H GLN A 78 123.143 3.128 -5.198 1.00 0.00 H new ATOM 0 HA GLN A 78 124.162 3.865 -7.796 1.00 0.00 H new ATOM 0 HB2 GLN A 78 125.233 4.583 -5.668 1.00 0.00 H new ATOM 0 HB3 GLN A 78 125.529 2.910 -5.238 1.00 0.00 H new ATOM 0 HG2 GLN A 78 127.308 2.718 -6.689 1.00 0.00 H new ATOM 0 HG3 GLN A 78 126.486 3.593 -7.965 1.00 0.00 H new ATOM 0 HE21 GLN A 78 129.204 3.812 -6.145 1.00 0.00 H new ATOM 0 HE22 GLN A 78 129.327 5.567 -5.982 1.00 0.00 H new ATOM 1235 N TYR A 79 124.596 0.785 -6.661 1.00 0.00 N ATOM 1236 CA TYR A 79 124.852 -0.584 -7.085 1.00 0.00 C ATOM 1237 C TYR A 79 123.677 -1.118 -7.898 1.00 0.00 C ATOM 1238 O TYR A 79 123.821 -2.084 -8.647 1.00 0.00 O ATOM 1239 CB TYR A 79 125.087 -1.478 -5.866 1.00 0.00 C ATOM 1240 CG TYR A 79 126.089 -2.552 -6.214 1.00 0.00 C ATOM 1241 CD1 TYR A 79 127.442 -2.223 -6.362 1.00 0.00 C ATOM 1242 CD2 TYR A 79 125.668 -3.875 -6.389 1.00 0.00 C ATOM 1243 CE1 TYR A 79 128.374 -3.217 -6.684 1.00 0.00 C ATOM 1244 CE2 TYR A 79 126.599 -4.870 -6.712 1.00 0.00 C ATOM 1245 CZ TYR A 79 127.952 -4.541 -6.859 1.00 0.00 C ATOM 1246 OH TYR A 79 128.870 -5.520 -7.177 1.00 0.00 O ATOM 0 H TYR A 79 124.468 0.903 -5.656 1.00 0.00 H new ATOM 0 HA TYR A 79 125.745 -0.591 -7.710 1.00 0.00 H new ATOM 0 HB2 TYR A 79 125.453 -0.882 -5.030 1.00 0.00 H new ATOM 0 HB3 TYR A 79 124.148 -1.931 -5.548 1.00 0.00 H new ATOM 0 HD1 TYR A 79 127.767 -1.202 -6.228 1.00 0.00 H new ATOM 0 HD2 TYR A 79 124.624 -4.129 -6.275 1.00 0.00 H new ATOM 0 HE1 TYR A 79 129.418 -2.963 -6.797 1.00 0.00 H new ATOM 0 HE2 TYR A 79 126.273 -5.891 -6.848 1.00 0.00 H new ATOM 0 HH TYR A 79 129.545 -5.578 -6.469 1.00 0.00 H new ATOM 1256 N MET A 80 122.516 -0.483 -7.752 1.00 0.00 N ATOM 1257 CA MET A 80 121.333 -0.910 -8.489 1.00 0.00 C ATOM 1258 C MET A 80 121.362 -0.352 -9.908 1.00 0.00 C ATOM 1259 O MET A 80 120.971 -1.030 -10.859 1.00 0.00 O ATOM 1260 CB MET A 80 120.067 -0.429 -7.777 1.00 0.00 C ATOM 1261 CG MET A 80 119.780 -1.333 -6.577 1.00 0.00 C ATOM 1262 SD MET A 80 118.697 -0.467 -5.415 1.00 0.00 S ATOM 1263 CE MET A 80 117.292 -0.250 -6.535 1.00 0.00 C ATOM 0 H MET A 80 122.371 0.319 -7.138 1.00 0.00 H new ATOM 0 HA MET A 80 121.330 -1.999 -8.534 1.00 0.00 H new ATOM 0 HB2 MET A 80 120.193 0.602 -7.447 1.00 0.00 H new ATOM 0 HB3 MET A 80 119.222 -0.443 -8.466 1.00 0.00 H new ATOM 0 HG2 MET A 80 119.309 -2.258 -6.909 1.00 0.00 H new ATOM 0 HG3 MET A 80 120.713 -1.609 -6.085 1.00 0.00 H new ATOM 0 HE1 MET A 80 116.403 0.007 -5.958 1.00 0.00 H new ATOM 0 HE2 MET A 80 117.510 0.551 -7.242 1.00 0.00 H new ATOM 0 HE3 MET A 80 117.115 -1.177 -7.080 1.00 0.00 H new ATOM 1273 N MET A 81 121.828 0.885 -10.044 1.00 0.00 N ATOM 1274 CA MET A 81 121.905 1.524 -11.350 1.00 0.00 C ATOM 1275 C MET A 81 123.163 1.075 -12.091 1.00 0.00 C ATOM 1276 O MET A 81 123.255 1.205 -13.311 1.00 0.00 O ATOM 1277 CB MET A 81 121.909 3.046 -11.172 1.00 0.00 C ATOM 1278 CG MET A 81 122.898 3.683 -12.146 1.00 0.00 C ATOM 1279 SD MET A 81 122.570 5.458 -12.258 1.00 0.00 S ATOM 1280 CE MET A 81 120.872 5.331 -12.869 1.00 0.00 C ATOM 0 H MET A 81 122.156 1.462 -9.269 1.00 0.00 H new ATOM 0 HA MET A 81 121.038 1.232 -11.942 1.00 0.00 H new ATOM 0 HB2 MET A 81 120.909 3.443 -11.345 1.00 0.00 H new ATOM 0 HB3 MET A 81 122.180 3.300 -10.147 1.00 0.00 H new ATOM 0 HG2 MET A 81 123.920 3.511 -11.808 1.00 0.00 H new ATOM 0 HG3 MET A 81 122.805 3.222 -13.129 1.00 0.00 H new ATOM 0 HE1 MET A 81 120.650 6.186 -13.508 1.00 0.00 H new ATOM 0 HE2 MET A 81 120.759 4.411 -13.442 1.00 0.00 H new ATOM 0 HE3 MET A 81 120.182 5.320 -12.026 1.00 0.00 H new ATOM 1290 N GLU A 82 124.128 0.542 -11.347 1.00 0.00 N ATOM 1291 CA GLU A 82 125.374 0.080 -11.946 1.00 0.00 C ATOM 1292 C GLU A 82 125.110 -1.009 -12.981 1.00 0.00 C ATOM 1293 O GLU A 82 125.934 -1.242 -13.865 1.00 0.00 O ATOM 1294 CB GLU A 82 126.300 -0.464 -10.858 1.00 0.00 C ATOM 1295 CG GLU A 82 126.120 -1.979 -10.735 1.00 0.00 C ATOM 1296 CD GLU A 82 126.848 -2.492 -9.497 1.00 0.00 C ATOM 1297 OE1 GLU A 82 128.047 -2.283 -9.409 1.00 0.00 O ATOM 1298 OE2 GLU A 82 126.196 -3.087 -8.656 1.00 0.00 O ATOM 0 H GLU A 82 124.071 0.420 -10.336 1.00 0.00 H new ATOM 0 HA GLU A 82 125.848 0.925 -12.445 1.00 0.00 H new ATOM 0 HB2 GLU A 82 127.337 -0.230 -11.099 1.00 0.00 H new ATOM 0 HB3 GLU A 82 126.078 0.017 -9.905 1.00 0.00 H new ATOM 0 HG2 GLU A 82 125.060 -2.223 -10.671 1.00 0.00 H new ATOM 0 HG3 GLU A 82 126.508 -2.473 -11.626 1.00 0.00 H new ATOM 1305 N SER A 83 123.956 -1.663 -12.864 1.00 0.00 N ATOM 1306 CA SER A 83 123.572 -2.726 -13.793 1.00 0.00 C ATOM 1307 C SER A 83 123.055 -3.945 -13.036 1.00 0.00 C ATOM 1308 O SER A 83 122.743 -4.971 -13.636 1.00 0.00 O ATOM 1309 CB SER A 83 124.761 -3.142 -14.663 1.00 0.00 C ATOM 1310 OG SER A 83 124.420 -4.317 -15.387 1.00 0.00 O ATOM 0 H SER A 83 123.269 -1.476 -12.134 1.00 0.00 H new ATOM 0 HA SER A 83 122.779 -2.336 -14.431 1.00 0.00 H new ATOM 0 HB2 SER A 83 125.022 -2.339 -15.352 1.00 0.00 H new ATOM 0 HB3 SER A 83 125.637 -3.325 -14.040 1.00 0.00 H new ATOM 0 HG SER A 83 123.522 -4.612 -15.128 1.00 0.00 H new ATOM 1316 N HIS A 84 122.970 -3.831 -11.716 1.00 0.00 N ATOM 1317 CA HIS A 84 122.492 -4.938 -10.896 1.00 0.00 C ATOM 1318 C HIS A 84 120.979 -4.851 -10.699 1.00 0.00 C ATOM 1319 O HIS A 84 120.470 -3.858 -10.179 1.00 0.00 O ATOM 1320 CB HIS A 84 123.192 -4.917 -9.535 1.00 0.00 C ATOM 1321 CG HIS A 84 123.951 -6.201 -9.333 1.00 0.00 C ATOM 1322 ND1 HIS A 84 124.157 -6.744 -8.074 1.00 0.00 N ATOM 1323 CD2 HIS A 84 124.561 -7.060 -10.214 1.00 0.00 C ATOM 1324 CE1 HIS A 84 124.864 -7.877 -8.230 1.00 0.00 C ATOM 1325 NE2 HIS A 84 125.136 -8.117 -9.516 1.00 0.00 N ATOM 0 H HIS A 84 123.223 -2.992 -11.194 1.00 0.00 H new ATOM 0 HA HIS A 84 122.723 -5.872 -11.409 1.00 0.00 H new ATOM 0 HB2 HIS A 84 123.874 -4.068 -9.479 1.00 0.00 H new ATOM 0 HB3 HIS A 84 122.458 -4.789 -8.740 1.00 0.00 H new ATOM 0 HD1 HIS A 84 123.831 -6.354 -7.189 1.00 0.00 H new ATOM 0 HD2 HIS A 84 124.590 -6.934 -11.286 1.00 0.00 H new ATOM 0 HE1 HIS A 84 125.174 -8.515 -7.416 1.00 0.00 H new ATOM 1334 N GLY A 85 120.270 -5.895 -11.119 1.00 0.00 N ATOM 1335 CA GLY A 85 118.816 -5.926 -10.983 1.00 0.00 C ATOM 1336 C GLY A 85 118.182 -4.702 -11.635 1.00 0.00 C ATOM 1337 O GLY A 85 118.617 -3.575 -11.407 1.00 0.00 O ATOM 0 H GLY A 85 120.674 -6.725 -11.553 1.00 0.00 H new ATOM 0 HA2 GLY A 85 118.423 -6.833 -11.443 1.00 0.00 H new ATOM 0 HA3 GLY A 85 118.546 -5.962 -9.928 1.00 0.00 H new ATOM 1341 N ASP A 86 117.155 -4.929 -12.453 1.00 0.00 N ATOM 1342 CA ASP A 86 116.485 -3.826 -13.130 1.00 0.00 C ATOM 1343 C ASP A 86 115.038 -3.684 -12.662 1.00 0.00 C ATOM 1344 O ASP A 86 114.105 -3.860 -13.445 1.00 0.00 O ATOM 1345 CB ASP A 86 116.515 -4.049 -14.644 1.00 0.00 C ATOM 1346 CG ASP A 86 117.387 -2.990 -15.311 1.00 0.00 C ATOM 1347 OD1 ASP A 86 117.273 -1.835 -14.935 1.00 0.00 O ATOM 1348 OD2 ASP A 86 118.155 -3.349 -16.188 1.00 0.00 O ATOM 0 H ASP A 86 116.775 -5.853 -12.659 1.00 0.00 H new ATOM 0 HA ASP A 86 117.016 -2.907 -12.882 1.00 0.00 H new ATOM 0 HB2 ASP A 86 116.903 -5.043 -14.866 1.00 0.00 H new ATOM 0 HB3 ASP A 86 115.503 -4.005 -15.046 1.00 0.00 H new ATOM 1353 N TRP A 87 114.850 -3.358 -11.384 1.00 0.00 N ATOM 1354 CA TRP A 87 113.498 -3.191 -10.854 1.00 0.00 C ATOM 1355 C TRP A 87 113.488 -2.357 -9.577 1.00 0.00 C ATOM 1356 O TRP A 87 113.626 -1.135 -9.623 1.00 0.00 O ATOM 1357 CB TRP A 87 112.865 -4.554 -10.581 1.00 0.00 C ATOM 1358 CG TRP A 87 112.798 -5.318 -11.862 1.00 0.00 C ATOM 1359 CD1 TRP A 87 111.769 -5.285 -12.741 1.00 0.00 C ATOM 1360 CD2 TRP A 87 113.788 -6.217 -12.425 1.00 0.00 C ATOM 1361 NE1 TRP A 87 112.073 -6.107 -13.811 1.00 0.00 N ATOM 1362 CE2 TRP A 87 113.309 -6.704 -13.661 1.00 0.00 C ATOM 1363 CE3 TRP A 87 115.046 -6.649 -11.984 1.00 0.00 C ATOM 1364 CZ2 TRP A 87 114.059 -7.590 -14.434 1.00 0.00 C ATOM 1365 CZ3 TRP A 87 115.804 -7.539 -12.756 1.00 0.00 C ATOM 1366 CH2 TRP A 87 115.312 -8.008 -13.979 1.00 0.00 C ATOM 0 H TRP A 87 115.599 -3.207 -10.709 1.00 0.00 H new ATOM 0 HA TRP A 87 112.917 -2.660 -11.608 1.00 0.00 H new ATOM 0 HB2 TRP A 87 113.453 -5.102 -9.845 1.00 0.00 H new ATOM 0 HB3 TRP A 87 111.866 -4.429 -10.163 1.00 0.00 H new ATOM 0 HD1 TRP A 87 110.861 -4.712 -12.626 1.00 0.00 H new ATOM 0 HE1 TRP A 87 111.459 -6.254 -14.612 1.00 0.00 H new ATOM 0 HE3 TRP A 87 115.434 -6.293 -11.041 1.00 0.00 H new ATOM 0 HZ2 TRP A 87 113.674 -7.950 -15.377 1.00 0.00 H new ATOM 0 HZ3 TRP A 87 116.772 -7.865 -12.406 1.00 0.00 H new ATOM 0 HH2 TRP A 87 115.901 -8.693 -14.571 1.00 0.00 H new ATOM 1377 N LEU A 88 113.285 -3.019 -8.440 1.00 0.00 N ATOM 1378 CA LEU A 88 113.216 -2.310 -7.166 1.00 0.00 C ATOM 1379 C LEU A 88 114.126 -2.918 -6.104 1.00 0.00 C ATOM 1380 O LEU A 88 114.773 -3.945 -6.313 1.00 0.00 O ATOM 1381 CB LEU A 88 111.775 -2.318 -6.658 1.00 0.00 C ATOM 1382 CG LEU A 88 110.883 -1.584 -7.660 1.00 0.00 C ATOM 1383 CD1 LEU A 88 109.875 -2.562 -8.268 1.00 0.00 C ATOM 1384 CD2 LEU A 88 110.133 -0.461 -6.943 1.00 0.00 C ATOM 0 H LEU A 88 113.167 -4.030 -8.375 1.00 0.00 H new ATOM 0 HA LEU A 88 113.559 -1.291 -7.345 1.00 0.00 H new ATOM 0 HB2 LEU A 88 111.429 -3.343 -6.528 1.00 0.00 H new ATOM 0 HB3 LEU A 88 111.718 -1.836 -5.682 1.00 0.00 H new ATOM 0 HG LEU A 88 111.501 -1.164 -8.454 1.00 0.00 H new ATOM 0 HD11 LEU A 88 109.241 -2.035 -8.981 1.00 0.00 H new ATOM 0 HD12 LEU A 88 110.408 -3.363 -8.779 1.00 0.00 H new ATOM 0 HD13 LEU A 88 109.256 -2.985 -7.477 1.00 0.00 H new ATOM 0 HD21 LEU A 88 109.496 0.064 -7.655 1.00 0.00 H new ATOM 0 HD22 LEU A 88 109.517 -0.884 -6.149 1.00 0.00 H new ATOM 0 HD23 LEU A 88 110.850 0.239 -6.513 1.00 0.00 H new ATOM 1396 N ALA A 89 114.141 -2.251 -4.958 1.00 0.00 N ATOM 1397 CA ALA A 89 114.938 -2.677 -3.817 1.00 0.00 C ATOM 1398 C ALA A 89 114.157 -2.445 -2.530 1.00 0.00 C ATOM 1399 O ALA A 89 113.713 -1.329 -2.259 1.00 0.00 O ATOM 1400 CB ALA A 89 116.250 -1.888 -3.770 1.00 0.00 C ATOM 0 H ALA A 89 113.602 -1.401 -4.794 1.00 0.00 H new ATOM 0 HA ALA A 89 115.163 -3.739 -3.918 1.00 0.00 H new ATOM 0 HB1 ALA A 89 116.840 -2.213 -2.913 1.00 0.00 H new ATOM 0 HB2 ALA A 89 116.813 -2.064 -4.686 1.00 0.00 H new ATOM 0 HB3 ALA A 89 116.032 -0.824 -3.677 1.00 0.00 H new ATOM 1406 N ILE A 90 113.988 -3.498 -1.739 1.00 0.00 N ATOM 1407 CA ILE A 90 113.254 -3.374 -0.486 1.00 0.00 C ATOM 1408 C ILE A 90 114.067 -2.593 0.529 1.00 0.00 C ATOM 1409 O ILE A 90 115.119 -3.050 0.975 1.00 0.00 O ATOM 1410 CB ILE A 90 112.954 -4.747 0.099 1.00 0.00 C ATOM 1411 CG1 ILE A 90 112.839 -5.776 -1.030 1.00 0.00 C ATOM 1412 CG2 ILE A 90 111.640 -4.687 0.884 1.00 0.00 C ATOM 1413 CD1 ILE A 90 111.823 -6.855 -0.644 1.00 0.00 C ATOM 0 H ILE A 90 114.343 -4.433 -1.938 1.00 0.00 H new ATOM 0 HA ILE A 90 112.322 -2.852 -0.700 1.00 0.00 H new ATOM 0 HB ILE A 90 113.762 -5.043 0.768 1.00 0.00 H new ATOM 0 HG12 ILE A 90 112.529 -5.285 -1.952 1.00 0.00 H new ATOM 0 HG13 ILE A 90 113.811 -6.230 -1.221 1.00 0.00 H new ATOM 0 HG21 ILE A 90 111.422 -5.669 1.304 1.00 0.00 H new ATOM 0 HG22 ILE A 90 111.731 -3.959 1.690 1.00 0.00 H new ATOM 0 HG23 ILE A 90 110.831 -4.390 0.217 1.00 0.00 H new ATOM 0 HD11 ILE A 90 111.744 -7.585 -1.449 1.00 0.00 H new ATOM 0 HD12 ILE A 90 112.151 -7.354 0.268 1.00 0.00 H new ATOM 0 HD13 ILE A 90 110.850 -6.394 -0.475 1.00 0.00 H new ATOM 1425 N PRO A 91 113.607 -1.439 0.911 1.00 0.00 N ATOM 1426 CA PRO A 91 114.318 -0.607 1.904 1.00 0.00 C ATOM 1427 C PRO A 91 114.746 -1.433 3.114 1.00 0.00 C ATOM 1428 O PRO A 91 113.912 -1.858 3.909 1.00 0.00 O ATOM 1429 CB PRO A 91 113.296 0.461 2.295 1.00 0.00 C ATOM 1430 CG PRO A 91 112.353 0.556 1.141 1.00 0.00 C ATOM 1431 CD PRO A 91 112.369 -0.802 0.437 1.00 0.00 C ATOM 0 HA PRO A 91 115.237 -0.178 1.506 1.00 0.00 H new ATOM 0 HB2 PRO A 91 112.770 0.185 3.209 1.00 0.00 H new ATOM 0 HB3 PRO A 91 113.782 1.418 2.484 1.00 0.00 H new ATOM 0 HG2 PRO A 91 111.348 0.801 1.484 1.00 0.00 H new ATOM 0 HG3 PRO A 91 112.659 1.348 0.458 1.00 0.00 H new ATOM 0 HD2 PRO A 91 111.492 -1.395 0.695 1.00 0.00 H new ATOM 0 HD3 PRO A 91 112.369 -0.689 -0.647 1.00 0.00 H new ATOM 1439 N TYR A 92 116.049 -1.666 3.236 1.00 0.00 N ATOM 1440 CA TYR A 92 116.578 -2.452 4.345 1.00 0.00 C ATOM 1441 C TYR A 92 115.701 -2.292 5.581 1.00 0.00 C ATOM 1442 O TYR A 92 115.666 -3.163 6.449 1.00 0.00 O ATOM 1443 CB TYR A 92 118.008 -2.011 4.666 1.00 0.00 C ATOM 1444 CG TYR A 92 118.008 -0.572 5.124 1.00 0.00 C ATOM 1445 CD1 TYR A 92 117.598 0.443 4.250 1.00 0.00 C ATOM 1446 CD2 TYR A 92 118.421 -0.252 6.423 1.00 0.00 C ATOM 1447 CE1 TYR A 92 117.600 1.776 4.676 1.00 0.00 C ATOM 1448 CE2 TYR A 92 118.424 1.082 6.848 1.00 0.00 C ATOM 1449 CZ TYR A 92 118.013 2.096 5.975 1.00 0.00 C ATOM 1450 OH TYR A 92 118.015 3.410 6.394 1.00 0.00 O ATOM 0 H TYR A 92 116.755 -1.324 2.584 1.00 0.00 H new ATOM 0 HA TYR A 92 116.582 -3.502 4.052 1.00 0.00 H new ATOM 0 HB2 TYR A 92 118.430 -2.649 5.442 1.00 0.00 H new ATOM 0 HB3 TYR A 92 118.639 -2.122 3.784 1.00 0.00 H new ATOM 0 HD1 TYR A 92 117.280 0.197 3.248 1.00 0.00 H new ATOM 0 HD2 TYR A 92 118.737 -1.034 7.097 1.00 0.00 H new ATOM 0 HE1 TYR A 92 117.283 2.558 4.002 1.00 0.00 H new ATOM 0 HE2 TYR A 92 118.744 1.329 7.850 1.00 0.00 H new ATOM 0 HH TYR A 92 118.399 3.976 5.693 1.00 0.00 H new ATOM 1460 N ARG A 93 114.987 -1.175 5.646 1.00 0.00 N ATOM 1461 CA ARG A 93 114.102 -0.909 6.775 1.00 0.00 C ATOM 1462 C ARG A 93 112.717 -1.482 6.507 1.00 0.00 C ATOM 1463 O ARG A 93 111.725 -1.051 7.097 1.00 0.00 O ATOM 1464 CB ARG A 93 114.002 0.597 7.026 1.00 0.00 C ATOM 1465 CG ARG A 93 115.088 1.023 8.015 1.00 0.00 C ATOM 1466 CD ARG A 93 114.822 2.456 8.480 1.00 0.00 C ATOM 1467 NE ARG A 93 113.878 3.110 7.582 1.00 0.00 N ATOM 1468 CZ ARG A 93 113.707 4.428 7.607 1.00 0.00 C ATOM 1469 NH1 ARG A 93 114.389 5.159 8.445 1.00 0.00 N ATOM 1470 NH2 ARG A 93 112.855 4.991 6.794 1.00 0.00 N ATOM 0 H ARG A 93 115.002 -0.443 4.936 1.00 0.00 H new ATOM 0 HA ARG A 93 114.517 -1.389 7.661 1.00 0.00 H new ATOM 0 HB2 ARG A 93 114.116 1.141 6.088 1.00 0.00 H new ATOM 0 HB3 ARG A 93 113.017 0.846 7.422 1.00 0.00 H new ATOM 0 HG2 ARG A 93 115.100 0.348 8.871 1.00 0.00 H new ATOM 0 HG3 ARG A 93 116.069 0.958 7.544 1.00 0.00 H new ATOM 0 HD2 ARG A 93 114.424 2.449 9.495 1.00 0.00 H new ATOM 0 HD3 ARG A 93 115.757 3.016 8.508 1.00 0.00 H new ATOM 0 HE ARG A 93 113.340 2.547 6.924 1.00 0.00 H new ATOM 0 HH11 ARG A 93 115.054 4.719 9.081 1.00 0.00 H new ATOM 0 HH12 ARG A 93 114.257 6.170 8.464 1.00 0.00 H new ATOM 0 HH21 ARG A 93 112.321 4.420 6.140 1.00 0.00 H new ATOM 0 HH22 ARG A 93 112.724 6.002 6.813 1.00 0.00 H new ATOM 1484 N SER A 94 112.664 -2.453 5.608 1.00 0.00 N ATOM 1485 CA SER A 94 111.406 -3.092 5.245 1.00 0.00 C ATOM 1486 C SER A 94 111.264 -4.442 5.941 1.00 0.00 C ATOM 1487 O SER A 94 111.206 -5.480 5.287 1.00 0.00 O ATOM 1488 CB SER A 94 111.342 -3.289 3.731 1.00 0.00 C ATOM 1489 OG SER A 94 110.310 -4.217 3.422 1.00 0.00 O ATOM 0 H SER A 94 113.479 -2.817 5.115 1.00 0.00 H new ATOM 0 HA SER A 94 110.588 -2.446 5.565 1.00 0.00 H new ATOM 0 HB2 SER A 94 111.151 -2.337 3.236 1.00 0.00 H new ATOM 0 HB3 SER A 94 112.299 -3.655 3.359 1.00 0.00 H new ATOM 0 HG SER A 94 110.606 -5.123 3.650 1.00 0.00 H new ATOM 1495 N GLY A 95 111.209 -4.414 7.269 1.00 0.00 N ATOM 1496 CA GLY A 95 111.074 -5.639 8.057 1.00 0.00 C ATOM 1497 C GLY A 95 110.784 -6.851 7.173 1.00 0.00 C ATOM 1498 O GLY A 95 111.586 -7.783 7.107 1.00 0.00 O ATOM 0 H GLY A 95 111.256 -3.559 7.823 1.00 0.00 H new ATOM 0 HA2 GLY A 95 111.990 -5.811 8.621 1.00 0.00 H new ATOM 0 HA3 GLY A 95 110.270 -5.518 8.783 1.00 0.00 H new ATOM 1502 N PRO A 96 109.665 -6.854 6.495 1.00 0.00 N ATOM 1503 CA PRO A 96 109.271 -7.975 5.597 1.00 0.00 C ATOM 1504 C PRO A 96 110.459 -8.554 4.829 1.00 0.00 C ATOM 1505 O PRO A 96 110.455 -9.726 4.454 1.00 0.00 O ATOM 1506 CB PRO A 96 108.266 -7.322 4.653 1.00 0.00 C ATOM 1507 CG PRO A 96 107.627 -6.232 5.452 1.00 0.00 C ATOM 1508 CD PRO A 96 108.642 -5.795 6.515 1.00 0.00 C ATOM 0 HA PRO A 96 108.865 -8.825 6.146 1.00 0.00 H new ATOM 0 HB2 PRO A 96 108.760 -6.923 3.767 1.00 0.00 H new ATOM 0 HB3 PRO A 96 107.525 -8.043 4.307 1.00 0.00 H new ATOM 0 HG2 PRO A 96 107.356 -5.393 4.811 1.00 0.00 H new ATOM 0 HG3 PRO A 96 106.708 -6.586 5.920 1.00 0.00 H new ATOM 0 HD2 PRO A 96 109.072 -4.822 6.279 1.00 0.00 H new ATOM 0 HD3 PRO A 96 108.178 -5.708 7.497 1.00 0.00 H new ATOM 1516 N ALA A 97 111.476 -7.729 4.608 1.00 0.00 N ATOM 1517 CA ALA A 97 112.668 -8.171 3.895 1.00 0.00 C ATOM 1518 C ALA A 97 113.522 -9.053 4.798 1.00 0.00 C ATOM 1519 O ALA A 97 114.091 -10.052 4.354 1.00 0.00 O ATOM 1520 CB ALA A 97 113.482 -6.961 3.434 1.00 0.00 C ATOM 0 H ALA A 97 111.499 -6.755 4.911 1.00 0.00 H new ATOM 0 HA ALA A 97 112.361 -8.748 3.023 1.00 0.00 H new ATOM 0 HB1 ALA A 97 114.371 -7.301 2.902 1.00 0.00 H new ATOM 0 HB2 ALA A 97 112.875 -6.346 2.770 1.00 0.00 H new ATOM 0 HB3 ALA A 97 113.781 -6.372 4.301 1.00 0.00 H new ATOM 1526 N SER A 98 113.597 -8.687 6.074 1.00 0.00 N ATOM 1527 CA SER A 98 114.373 -9.472 7.025 1.00 0.00 C ATOM 1528 C SER A 98 113.664 -10.792 7.280 1.00 0.00 C ATOM 1529 O SER A 98 114.179 -11.860 6.951 1.00 0.00 O ATOM 1530 CB SER A 98 114.529 -8.705 8.338 1.00 0.00 C ATOM 1531 OG SER A 98 114.161 -7.347 8.136 1.00 0.00 O ATOM 0 H SER A 98 113.138 -7.866 6.468 1.00 0.00 H new ATOM 0 HA SER A 98 115.364 -9.662 6.612 1.00 0.00 H new ATOM 0 HB2 SER A 98 113.903 -9.152 9.110 1.00 0.00 H new ATOM 0 HB3 SER A 98 115.559 -8.766 8.688 1.00 0.00 H new ATOM 0 HG SER A 98 114.258 -6.853 8.977 1.00 0.00 H new ATOM 1537 N ASN A 99 112.472 -10.709 7.857 1.00 0.00 N ATOM 1538 CA ASN A 99 111.693 -11.907 8.137 1.00 0.00 C ATOM 1539 C ASN A 99 111.725 -12.825 6.922 1.00 0.00 C ATOM 1540 O ASN A 99 111.733 -14.049 7.051 1.00 0.00 O ATOM 1541 CB ASN A 99 110.247 -11.532 8.464 1.00 0.00 C ATOM 1542 CG ASN A 99 110.085 -11.343 9.968 1.00 0.00 C ATOM 1543 OD1 ASN A 99 109.573 -10.315 10.414 1.00 0.00 O ATOM 1544 ND2 ASN A 99 110.494 -12.277 10.782 1.00 0.00 N ATOM 0 H ASN A 99 112.028 -9.835 8.137 1.00 0.00 H new ATOM 0 HA ASN A 99 112.124 -12.422 8.996 1.00 0.00 H new ATOM 0 HB2 ASN A 99 109.974 -10.615 7.942 1.00 0.00 H new ATOM 0 HB3 ASN A 99 109.572 -12.312 8.112 1.00 0.00 H new ATOM 0 HD21 ASN A 99 110.390 -12.157 11.790 1.00 0.00 H new ATOM 0 HD22 ASN A 99 110.918 -13.127 10.411 1.00 0.00 H new ATOM 1551 N VAL A 100 111.763 -12.215 5.740 1.00 0.00 N ATOM 1552 CA VAL A 100 111.814 -12.970 4.495 1.00 0.00 C ATOM 1553 C VAL A 100 113.060 -13.849 4.475 1.00 0.00 C ATOM 1554 O VAL A 100 112.975 -15.067 4.317 1.00 0.00 O ATOM 1555 CB VAL A 100 111.845 -12.000 3.312 1.00 0.00 C ATOM 1556 CG1 VAL A 100 112.586 -12.641 2.137 1.00 0.00 C ATOM 1557 CG2 VAL A 100 110.413 -11.662 2.889 1.00 0.00 C ATOM 0 H VAL A 100 111.759 -11.202 5.620 1.00 0.00 H new ATOM 0 HA VAL A 100 110.931 -13.604 4.420 1.00 0.00 H new ATOM 0 HB VAL A 100 112.362 -11.088 3.609 1.00 0.00 H new ATOM 0 HG11 VAL A 100 112.606 -11.947 1.297 1.00 0.00 H new ATOM 0 HG12 VAL A 100 113.607 -12.877 2.436 1.00 0.00 H new ATOM 0 HG13 VAL A 100 112.074 -13.556 1.840 1.00 0.00 H new ATOM 0 HG21 VAL A 100 110.436 -10.971 2.046 1.00 0.00 H new ATOM 0 HG22 VAL A 100 109.895 -12.575 2.595 1.00 0.00 H new ATOM 0 HG23 VAL A 100 109.887 -11.199 3.724 1.00 0.00 H new ATOM 1567 N THR A 101 114.214 -13.216 4.650 1.00 0.00 N ATOM 1568 CA THR A 101 115.485 -13.933 4.667 1.00 0.00 C ATOM 1569 C THR A 101 115.517 -14.934 5.804 1.00 0.00 C ATOM 1570 O THR A 101 115.908 -16.088 5.637 1.00 0.00 O ATOM 1571 CB THR A 101 116.625 -12.944 4.886 1.00 0.00 C ATOM 1572 OG1 THR A 101 116.378 -11.761 4.138 1.00 0.00 O ATOM 1573 CG2 THR A 101 117.945 -13.574 4.439 1.00 0.00 C ATOM 0 H THR A 101 114.297 -12.208 4.782 1.00 0.00 H new ATOM 0 HA THR A 101 115.595 -14.451 3.714 1.00 0.00 H new ATOM 0 HB THR A 101 116.689 -12.693 5.945 1.00 0.00 H new ATOM 0 HG1 THR A 101 117.110 -11.125 4.280 1.00 0.00 H new ATOM 0 HG21 THR A 101 118.758 -12.865 4.596 1.00 0.00 H new ATOM 0 HG22 THR A 101 118.133 -14.477 5.020 1.00 0.00 H new ATOM 0 HG23 THR A 101 117.886 -13.830 3.381 1.00 0.00 H new ATOM 1581 N ALA A 102 115.109 -14.460 6.967 1.00 0.00 N ATOM 1582 CA ALA A 102 115.089 -15.280 8.160 1.00 0.00 C ATOM 1583 C ALA A 102 113.992 -16.334 8.063 1.00 0.00 C ATOM 1584 O ALA A 102 114.042 -17.363 8.738 1.00 0.00 O ATOM 1585 CB ALA A 102 114.865 -14.384 9.372 1.00 0.00 C ATOM 0 H ALA A 102 114.785 -13.503 7.109 1.00 0.00 H new ATOM 0 HA ALA A 102 116.043 -15.798 8.263 1.00 0.00 H new ATOM 0 HB1 ALA A 102 114.848 -14.992 10.276 1.00 0.00 H new ATOM 0 HB2 ALA A 102 115.673 -13.655 9.440 1.00 0.00 H new ATOM 0 HB3 ALA A 102 113.914 -13.862 9.268 1.00 0.00 H new ATOM 1591 N LYS A 103 113.008 -16.076 7.207 1.00 0.00 N ATOM 1592 CA LYS A 103 111.910 -17.015 7.017 1.00 0.00 C ATOM 1593 C LYS A 103 112.361 -18.177 6.138 1.00 0.00 C ATOM 1594 O LYS A 103 111.969 -19.324 6.358 1.00 0.00 O ATOM 1595 CB LYS A 103 110.720 -16.311 6.363 1.00 0.00 C ATOM 1596 CG LYS A 103 109.887 -15.608 7.437 1.00 0.00 C ATOM 1597 CD LYS A 103 108.631 -16.432 7.727 1.00 0.00 C ATOM 1598 CE LYS A 103 108.001 -15.958 9.039 1.00 0.00 C ATOM 1599 NZ LYS A 103 107.119 -17.029 9.582 1.00 0.00 N ATOM 0 H LYS A 103 112.949 -15.231 6.638 1.00 0.00 H new ATOM 0 HA LYS A 103 111.607 -17.398 7.992 1.00 0.00 H new ATOM 0 HB2 LYS A 103 111.072 -15.586 5.629 1.00 0.00 H new ATOM 0 HB3 LYS A 103 110.106 -17.035 5.827 1.00 0.00 H new ATOM 0 HG2 LYS A 103 110.474 -15.488 8.347 1.00 0.00 H new ATOM 0 HG3 LYS A 103 109.610 -14.609 7.102 1.00 0.00 H new ATOM 0 HD2 LYS A 103 107.917 -16.327 6.910 1.00 0.00 H new ATOM 0 HD3 LYS A 103 108.885 -17.490 7.794 1.00 0.00 H new ATOM 0 HE2 LYS A 103 108.780 -15.713 9.761 1.00 0.00 H new ATOM 0 HE3 LYS A 103 107.425 -15.048 8.870 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 106.691 -16.707 10.473 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 106.368 -17.242 8.894 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 107.681 -17.886 9.758 1.00 0.00 H new ATOM 1613 N TYR A 104 113.188 -17.872 5.142 1.00 0.00 N ATOM 1614 CA TYR A 104 113.688 -18.900 4.236 1.00 0.00 C ATOM 1615 C TYR A 104 114.786 -19.718 4.909 1.00 0.00 C ATOM 1616 O TYR A 104 115.124 -20.812 4.457 1.00 0.00 O ATOM 1617 CB TYR A 104 114.239 -18.253 2.964 1.00 0.00 C ATOM 1618 CG TYR A 104 113.105 -17.986 2.003 1.00 0.00 C ATOM 1619 CD1 TYR A 104 112.450 -19.055 1.380 1.00 0.00 C ATOM 1620 CD2 TYR A 104 112.709 -16.670 1.735 1.00 0.00 C ATOM 1621 CE1 TYR A 104 111.399 -18.809 0.489 1.00 0.00 C ATOM 1622 CE2 TYR A 104 111.657 -16.424 0.844 1.00 0.00 C ATOM 1623 CZ TYR A 104 111.002 -17.493 0.221 1.00 0.00 C ATOM 1624 OH TYR A 104 109.967 -17.249 -0.657 1.00 0.00 O ATOM 0 H TYR A 104 113.524 -16.930 4.943 1.00 0.00 H new ATOM 0 HA TYR A 104 112.862 -19.563 3.977 1.00 0.00 H new ATOM 0 HB2 TYR A 104 114.749 -17.321 3.209 1.00 0.00 H new ATOM 0 HB3 TYR A 104 114.976 -18.908 2.500 1.00 0.00 H new ATOM 0 HD1 TYR A 104 112.756 -20.070 1.587 1.00 0.00 H new ATOM 0 HD2 TYR A 104 113.215 -15.845 2.215 1.00 0.00 H new ATOM 0 HE1 TYR A 104 110.894 -19.634 0.008 1.00 0.00 H new ATOM 0 HE2 TYR A 104 111.351 -15.409 0.637 1.00 0.00 H new ATOM 0 HH TYR A 104 109.819 -16.283 -0.728 1.00 0.00 H new ATOM 1634 N GLY A 105 115.339 -19.179 5.992 1.00 0.00 N ATOM 1635 CA GLY A 105 116.398 -19.868 6.719 1.00 0.00 C ATOM 1636 C GLY A 105 117.721 -19.786 5.964 1.00 0.00 C ATOM 1637 O GLY A 105 118.498 -20.741 5.948 1.00 0.00 O ATOM 0 H GLY A 105 115.073 -18.275 6.382 1.00 0.00 H new ATOM 0 HA2 GLY A 105 116.512 -19.426 7.709 1.00 0.00 H new ATOM 0 HA3 GLY A 105 116.123 -20.912 6.866 1.00 0.00 H new ATOM 1641 N ILE A 106 117.968 -18.642 5.336 1.00 0.00 N ATOM 1642 CA ILE A 106 119.198 -18.446 4.580 1.00 0.00 C ATOM 1643 C ILE A 106 120.415 -18.549 5.492 1.00 0.00 C ATOM 1644 O ILE A 106 120.758 -19.633 5.964 1.00 0.00 O ATOM 1645 CB ILE A 106 119.172 -17.077 3.909 1.00 0.00 C ATOM 1646 CG1 ILE A 106 117.829 -16.895 3.187 1.00 0.00 C ATOM 1647 CG2 ILE A 106 120.323 -16.982 2.908 1.00 0.00 C ATOM 1648 CD1 ILE A 106 117.975 -17.259 1.706 1.00 0.00 C ATOM 0 H ILE A 106 117.337 -17.841 5.335 1.00 0.00 H new ATOM 0 HA ILE A 106 119.268 -19.225 3.821 1.00 0.00 H new ATOM 0 HB ILE A 106 119.286 -16.293 4.658 1.00 0.00 H new ATOM 0 HG12 ILE A 106 117.069 -17.524 3.651 1.00 0.00 H new ATOM 0 HG13 ILE A 106 117.492 -15.863 3.285 1.00 0.00 H new ATOM 0 HG21 ILE A 106 120.307 -16.004 2.427 1.00 0.00 H new ATOM 0 HG22 ILE A 106 121.271 -17.114 3.430 1.00 0.00 H new ATOM 0 HG23 ILE A 106 120.213 -17.760 2.153 1.00 0.00 H new ATOM 0 HD11 ILE A 106 117.017 -17.127 1.203 1.00 0.00 H new ATOM 0 HD12 ILE A 106 118.720 -16.612 1.244 1.00 0.00 H new ATOM 0 HD13 ILE A 106 118.292 -18.298 1.616 1.00 0.00 H new ATOM 1660 N THR A 107 121.065 -17.416 5.736 1.00 0.00 N ATOM 1661 CA THR A 107 122.243 -17.396 6.595 1.00 0.00 C ATOM 1662 C THR A 107 123.455 -17.951 5.855 1.00 0.00 C ATOM 1663 O THR A 107 124.530 -18.107 6.433 1.00 0.00 O ATOM 1664 CB THR A 107 121.977 -18.226 7.852 1.00 0.00 C ATOM 1665 OG1 THR A 107 122.330 -19.581 7.606 1.00 0.00 O ATOM 1666 CG2 THR A 107 120.494 -18.138 8.212 1.00 0.00 C ATOM 0 H THR A 107 120.799 -16.508 5.355 1.00 0.00 H new ATOM 0 HA THR A 107 122.452 -16.364 6.878 1.00 0.00 H new ATOM 0 HB THR A 107 122.574 -17.842 8.679 1.00 0.00 H new ATOM 0 HG1 THR A 107 121.686 -19.979 6.983 1.00 0.00 H new ATOM 0 HG21 THR A 107 120.301 -18.729 9.108 1.00 0.00 H new ATOM 0 HG22 THR A 107 120.226 -17.098 8.399 1.00 0.00 H new ATOM 0 HG23 THR A 107 119.896 -18.524 7.387 1.00 0.00 H new ATOM 1674 N GLY A 108 123.272 -18.243 4.571 1.00 0.00 N ATOM 1675 CA GLY A 108 124.358 -18.777 3.757 1.00 0.00 C ATOM 1676 C GLY A 108 124.969 -17.682 2.889 1.00 0.00 C ATOM 1677 O GLY A 108 125.686 -17.964 1.929 1.00 0.00 O ATOM 0 H GLY A 108 122.389 -18.120 4.075 1.00 0.00 H new ATOM 0 HA2 GLY A 108 125.125 -19.207 4.401 1.00 0.00 H new ATOM 0 HA3 GLY A 108 123.984 -19.582 3.125 1.00 0.00 H new ATOM 1681 N ILE A 109 124.680 -16.432 3.237 1.00 0.00 N ATOM 1682 CA ILE A 109 125.202 -15.297 2.488 1.00 0.00 C ATOM 1683 C ILE A 109 126.727 -15.373 2.405 1.00 0.00 C ATOM 1684 O ILE A 109 127.387 -15.751 3.372 1.00 0.00 O ATOM 1685 CB ILE A 109 124.783 -14.001 3.182 1.00 0.00 C ATOM 1686 CG1 ILE A 109 124.010 -14.344 4.457 1.00 0.00 C ATOM 1687 CG2 ILE A 109 123.888 -13.178 2.252 1.00 0.00 C ATOM 1688 CD1 ILE A 109 122.713 -15.073 4.093 1.00 0.00 C ATOM 0 H ILE A 109 124.089 -16.181 4.030 1.00 0.00 H new ATOM 0 HA ILE A 109 124.798 -15.318 1.476 1.00 0.00 H new ATOM 0 HB ILE A 109 125.671 -13.419 3.430 1.00 0.00 H new ATOM 0 HG12 ILE A 109 124.621 -14.971 5.107 1.00 0.00 H new ATOM 0 HG13 ILE A 109 123.784 -13.434 5.013 1.00 0.00 H new ATOM 0 HG21 ILE A 109 123.593 -12.256 2.753 1.00 0.00 H new ATOM 0 HG22 ILE A 109 124.435 -12.937 1.340 1.00 0.00 H new ATOM 0 HG23 ILE A 109 122.998 -13.754 2.000 1.00 0.00 H new ATOM 0 HD11 ILE A 109 122.165 -15.316 5.003 1.00 0.00 H new ATOM 0 HD12 ILE A 109 122.100 -14.431 3.460 1.00 0.00 H new ATOM 0 HD13 ILE A 109 122.950 -15.991 3.556 1.00 0.00 H new ATOM 1700 N PRO A 110 127.295 -15.025 1.277 1.00 0.00 N ATOM 1701 CA PRO A 110 126.530 -14.560 0.080 1.00 0.00 C ATOM 1702 C PRO A 110 125.775 -15.698 -0.601 1.00 0.00 C ATOM 1703 O PRO A 110 126.292 -16.808 -0.734 1.00 0.00 O ATOM 1704 CB PRO A 110 127.613 -13.997 -0.844 1.00 0.00 C ATOM 1705 CG PRO A 110 128.868 -14.705 -0.460 1.00 0.00 C ATOM 1706 CD PRO A 110 128.744 -15.042 1.026 1.00 0.00 C ATOM 0 HA PRO A 110 125.764 -13.831 0.343 1.00 0.00 H new ATOM 0 HB2 PRO A 110 127.367 -14.174 -1.891 1.00 0.00 H new ATOM 0 HB3 PRO A 110 127.716 -12.919 -0.718 1.00 0.00 H new ATOM 0 HG2 PRO A 110 128.999 -15.610 -1.053 1.00 0.00 H new ATOM 0 HG3 PRO A 110 129.739 -14.076 -0.643 1.00 0.00 H new ATOM 0 HD2 PRO A 110 129.176 -16.017 1.251 1.00 0.00 H new ATOM 0 HD3 PRO A 110 129.265 -14.312 1.645 1.00 0.00 H new ATOM 1714 N ALA A 111 124.547 -15.416 -1.027 1.00 0.00 N ATOM 1715 CA ALA A 111 123.732 -16.428 -1.690 1.00 0.00 C ATOM 1716 C ALA A 111 122.603 -15.780 -2.485 1.00 0.00 C ATOM 1717 O ALA A 111 122.191 -14.656 -2.195 1.00 0.00 O ATOM 1718 CB ALA A 111 123.143 -17.385 -0.652 1.00 0.00 C ATOM 0 H ALA A 111 124.099 -14.505 -0.926 1.00 0.00 H new ATOM 0 HA ALA A 111 124.369 -16.983 -2.378 1.00 0.00 H new ATOM 0 HB1 ALA A 111 122.536 -18.138 -1.154 1.00 0.00 H new ATOM 0 HB2 ALA A 111 123.951 -17.874 -0.108 1.00 0.00 H new ATOM 0 HB3 ALA A 111 122.522 -16.826 0.048 1.00 0.00 H new ATOM 1724 N LEU A 112 122.110 -16.497 -3.487 1.00 0.00 N ATOM 1725 CA LEU A 112 121.028 -15.989 -4.323 1.00 0.00 C ATOM 1726 C LEU A 112 119.805 -16.893 -4.213 1.00 0.00 C ATOM 1727 O LEU A 112 119.894 -18.096 -4.447 1.00 0.00 O ATOM 1728 CB LEU A 112 121.493 -15.929 -5.782 1.00 0.00 C ATOM 1729 CG LEU A 112 120.795 -14.779 -6.509 1.00 0.00 C ATOM 1730 CD1 LEU A 112 121.697 -14.271 -7.636 1.00 0.00 C ATOM 1731 CD2 LEU A 112 119.475 -15.279 -7.104 1.00 0.00 C ATOM 0 H LEU A 112 122.440 -17.428 -3.740 1.00 0.00 H new ATOM 0 HA LEU A 112 120.758 -14.989 -3.983 1.00 0.00 H new ATOM 0 HB2 LEU A 112 122.574 -15.792 -5.822 1.00 0.00 H new ATOM 0 HB3 LEU A 112 121.272 -16.872 -6.281 1.00 0.00 H new ATOM 0 HG LEU A 112 120.596 -13.971 -5.806 1.00 0.00 H new ATOM 0 HD11 LEU A 112 121.202 -13.451 -8.156 1.00 0.00 H new ATOM 0 HD12 LEU A 112 122.640 -13.919 -7.217 1.00 0.00 H new ATOM 0 HD13 LEU A 112 121.893 -15.081 -8.339 1.00 0.00 H new ATOM 0 HD21 LEU A 112 118.976 -14.460 -7.623 1.00 0.00 H new ATOM 0 HD22 LEU A 112 119.676 -16.086 -7.809 1.00 0.00 H new ATOM 0 HD23 LEU A 112 118.832 -15.647 -6.305 1.00 0.00 H new ATOM 1743 N VAL A 113 118.663 -16.312 -3.855 1.00 0.00 N ATOM 1744 CA VAL A 113 117.436 -17.089 -3.723 1.00 0.00 C ATOM 1745 C VAL A 113 116.467 -16.745 -4.849 1.00 0.00 C ATOM 1746 O VAL A 113 116.080 -15.589 -5.017 1.00 0.00 O ATOM 1747 CB VAL A 113 116.788 -16.805 -2.365 1.00 0.00 C ATOM 1748 CG1 VAL A 113 115.266 -16.969 -2.457 1.00 0.00 C ATOM 1749 CG2 VAL A 113 117.342 -17.778 -1.318 1.00 0.00 C ATOM 0 H VAL A 113 118.562 -15.317 -3.653 1.00 0.00 H new ATOM 0 HA VAL A 113 117.680 -18.149 -3.788 1.00 0.00 H new ATOM 0 HB VAL A 113 117.018 -15.780 -2.073 1.00 0.00 H new ATOM 0 HG11 VAL A 113 114.819 -16.764 -1.484 1.00 0.00 H new ATOM 0 HG12 VAL A 113 114.869 -16.271 -3.194 1.00 0.00 H new ATOM 0 HG13 VAL A 113 115.028 -17.989 -2.758 1.00 0.00 H new ATOM 0 HG21 VAL A 113 116.880 -17.575 -0.352 1.00 0.00 H new ATOM 0 HG22 VAL A 113 117.119 -18.802 -1.619 1.00 0.00 H new ATOM 0 HG23 VAL A 113 118.422 -17.650 -1.238 1.00 0.00 H new ATOM 1759 N ILE A 114 116.087 -17.756 -5.623 1.00 0.00 N ATOM 1760 CA ILE A 114 115.170 -17.544 -6.734 1.00 0.00 C ATOM 1761 C ILE A 114 113.819 -18.197 -6.468 1.00 0.00 C ATOM 1762 O ILE A 114 113.743 -19.365 -6.090 1.00 0.00 O ATOM 1763 CB ILE A 114 115.769 -18.108 -8.023 1.00 0.00 C ATOM 1764 CG1 ILE A 114 117.133 -17.463 -8.274 1.00 0.00 C ATOM 1765 CG2 ILE A 114 114.838 -17.799 -9.197 1.00 0.00 C ATOM 1766 CD1 ILE A 114 116.971 -15.945 -8.364 1.00 0.00 C ATOM 0 H ILE A 114 116.397 -18.720 -5.503 1.00 0.00 H new ATOM 0 HA ILE A 114 115.016 -16.470 -6.842 1.00 0.00 H new ATOM 0 HB ILE A 114 115.887 -19.187 -7.927 1.00 0.00 H new ATOM 0 HG12 ILE A 114 117.822 -17.719 -7.469 1.00 0.00 H new ATOM 0 HG13 ILE A 114 117.565 -17.849 -9.197 1.00 0.00 H new ATOM 0 HG21 ILE A 114 115.265 -18.201 -10.116 1.00 0.00 H new ATOM 0 HG22 ILE A 114 113.864 -18.256 -9.019 1.00 0.00 H new ATOM 0 HG23 ILE A 114 114.720 -16.720 -9.294 1.00 0.00 H new ATOM 0 HD11 ILE A 114 117.943 -15.485 -8.543 1.00 0.00 H new ATOM 0 HD12 ILE A 114 116.297 -15.699 -9.184 1.00 0.00 H new ATOM 0 HD13 ILE A 114 116.558 -15.567 -7.429 1.00 0.00 H new ATOM 1778 N VAL A 115 112.756 -17.425 -6.667 1.00 0.00 N ATOM 1779 CA VAL A 115 111.404 -17.927 -6.449 1.00 0.00 C ATOM 1780 C VAL A 115 110.453 -17.364 -7.496 1.00 0.00 C ATOM 1781 O VAL A 115 110.667 -16.270 -8.018 1.00 0.00 O ATOM 1782 CB VAL A 115 110.918 -17.540 -5.052 1.00 0.00 C ATOM 1783 CG1 VAL A 115 112.091 -17.587 -4.071 1.00 0.00 C ATOM 1784 CG2 VAL A 115 110.340 -16.125 -5.089 1.00 0.00 C ATOM 0 H VAL A 115 112.803 -16.454 -6.977 1.00 0.00 H new ATOM 0 HA VAL A 115 111.422 -19.013 -6.535 1.00 0.00 H new ATOM 0 HB VAL A 115 110.147 -18.240 -4.728 1.00 0.00 H new ATOM 0 HG11 VAL A 115 111.744 -17.311 -3.075 1.00 0.00 H new ATOM 0 HG12 VAL A 115 112.503 -18.596 -4.045 1.00 0.00 H new ATOM 0 HG13 VAL A 115 112.863 -16.888 -4.393 1.00 0.00 H new ATOM 0 HG21 VAL A 115 109.993 -15.848 -4.094 1.00 0.00 H new ATOM 0 HG22 VAL A 115 111.111 -15.425 -5.413 1.00 0.00 H new ATOM 0 HG23 VAL A 115 109.504 -16.092 -5.787 1.00 0.00 H new ATOM 1794 N LYS A 116 109.406 -18.120 -7.802 1.00 0.00 N ATOM 1795 CA LYS A 116 108.432 -17.685 -8.793 1.00 0.00 C ATOM 1796 C LYS A 116 107.608 -16.515 -8.263 1.00 0.00 C ATOM 1797 O LYS A 116 107.957 -15.906 -7.252 1.00 0.00 O ATOM 1798 CB LYS A 116 107.505 -18.846 -9.152 1.00 0.00 C ATOM 1799 CG LYS A 116 108.072 -19.595 -10.360 1.00 0.00 C ATOM 1800 CD LYS A 116 109.266 -20.449 -9.926 1.00 0.00 C ATOM 1801 CE LYS A 116 109.116 -21.862 -10.490 1.00 0.00 C ATOM 1802 NZ LYS A 116 109.387 -21.843 -11.956 1.00 0.00 N ATOM 0 H LYS A 116 109.211 -19.029 -7.382 1.00 0.00 H new ATOM 0 HA LYS A 116 108.968 -17.357 -9.684 1.00 0.00 H new ATOM 0 HB2 LYS A 116 107.407 -19.523 -8.304 1.00 0.00 H new ATOM 0 HB3 LYS A 116 106.506 -18.472 -9.378 1.00 0.00 H new ATOM 0 HG2 LYS A 116 107.302 -20.228 -10.802 1.00 0.00 H new ATOM 0 HG3 LYS A 116 108.380 -18.885 -11.128 1.00 0.00 H new ATOM 0 HD2 LYS A 116 110.194 -20.001 -10.281 1.00 0.00 H new ATOM 0 HD3 LYS A 116 109.324 -20.485 -8.838 1.00 0.00 H new ATOM 0 HE2 LYS A 116 109.808 -22.540 -9.990 1.00 0.00 H new ATOM 0 HE3 LYS A 116 108.110 -22.236 -10.300 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 109.369 -22.815 -12.325 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 108.659 -21.276 -12.436 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 110.323 -21.424 -12.131 1.00 0.00 H new ATOM 1816 N LYS A 117 106.514 -16.205 -8.952 1.00 0.00 N ATOM 1817 CA LYS A 117 105.649 -15.104 -8.541 1.00 0.00 C ATOM 1818 C LYS A 117 104.743 -15.533 -7.392 1.00 0.00 C ATOM 1819 O LYS A 117 104.649 -14.846 -6.375 1.00 0.00 O ATOM 1820 CB LYS A 117 104.793 -14.645 -9.725 1.00 0.00 C ATOM 1821 CG LYS A 117 103.878 -13.496 -9.288 1.00 0.00 C ATOM 1822 CD LYS A 117 102.603 -13.510 -10.130 1.00 0.00 C ATOM 1823 CE LYS A 117 101.621 -14.532 -9.554 1.00 0.00 C ATOM 1824 NZ LYS A 117 100.900 -13.930 -8.397 1.00 0.00 N ATOM 0 H LYS A 117 106.207 -16.696 -9.791 1.00 0.00 H new ATOM 0 HA LYS A 117 106.277 -14.279 -8.203 1.00 0.00 H new ATOM 0 HB2 LYS A 117 105.434 -14.320 -10.545 1.00 0.00 H new ATOM 0 HB3 LYS A 117 104.195 -15.477 -10.098 1.00 0.00 H new ATOM 0 HG2 LYS A 117 103.630 -13.597 -8.231 1.00 0.00 H new ATOM 0 HG3 LYS A 117 104.393 -12.542 -9.405 1.00 0.00 H new ATOM 0 HD2 LYS A 117 102.149 -12.519 -10.138 1.00 0.00 H new ATOM 0 HD3 LYS A 117 102.840 -13.761 -11.164 1.00 0.00 H new ATOM 0 HE2 LYS A 117 100.909 -14.840 -10.320 1.00 0.00 H new ATOM 0 HE3 LYS A 117 102.156 -15.428 -9.237 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 100.603 -14.682 -7.743 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 101.531 -13.269 -7.901 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 100.062 -13.418 -8.739 1.00 0.00 H new ATOM 1838 N ASP A 118 104.078 -16.671 -7.561 1.00 0.00 N ATOM 1839 CA ASP A 118 103.180 -17.178 -6.529 1.00 0.00 C ATOM 1840 C ASP A 118 103.976 -17.681 -5.329 1.00 0.00 C ATOM 1841 O ASP A 118 103.403 -18.071 -4.312 1.00 0.00 O ATOM 1842 CB ASP A 118 102.327 -18.316 -7.093 1.00 0.00 C ATOM 1843 CG ASP A 118 101.662 -19.081 -5.954 1.00 0.00 C ATOM 1844 OD1 ASP A 118 100.662 -18.599 -5.447 1.00 0.00 O ATOM 1845 OD2 ASP A 118 102.161 -20.138 -5.605 1.00 0.00 O ATOM 0 H ASP A 118 104.142 -17.255 -8.395 1.00 0.00 H new ATOM 0 HA ASP A 118 102.531 -16.365 -6.205 1.00 0.00 H new ATOM 0 HB2 ASP A 118 101.568 -17.915 -7.765 1.00 0.00 H new ATOM 0 HB3 ASP A 118 102.949 -18.991 -7.681 1.00 0.00 H new ATOM 1850 N GLY A 119 105.298 -17.674 -5.458 1.00 0.00 N ATOM 1851 CA GLY A 119 106.162 -18.135 -4.379 1.00 0.00 C ATOM 1852 C GLY A 119 106.798 -19.471 -4.738 1.00 0.00 C ATOM 1853 O GLY A 119 107.691 -19.954 -4.042 1.00 0.00 O ATOM 0 H GLY A 119 105.791 -17.357 -6.292 1.00 0.00 H new ATOM 0 HA2 GLY A 119 106.939 -17.396 -4.187 1.00 0.00 H new ATOM 0 HA3 GLY A 119 105.584 -18.236 -3.460 1.00 0.00 H new ATOM 1857 N THR A 120 106.332 -20.062 -5.833 1.00 0.00 N ATOM 1858 CA THR A 120 106.860 -21.343 -6.282 1.00 0.00 C ATOM 1859 C THR A 120 108.384 -21.339 -6.225 1.00 0.00 C ATOM 1860 O THR A 120 109.030 -20.412 -6.712 1.00 0.00 O ATOM 1861 CB THR A 120 106.400 -21.627 -7.713 1.00 0.00 C ATOM 1862 OG1 THR A 120 105.512 -20.601 -8.135 1.00 0.00 O ATOM 1863 CG2 THR A 120 105.683 -22.977 -7.764 1.00 0.00 C ATOM 0 H THR A 120 105.594 -19.676 -6.422 1.00 0.00 H new ATOM 0 HA THR A 120 106.483 -22.124 -5.621 1.00 0.00 H new ATOM 0 HB THR A 120 107.266 -21.654 -8.374 1.00 0.00 H new ATOM 0 HG1 THR A 120 105.468 -20.589 -9.114 1.00 0.00 H new ATOM 0 HG21 THR A 120 105.356 -23.177 -8.784 1.00 0.00 H new ATOM 0 HG22 THR A 120 106.365 -23.764 -7.440 1.00 0.00 H new ATOM 0 HG23 THR A 120 104.816 -22.954 -7.103 1.00 0.00 H new ATOM 1871 N LEU A 121 108.953 -22.381 -5.630 1.00 0.00 N ATOM 1872 CA LEU A 121 110.403 -22.485 -5.521 1.00 0.00 C ATOM 1873 C LEU A 121 110.987 -23.043 -6.808 1.00 0.00 C ATOM 1874 O LEU A 121 110.320 -23.772 -7.543 1.00 0.00 O ATOM 1875 CB LEU A 121 110.782 -23.386 -4.345 1.00 0.00 C ATOM 1876 CG LEU A 121 111.824 -22.679 -3.477 1.00 0.00 C ATOM 1877 CD1 LEU A 121 113.076 -22.395 -4.310 1.00 0.00 C ATOM 1878 CD2 LEU A 121 111.246 -21.357 -2.963 1.00 0.00 C ATOM 0 H LEU A 121 108.438 -23.159 -5.219 1.00 0.00 H new ATOM 0 HA LEU A 121 110.811 -21.489 -5.349 1.00 0.00 H new ATOM 0 HB2 LEU A 121 109.898 -23.620 -3.752 1.00 0.00 H new ATOM 0 HB3 LEU A 121 111.180 -24.332 -4.711 1.00 0.00 H new ATOM 0 HG LEU A 121 112.086 -23.317 -2.633 1.00 0.00 H new ATOM 0 HD11 LEU A 121 113.818 -21.891 -3.691 1.00 0.00 H new ATOM 0 HD12 LEU A 121 113.488 -23.334 -4.679 1.00 0.00 H new ATOM 0 HD13 LEU A 121 112.814 -21.757 -5.154 1.00 0.00 H new ATOM 0 HD21 LEU A 121 111.988 -20.852 -2.344 1.00 0.00 H new ATOM 0 HD22 LEU A 121 110.985 -20.721 -3.809 1.00 0.00 H new ATOM 0 HD23 LEU A 121 110.353 -21.556 -2.370 1.00 0.00 H new ATOM 1890 N ILE A 122 112.229 -22.677 -7.084 1.00 0.00 N ATOM 1891 CA ILE A 122 112.893 -23.126 -8.297 1.00 0.00 C ATOM 1892 C ILE A 122 114.333 -23.523 -8.010 1.00 0.00 C ATOM 1893 O ILE A 122 114.713 -24.686 -8.147 1.00 0.00 O ATOM 1894 CB ILE A 122 112.872 -21.987 -9.308 1.00 0.00 C ATOM 1895 CG1 ILE A 122 113.724 -22.357 -10.522 1.00 0.00 C ATOM 1896 CG2 ILE A 122 113.430 -20.725 -8.651 1.00 0.00 C ATOM 1897 CD1 ILE A 122 112.884 -22.192 -11.789 1.00 0.00 C ATOM 0 H ILE A 122 112.795 -22.073 -6.488 1.00 0.00 H new ATOM 0 HA ILE A 122 112.371 -23.998 -8.691 1.00 0.00 H new ATOM 0 HB ILE A 122 111.848 -21.808 -9.636 1.00 0.00 H new ATOM 0 HG12 ILE A 122 114.607 -21.720 -10.570 1.00 0.00 H new ATOM 0 HG13 ILE A 122 114.077 -23.385 -10.435 1.00 0.00 H new ATOM 0 HG21 ILE A 122 113.418 -19.905 -9.369 1.00 0.00 H new ATOM 0 HG22 ILE A 122 112.816 -20.462 -7.789 1.00 0.00 H new ATOM 0 HG23 ILE A 122 114.454 -20.907 -8.325 1.00 0.00 H new ATOM 0 HD11 ILE A 122 113.484 -22.454 -12.660 1.00 0.00 H new ATOM 0 HD12 ILE A 122 112.015 -22.847 -11.737 1.00 0.00 H new ATOM 0 HD13 ILE A 122 112.553 -21.157 -11.874 1.00 0.00 H new ATOM 1909 N SER A 123 115.127 -22.540 -7.613 1.00 0.00 N ATOM 1910 CA SER A 123 116.532 -22.776 -7.302 1.00 0.00 C ATOM 1911 C SER A 123 117.049 -21.712 -6.340 1.00 0.00 C ATOM 1912 O SER A 123 117.050 -20.523 -6.657 1.00 0.00 O ATOM 1913 CB SER A 123 117.361 -22.751 -8.587 1.00 0.00 C ATOM 1914 OG SER A 123 116.899 -23.771 -9.463 1.00 0.00 O ATOM 0 H SER A 123 114.825 -21.573 -7.498 1.00 0.00 H new ATOM 0 HA SER A 123 116.624 -23.754 -6.830 1.00 0.00 H new ATOM 0 HB2 SER A 123 117.278 -21.777 -9.068 1.00 0.00 H new ATOM 0 HB3 SER A 123 118.415 -22.903 -8.356 1.00 0.00 H new ATOM 0 HG SER A 123 117.427 -23.757 -10.289 1.00 0.00 H new ATOM 1920 N MET A 124 117.482 -22.147 -5.162 1.00 0.00 N ATOM 1921 CA MET A 124 117.992 -21.217 -4.162 1.00 0.00 C ATOM 1922 C MET A 124 119.412 -20.779 -4.502 1.00 0.00 C ATOM 1923 O MET A 124 119.614 -19.936 -5.375 1.00 0.00 O ATOM 1924 CB MET A 124 117.969 -21.872 -2.779 1.00 0.00 C ATOM 1925 CG MET A 124 116.571 -22.431 -2.507 1.00 0.00 C ATOM 1926 SD MET A 124 115.634 -21.260 -1.492 1.00 0.00 S ATOM 1927 CE MET A 124 115.295 -20.043 -2.790 1.00 0.00 C ATOM 0 H MET A 124 117.490 -23.127 -4.878 1.00 0.00 H new ATOM 0 HA MET A 124 117.351 -20.336 -4.156 1.00 0.00 H new ATOM 0 HB2 MET A 124 118.709 -22.671 -2.730 1.00 0.00 H new ATOM 0 HB3 MET A 124 118.237 -21.143 -2.014 1.00 0.00 H new ATOM 0 HG2 MET A 124 116.051 -22.609 -3.448 1.00 0.00 H new ATOM 0 HG3 MET A 124 116.645 -23.391 -1.997 1.00 0.00 H new ATOM 0 HE1 MET A 124 114.406 -19.469 -2.528 1.00 0.00 H new ATOM 0 HE2 MET A 124 116.146 -19.369 -2.888 1.00 0.00 H new ATOM 0 HE3 MET A 124 115.129 -20.557 -3.737 1.00 0.00 H new ATOM 1937 N ASN A 125 120.389 -21.352 -3.805 1.00 0.00 N ATOM 1938 CA ASN A 125 121.788 -21.008 -4.038 1.00 0.00 C ATOM 1939 C ASN A 125 122.182 -21.284 -5.486 1.00 0.00 C ATOM 1940 O ASN A 125 123.270 -21.792 -5.756 1.00 0.00 O ATOM 1941 CB ASN A 125 122.685 -21.818 -3.100 1.00 0.00 C ATOM 1942 CG ASN A 125 123.862 -20.964 -2.640 1.00 0.00 C ATOM 1943 OD1 ASN A 125 124.484 -21.261 -1.620 1.00 0.00 O ATOM 1944 ND2 ASN A 125 124.207 -19.915 -3.335 1.00 0.00 N ATOM 0 H ASN A 125 120.239 -22.052 -3.079 1.00 0.00 H new ATOM 0 HA ASN A 125 121.916 -19.944 -3.840 1.00 0.00 H new ATOM 0 HB2 ASN A 125 122.111 -22.157 -2.237 1.00 0.00 H new ATOM 0 HB3 ASN A 125 123.049 -22.709 -3.611 1.00 0.00 H new ATOM 0 HD21 ASN A 125 124.993 -19.339 -3.033 1.00 0.00 H new ATOM 0 HD22 ASN A 125 123.690 -19.671 -4.180 1.00 0.00 H new ATOM 1951 N GLY A 126 121.295 -20.941 -6.413 1.00 0.00 N ATOM 1952 CA GLY A 126 121.567 -21.150 -7.828 1.00 0.00 C ATOM 1953 C GLY A 126 122.517 -20.081 -8.350 1.00 0.00 C ATOM 1954 O GLY A 126 122.693 -19.929 -9.558 1.00 0.00 O ATOM 0 H GLY A 126 120.388 -20.520 -6.211 1.00 0.00 H new ATOM 0 HA2 GLY A 126 122.003 -22.138 -7.979 1.00 0.00 H new ATOM 0 HA3 GLY A 126 120.635 -21.123 -8.392 1.00 0.00 H new ATOM 1958 N ARG A 127 123.114 -19.330 -7.430 1.00 0.00 N ATOM 1959 CA ARG A 127 124.032 -18.265 -7.814 1.00 0.00 C ATOM 1960 C ARG A 127 124.951 -18.724 -8.936 1.00 0.00 C ATOM 1961 O ARG A 127 124.685 -18.453 -10.107 1.00 0.00 O ATOM 1962 CB ARG A 127 124.864 -17.828 -6.607 1.00 0.00 C ATOM 1963 CG ARG A 127 125.226 -16.347 -6.742 1.00 0.00 C ATOM 1964 CD ARG A 127 125.705 -15.813 -5.391 1.00 0.00 C ATOM 1965 NE ARG A 127 126.625 -16.760 -4.772 1.00 0.00 N ATOM 1966 CZ ARG A 127 127.921 -16.752 -5.068 1.00 0.00 C ATOM 1967 NH1 ARG A 127 128.389 -15.888 -5.927 1.00 0.00 N ATOM 1968 NH2 ARG A 127 128.725 -17.610 -4.502 1.00 0.00 N ATOM 0 H ARG A 127 122.981 -19.437 -6.424 1.00 0.00 H new ATOM 0 HA ARG A 127 123.445 -17.419 -8.171 1.00 0.00 H new ATOM 0 HB2 ARG A 127 124.303 -17.993 -5.687 1.00 0.00 H new ATOM 0 HB3 ARG A 127 125.770 -18.430 -6.540 1.00 0.00 H new ATOM 0 HG2 ARG A 127 126.006 -16.219 -7.493 1.00 0.00 H new ATOM 0 HG3 ARG A 127 124.360 -15.780 -7.083 1.00 0.00 H new ATOM 0 HD2 ARG A 127 126.199 -14.851 -5.527 1.00 0.00 H new ATOM 0 HD3 ARG A 127 124.851 -15.643 -4.735 1.00 0.00 H new ATOM 0 HE ARG A 127 126.268 -17.440 -4.101 1.00 0.00 H new ATOM 0 HH11 ARG A 127 127.760 -15.219 -6.371 1.00 0.00 H new ATOM 0 HH12 ARG A 127 129.383 -15.882 -6.154 1.00 0.00 H new ATOM 0 HH21 ARG A 127 128.359 -18.287 -3.832 1.00 0.00 H new ATOM 0 HH22 ARG A 127 129.719 -17.604 -4.729 1.00 0.00 H new ATOM 1982 N GLY A 128 126.028 -19.415 -8.590 1.00 0.00 N ATOM 1983 CA GLY A 128 126.958 -19.890 -9.605 1.00 0.00 C ATOM 1984 C GLY A 128 126.204 -20.472 -10.792 1.00 0.00 C ATOM 1985 O GLY A 128 126.709 -20.481 -11.913 1.00 0.00 O ATOM 0 H GLY A 128 126.277 -19.656 -7.631 1.00 0.00 H new ATOM 0 HA2 GLY A 128 127.592 -19.068 -9.938 1.00 0.00 H new ATOM 0 HA3 GLY A 128 127.615 -20.647 -9.178 1.00 0.00 H new ATOM 1989 N GLU A 129 124.993 -20.957 -10.539 1.00 0.00 N ATOM 1990 CA GLU A 129 124.183 -21.535 -11.601 1.00 0.00 C ATOM 1991 C GLU A 129 123.889 -20.491 -12.668 1.00 0.00 C ATOM 1992 O GLU A 129 124.131 -20.719 -13.853 1.00 0.00 O ATOM 1993 CB GLU A 129 122.874 -22.080 -11.030 1.00 0.00 C ATOM 1994 CG GLU A 129 122.675 -23.523 -11.493 1.00 0.00 C ATOM 1995 CD GLU A 129 121.199 -23.898 -11.416 1.00 0.00 C ATOM 1996 OE1 GLU A 129 120.380 -23.080 -11.802 1.00 0.00 O ATOM 1997 OE2 GLU A 129 120.910 -24.998 -10.975 1.00 0.00 O ATOM 0 H GLU A 129 124.556 -20.961 -9.617 1.00 0.00 H new ATOM 0 HA GLU A 129 124.739 -22.355 -12.055 1.00 0.00 H new ATOM 0 HB2 GLU A 129 122.894 -22.036 -9.941 1.00 0.00 H new ATOM 0 HB3 GLU A 129 122.037 -21.463 -11.358 1.00 0.00 H new ATOM 0 HG2 GLU A 129 123.035 -23.638 -12.515 1.00 0.00 H new ATOM 0 HG3 GLU A 129 123.263 -24.197 -10.870 1.00 0.00 H new ATOM 2004 N VAL A 130 123.376 -19.343 -12.246 1.00 0.00 N ATOM 2005 CA VAL A 130 123.072 -18.278 -13.192 1.00 0.00 C ATOM 2006 C VAL A 130 124.365 -17.744 -13.797 1.00 0.00 C ATOM 2007 O VAL A 130 124.498 -17.640 -15.016 1.00 0.00 O ATOM 2008 CB VAL A 130 122.301 -17.152 -12.491 1.00 0.00 C ATOM 2009 CG1 VAL A 130 123.025 -15.816 -12.681 1.00 0.00 C ATOM 2010 CG2 VAL A 130 120.898 -17.055 -13.096 1.00 0.00 C ATOM 0 H VAL A 130 123.165 -19.127 -11.272 1.00 0.00 H new ATOM 0 HA VAL A 130 122.447 -18.676 -13.992 1.00 0.00 H new ATOM 0 HB VAL A 130 122.237 -17.372 -11.425 1.00 0.00 H new ATOM 0 HG11 VAL A 130 122.467 -15.025 -12.179 1.00 0.00 H new ATOM 0 HG12 VAL A 130 124.026 -15.881 -12.255 1.00 0.00 H new ATOM 0 HG13 VAL A 130 123.097 -15.589 -13.745 1.00 0.00 H new ATOM 0 HG21 VAL A 130 120.344 -16.257 -12.603 1.00 0.00 H new ATOM 0 HG22 VAL A 130 120.975 -16.839 -14.161 1.00 0.00 H new ATOM 0 HG23 VAL A 130 120.375 -18.001 -12.955 1.00 0.00 H new ATOM 2020 N GLN A 131 125.313 -17.411 -12.931 1.00 0.00 N ATOM 2021 CA GLN A 131 126.598 -16.892 -13.381 1.00 0.00 C ATOM 2022 C GLN A 131 127.336 -17.933 -14.218 1.00 0.00 C ATOM 2023 O GLN A 131 128.167 -17.589 -15.058 1.00 0.00 O ATOM 2024 CB GLN A 131 127.456 -16.499 -12.175 1.00 0.00 C ATOM 2025 CG GLN A 131 127.067 -15.097 -11.696 1.00 0.00 C ATOM 2026 CD GLN A 131 125.890 -15.182 -10.730 1.00 0.00 C ATOM 2027 OE1 GLN A 131 125.445 -14.161 -10.204 1.00 0.00 O ATOM 2028 NE2 GLN A 131 125.358 -16.342 -10.462 1.00 0.00 N ATOM 0 H GLN A 131 125.218 -17.490 -11.919 1.00 0.00 H new ATOM 0 HA GLN A 131 126.416 -16.012 -13.998 1.00 0.00 H new ATOM 0 HB2 GLN A 131 127.318 -17.220 -11.369 1.00 0.00 H new ATOM 0 HB3 GLN A 131 128.512 -16.521 -12.446 1.00 0.00 H new ATOM 0 HG2 GLN A 131 127.917 -14.623 -11.205 1.00 0.00 H new ATOM 0 HG3 GLN A 131 126.803 -14.473 -12.550 1.00 0.00 H new ATOM 0 HE21 GLN A 131 125.728 -17.186 -10.899 1.00 0.00 H new ATOM 0 HE22 GLN A 131 124.572 -16.405 -9.816 1.00 0.00 H new ATOM 2037 N SER A 132 127.028 -19.208 -13.988 1.00 0.00 N ATOM 2038 CA SER A 132 127.675 -20.281 -14.735 1.00 0.00 C ATOM 2039 C SER A 132 127.021 -20.449 -16.100 1.00 0.00 C ATOM 2040 O SER A 132 127.705 -20.535 -17.121 1.00 0.00 O ATOM 2041 CB SER A 132 127.575 -21.598 -13.964 1.00 0.00 C ATOM 2042 OG SER A 132 128.042 -22.659 -14.787 1.00 0.00 O ATOM 0 H SER A 132 126.343 -19.519 -13.299 1.00 0.00 H new ATOM 0 HA SER A 132 128.724 -20.017 -14.869 1.00 0.00 H new ATOM 0 HB2 SER A 132 128.166 -21.544 -13.050 1.00 0.00 H new ATOM 0 HB3 SER A 132 126.543 -21.781 -13.665 1.00 0.00 H new ATOM 0 HG SER A 132 127.981 -23.505 -14.296 1.00 0.00 H new ATOM 2048 N LEU A 133 125.695 -20.502 -16.108 1.00 0.00 N ATOM 2049 CA LEU A 133 124.957 -20.668 -17.351 1.00 0.00 C ATOM 2050 C LEU A 133 124.537 -19.322 -17.924 1.00 0.00 C ATOM 2051 O LEU A 133 123.882 -19.264 -18.963 1.00 0.00 O ATOM 2052 CB LEU A 133 123.712 -21.519 -17.105 1.00 0.00 C ATOM 2053 CG LEU A 133 124.026 -22.984 -17.405 1.00 0.00 C ATOM 2054 CD1 LEU A 133 122.787 -23.835 -17.127 1.00 0.00 C ATOM 2055 CD2 LEU A 133 124.423 -23.126 -18.876 1.00 0.00 C ATOM 0 H LEU A 133 125.113 -20.433 -15.273 1.00 0.00 H new ATOM 0 HA LEU A 133 125.612 -21.163 -18.068 1.00 0.00 H new ATOM 0 HB2 LEU A 133 123.384 -21.411 -16.071 1.00 0.00 H new ATOM 0 HB3 LEU A 133 122.893 -21.175 -17.737 1.00 0.00 H new ATOM 0 HG LEU A 133 124.847 -23.320 -16.772 1.00 0.00 H new ATOM 0 HD11 LEU A 133 123.008 -24.881 -17.340 1.00 0.00 H new ATOM 0 HD12 LEU A 133 122.501 -23.731 -16.080 1.00 0.00 H new ATOM 0 HD13 LEU A 133 121.966 -23.501 -17.762 1.00 0.00 H new ATOM 0 HD21 LEU A 133 124.648 -24.170 -19.093 1.00 0.00 H new ATOM 0 HD22 LEU A 133 123.600 -22.793 -19.509 1.00 0.00 H new ATOM 0 HD23 LEU A 133 125.304 -22.516 -19.076 1.00 0.00 H new ATOM 2067 N GLY A 134 124.904 -18.242 -17.245 1.00 0.00 N ATOM 2068 CA GLY A 134 124.536 -16.917 -17.722 1.00 0.00 C ATOM 2069 C GLY A 134 123.023 -16.828 -17.900 1.00 0.00 C ATOM 2070 O GLY A 134 122.268 -17.430 -17.137 1.00 0.00 O ATOM 0 H GLY A 134 125.445 -18.256 -16.380 1.00 0.00 H new ATOM 0 HA2 GLY A 134 124.872 -16.160 -17.013 1.00 0.00 H new ATOM 0 HA3 GLY A 134 125.035 -16.711 -18.669 1.00 0.00 H new ATOM 2074 N PRO A 135 122.568 -16.095 -18.880 1.00 0.00 N ATOM 2075 CA PRO A 135 121.109 -15.937 -19.143 1.00 0.00 C ATOM 2076 C PRO A 135 120.464 -17.247 -19.584 1.00 0.00 C ATOM 2077 O PRO A 135 119.240 -17.380 -19.574 1.00 0.00 O ATOM 2078 CB PRO A 135 121.037 -14.889 -20.255 1.00 0.00 C ATOM 2079 CG PRO A 135 122.386 -14.871 -20.895 1.00 0.00 C ATOM 2080 CD PRO A 135 123.388 -15.342 -19.842 1.00 0.00 C ATOM 0 HA PRO A 135 120.566 -15.638 -18.246 1.00 0.00 H new ATOM 0 HB2 PRO A 135 120.265 -15.143 -20.981 1.00 0.00 H new ATOM 0 HB3 PRO A 135 120.784 -13.909 -19.851 1.00 0.00 H new ATOM 0 HG2 PRO A 135 122.408 -15.525 -21.767 1.00 0.00 H new ATOM 0 HG3 PRO A 135 122.635 -13.868 -21.242 1.00 0.00 H new ATOM 0 HD2 PRO A 135 124.164 -15.969 -20.282 1.00 0.00 H new ATOM 0 HD3 PRO A 135 123.891 -14.501 -19.365 1.00 0.00 H new ATOM 2088 N ARG A 136 121.294 -18.217 -19.957 1.00 0.00 N ATOM 2089 CA ARG A 136 120.785 -19.515 -20.383 1.00 0.00 C ATOM 2090 C ARG A 136 120.234 -20.260 -19.181 1.00 0.00 C ATOM 2091 O ARG A 136 119.474 -21.220 -19.319 1.00 0.00 O ATOM 2092 CB ARG A 136 121.903 -20.333 -21.032 1.00 0.00 C ATOM 2093 CG ARG A 136 122.908 -19.389 -21.693 1.00 0.00 C ATOM 2094 CD ARG A 136 123.286 -19.927 -23.073 1.00 0.00 C ATOM 2095 NE ARG A 136 123.407 -21.381 -23.031 1.00 0.00 N ATOM 2096 CZ ARG A 136 123.087 -22.128 -24.082 1.00 0.00 C ATOM 2097 NH1 ARG A 136 122.654 -21.563 -25.177 1.00 0.00 N ATOM 2098 NH2 ARG A 136 123.205 -23.426 -24.021 1.00 0.00 N ATOM 0 H ARG A 136 122.310 -18.130 -19.973 1.00 0.00 H new ATOM 0 HA ARG A 136 119.991 -19.365 -21.114 1.00 0.00 H new ATOM 0 HB2 ARG A 136 122.403 -20.945 -20.281 1.00 0.00 H new ATOM 0 HB3 ARG A 136 121.486 -21.014 -21.773 1.00 0.00 H new ATOM 0 HG2 ARG A 136 122.479 -18.391 -21.786 1.00 0.00 H new ATOM 0 HG3 ARG A 136 123.798 -19.296 -21.071 1.00 0.00 H new ATOM 0 HD2 ARG A 136 122.530 -19.639 -23.803 1.00 0.00 H new ATOM 0 HD3 ARG A 136 124.228 -19.486 -23.398 1.00 0.00 H new ATOM 0 HE ARG A 136 123.743 -21.831 -22.180 1.00 0.00 H new ATOM 0 HH11 ARG A 136 122.562 -20.548 -25.225 1.00 0.00 H new ATOM 0 HH12 ARG A 136 122.408 -22.136 -25.984 1.00 0.00 H new ATOM 0 HH21 ARG A 136 123.543 -23.868 -23.166 1.00 0.00 H new ATOM 0 HH22 ARG A 136 122.959 -23.999 -24.828 1.00 0.00 H new ATOM 2112 N ALA A 137 120.615 -19.795 -17.998 1.00 0.00 N ATOM 2113 CA ALA A 137 120.148 -20.404 -16.761 1.00 0.00 C ATOM 2114 C ALA A 137 118.662 -20.125 -16.575 1.00 0.00 C ATOM 2115 O ALA A 137 117.955 -20.883 -15.912 1.00 0.00 O ATOM 2116 CB ALA A 137 120.931 -19.845 -15.572 1.00 0.00 C ATOM 0 H ALA A 137 121.243 -19.002 -17.870 1.00 0.00 H new ATOM 0 HA ALA A 137 120.307 -21.481 -16.816 1.00 0.00 H new ATOM 0 HB1 ALA A 137 120.574 -20.307 -14.652 1.00 0.00 H new ATOM 0 HB2 ALA A 137 121.991 -20.063 -15.700 1.00 0.00 H new ATOM 0 HB3 ALA A 137 120.787 -18.766 -15.516 1.00 0.00 H new ATOM 2122 N PHE A 138 118.193 -19.031 -17.172 1.00 0.00 N ATOM 2123 CA PHE A 138 116.786 -18.666 -17.070 1.00 0.00 C ATOM 2124 C PHE A 138 115.925 -19.921 -17.084 1.00 0.00 C ATOM 2125 O PHE A 138 114.819 -19.937 -16.544 1.00 0.00 O ATOM 2126 CB PHE A 138 116.393 -17.757 -18.236 1.00 0.00 C ATOM 2127 CG PHE A 138 114.902 -17.835 -18.455 1.00 0.00 C ATOM 2128 CD1 PHE A 138 114.028 -17.238 -17.538 1.00 0.00 C ATOM 2129 CD2 PHE A 138 114.392 -18.504 -19.574 1.00 0.00 C ATOM 2130 CE1 PHE A 138 112.644 -17.311 -17.741 1.00 0.00 C ATOM 2131 CE2 PHE A 138 113.009 -18.576 -19.777 1.00 0.00 C ATOM 2132 CZ PHE A 138 112.134 -17.980 -18.861 1.00 0.00 C ATOM 0 H PHE A 138 118.761 -18.390 -17.725 1.00 0.00 H new ATOM 0 HA PHE A 138 116.627 -18.131 -16.134 1.00 0.00 H new ATOM 0 HB2 PHE A 138 116.687 -16.729 -18.024 1.00 0.00 H new ATOM 0 HB3 PHE A 138 116.920 -18.060 -19.141 1.00 0.00 H new ATOM 0 HD1 PHE A 138 114.421 -16.722 -16.675 1.00 0.00 H new ATOM 0 HD2 PHE A 138 115.066 -18.965 -20.281 1.00 0.00 H new ATOM 0 HE1 PHE A 138 111.970 -16.851 -17.034 1.00 0.00 H new ATOM 0 HE2 PHE A 138 112.617 -19.092 -20.641 1.00 0.00 H new ATOM 0 HZ PHE A 138 111.067 -18.036 -19.018 1.00 0.00 H new ATOM 2142 N GLN A 139 116.449 -20.977 -17.699 1.00 0.00 N ATOM 2143 CA GLN A 139 115.730 -22.240 -17.771 1.00 0.00 C ATOM 2144 C GLN A 139 115.681 -22.885 -16.393 1.00 0.00 C ATOM 2145 O GLN A 139 114.628 -23.328 -15.939 1.00 0.00 O ATOM 2146 CB GLN A 139 116.420 -23.181 -18.760 1.00 0.00 C ATOM 2147 CG GLN A 139 116.398 -22.556 -20.156 1.00 0.00 C ATOM 2148 CD GLN A 139 117.404 -23.262 -21.060 1.00 0.00 C ATOM 2149 OE1 GLN A 139 118.515 -23.570 -20.629 1.00 0.00 O ATOM 2150 NE2 GLN A 139 117.079 -23.537 -22.293 1.00 0.00 N ATOM 0 H GLN A 139 117.363 -20.982 -18.151 1.00 0.00 H new ATOM 0 HA GLN A 139 114.713 -22.050 -18.114 1.00 0.00 H new ATOM 0 HB2 GLN A 139 117.448 -23.364 -18.448 1.00 0.00 H new ATOM 0 HB3 GLN A 139 115.914 -24.146 -18.774 1.00 0.00 H new ATOM 0 HG2 GLN A 139 115.398 -22.633 -20.582 1.00 0.00 H new ATOM 0 HG3 GLN A 139 116.637 -21.494 -20.092 1.00 0.00 H new ATOM 0 HE21 GLN A 139 116.157 -23.280 -22.647 1.00 0.00 H new ATOM 0 HE22 GLN A 139 117.746 -24.009 -22.903 1.00 0.00 H new ATOM 2159 N ASN A 140 116.829 -22.915 -15.727 1.00 0.00 N ATOM 2160 CA ASN A 140 116.909 -23.486 -14.390 1.00 0.00 C ATOM 2161 C ASN A 140 116.270 -22.533 -13.390 1.00 0.00 C ATOM 2162 O ASN A 140 115.585 -22.955 -12.458 1.00 0.00 O ATOM 2163 CB ASN A 140 118.371 -23.733 -14.009 1.00 0.00 C ATOM 2164 CG ASN A 140 119.071 -24.522 -15.109 1.00 0.00 C ATOM 2165 OD1 ASN A 140 119.464 -25.669 -14.898 1.00 0.00 O ATOM 2166 ND2 ASN A 140 119.253 -23.973 -16.279 1.00 0.00 N ATOM 0 H ASN A 140 117.711 -22.553 -16.089 1.00 0.00 H new ATOM 0 HA ASN A 140 116.376 -24.437 -14.376 1.00 0.00 H new ATOM 0 HB2 ASN A 140 118.880 -22.782 -13.852 1.00 0.00 H new ATOM 0 HB3 ASN A 140 118.422 -24.281 -13.068 1.00 0.00 H new ATOM 0 HD21 ASN A 140 119.721 -24.495 -17.020 1.00 0.00 H new ATOM 0 HD22 ASN A 140 118.927 -23.022 -16.453 1.00 0.00 H new ATOM 2173 N TRP A 141 116.494 -21.241 -13.605 1.00 0.00 N ATOM 2174 CA TRP A 141 115.932 -20.216 -12.735 1.00 0.00 C ATOM 2175 C TRP A 141 114.433 -20.079 -12.987 1.00 0.00 C ATOM 2176 O TRP A 141 113.705 -19.515 -12.170 1.00 0.00 O ATOM 2177 CB TRP A 141 116.609 -18.872 -13.008 1.00 0.00 C ATOM 2178 CG TRP A 141 117.795 -18.699 -12.111 1.00 0.00 C ATOM 2179 CD1 TRP A 141 118.561 -19.702 -11.622 1.00 0.00 C ATOM 2180 CD2 TRP A 141 118.366 -17.462 -11.597 1.00 0.00 C ATOM 2181 NE1 TRP A 141 119.559 -19.158 -10.834 1.00 0.00 N ATOM 2182 CE2 TRP A 141 119.482 -17.781 -10.789 1.00 0.00 C ATOM 2183 CE3 TRP A 141 118.025 -16.106 -11.750 1.00 0.00 C ATOM 2184 CZ2 TRP A 141 120.234 -16.792 -10.157 1.00 0.00 C ATOM 2185 CZ3 TRP A 141 118.781 -15.108 -11.115 1.00 0.00 C ATOM 2186 CH2 TRP A 141 119.882 -15.450 -10.320 1.00 0.00 C ATOM 0 H TRP A 141 117.060 -20.880 -14.373 1.00 0.00 H new ATOM 0 HA TRP A 141 116.102 -20.508 -11.699 1.00 0.00 H new ATOM 0 HB2 TRP A 141 116.922 -18.819 -14.051 1.00 0.00 H new ATOM 0 HB3 TRP A 141 115.900 -18.060 -12.846 1.00 0.00 H new ATOM 0 HD1 TRP A 141 118.417 -20.755 -11.815 1.00 0.00 H new ATOM 0 HE1 TRP A 141 120.266 -19.708 -10.346 1.00 0.00 H new ATOM 0 HE3 TRP A 141 117.177 -15.831 -12.359 1.00 0.00 H new ATOM 0 HZ2 TRP A 141 121.083 -17.061 -9.546 1.00 0.00 H new ATOM 0 HZ3 TRP A 141 118.512 -14.070 -11.240 1.00 0.00 H new ATOM 0 HH2 TRP A 141 120.458 -14.677 -9.833 1.00 0.00 H new ATOM 2197 N ALA A 142 113.981 -20.591 -14.132 1.00 0.00 N ATOM 2198 CA ALA A 142 112.570 -20.514 -14.489 1.00 0.00 C ATOM 2199 C ALA A 142 112.023 -21.889 -14.841 1.00 0.00 C ATOM 2200 O ALA A 142 110.886 -22.026 -15.292 1.00 0.00 O ATOM 2201 CB ALA A 142 112.374 -19.560 -15.669 1.00 0.00 C ATOM 0 H ALA A 142 114.569 -21.060 -14.822 1.00 0.00 H new ATOM 0 HA ALA A 142 112.023 -20.134 -13.626 1.00 0.00 H new ATOM 0 HB1 ALA A 142 111.316 -19.511 -15.926 1.00 0.00 H new ATOM 0 HB2 ALA A 142 112.727 -18.566 -15.396 1.00 0.00 H new ATOM 0 HB3 ALA A 142 112.939 -19.922 -16.528 1.00 0.00 H new ATOM 2207 N ARG A 143 112.846 -22.895 -14.629 1.00 0.00 N ATOM 2208 CA ARG A 143 112.458 -24.271 -14.919 1.00 0.00 C ATOM 2209 C ARG A 143 111.619 -24.334 -16.191 1.00 0.00 C ATOM 2210 O ARG A 143 110.926 -25.322 -16.373 1.00 0.00 O ATOM 2211 CB ARG A 143 111.657 -24.845 -13.750 1.00 0.00 C ATOM 2212 CG ARG A 143 112.620 -25.325 -12.661 1.00 0.00 C ATOM 2213 CD ARG A 143 111.866 -25.482 -11.339 1.00 0.00 C ATOM 2214 NE ARG A 143 111.370 -26.846 -11.199 1.00 0.00 N ATOM 2215 CZ ARG A 143 110.348 -27.126 -10.398 1.00 0.00 C ATOM 2216 NH1 ARG A 143 109.768 -26.173 -9.721 1.00 0.00 N ATOM 2217 NH2 ARG A 143 109.922 -28.355 -10.290 1.00 0.00 N ATOM 2218 OXT ARG A 143 111.681 -23.394 -16.966 1.00 0.00 O ATOM 0 H ARG A 143 113.790 -22.791 -14.257 1.00 0.00 H new ATOM 0 HA ARG A 143 113.363 -24.861 -15.064 1.00 0.00 H new ATOM 0 HB2 ARG A 143 110.985 -24.087 -13.348 1.00 0.00 H new ATOM 0 HB3 ARG A 143 111.036 -25.673 -14.092 1.00 0.00 H new ATOM 0 HG2 ARG A 143 113.067 -26.276 -12.951 1.00 0.00 H new ATOM 0 HG3 ARG A 143 113.436 -24.612 -12.543 1.00 0.00 H new ATOM 0 HD2 ARG A 143 112.525 -25.240 -10.505 1.00 0.00 H new ATOM 0 HD3 ARG A 143 111.034 -24.779 -11.301 1.00 0.00 H new ATOM 0 HE ARG A 143 111.815 -27.598 -11.725 1.00 0.00 H new ATOM 0 HH11 ARG A 143 110.099 -25.212 -9.807 1.00 0.00 H new ATOM 0 HH12 ARG A 143 108.983 -26.389 -9.106 1.00 0.00 H new ATOM 0 HH21 ARG A 143 110.374 -29.100 -10.821 1.00 0.00 H new ATOM 0 HH22 ARG A 143 109.137 -28.571 -9.675 1.00 0.00 H new TER 2232 ARG A 143