USER MOD reduce.3.24.130724 H: found=0, std=0, add=1072, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 1070 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 120 LYS NZ :NH3+ -174:sc= -0.594 (180deg=-0.515) USER MOD Set 1.2: A 123 HIS : no HE2:sc= -8.12! C(o=-8.7!,f=-7.9!) USER MOD Set 2.1: A 88 GLN : amide:sc= -2.3! K(o=-2.8!,f=-0.43) USER MOD Set 2.2: A 89 GLN : amide:sc= -0.505 K(o=-2.8,f=-0.43) USER MOD Set 3.1: A 78 MET CE :methyl 123:sc= -11.8! (180deg=-12.9!) USER MOD Set 3.2: A 86 MET CE :methyl -140:sc= -7.38! (180deg=-8.26!) USER MOD Set 4.1: A 67 ASN : amide:sc= -0.0499 K(o=-0.47,f=-1.6) USER MOD Set 4.2: A 80 HIS : no HE2:sc= -0.422 K(o=-0.47,f=-8.2!) USER MOD Set 5.1: A 43 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 5.2: A 44 THR OG1 : rot 180:sc= 0 USER MOD Set 5.3: A 131 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 SER N :NH3+ -111:sc= -0.114 (180deg=-1.08) USER MOD Single : A 1 SER OG : rot 180:sc= 0.0159 USER MOD Single : A 5 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 6 LYS NZ :NH3+ -111:sc= 0.537 (180deg=-0.414) USER MOD Single : A 7 ASN : amide:sc= -0.417 X(o=-0.42,f=-0.66) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 10 ASN : amide:sc= -1.95! C(o=-2!,f=-4.1!) USER MOD Single : A 11 ASN : amide:sc= -6.26! C(o=-6.3!,f=-9.2!) USER MOD Single : A 14 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0777) USER MOD Single : A 16 MET CE :methyl -154:sc= -7.35! (180deg=-11.1!) USER MOD Single : A 18 GLN : amide:sc= -0.666 K(o=-0.67,f=-1.8!) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 SER OG : rot 43:sc= 0.601 USER MOD Single : A 28 SER OG : rot 180:sc= -0.536 USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 ASN : amide:sc= -0.276 K(o=-0.28,f=-1.4!) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0.099 (180deg=0.099) USER MOD Single : A 41 TYR OH : rot -178:sc= -4.43! USER MOD Single : A 53 ASN : amide:sc=-0.00277 X(o=-0.0028,f=-0.0081) USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 HIS : no HD1:sc= -4.94! K(o=-4.9!,f=-2.4) USER MOD Single : A 70 HIS : no HE2:sc= -4.9! C(o=-4.9!,f=-6.9!) USER MOD Single : A 72 ASN : amide:sc= -1.35 K(o=-1.3,f=-0.63!) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 THR OG1 : rot 180:sc= -1.28 USER MOD Single : A 95 HIS : no HD1:sc= -3.76! C(o=-3.8!,f=-3!) USER MOD Single : A 99 LYS NZ :NH3+ -179:sc=-0.00181 (180deg=-0.00256) USER MOD Single : A 100 SER OG : rot -137:sc= -1.85! USER MOD Single : A 104 ASN : amide:sc= -0.483 K(o=-0.48,f=-4.8!) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 MET CE :methyl 142:sc= -0.109 (180deg=-0.618) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 THR OG1 : rot -160:sc= -0.583 USER MOD Single : A 116 MET CE :methyl 147:sc= -1.19 (180deg=-1.93) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 LYS NZ :NH3+ -165:sc= 0.024 (180deg=0.00169) USER MOD Single : A 126 ASN : amide:sc= -2.67! C(o=-2.7!,f=-1.6!) USER MOD Single : A 130 ASN : amide:sc= 0 X(o=0,f=-0.095) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 -8.932 -11.213 -16.918 1.00 0.00 N ATOM 2 CA SER A 1 -9.595 -10.688 -15.737 1.00 0.00 C ATOM 3 C SER A 1 -8.848 -11.132 -14.477 1.00 0.00 C ATOM 4 O SER A 1 -9.274 -12.065 -13.797 1.00 0.00 O ATOM 5 CB SER A 1 -11.054 -11.140 -15.677 1.00 0.00 C ATOM 6 OG SER A 1 -11.725 -10.946 -16.919 1.00 0.00 O ATOM 0 H1 SER A 1 -8.495 -10.432 -17.447 1.00 0.00 H new ATOM 0 H2 SER A 1 -8.197 -11.891 -16.631 1.00 0.00 H new ATOM 0 H3 SER A 1 -9.629 -11.693 -17.523 1.00 0.00 H new ATOM 0 HA SER A 1 -9.584 -9.600 -15.794 1.00 0.00 H new ATOM 0 HB2 SER A 1 -11.096 -12.194 -15.403 1.00 0.00 H new ATOM 0 HB3 SER A 1 -11.573 -10.587 -14.894 1.00 0.00 H new ATOM 0 HG SER A 1 -12.654 -11.249 -16.840 1.00 0.00 H new ATOM 12 N PRO A 2 -7.722 -10.425 -14.196 1.00 0.00 N ATOM 13 CA PRO A 2 -6.913 -10.736 -13.029 1.00 0.00 C ATOM 14 C PRO A 2 -7.586 -10.239 -11.748 1.00 0.00 C ATOM 15 O PRO A 2 -8.780 -9.944 -11.744 1.00 0.00 O ATOM 16 CB PRO A 2 -5.572 -10.072 -13.292 1.00 0.00 C ATOM 17 CG PRO A 2 -5.826 -9.030 -14.369 1.00 0.00 C ATOM 18 CD PRO A 2 -7.190 -9.313 -14.978 1.00 0.00 C ATOM 0 HA PRO A 2 -6.788 -11.808 -12.877 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -5.181 -9.609 -12.386 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -4.833 -10.802 -13.622 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -5.798 -8.027 -13.944 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -5.050 -9.074 -15.133 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -7.840 -8.440 -14.917 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -7.106 -9.575 -16.033 1.00 0.00 H new ATOM 26 N GLU A 3 -6.790 -10.165 -10.691 1.00 0.00 N ATOM 27 CA GLU A 3 -7.293 -9.710 -9.407 1.00 0.00 C ATOM 28 C GLU A 3 -7.964 -8.342 -9.552 1.00 0.00 C ATOM 29 O GLU A 3 -8.834 -7.985 -8.760 1.00 0.00 O ATOM 30 CB GLU A 3 -6.173 -9.662 -8.364 1.00 0.00 C ATOM 31 CG GLU A 3 -5.515 -11.035 -8.204 1.00 0.00 C ATOM 32 CD GLU A 3 -6.184 -11.836 -7.085 1.00 0.00 C ATOM 33 OE1 GLU A 3 -7.416 -11.688 -6.939 1.00 0.00 O ATOM 34 OE2 GLU A 3 -5.445 -12.576 -6.399 1.00 0.00 O ATOM 0 H GLU A 3 -5.801 -10.413 -10.698 1.00 0.00 H new ATOM 0 HA GLU A 3 -8.039 -10.424 -9.059 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -5.424 -8.928 -8.662 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -6.577 -9.334 -7.406 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -5.583 -11.586 -9.142 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -4.455 -10.911 -7.984 1.00 0.00 H new ATOM 41 N ILE A 4 -7.535 -7.615 -10.573 1.00 0.00 N ATOM 42 CA ILE A 4 -8.081 -6.295 -10.833 1.00 0.00 C ATOM 43 C ILE A 4 -9.595 -6.405 -11.032 1.00 0.00 C ATOM 44 O ILE A 4 -10.349 -5.546 -10.576 1.00 0.00 O ATOM 45 CB ILE A 4 -7.355 -5.634 -12.008 1.00 0.00 C ATOM 46 CG1 ILE A 4 -5.852 -5.914 -11.948 1.00 0.00 C ATOM 47 CG2 ILE A 4 -7.657 -4.137 -12.067 1.00 0.00 C ATOM 48 CD1 ILE A 4 -5.314 -5.723 -10.529 1.00 0.00 C ATOM 0 H ILE A 4 -6.815 -7.916 -11.230 1.00 0.00 H new ATOM 0 HA ILE A 4 -7.916 -5.641 -9.977 1.00 0.00 H new ATOM 0 HB ILE A 4 -7.729 -6.073 -12.933 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -5.655 -6.933 -12.281 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -5.327 -5.248 -12.632 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -7.129 -3.692 -12.910 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -8.730 -3.987 -12.190 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -7.328 -3.663 -11.142 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -4.244 -5.928 -10.515 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -5.491 -4.696 -10.208 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -5.824 -6.408 -9.851 1.00 0.00 H new ATOM 60 N MET A 5 -9.995 -7.469 -11.711 1.00 0.00 N ATOM 61 CA MET A 5 -11.404 -7.704 -11.974 1.00 0.00 C ATOM 62 C MET A 5 -12.129 -8.169 -10.710 1.00 0.00 C ATOM 63 O MET A 5 -13.342 -8.373 -10.724 1.00 0.00 O ATOM 64 CB MET A 5 -11.550 -8.764 -13.067 1.00 0.00 C ATOM 65 CG MET A 5 -12.710 -8.429 -14.006 1.00 0.00 C ATOM 66 SD MET A 5 -14.225 -9.142 -13.387 1.00 0.00 S ATOM 67 CE MET A 5 -15.395 -7.912 -13.938 1.00 0.00 C ATOM 0 H MET A 5 -9.367 -8.179 -12.088 1.00 0.00 H new ATOM 0 HA MET A 5 -11.853 -6.767 -12.303 1.00 0.00 H new ATOM 0 HB2 MET A 5 -10.624 -8.833 -13.638 1.00 0.00 H new ATOM 0 HB3 MET A 5 -11.717 -9.740 -12.612 1.00 0.00 H new ATOM 0 HG2 MET A 5 -12.817 -7.348 -14.093 1.00 0.00 H new ATOM 0 HG3 MET A 5 -12.501 -8.811 -15.005 1.00 0.00 H new ATOM 0 HE1 MET A 5 -16.400 -8.203 -13.632 1.00 0.00 H new ATOM 0 HE2 MET A 5 -15.146 -6.948 -13.494 1.00 0.00 H new ATOM 0 HE3 MET A 5 -15.355 -7.832 -15.024 1.00 0.00 H new ATOM 77 N LYS A 6 -11.354 -8.325 -9.646 1.00 0.00 N ATOM 78 CA LYS A 6 -11.907 -8.763 -8.376 1.00 0.00 C ATOM 79 C LYS A 6 -11.523 -7.759 -7.285 1.00 0.00 C ATOM 80 O LYS A 6 -10.372 -7.716 -6.855 1.00 0.00 O ATOM 81 CB LYS A 6 -11.474 -10.198 -8.070 1.00 0.00 C ATOM 82 CG LYS A 6 -11.962 -10.634 -6.686 1.00 0.00 C ATOM 83 CD LYS A 6 -13.389 -11.179 -6.755 1.00 0.00 C ATOM 84 CE LYS A 6 -14.262 -10.569 -5.656 1.00 0.00 C ATOM 85 NZ LYS A 6 -14.845 -9.287 -6.109 1.00 0.00 N ATOM 0 H LYS A 6 -10.348 -8.156 -9.638 1.00 0.00 H new ATOM 0 HA LYS A 6 -12.996 -8.786 -8.421 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -11.872 -10.872 -8.829 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -10.387 -10.272 -8.117 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -11.296 -11.398 -6.286 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -11.925 -9.788 -6.000 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -13.820 -10.958 -7.732 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -13.373 -12.264 -6.652 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -15.059 -11.263 -5.389 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -13.666 -10.407 -4.758 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -14.417 -8.503 -5.576 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -14.657 -9.159 -7.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -15.872 -9.296 -5.946 1.00 0.00 H new ATOM 99 N ASN A 7 -12.511 -6.981 -6.869 1.00 0.00 N ATOM 100 CA ASN A 7 -12.291 -5.981 -5.837 1.00 0.00 C ATOM 101 C ASN A 7 -13.183 -6.293 -4.634 1.00 0.00 C ATOM 102 O ASN A 7 -14.343 -6.668 -4.798 1.00 0.00 O ATOM 103 CB ASN A 7 -12.649 -4.582 -6.341 1.00 0.00 C ATOM 104 CG ASN A 7 -14.166 -4.406 -6.442 1.00 0.00 C ATOM 105 OD1 ASN A 7 -14.835 -5.024 -7.254 1.00 0.00 O ATOM 106 ND2 ASN A 7 -14.668 -3.532 -5.575 1.00 0.00 N ATOM 0 H ASN A 7 -13.465 -7.022 -7.227 1.00 0.00 H new ATOM 0 HA ASN A 7 -11.237 -6.006 -5.562 1.00 0.00 H new ATOM 0 HB2 ASN A 7 -12.237 -3.832 -5.666 1.00 0.00 H new ATOM 0 HB3 ASN A 7 -12.194 -4.416 -7.318 1.00 0.00 H new ATOM 0 HD21 ASN A 7 -15.671 -3.344 -5.563 1.00 0.00 H new ATOM 0 HD22 ASN A 7 -14.051 -3.049 -4.922 1.00 0.00 H new ATOM 113 N LEU A 8 -12.608 -6.126 -3.451 1.00 0.00 N ATOM 114 CA LEU A 8 -13.337 -6.386 -2.222 1.00 0.00 C ATOM 115 C LEU A 8 -14.415 -5.317 -2.038 1.00 0.00 C ATOM 116 O LEU A 8 -14.719 -4.571 -2.968 1.00 0.00 O ATOM 117 CB LEU A 8 -12.370 -6.493 -1.040 1.00 0.00 C ATOM 118 CG LEU A 8 -11.378 -5.341 -0.877 1.00 0.00 C ATOM 119 CD1 LEU A 8 -11.894 -4.312 0.129 1.00 0.00 C ATOM 120 CD2 LEU A 8 -9.989 -5.863 -0.504 1.00 0.00 C ATOM 0 H LEU A 8 -11.646 -5.814 -3.319 1.00 0.00 H new ATOM 0 HA LEU A 8 -13.847 -7.348 -2.277 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -12.955 -6.574 -0.124 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -11.806 -7.420 -1.141 1.00 0.00 H new ATOM 0 HG LEU A 8 -11.283 -4.832 -1.836 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -11.170 -3.503 0.226 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -12.845 -3.908 -0.219 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -12.036 -4.790 1.098 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -9.302 -5.024 -0.394 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -10.047 -6.410 0.437 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -9.627 -6.527 -1.289 1.00 0.00 H new ATOM 132 N SER A 9 -14.962 -5.274 -0.832 1.00 0.00 N ATOM 133 CA SER A 9 -16.001 -4.309 -0.515 1.00 0.00 C ATOM 134 C SER A 9 -15.582 -2.915 -0.989 1.00 0.00 C ATOM 135 O SER A 9 -15.672 -2.607 -2.176 1.00 0.00 O ATOM 136 CB SER A 9 -16.297 -4.292 0.986 1.00 0.00 C ATOM 137 OG SER A 9 -17.040 -5.437 1.396 1.00 0.00 O ATOM 0 H SER A 9 -14.705 -5.892 -0.062 1.00 0.00 H new ATOM 0 HA SER A 9 -16.913 -4.604 -1.035 1.00 0.00 H new ATOM 0 HB2 SER A 9 -15.359 -4.251 1.540 1.00 0.00 H new ATOM 0 HB3 SER A 9 -16.855 -3.389 1.235 1.00 0.00 H new ATOM 0 HG SER A 9 -17.207 -5.390 2.360 1.00 0.00 H new ATOM 143 N ASN A 10 -15.133 -2.111 -0.037 1.00 0.00 N ATOM 144 CA ASN A 10 -14.700 -0.757 -0.341 1.00 0.00 C ATOM 145 C ASN A 10 -13.264 -0.564 0.149 1.00 0.00 C ATOM 146 O ASN A 10 -12.486 0.163 -0.468 1.00 0.00 O ATOM 147 CB ASN A 10 -15.583 0.275 0.362 1.00 0.00 C ATOM 148 CG ASN A 10 -16.728 0.726 -0.546 1.00 0.00 C ATOM 149 OD1 ASN A 10 -16.859 0.300 -1.683 1.00 0.00 O ATOM 150 ND2 ASN A 10 -17.547 1.612 0.015 1.00 0.00 N ATOM 0 H ASN A 10 -15.059 -2.371 0.947 1.00 0.00 H new ATOM 0 HA ASN A 10 -14.769 -0.615 -1.419 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -15.988 -0.152 1.279 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -14.982 1.137 0.651 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -18.342 1.976 -0.511 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -17.380 1.927 0.971 1.00 0.00 H new ATOM 157 N ASN A 11 -12.955 -1.227 1.253 1.00 0.00 N ATOM 158 CA ASN A 11 -11.626 -1.137 1.834 1.00 0.00 C ATOM 159 C ASN A 11 -10.605 -0.887 0.723 1.00 0.00 C ATOM 160 O ASN A 11 -9.631 -0.162 0.919 1.00 0.00 O ATOM 161 CB ASN A 11 -11.245 -2.437 2.543 1.00 0.00 C ATOM 162 CG ASN A 11 -9.776 -2.786 2.296 1.00 0.00 C ATOM 163 OD1 ASN A 11 -8.896 -1.943 2.333 1.00 0.00 O ATOM 164 ND2 ASN A 11 -9.561 -4.075 2.044 1.00 0.00 N ATOM 0 H ASN A 11 -13.602 -1.829 1.761 1.00 0.00 H new ATOM 0 HA ASN A 11 -11.628 -0.321 2.556 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -11.424 -2.337 3.614 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -11.880 -3.249 2.188 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -8.614 -4.409 1.867 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -10.344 -4.729 2.028 1.00 0.00 H new ATOM 171 N PHE A 12 -10.862 -1.504 -0.423 1.00 0.00 N ATOM 172 CA PHE A 12 -9.977 -1.359 -1.566 1.00 0.00 C ATOM 173 C PHE A 12 -10.646 -0.548 -2.677 1.00 0.00 C ATOM 174 O PHE A 12 -10.205 0.555 -2.996 1.00 0.00 O ATOM 175 CB PHE A 12 -9.683 -2.767 -2.087 1.00 0.00 C ATOM 176 CG PHE A 12 -8.214 -3.008 -2.437 1.00 0.00 C ATOM 177 CD1 PHE A 12 -7.433 -1.970 -2.841 1.00 0.00 C ATOM 178 CD2 PHE A 12 -7.688 -4.259 -2.346 1.00 0.00 C ATOM 179 CE1 PHE A 12 -6.070 -2.193 -3.167 1.00 0.00 C ATOM 180 CE2 PHE A 12 -6.324 -4.482 -2.671 1.00 0.00 C ATOM 181 CZ PHE A 12 -5.543 -3.444 -3.075 1.00 0.00 C ATOM 0 H PHE A 12 -11.670 -2.105 -0.583 1.00 0.00 H new ATOM 0 HA PHE A 12 -9.068 -0.837 -1.268 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -9.990 -3.493 -1.334 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -10.291 -2.950 -2.973 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -7.850 -0.976 -2.914 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -8.308 -5.083 -2.026 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -5.450 -1.369 -3.488 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -5.907 -5.475 -2.598 1.00 0.00 H new ATOM 0 HZ PHE A 12 -4.505 -3.613 -3.323 1.00 0.00 H new ATOM 191 N GLY A 13 -11.699 -1.125 -3.236 1.00 0.00 N ATOM 192 CA GLY A 13 -12.433 -0.468 -4.304 1.00 0.00 C ATOM 193 C GLY A 13 -12.658 1.012 -3.987 1.00 0.00 C ATOM 194 O GLY A 13 -12.577 1.859 -4.874 1.00 0.00 O ATOM 0 H GLY A 13 -12.062 -2.040 -2.970 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -11.883 -0.563 -5.240 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -13.394 -0.963 -4.447 1.00 0.00 H new ATOM 198 N LYS A 14 -12.936 1.276 -2.718 1.00 0.00 N ATOM 199 CA LYS A 14 -13.172 2.639 -2.273 1.00 0.00 C ATOM 200 C LYS A 14 -11.843 3.394 -2.226 1.00 0.00 C ATOM 201 O LYS A 14 -11.703 4.451 -2.840 1.00 0.00 O ATOM 202 CB LYS A 14 -13.930 2.643 -0.943 1.00 0.00 C ATOM 203 CG LYS A 14 -14.241 4.073 -0.495 1.00 0.00 C ATOM 204 CD LYS A 14 -13.372 4.475 0.698 1.00 0.00 C ATOM 205 CE LYS A 14 -13.818 3.751 1.970 1.00 0.00 C ATOM 206 NZ LYS A 14 -14.645 4.643 2.812 1.00 0.00 N ATOM 0 H LYS A 14 -13.003 0.570 -1.985 1.00 0.00 H new ATOM 0 HA LYS A 14 -13.812 3.166 -2.981 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -14.858 2.081 -1.047 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -13.336 2.140 -0.180 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -14.071 4.762 -1.322 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -15.294 4.153 -0.226 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -12.329 4.240 0.488 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -13.431 5.553 0.849 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -14.387 2.859 1.707 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -12.945 3.418 2.531 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -15.077 4.092 3.581 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -14.047 5.391 3.216 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -15.393 5.073 2.231 1.00 0.00 H new ATOM 220 N ALA A 15 -10.900 2.822 -1.493 1.00 0.00 N ATOM 221 CA ALA A 15 -9.586 3.429 -1.358 1.00 0.00 C ATOM 222 C ALA A 15 -8.983 3.644 -2.748 1.00 0.00 C ATOM 223 O ALA A 15 -8.290 4.631 -2.981 1.00 0.00 O ATOM 224 CB ALA A 15 -8.705 2.546 -0.470 1.00 0.00 C ATOM 0 H ALA A 15 -11.019 1.945 -0.986 1.00 0.00 H new ATOM 0 HA ALA A 15 -9.661 4.404 -0.877 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -7.720 3.001 -0.368 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -9.163 2.448 0.514 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -8.605 1.560 -0.923 1.00 0.00 H new ATOM 230 N MET A 16 -9.270 2.701 -3.634 1.00 0.00 N ATOM 231 CA MET A 16 -8.766 2.775 -4.995 1.00 0.00 C ATOM 232 C MET A 16 -9.444 3.906 -5.771 1.00 0.00 C ATOM 233 O MET A 16 -8.774 4.714 -6.411 1.00 0.00 O ATOM 234 CB MET A 16 -9.017 1.445 -5.706 1.00 0.00 C ATOM 235 CG MET A 16 -7.744 0.934 -6.384 1.00 0.00 C ATOM 236 SD MET A 16 -6.847 -0.134 -5.270 1.00 0.00 S ATOM 237 CE MET A 16 -6.637 0.968 -3.883 1.00 0.00 C ATOM 0 H MET A 16 -9.845 1.882 -3.436 1.00 0.00 H new ATOM 0 HA MET A 16 -7.696 2.979 -4.955 1.00 0.00 H new ATOM 0 HB2 MET A 16 -9.372 0.706 -4.987 1.00 0.00 H new ATOM 0 HB3 MET A 16 -9.804 1.570 -6.450 1.00 0.00 H new ATOM 0 HG2 MET A 16 -7.999 0.392 -7.294 1.00 0.00 H new ATOM 0 HG3 MET A 16 -7.116 1.775 -6.679 1.00 0.00 H new ATOM 0 HE1 MET A 16 -5.753 0.676 -3.317 1.00 0.00 H new ATOM 0 HE2 MET A 16 -6.515 1.989 -4.245 1.00 0.00 H new ATOM 0 HE3 MET A 16 -7.515 0.914 -3.239 1.00 0.00 H new ATOM 247 N ASP A 17 -10.766 3.927 -5.688 1.00 0.00 N ATOM 248 CA ASP A 17 -11.542 4.945 -6.374 1.00 0.00 C ATOM 249 C ASP A 17 -11.265 6.308 -5.738 1.00 0.00 C ATOM 250 O ASP A 17 -11.171 7.316 -6.437 1.00 0.00 O ATOM 251 CB ASP A 17 -13.042 4.665 -6.258 1.00 0.00 C ATOM 252 CG ASP A 17 -13.948 5.718 -6.902 1.00 0.00 C ATOM 253 OD1 ASP A 17 -13.826 6.894 -6.501 1.00 0.00 O ATOM 254 OD2 ASP A 17 -14.741 5.320 -7.783 1.00 0.00 O ATOM 0 H ASP A 17 -11.319 3.255 -5.156 1.00 0.00 H new ATOM 0 HA ASP A 17 -11.253 4.937 -7.425 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -13.252 3.698 -6.715 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -13.300 4.582 -5.202 1.00 0.00 H new ATOM 259 N GLN A 18 -11.141 6.295 -4.418 1.00 0.00 N ATOM 260 CA GLN A 18 -10.876 7.517 -3.680 1.00 0.00 C ATOM 261 C GLN A 18 -9.443 7.993 -3.934 1.00 0.00 C ATOM 262 O GLN A 18 -9.205 9.185 -4.119 1.00 0.00 O ATOM 263 CB GLN A 18 -11.130 7.320 -2.184 1.00 0.00 C ATOM 264 CG GLN A 18 -12.553 7.743 -1.809 1.00 0.00 C ATOM 265 CD GLN A 18 -12.697 7.896 -0.294 1.00 0.00 C ATOM 266 OE1 GLN A 18 -11.730 8.009 0.441 1.00 0.00 O ATOM 267 NE2 GLN A 18 -13.958 7.890 0.131 1.00 0.00 N ATOM 0 H GLN A 18 -11.219 5.457 -3.842 1.00 0.00 H new ATOM 0 HA GLN A 18 -11.562 8.287 -4.034 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -10.976 6.274 -1.920 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -10.410 7.903 -1.609 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -12.797 8.686 -2.298 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -13.265 7.002 -2.173 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -14.721 7.792 -0.538 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -14.161 7.984 1.126 1.00 0.00 H new ATOM 276 N CYS A 19 -8.529 7.034 -3.937 1.00 0.00 N ATOM 277 CA CYS A 19 -7.128 7.338 -4.166 1.00 0.00 C ATOM 278 C CYS A 19 -6.989 7.944 -5.564 1.00 0.00 C ATOM 279 O CYS A 19 -6.196 8.860 -5.773 1.00 0.00 O ATOM 280 CB CYS A 19 -6.243 6.101 -3.991 1.00 0.00 C ATOM 281 SG CYS A 19 -5.814 5.705 -2.256 1.00 0.00 S ATOM 0 H CYS A 19 -8.732 6.046 -3.784 1.00 0.00 H new ATOM 0 HA CYS A 19 -6.785 8.058 -3.423 1.00 0.00 H new ATOM 0 HB2 CYS A 19 -6.751 5.243 -4.430 1.00 0.00 H new ATOM 0 HB3 CYS A 19 -5.321 6.248 -4.554 1.00 0.00 H new ATOM 286 N LYS A 20 -7.775 7.409 -6.487 1.00 0.00 N ATOM 287 CA LYS A 20 -7.751 7.885 -7.859 1.00 0.00 C ATOM 288 C LYS A 20 -8.299 9.313 -7.909 1.00 0.00 C ATOM 289 O LYS A 20 -8.277 9.954 -8.958 1.00 0.00 O ATOM 290 CB LYS A 20 -8.491 6.911 -8.777 1.00 0.00 C ATOM 291 CG LYS A 20 -7.709 6.676 -10.071 1.00 0.00 C ATOM 292 CD LYS A 20 -8.570 5.952 -11.109 1.00 0.00 C ATOM 293 CE LYS A 20 -9.011 6.909 -12.217 1.00 0.00 C ATOM 294 NZ LYS A 20 -10.458 7.205 -12.102 1.00 0.00 N ATOM 0 H LYS A 20 -8.433 6.650 -6.311 1.00 0.00 H new ATOM 0 HA LYS A 20 -6.727 7.923 -8.231 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -8.641 5.963 -8.261 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -9.479 7.306 -9.012 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -7.372 7.631 -10.475 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -6.817 6.087 -9.859 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -8.007 5.125 -11.541 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -9.447 5.522 -10.624 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -8.439 7.835 -12.155 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -8.800 6.468 -13.191 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -10.741 7.856 -12.862 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -11.001 6.322 -12.183 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -10.650 7.645 -11.180 1.00 0.00 H new ATOM 308 N ASP A 21 -8.779 9.769 -6.761 1.00 0.00 N ATOM 309 CA ASP A 21 -9.331 11.110 -6.659 1.00 0.00 C ATOM 310 C ASP A 21 -8.421 11.966 -5.776 1.00 0.00 C ATOM 311 O ASP A 21 -7.759 12.881 -6.265 1.00 0.00 O ATOM 312 CB ASP A 21 -10.722 11.084 -6.022 1.00 0.00 C ATOM 313 CG ASP A 21 -11.309 12.459 -5.700 1.00 0.00 C ATOM 314 OD1 ASP A 21 -11.852 13.080 -6.639 1.00 0.00 O ATOM 315 OD2 ASP A 21 -11.201 12.860 -4.520 1.00 0.00 O ATOM 0 H ASP A 21 -8.797 9.234 -5.893 1.00 0.00 H new ATOM 0 HA ASP A 21 -9.402 11.524 -7.665 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -11.404 10.563 -6.694 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -10.673 10.501 -5.102 1.00 0.00 H new ATOM 320 N GLU A 22 -8.418 11.639 -4.493 1.00 0.00 N ATOM 321 CA GLU A 22 -7.601 12.366 -3.538 1.00 0.00 C ATOM 322 C GLU A 22 -6.177 12.531 -4.073 1.00 0.00 C ATOM 323 O GLU A 22 -5.592 13.608 -3.973 1.00 0.00 O ATOM 324 CB GLU A 22 -7.597 11.670 -2.175 1.00 0.00 C ATOM 325 CG GLU A 22 -7.374 10.164 -2.330 1.00 0.00 C ATOM 326 CD GLU A 22 -8.497 9.372 -1.656 1.00 0.00 C ATOM 327 OE1 GLU A 22 -9.615 9.924 -1.581 1.00 0.00 O ATOM 328 OE2 GLU A 22 -8.209 8.231 -1.232 1.00 0.00 O ATOM 0 H GLU A 22 -8.969 10.880 -4.092 1.00 0.00 H new ATOM 0 HA GLU A 22 -8.034 13.357 -3.401 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -6.813 12.095 -1.548 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -8.544 11.851 -1.667 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -7.327 9.907 -3.388 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -6.415 9.888 -1.892 1.00 0.00 H new ATOM 335 N LEU A 23 -5.660 11.447 -4.632 1.00 0.00 N ATOM 336 CA LEU A 23 -4.316 11.457 -5.184 1.00 0.00 C ATOM 337 C LEU A 23 -4.394 11.651 -6.700 1.00 0.00 C ATOM 338 O LEU A 23 -3.379 11.899 -7.349 1.00 0.00 O ATOM 339 CB LEU A 23 -3.554 10.198 -4.763 1.00 0.00 C ATOM 340 CG LEU A 23 -3.823 9.694 -3.343 1.00 0.00 C ATOM 341 CD1 LEU A 23 -3.458 8.215 -3.209 1.00 0.00 C ATOM 342 CD2 LEU A 23 -3.102 10.560 -2.309 1.00 0.00 C ATOM 0 H LEU A 23 -6.148 10.555 -4.715 1.00 0.00 H new ATOM 0 HA LEU A 23 -3.746 12.295 -4.784 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -3.798 9.399 -5.463 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -2.486 10.394 -4.862 1.00 0.00 H new ATOM 0 HG LEU A 23 -4.891 9.780 -3.145 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -3.658 7.882 -2.191 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -4.055 7.628 -3.907 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -2.400 8.080 -3.433 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -3.310 10.181 -1.308 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -2.028 10.529 -2.493 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -3.454 11.589 -2.387 1.00 0.00 H new ATOM 354 N SER A 24 -5.606 11.528 -7.219 1.00 0.00 N ATOM 355 CA SER A 24 -5.829 11.688 -8.646 1.00 0.00 C ATOM 356 C SER A 24 -4.843 10.818 -9.429 1.00 0.00 C ATOM 357 O SER A 24 -4.631 11.034 -10.622 1.00 0.00 O ATOM 358 CB SER A 24 -5.693 13.153 -9.065 1.00 0.00 C ATOM 359 OG SER A 24 -6.911 13.872 -8.896 1.00 0.00 O ATOM 0 H SER A 24 -6.445 11.319 -6.677 1.00 0.00 H new ATOM 0 HA SER A 24 -6.846 11.368 -8.871 1.00 0.00 H new ATOM 0 HB2 SER A 24 -4.908 13.627 -8.476 1.00 0.00 H new ATOM 0 HB3 SER A 24 -5.384 13.204 -10.109 1.00 0.00 H new ATOM 0 HG SER A 24 -7.316 13.632 -8.036 1.00 0.00 H new ATOM 365 N LEU A 25 -4.268 9.852 -8.727 1.00 0.00 N ATOM 366 CA LEU A 25 -3.312 8.948 -9.343 1.00 0.00 C ATOM 367 C LEU A 25 -4.065 7.827 -10.059 1.00 0.00 C ATOM 368 O LEU A 25 -5.271 7.669 -9.880 1.00 0.00 O ATOM 369 CB LEU A 25 -2.304 8.448 -8.305 1.00 0.00 C ATOM 370 CG LEU A 25 -2.736 7.233 -7.482 1.00 0.00 C ATOM 371 CD1 LEU A 25 -4.238 7.275 -7.188 1.00 0.00 C ATOM 372 CD2 LEU A 25 -2.324 5.931 -8.170 1.00 0.00 C ATOM 0 H LEU A 25 -4.446 9.676 -7.738 1.00 0.00 H new ATOM 0 HA LEU A 25 -2.725 9.470 -10.099 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -1.375 8.202 -8.819 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -2.082 9.266 -7.620 1.00 0.00 H new ATOM 0 HG LEU A 25 -2.219 7.269 -6.523 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -4.519 6.400 -6.602 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -4.474 8.179 -6.626 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -4.793 7.276 -8.126 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -2.643 5.083 -7.564 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -2.795 5.873 -9.151 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -1.240 5.907 -8.285 1.00 0.00 H new ATOM 384 N PRO A 26 -3.302 7.054 -10.878 1.00 0.00 N ATOM 385 CA PRO A 26 -3.883 5.951 -11.624 1.00 0.00 C ATOM 386 C PRO A 26 -4.166 4.759 -10.707 1.00 0.00 C ATOM 387 O PRO A 26 -3.252 4.209 -10.096 1.00 0.00 O ATOM 388 CB PRO A 26 -2.872 5.634 -12.713 1.00 0.00 C ATOM 389 CG PRO A 26 -1.561 6.255 -12.258 1.00 0.00 C ATOM 390 CD PRO A 26 -1.869 7.209 -11.116 1.00 0.00 C ATOM 0 HA PRO A 26 -4.850 6.202 -12.059 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -2.768 4.557 -12.848 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -3.188 6.046 -13.671 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -0.865 5.482 -11.932 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -1.084 6.787 -13.082 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -1.291 6.961 -10.226 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -1.621 8.237 -11.381 1.00 0.00 H new ATOM 398 N ASP A 27 -5.439 4.394 -10.640 1.00 0.00 N ATOM 399 CA ASP A 27 -5.854 3.277 -9.808 1.00 0.00 C ATOM 400 C ASP A 27 -5.281 1.980 -10.380 1.00 0.00 C ATOM 401 O ASP A 27 -5.485 0.905 -9.817 1.00 0.00 O ATOM 402 CB ASP A 27 -7.379 3.150 -9.778 1.00 0.00 C ATOM 403 CG ASP A 27 -8.019 2.750 -11.109 1.00 0.00 C ATOM 404 OD1 ASP A 27 -7.272 2.713 -12.110 1.00 0.00 O ATOM 405 OD2 ASP A 27 -9.242 2.489 -11.094 1.00 0.00 O ATOM 0 H ASP A 27 -6.196 4.852 -11.148 1.00 0.00 H new ATOM 0 HA ASP A 27 -5.487 3.454 -8.797 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -7.653 2.412 -9.024 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -7.802 4.103 -9.460 1.00 0.00 H new ATOM 410 N SER A 28 -4.577 2.122 -11.494 1.00 0.00 N ATOM 411 CA SER A 28 -3.973 0.974 -12.150 1.00 0.00 C ATOM 412 C SER A 28 -2.655 0.612 -11.462 1.00 0.00 C ATOM 413 O SER A 28 -2.367 -0.565 -11.245 1.00 0.00 O ATOM 414 CB SER A 28 -3.739 1.249 -13.635 1.00 0.00 C ATOM 415 OG SER A 28 -3.042 2.474 -13.849 1.00 0.00 O ATOM 0 H SER A 28 -4.411 3.015 -11.959 1.00 0.00 H new ATOM 0 HA SER A 28 -4.661 0.132 -12.069 1.00 0.00 H new ATOM 0 HB2 SER A 28 -3.170 0.428 -14.070 1.00 0.00 H new ATOM 0 HB3 SER A 28 -4.698 1.282 -14.153 1.00 0.00 H new ATOM 0 HG SER A 28 -2.911 2.612 -14.810 1.00 0.00 H new ATOM 421 N VAL A 29 -1.890 1.644 -11.138 1.00 0.00 N ATOM 422 CA VAL A 29 -0.610 1.449 -10.480 1.00 0.00 C ATOM 423 C VAL A 29 -0.842 0.855 -9.089 1.00 0.00 C ATOM 424 O VAL A 29 -0.062 0.020 -8.630 1.00 0.00 O ATOM 425 CB VAL A 29 0.165 2.767 -10.445 1.00 0.00 C ATOM 426 CG1 VAL A 29 0.269 3.382 -11.842 1.00 0.00 C ATOM 427 CG2 VAL A 29 -0.471 3.752 -9.461 1.00 0.00 C ATOM 0 H VAL A 29 -2.132 2.618 -11.319 1.00 0.00 H new ATOM 0 HA VAL A 29 0.003 0.741 -11.038 1.00 0.00 H new ATOM 0 HB VAL A 29 1.175 2.550 -10.098 1.00 0.00 H new ATOM 0 HG11 VAL A 29 0.825 4.318 -11.787 1.00 0.00 H new ATOM 0 HG12 VAL A 29 0.787 2.691 -12.506 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -0.731 3.576 -12.229 1.00 0.00 H new ATOM 0 HG21 VAL A 29 0.100 4.681 -9.456 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -1.497 3.958 -9.765 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -0.469 3.319 -8.461 1.00 0.00 H new ATOM 437 N VAL A 30 -1.915 1.307 -8.459 1.00 0.00 N ATOM 438 CA VAL A 30 -2.259 0.829 -7.129 1.00 0.00 C ATOM 439 C VAL A 30 -2.902 -0.555 -7.241 1.00 0.00 C ATOM 440 O VAL A 30 -2.735 -1.393 -6.356 1.00 0.00 O ATOM 441 CB VAL A 30 -3.152 1.849 -6.421 1.00 0.00 C ATOM 442 CG1 VAL A 30 -4.510 1.965 -7.119 1.00 0.00 C ATOM 443 CG2 VAL A 30 -3.323 1.495 -4.943 1.00 0.00 C ATOM 0 H VAL A 30 -2.558 1.999 -8.843 1.00 0.00 H new ATOM 0 HA VAL A 30 -1.363 0.723 -6.517 1.00 0.00 H new ATOM 0 HB VAL A 30 -2.662 2.821 -6.477 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -5.126 2.696 -6.596 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -4.363 2.285 -8.150 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -5.009 0.996 -7.108 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -3.962 2.236 -4.463 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -3.781 0.510 -4.855 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -2.348 1.487 -4.456 1.00 0.00 H new ATOM 453 N ALA A 31 -3.624 -0.751 -8.335 1.00 0.00 N ATOM 454 CA ALA A 31 -4.293 -2.018 -8.572 1.00 0.00 C ATOM 455 C ALA A 31 -3.247 -3.095 -8.869 1.00 0.00 C ATOM 456 O ALA A 31 -3.533 -4.287 -8.772 1.00 0.00 O ATOM 457 CB ALA A 31 -5.302 -1.857 -9.710 1.00 0.00 C ATOM 0 H ALA A 31 -3.760 -0.053 -9.067 1.00 0.00 H new ATOM 0 HA ALA A 31 -4.846 -2.331 -7.687 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -5.804 -2.808 -9.888 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -6.040 -1.102 -9.438 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -4.782 -1.546 -10.616 1.00 0.00 H new ATOM 463 N ASP A 32 -2.057 -2.636 -9.223 1.00 0.00 N ATOM 464 CA ASP A 32 -0.967 -3.544 -9.536 1.00 0.00 C ATOM 465 C ASP A 32 -0.423 -4.144 -8.237 1.00 0.00 C ATOM 466 O ASP A 32 0.053 -5.280 -8.226 1.00 0.00 O ATOM 467 CB ASP A 32 0.180 -2.810 -10.233 1.00 0.00 C ATOM 468 CG ASP A 32 1.255 -3.717 -10.838 1.00 0.00 C ATOM 469 OD1 ASP A 32 1.049 -4.949 -10.796 1.00 0.00 O ATOM 470 OD2 ASP A 32 2.260 -3.156 -11.327 1.00 0.00 O ATOM 0 H ASP A 32 -1.823 -1.646 -9.300 1.00 0.00 H new ATOM 0 HA ASP A 32 -1.353 -4.319 -10.198 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -0.235 -2.186 -11.024 1.00 0.00 H new ATOM 0 HB3 ASP A 32 0.653 -2.140 -9.515 1.00 0.00 H new ATOM 475 N LEU A 33 -0.509 -3.357 -7.176 1.00 0.00 N ATOM 476 CA LEU A 33 -0.032 -3.796 -5.876 1.00 0.00 C ATOM 477 C LEU A 33 -0.647 -5.157 -5.546 1.00 0.00 C ATOM 478 O LEU A 33 0.019 -6.022 -4.978 1.00 0.00 O ATOM 479 CB LEU A 33 -0.301 -2.726 -4.816 1.00 0.00 C ATOM 480 CG LEU A 33 0.893 -2.329 -3.946 1.00 0.00 C ATOM 481 CD1 LEU A 33 1.827 -1.378 -4.697 1.00 0.00 C ATOM 482 CD2 LEU A 33 0.427 -1.741 -2.612 1.00 0.00 C ATOM 0 H LEU A 33 -0.903 -2.416 -7.190 1.00 0.00 H new ATOM 0 HA LEU A 33 1.050 -3.929 -5.892 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -0.673 -1.832 -5.317 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -1.098 -3.082 -4.163 1.00 0.00 H new ATOM 0 HG LEU A 33 1.465 -3.229 -3.719 1.00 0.00 H new ATOM 0 HD11 LEU A 33 2.667 -1.112 -4.056 1.00 0.00 H new ATOM 0 HD12 LEU A 33 2.198 -1.868 -5.597 1.00 0.00 H new ATOM 0 HD13 LEU A 33 1.282 -0.476 -4.974 1.00 0.00 H new ATOM 0 HD21 LEU A 33 1.295 -1.467 -2.012 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -0.180 -0.855 -2.797 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -0.166 -2.482 -2.075 1.00 0.00 H new ATOM 494 N TYR A 34 -1.911 -5.305 -5.914 1.00 0.00 N ATOM 495 CA TYR A 34 -2.622 -6.548 -5.664 1.00 0.00 C ATOM 496 C TYR A 34 -2.142 -7.654 -6.605 1.00 0.00 C ATOM 497 O TYR A 34 -2.311 -8.837 -6.314 1.00 0.00 O ATOM 498 CB TYR A 34 -4.096 -6.255 -5.952 1.00 0.00 C ATOM 499 CG TYR A 34 -5.071 -7.159 -5.195 1.00 0.00 C ATOM 500 CD1 TYR A 34 -4.825 -7.487 -3.877 1.00 0.00 C ATOM 501 CD2 TYR A 34 -6.194 -7.647 -5.831 1.00 0.00 C ATOM 502 CE1 TYR A 34 -5.743 -8.339 -3.165 1.00 0.00 C ATOM 503 CE2 TYR A 34 -7.111 -8.498 -5.119 1.00 0.00 C ATOM 504 CZ TYR A 34 -6.840 -8.802 -3.821 1.00 0.00 C ATOM 505 OH TYR A 34 -7.707 -9.606 -3.148 1.00 0.00 O ATOM 0 H TYR A 34 -2.461 -4.585 -6.383 1.00 0.00 H new ATOM 0 HA TYR A 34 -2.454 -6.887 -4.642 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -4.306 -5.217 -5.696 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -4.274 -6.361 -7.022 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -3.945 -7.105 -3.380 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -6.385 -7.391 -6.863 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -5.564 -8.604 -2.133 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -7.994 -8.886 -5.604 1.00 0.00 H new ATOM 0 HH TYR A 34 -8.445 -9.860 -3.741 1.00 0.00 H new ATOM 515 N ASN A 35 -1.553 -7.231 -7.712 1.00 0.00 N ATOM 516 CA ASN A 35 -1.046 -8.171 -8.698 1.00 0.00 C ATOM 517 C ASN A 35 0.174 -8.895 -8.125 1.00 0.00 C ATOM 518 O ASN A 35 0.094 -10.071 -7.772 1.00 0.00 O ATOM 519 CB ASN A 35 -0.611 -7.451 -9.975 1.00 0.00 C ATOM 520 CG ASN A 35 -1.297 -8.052 -11.204 1.00 0.00 C ATOM 521 OD1 ASN A 35 -2.400 -8.569 -11.141 1.00 0.00 O ATOM 522 ND2 ASN A 35 -0.583 -7.954 -12.323 1.00 0.00 N ATOM 0 H ASN A 35 -1.415 -6.249 -7.949 1.00 0.00 H new ATOM 0 HA ASN A 35 -1.845 -8.873 -8.935 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -0.854 -6.391 -9.900 1.00 0.00 H new ATOM 0 HB3 ASN A 35 0.471 -7.523 -10.087 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -0.953 -8.324 -13.198 1.00 0.00 H new ATOM 0 HD22 ASN A 35 0.334 -7.509 -12.305 1.00 0.00 H new ATOM 529 N PHE A 36 1.276 -8.163 -8.049 1.00 0.00 N ATOM 530 CA PHE A 36 2.511 -8.721 -7.526 1.00 0.00 C ATOM 531 C PHE A 36 3.721 -7.905 -7.987 1.00 0.00 C ATOM 532 O PHE A 36 4.808 -8.449 -8.171 1.00 0.00 O ATOM 533 CB PHE A 36 2.630 -10.143 -8.079 1.00 0.00 C ATOM 534 CG PHE A 36 2.295 -11.236 -7.060 1.00 0.00 C ATOM 535 CD1 PHE A 36 2.834 -11.192 -5.814 1.00 0.00 C ATOM 536 CD2 PHE A 36 1.457 -12.250 -7.405 1.00 0.00 C ATOM 537 CE1 PHE A 36 2.524 -12.205 -4.869 1.00 0.00 C ATOM 538 CE2 PHE A 36 1.146 -13.264 -6.461 1.00 0.00 C ATOM 539 CZ PHE A 36 1.686 -13.221 -5.213 1.00 0.00 C ATOM 0 H PHE A 36 1.339 -7.188 -8.341 1.00 0.00 H new ATOM 0 HA PHE A 36 2.492 -8.708 -6.436 1.00 0.00 H new ATOM 0 HB2 PHE A 36 1.966 -10.245 -8.938 1.00 0.00 H new ATOM 0 HB3 PHE A 36 3.646 -10.297 -8.442 1.00 0.00 H new ATOM 0 HD1 PHE A 36 3.499 -10.386 -5.542 1.00 0.00 H new ATOM 0 HD2 PHE A 36 1.029 -12.284 -8.396 1.00 0.00 H new ATOM 0 HE1 PHE A 36 2.953 -12.170 -3.878 1.00 0.00 H new ATOM 0 HE2 PHE A 36 0.481 -14.070 -6.734 1.00 0.00 H new ATOM 0 HZ PHE A 36 1.450 -13.993 -4.495 1.00 0.00 H new ATOM 549 N TRP A 37 3.489 -6.611 -8.159 1.00 0.00 N ATOM 550 CA TRP A 37 4.546 -5.715 -8.596 1.00 0.00 C ATOM 551 C TRP A 37 5.174 -5.082 -7.352 1.00 0.00 C ATOM 552 O TRP A 37 5.734 -3.989 -7.422 1.00 0.00 O ATOM 553 CB TRP A 37 4.012 -4.679 -9.588 1.00 0.00 C ATOM 554 CG TRP A 37 3.284 -3.505 -8.931 1.00 0.00 C ATOM 555 CD1 TRP A 37 2.338 -3.547 -7.981 1.00 0.00 C ATOM 556 CD2 TRP A 37 3.480 -2.103 -9.214 1.00 0.00 C ATOM 557 NE1 TRP A 37 1.913 -2.281 -7.633 1.00 0.00 N ATOM 558 CE2 TRP A 37 2.629 -1.376 -8.407 1.00 0.00 C ATOM 559 CE3 TRP A 37 4.347 -1.472 -10.122 1.00 0.00 C ATOM 560 CZ2 TRP A 37 2.563 0.023 -8.427 1.00 0.00 C ATOM 561 CZ3 TRP A 37 4.270 -0.074 -10.129 1.00 0.00 C ATOM 562 CH2 TRP A 37 3.419 0.673 -9.324 1.00 0.00 C ATOM 0 H TRP A 37 2.586 -6.163 -8.004 1.00 0.00 H new ATOM 0 HA TRP A 37 5.318 -6.264 -9.135 1.00 0.00 H new ATOM 0 HB2 TRP A 37 4.844 -4.293 -10.177 1.00 0.00 H new ATOM 0 HB3 TRP A 37 3.332 -5.173 -10.282 1.00 0.00 H new ATOM 0 HD1 TRP A 37 1.957 -4.458 -7.543 1.00 0.00 H new ATOM 0 HE1 TRP A 37 1.204 -2.052 -6.936 1.00 0.00 H new ATOM 0 HE3 TRP A 37 5.020 -2.022 -10.764 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 1.888 0.570 -7.785 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 4.918 0.461 -10.808 1.00 0.00 H new ATOM 0 HH2 TRP A 37 3.418 1.751 -9.390 1.00 0.00 H new ATOM 573 N LYS A 38 5.057 -5.797 -6.242 1.00 0.00 N ATOM 574 CA LYS A 38 5.605 -5.319 -4.984 1.00 0.00 C ATOM 575 C LYS A 38 7.035 -4.822 -5.211 1.00 0.00 C ATOM 576 O LYS A 38 7.396 -3.733 -4.767 1.00 0.00 O ATOM 577 CB LYS A 38 5.495 -6.400 -3.907 1.00 0.00 C ATOM 578 CG LYS A 38 4.268 -6.167 -3.022 1.00 0.00 C ATOM 579 CD LYS A 38 3.039 -6.878 -3.592 1.00 0.00 C ATOM 580 CE LYS A 38 2.109 -7.348 -2.473 1.00 0.00 C ATOM 581 NZ LYS A 38 1.087 -8.278 -3.002 1.00 0.00 N ATOM 0 H LYS A 38 4.591 -6.703 -6.188 1.00 0.00 H new ATOM 0 HA LYS A 38 5.027 -4.472 -4.615 1.00 0.00 H new ATOM 0 HB2 LYS A 38 5.428 -7.381 -4.377 1.00 0.00 H new ATOM 0 HB3 LYS A 38 6.396 -6.401 -3.293 1.00 0.00 H new ATOM 0 HG2 LYS A 38 4.468 -6.530 -2.014 1.00 0.00 H new ATOM 0 HG3 LYS A 38 4.070 -5.098 -2.942 1.00 0.00 H new ATOM 0 HD2 LYS A 38 2.501 -6.204 -4.258 1.00 0.00 H new ATOM 0 HD3 LYS A 38 3.354 -7.733 -4.191 1.00 0.00 H new ATOM 0 HE2 LYS A 38 2.689 -7.842 -1.694 1.00 0.00 H new ATOM 0 HE3 LYS A 38 1.623 -6.488 -2.012 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 0.465 -8.587 -2.228 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 0.522 -7.795 -3.729 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 1.555 -9.107 -3.421 1.00 0.00 H new ATOM 595 N ASP A 39 7.809 -5.644 -5.903 1.00 0.00 N ATOM 596 CA ASP A 39 9.191 -5.302 -6.196 1.00 0.00 C ATOM 597 C ASP A 39 9.253 -3.879 -6.752 1.00 0.00 C ATOM 598 O ASP A 39 10.284 -3.214 -6.654 1.00 0.00 O ATOM 599 CB ASP A 39 9.783 -6.245 -7.244 1.00 0.00 C ATOM 600 CG ASP A 39 11.108 -5.785 -7.855 1.00 0.00 C ATOM 601 OD1 ASP A 39 12.086 -5.691 -7.082 1.00 0.00 O ATOM 602 OD2 ASP A 39 11.113 -5.538 -9.080 1.00 0.00 O ATOM 0 H ASP A 39 7.506 -6.546 -6.270 1.00 0.00 H new ATOM 0 HA ASP A 39 9.762 -5.388 -5.271 1.00 0.00 H new ATOM 0 HB2 ASP A 39 9.931 -7.224 -6.787 1.00 0.00 H new ATOM 0 HB3 ASP A 39 9.056 -6.374 -8.046 1.00 0.00 H new ATOM 607 N ASP A 40 8.137 -3.452 -7.325 1.00 0.00 N ATOM 608 CA ASP A 40 8.050 -2.120 -7.897 1.00 0.00 C ATOM 609 C ASP A 40 7.732 -1.113 -6.791 1.00 0.00 C ATOM 610 O ASP A 40 6.566 -0.847 -6.504 1.00 0.00 O ATOM 611 CB ASP A 40 6.936 -2.041 -8.943 1.00 0.00 C ATOM 612 CG ASP A 40 6.980 -0.804 -9.843 1.00 0.00 C ATOM 613 OD1 ASP A 40 6.665 0.288 -9.322 1.00 0.00 O ATOM 614 OD2 ASP A 40 7.329 -0.977 -11.030 1.00 0.00 O ATOM 0 H ASP A 40 7.285 -4.006 -7.405 1.00 0.00 H new ATOM 0 HA ASP A 40 9.006 -1.894 -8.370 1.00 0.00 H new ATOM 0 HB2 ASP A 40 6.984 -2.931 -9.571 1.00 0.00 H new ATOM 0 HB3 ASP A 40 5.974 -2.065 -8.430 1.00 0.00 H new ATOM 619 N TYR A 41 8.792 -0.580 -6.197 1.00 0.00 N ATOM 620 CA TYR A 41 8.639 0.392 -5.128 1.00 0.00 C ATOM 621 C TYR A 41 8.552 1.813 -5.687 1.00 0.00 C ATOM 622 O TYR A 41 8.716 2.023 -6.888 1.00 0.00 O ATOM 623 CB TYR A 41 9.897 0.271 -4.265 1.00 0.00 C ATOM 624 CG TYR A 41 10.034 1.366 -3.207 1.00 0.00 C ATOM 625 CD1 TYR A 41 9.157 1.410 -2.143 1.00 0.00 C ATOM 626 CD2 TYR A 41 11.034 2.311 -3.316 1.00 0.00 C ATOM 627 CE1 TYR A 41 9.286 2.441 -1.146 1.00 0.00 C ATOM 628 CE2 TYR A 41 11.163 3.342 -2.319 1.00 0.00 C ATOM 629 CZ TYR A 41 10.283 3.356 -1.284 1.00 0.00 C ATOM 630 OH TYR A 41 10.405 4.330 -0.342 1.00 0.00 O ATOM 0 H TYR A 41 9.758 -0.803 -6.436 1.00 0.00 H new ATOM 0 HA TYR A 41 7.726 0.202 -4.564 1.00 0.00 H new ATOM 0 HB2 TYR A 41 9.893 -0.700 -3.770 1.00 0.00 H new ATOM 0 HB3 TYR A 41 10.773 0.295 -4.913 1.00 0.00 H new ATOM 0 HD1 TYR A 41 8.374 0.671 -2.058 1.00 0.00 H new ATOM 0 HD2 TYR A 41 11.720 2.277 -4.149 1.00 0.00 H new ATOM 0 HE1 TYR A 41 8.607 2.487 -0.308 1.00 0.00 H new ATOM 0 HE2 TYR A 41 11.941 4.087 -2.392 1.00 0.00 H new ATOM 0 HH TYR A 41 11.140 4.930 -0.586 1.00 0.00 H new ATOM 640 N VAL A 42 8.295 2.754 -4.789 1.00 0.00 N ATOM 641 CA VAL A 42 8.185 4.149 -5.178 1.00 0.00 C ATOM 642 C VAL A 42 9.230 4.459 -6.251 1.00 0.00 C ATOM 643 O VAL A 42 9.010 5.314 -7.109 1.00 0.00 O ATOM 644 CB VAL A 42 8.309 5.047 -3.945 1.00 0.00 C ATOM 645 CG1 VAL A 42 8.493 6.511 -4.350 1.00 0.00 C ATOM 646 CG2 VAL A 42 7.102 4.879 -3.021 1.00 0.00 C ATOM 0 H VAL A 42 8.160 2.577 -3.794 1.00 0.00 H new ATOM 0 HA VAL A 42 7.205 4.348 -5.612 1.00 0.00 H new ATOM 0 HB VAL A 42 9.197 4.739 -3.393 1.00 0.00 H new ATOM 0 HG11 VAL A 42 8.579 7.128 -3.456 1.00 0.00 H new ATOM 0 HG12 VAL A 42 9.398 6.612 -4.948 1.00 0.00 H new ATOM 0 HG13 VAL A 42 7.633 6.837 -4.935 1.00 0.00 H new ATOM 0 HG21 VAL A 42 7.215 5.528 -2.153 1.00 0.00 H new ATOM 0 HG22 VAL A 42 6.192 5.147 -3.558 1.00 0.00 H new ATOM 0 HG23 VAL A 42 7.037 3.842 -2.692 1.00 0.00 H new ATOM 656 N MET A 43 10.344 3.747 -6.169 1.00 0.00 N ATOM 657 CA MET A 43 11.424 3.936 -7.124 1.00 0.00 C ATOM 658 C MET A 43 10.881 4.078 -8.546 1.00 0.00 C ATOM 659 O MET A 43 11.533 4.665 -9.408 1.00 0.00 O ATOM 660 CB MET A 43 12.377 2.741 -7.058 1.00 0.00 C ATOM 661 CG MET A 43 11.691 1.464 -7.546 1.00 0.00 C ATOM 662 SD MET A 43 12.796 0.072 -7.376 1.00 0.00 S ATOM 663 CE MET A 43 12.265 -0.917 -8.763 1.00 0.00 C ATOM 0 H MET A 43 10.523 3.039 -5.457 1.00 0.00 H new ATOM 0 HA MET A 43 11.956 4.852 -6.866 1.00 0.00 H new ATOM 0 HB2 MET A 43 13.258 2.940 -7.668 1.00 0.00 H new ATOM 0 HB3 MET A 43 12.723 2.603 -6.033 1.00 0.00 H new ATOM 0 HG2 MET A 43 10.781 1.288 -6.972 1.00 0.00 H new ATOM 0 HG3 MET A 43 11.393 1.577 -8.588 1.00 0.00 H new ATOM 0 HE1 MET A 43 12.857 -1.832 -8.805 1.00 0.00 H new ATOM 0 HE2 MET A 43 11.212 -1.171 -8.646 1.00 0.00 H new ATOM 0 HE3 MET A 43 12.402 -0.353 -9.686 1.00 0.00 H new ATOM 673 N THR A 44 9.690 3.532 -8.748 1.00 0.00 N ATOM 674 CA THR A 44 9.052 3.591 -10.051 1.00 0.00 C ATOM 675 C THR A 44 7.806 4.477 -9.995 1.00 0.00 C ATOM 676 O THR A 44 7.705 5.460 -10.730 1.00 0.00 O ATOM 677 CB THR A 44 8.757 2.157 -10.499 1.00 0.00 C ATOM 678 OG1 THR A 44 9.968 1.729 -11.113 1.00 0.00 O ATOM 679 CG2 THR A 44 7.724 2.097 -11.627 1.00 0.00 C ATOM 0 H THR A 44 9.151 3.047 -8.031 1.00 0.00 H new ATOM 0 HA THR A 44 9.707 4.050 -10.791 1.00 0.00 H new ATOM 0 HB THR A 44 8.399 1.577 -9.648 1.00 0.00 H new ATOM 0 HG1 THR A 44 9.866 0.808 -11.431 1.00 0.00 H new ATOM 0 HG21 THR A 44 7.551 1.058 -11.907 1.00 0.00 H new ATOM 0 HG22 THR A 44 6.789 2.542 -11.288 1.00 0.00 H new ATOM 0 HG23 THR A 44 8.096 2.649 -12.491 1.00 0.00 H new ATOM 687 N ASP A 45 6.889 4.101 -9.116 1.00 0.00 N ATOM 688 CA ASP A 45 5.654 4.850 -8.954 1.00 0.00 C ATOM 689 C ASP A 45 5.436 5.152 -7.471 1.00 0.00 C ATOM 690 O ASP A 45 5.286 4.236 -6.664 1.00 0.00 O ATOM 691 CB ASP A 45 4.453 4.045 -9.456 1.00 0.00 C ATOM 692 CG ASP A 45 3.361 4.874 -10.138 1.00 0.00 C ATOM 693 OD1 ASP A 45 3.722 5.648 -11.050 1.00 0.00 O ATOM 694 OD2 ASP A 45 2.189 4.712 -9.732 1.00 0.00 O ATOM 0 H ASP A 45 6.976 3.287 -8.508 1.00 0.00 H new ATOM 0 HA ASP A 45 5.739 5.770 -9.532 1.00 0.00 H new ATOM 0 HB2 ASP A 45 4.808 3.290 -10.158 1.00 0.00 H new ATOM 0 HB3 ASP A 45 4.012 3.514 -8.613 1.00 0.00 H new ATOM 699 N ARG A 46 5.427 6.438 -7.156 1.00 0.00 N ATOM 700 CA ARG A 46 5.229 6.873 -5.784 1.00 0.00 C ATOM 701 C ARG A 46 3.747 6.804 -5.413 1.00 0.00 C ATOM 702 O ARG A 46 3.398 6.410 -4.302 1.00 0.00 O ATOM 703 CB ARG A 46 5.735 8.303 -5.580 1.00 0.00 C ATOM 704 CG ARG A 46 5.436 8.792 -4.161 1.00 0.00 C ATOM 705 CD ARG A 46 4.763 10.166 -4.186 1.00 0.00 C ATOM 706 NE ARG A 46 4.511 10.631 -2.804 1.00 0.00 N ATOM 707 CZ ARG A 46 4.375 11.918 -2.457 1.00 0.00 C ATOM 708 NH1 ARG A 46 4.466 12.876 -3.389 1.00 0.00 N ATOM 709 NH2 ARG A 46 4.149 12.246 -1.178 1.00 0.00 N ATOM 0 H ARG A 46 5.554 7.194 -7.828 1.00 0.00 H new ATOM 0 HA ARG A 46 5.799 6.204 -5.139 1.00 0.00 H new ATOM 0 HB2 ARG A 46 6.809 8.343 -5.764 1.00 0.00 H new ATOM 0 HB3 ARG A 46 5.263 8.967 -6.304 1.00 0.00 H new ATOM 0 HG2 ARG A 46 4.790 8.076 -3.654 1.00 0.00 H new ATOM 0 HG3 ARG A 46 6.362 8.847 -3.589 1.00 0.00 H new ATOM 0 HD2 ARG A 46 5.397 10.881 -4.709 1.00 0.00 H new ATOM 0 HD3 ARG A 46 3.824 10.110 -4.737 1.00 0.00 H new ATOM 0 HE ARG A 46 4.436 9.927 -2.069 1.00 0.00 H new ATOM 0 HH11 ARG A 46 4.639 12.626 -4.363 1.00 0.00 H new ATOM 0 HH12 ARG A 46 4.362 13.856 -3.125 1.00 0.00 H new ATOM 0 HH21 ARG A 46 4.081 11.516 -0.469 1.00 0.00 H new ATOM 0 HH22 ARG A 46 4.045 13.226 -0.913 1.00 0.00 H new ATOM 723 N LEU A 47 2.914 7.195 -6.367 1.00 0.00 N ATOM 724 CA LEU A 47 1.476 7.183 -6.155 1.00 0.00 C ATOM 725 C LEU A 47 1.069 5.850 -5.527 1.00 0.00 C ATOM 726 O LEU A 47 0.257 5.815 -4.602 1.00 0.00 O ATOM 727 CB LEU A 47 0.739 7.501 -7.457 1.00 0.00 C ATOM 728 CG LEU A 47 1.350 8.608 -8.320 1.00 0.00 C ATOM 729 CD1 LEU A 47 1.987 9.692 -7.450 1.00 0.00 C ATOM 730 CD2 LEU A 47 2.339 8.030 -9.334 1.00 0.00 C ATOM 0 H LEU A 47 3.207 7.522 -7.288 1.00 0.00 H new ATOM 0 HA LEU A 47 1.188 7.967 -5.454 1.00 0.00 H new ATOM 0 HB2 LEU A 47 0.686 6.590 -8.053 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -0.285 7.782 -7.212 1.00 0.00 H new ATOM 0 HG LEU A 47 0.548 9.081 -8.887 1.00 0.00 H new ATOM 0 HD11 LEU A 47 2.414 10.466 -8.088 1.00 0.00 H new ATOM 0 HD12 LEU A 47 1.228 10.132 -6.803 1.00 0.00 H new ATOM 0 HD13 LEU A 47 2.774 9.252 -6.838 1.00 0.00 H new ATOM 0 HD21 LEU A 47 2.758 8.837 -9.934 1.00 0.00 H new ATOM 0 HD22 LEU A 47 3.142 7.515 -8.806 1.00 0.00 H new ATOM 0 HD23 LEU A 47 1.822 7.325 -9.985 1.00 0.00 H new ATOM 742 N ALA A 48 1.649 4.782 -6.054 1.00 0.00 N ATOM 743 CA ALA A 48 1.357 3.448 -5.557 1.00 0.00 C ATOM 744 C ALA A 48 1.599 3.406 -4.046 1.00 0.00 C ATOM 745 O ALA A 48 0.916 2.683 -3.324 1.00 0.00 O ATOM 746 CB ALA A 48 2.206 2.423 -6.312 1.00 0.00 C ATOM 0 H ALA A 48 2.321 4.813 -6.821 1.00 0.00 H new ATOM 0 HA ALA A 48 0.311 3.195 -5.731 1.00 0.00 H new ATOM 0 HB1 ALA A 48 1.986 1.423 -5.939 1.00 0.00 H new ATOM 0 HB2 ALA A 48 1.975 2.472 -7.376 1.00 0.00 H new ATOM 0 HB3 ALA A 48 3.263 2.643 -6.160 1.00 0.00 H new ATOM 752 N GLY A 49 2.574 4.193 -3.614 1.00 0.00 N ATOM 753 CA GLY A 49 2.915 4.254 -2.203 1.00 0.00 C ATOM 754 C GLY A 49 1.934 5.148 -1.441 1.00 0.00 C ATOM 755 O GLY A 49 1.667 4.918 -0.263 1.00 0.00 O ATOM 0 H GLY A 49 3.138 4.793 -4.216 1.00 0.00 H new ATOM 0 HA2 GLY A 49 2.903 3.250 -1.778 1.00 0.00 H new ATOM 0 HA3 GLY A 49 3.929 4.638 -2.086 1.00 0.00 H new ATOM 759 N CYS A 50 1.425 6.149 -2.145 1.00 0.00 N ATOM 760 CA CYS A 50 0.479 7.077 -1.549 1.00 0.00 C ATOM 761 C CYS A 50 -0.901 6.419 -1.543 1.00 0.00 C ATOM 762 O CYS A 50 -1.605 6.454 -0.535 1.00 0.00 O ATOM 763 CB CYS A 50 0.468 8.420 -2.282 1.00 0.00 C ATOM 764 SG CYS A 50 1.373 9.765 -1.433 1.00 0.00 S ATOM 0 H CYS A 50 1.650 6.337 -3.122 1.00 0.00 H new ATOM 0 HA CYS A 50 0.778 7.298 -0.525 1.00 0.00 H new ATOM 0 HB2 CYS A 50 0.899 8.280 -3.273 1.00 0.00 H new ATOM 0 HB3 CYS A 50 -0.567 8.731 -2.425 1.00 0.00 H new ATOM 769 N ALA A 51 -1.248 5.833 -2.680 1.00 0.00 N ATOM 770 CA ALA A 51 -2.532 5.168 -2.818 1.00 0.00 C ATOM 771 C ALA A 51 -2.686 4.128 -1.707 1.00 0.00 C ATOM 772 O ALA A 51 -3.724 4.064 -1.050 1.00 0.00 O ATOM 773 CB ALA A 51 -2.640 4.552 -4.214 1.00 0.00 C ATOM 0 H ALA A 51 -0.662 5.805 -3.514 1.00 0.00 H new ATOM 0 HA ALA A 51 -3.348 5.883 -2.714 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -3.603 4.053 -4.318 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -2.555 5.337 -4.966 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -1.839 3.827 -4.355 1.00 0.00 H new ATOM 779 N ILE A 52 -1.635 3.340 -1.531 1.00 0.00 N ATOM 780 CA ILE A 52 -1.640 2.305 -0.510 1.00 0.00 C ATOM 781 C ILE A 52 -1.848 2.951 0.863 1.00 0.00 C ATOM 782 O ILE A 52 -2.555 2.404 1.708 1.00 0.00 O ATOM 783 CB ILE A 52 -0.371 1.455 -0.603 1.00 0.00 C ATOM 784 CG1 ILE A 52 -0.458 0.239 0.322 1.00 0.00 C ATOM 785 CG2 ILE A 52 0.875 2.297 -0.326 1.00 0.00 C ATOM 786 CD1 ILE A 52 -1.882 -0.322 0.358 1.00 0.00 C ATOM 0 H ILE A 52 -0.775 3.397 -2.077 1.00 0.00 H new ATOM 0 HA ILE A 52 -2.470 1.616 -0.669 1.00 0.00 H new ATOM 0 HB ILE A 52 -0.285 1.080 -1.623 1.00 0.00 H new ATOM 0 HG12 ILE A 52 0.232 -0.532 -0.020 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -0.149 0.520 1.329 1.00 0.00 H new ATOM 0 HG21 ILE A 52 1.762 1.668 -0.399 1.00 0.00 H new ATOM 0 HG22 ILE A 52 0.940 3.102 -1.058 1.00 0.00 H new ATOM 0 HG23 ILE A 52 0.812 2.721 0.676 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -1.916 -1.185 1.022 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -2.566 0.444 0.723 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -2.179 -0.625 -0.646 1.00 0.00 H new ATOM 798 N ASN A 53 -1.221 4.103 1.041 1.00 0.00 N ATOM 799 CA ASN A 53 -1.329 4.828 2.295 1.00 0.00 C ATOM 800 C ASN A 53 -2.797 5.167 2.559 1.00 0.00 C ATOM 801 O ASN A 53 -3.297 4.962 3.664 1.00 0.00 O ATOM 802 CB ASN A 53 -0.542 6.140 2.243 1.00 0.00 C ATOM 803 CG ASN A 53 0.533 6.178 3.330 1.00 0.00 C ATOM 804 OD1 ASN A 53 1.558 5.520 3.248 1.00 0.00 O ATOM 805 ND2 ASN A 53 0.246 6.982 4.349 1.00 0.00 N ATOM 0 H ASN A 53 -0.636 4.553 0.337 1.00 0.00 H new ATOM 0 HA ASN A 53 -0.924 4.196 3.085 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -0.077 6.251 1.263 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -1.223 6.982 2.370 1.00 0.00 H new ATOM 0 HD21 ASN A 53 0.902 7.076 5.125 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -0.630 7.505 4.355 1.00 0.00 H new ATOM 812 N CYS A 54 -3.448 5.681 1.525 1.00 0.00 N ATOM 813 CA CYS A 54 -4.849 6.051 1.632 1.00 0.00 C ATOM 814 C CYS A 54 -5.662 4.780 1.890 1.00 0.00 C ATOM 815 O CYS A 54 -6.744 4.840 2.472 1.00 0.00 O ATOM 816 CB CYS A 54 -5.334 6.795 0.385 1.00 0.00 C ATOM 817 SG CYS A 54 -6.541 5.875 -0.637 1.00 0.00 S ATOM 0 H CYS A 54 -3.031 5.850 0.610 1.00 0.00 H new ATOM 0 HA CYS A 54 -4.983 6.743 2.463 1.00 0.00 H new ATOM 0 HB2 CYS A 54 -5.785 7.738 0.694 1.00 0.00 H new ATOM 0 HB3 CYS A 54 -4.470 7.042 -0.232 1.00 0.00 H new ATOM 822 N LEU A 55 -5.110 3.661 1.448 1.00 0.00 N ATOM 823 CA LEU A 55 -5.770 2.379 1.625 1.00 0.00 C ATOM 824 C LEU A 55 -6.121 2.190 3.101 1.00 0.00 C ATOM 825 O LEU A 55 -7.147 1.596 3.428 1.00 0.00 O ATOM 826 CB LEU A 55 -4.914 1.251 1.048 1.00 0.00 C ATOM 827 CG LEU A 55 -5.670 0.004 0.582 1.00 0.00 C ATOM 828 CD1 LEU A 55 -6.552 -0.550 1.703 1.00 0.00 C ATOM 829 CD2 LEU A 55 -6.472 0.293 -0.689 1.00 0.00 C ATOM 0 H LEU A 55 -4.212 3.615 0.967 1.00 0.00 H new ATOM 0 HA LEU A 55 -6.707 2.354 1.068 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -4.350 1.646 0.203 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -4.188 0.950 1.803 1.00 0.00 H new ATOM 0 HG LEU A 55 -4.941 -0.767 0.334 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -7.079 -1.436 1.348 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -5.930 -0.816 2.557 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -7.276 0.207 2.004 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -7.000 -0.609 -0.999 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -7.193 1.086 -0.492 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -5.795 0.608 -1.483 1.00 0.00 H new ATOM 841 N ALA A 56 -5.249 2.709 3.954 1.00 0.00 N ATOM 842 CA ALA A 56 -5.454 2.604 5.389 1.00 0.00 C ATOM 843 C ALA A 56 -6.592 3.537 5.806 1.00 0.00 C ATOM 844 O ALA A 56 -7.093 3.450 6.927 1.00 0.00 O ATOM 845 CB ALA A 56 -4.145 2.920 6.116 1.00 0.00 C ATOM 0 H ALA A 56 -4.400 3.203 3.679 1.00 0.00 H new ATOM 0 HA ALA A 56 -5.742 1.589 5.663 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -4.298 2.841 7.192 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -3.377 2.212 5.806 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -3.826 3.932 5.868 1.00 0.00 H new ATOM 851 N THR A 57 -6.968 4.412 4.883 1.00 0.00 N ATOM 852 CA THR A 57 -8.037 5.360 5.140 1.00 0.00 C ATOM 853 C THR A 57 -8.874 4.909 6.340 1.00 0.00 C ATOM 854 O THR A 57 -8.981 5.628 7.332 1.00 0.00 O ATOM 855 CB THR A 57 -8.852 5.514 3.855 1.00 0.00 C ATOM 856 OG1 THR A 57 -10.117 5.996 4.302 1.00 0.00 O ATOM 857 CG2 THR A 57 -9.176 4.169 3.202 1.00 0.00 C ATOM 0 H THR A 57 -6.550 4.483 3.955 1.00 0.00 H new ATOM 0 HA THR A 57 -7.640 6.339 5.410 1.00 0.00 H new ATOM 0 HB THR A 57 -8.302 6.137 3.149 1.00 0.00 H new ATOM 0 HG1 THR A 57 -10.709 6.126 3.531 1.00 0.00 H new ATOM 0 HG21 THR A 57 -9.756 4.336 2.294 1.00 0.00 H new ATOM 0 HG22 THR A 57 -8.249 3.654 2.951 1.00 0.00 H new ATOM 0 HG23 THR A 57 -9.755 3.558 3.895 1.00 0.00 H new ATOM 865 N LYS A 58 -9.443 3.720 6.210 1.00 0.00 N ATOM 866 CA LYS A 58 -10.266 3.163 7.271 1.00 0.00 C ATOM 867 C LYS A 58 -9.550 1.962 7.887 1.00 0.00 C ATOM 868 O LYS A 58 -9.640 0.847 7.373 1.00 0.00 O ATOM 869 CB LYS A 58 -11.668 2.843 6.748 1.00 0.00 C ATOM 870 CG LYS A 58 -12.436 4.123 6.413 1.00 0.00 C ATOM 871 CD LYS A 58 -13.573 4.357 7.409 1.00 0.00 C ATOM 872 CE LYS A 58 -14.821 4.886 6.703 1.00 0.00 C ATOM 873 NZ LYS A 58 -16.032 4.601 7.504 1.00 0.00 N ATOM 0 H LYS A 58 -9.351 3.126 5.386 1.00 0.00 H new ATOM 0 HA LYS A 58 -10.407 3.893 8.068 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -11.594 2.217 5.859 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -12.217 2.271 7.496 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -11.755 4.974 6.427 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -12.841 4.055 5.403 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -13.809 3.425 7.922 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -13.253 5.068 8.171 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -14.728 5.960 6.544 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -14.912 4.425 5.719 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -16.870 4.968 7.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -16.128 3.574 7.634 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -15.950 5.061 8.433 1.00 0.00 H new ATOM 887 N LEU A 59 -8.855 2.227 8.984 1.00 0.00 N ATOM 888 CA LEU A 59 -8.122 1.181 9.677 1.00 0.00 C ATOM 889 C LEU A 59 -9.111 0.144 10.215 1.00 0.00 C ATOM 890 O LEU A 59 -8.718 -0.963 10.580 1.00 0.00 O ATOM 891 CB LEU A 59 -7.219 1.784 10.754 1.00 0.00 C ATOM 892 CG LEU A 59 -5.713 1.710 10.484 1.00 0.00 C ATOM 893 CD1 LEU A 59 -5.392 2.139 9.051 1.00 0.00 C ATOM 894 CD2 LEU A 59 -4.931 2.525 11.517 1.00 0.00 C ATOM 0 H LEU A 59 -8.784 3.151 9.410 1.00 0.00 H new ATOM 0 HA LEU A 59 -7.456 0.662 8.988 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -7.494 2.830 10.887 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -7.424 1.279 11.698 1.00 0.00 H new ATOM 0 HG LEU A 59 -5.397 0.672 10.587 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -4.316 2.077 8.885 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -5.906 1.481 8.350 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -5.725 3.165 8.895 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -3.864 2.456 11.303 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -5.244 3.568 11.470 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -5.127 2.132 12.515 1.00 0.00 H new ATOM 906 N ASP A 60 -10.375 0.539 10.246 1.00 0.00 N ATOM 907 CA ASP A 60 -11.423 -0.342 10.733 1.00 0.00 C ATOM 908 C ASP A 60 -11.631 -1.482 9.733 1.00 0.00 C ATOM 909 O ASP A 60 -12.133 -2.544 10.094 1.00 0.00 O ATOM 910 CB ASP A 60 -12.750 0.407 10.879 1.00 0.00 C ATOM 911 CG ASP A 60 -12.949 1.114 12.221 1.00 0.00 C ATOM 912 OD1 ASP A 60 -11.921 1.388 12.876 1.00 0.00 O ATOM 913 OD2 ASP A 60 -14.126 1.365 12.561 1.00 0.00 O ATOM 0 H ASP A 60 -10.697 1.458 9.942 1.00 0.00 H new ATOM 0 HA ASP A 60 -11.116 -0.724 11.706 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -12.822 1.147 10.082 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -13.567 -0.300 10.733 1.00 0.00 H new ATOM 918 N VAL A 61 -11.232 -1.221 8.497 1.00 0.00 N ATOM 919 CA VAL A 61 -11.368 -2.211 7.442 1.00 0.00 C ATOM 920 C VAL A 61 -10.194 -3.189 7.513 1.00 0.00 C ATOM 921 O VAL A 61 -10.375 -4.395 7.344 1.00 0.00 O ATOM 922 CB VAL A 61 -11.487 -1.516 6.084 1.00 0.00 C ATOM 923 CG1 VAL A 61 -12.284 -0.215 6.201 1.00 0.00 C ATOM 924 CG2 VAL A 61 -10.106 -1.260 5.477 1.00 0.00 C ATOM 0 H VAL A 61 -10.814 -0.338 8.202 1.00 0.00 H new ATOM 0 HA VAL A 61 -12.282 -2.790 7.576 1.00 0.00 H new ATOM 0 HB VAL A 61 -12.030 -2.182 5.413 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -12.353 0.259 5.222 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -13.286 -0.434 6.570 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -11.781 0.459 6.895 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -10.219 -0.765 4.512 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -9.527 -0.623 6.146 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -9.587 -2.209 5.340 1.00 0.00 H new ATOM 934 N VAL A 62 -9.018 -2.635 7.762 1.00 0.00 N ATOM 935 CA VAL A 62 -7.814 -3.443 7.857 1.00 0.00 C ATOM 936 C VAL A 62 -7.742 -4.081 9.246 1.00 0.00 C ATOM 937 O VAL A 62 -7.455 -5.271 9.372 1.00 0.00 O ATOM 938 CB VAL A 62 -6.585 -2.594 7.524 1.00 0.00 C ATOM 939 CG1 VAL A 62 -6.241 -2.687 6.038 1.00 0.00 C ATOM 940 CG2 VAL A 62 -6.793 -1.139 7.950 1.00 0.00 C ATOM 0 H VAL A 62 -8.872 -1.635 7.901 1.00 0.00 H new ATOM 0 HA VAL A 62 -7.839 -4.253 7.128 1.00 0.00 H new ATOM 0 HB VAL A 62 -5.741 -2.991 8.088 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -5.364 -2.074 5.829 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -6.030 -3.724 5.778 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -7.083 -2.329 5.446 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -5.905 -0.557 7.702 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -7.655 -0.726 7.426 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -6.967 -1.096 9.025 1.00 0.00 H new ATOM 950 N ASP A 63 -8.006 -3.262 10.253 1.00 0.00 N ATOM 951 CA ASP A 63 -7.974 -3.731 11.627 1.00 0.00 C ATOM 952 C ASP A 63 -9.332 -3.471 12.282 1.00 0.00 C ATOM 953 O ASP A 63 -9.642 -2.339 12.649 1.00 0.00 O ATOM 954 CB ASP A 63 -6.909 -2.989 12.438 1.00 0.00 C ATOM 955 CG ASP A 63 -7.128 -1.481 12.568 1.00 0.00 C ATOM 956 OD1 ASP A 63 -7.811 -1.088 13.539 1.00 0.00 O ATOM 957 OD2 ASP A 63 -6.608 -0.756 11.694 1.00 0.00 O ATOM 0 H ASP A 63 -8.243 -2.276 10.144 1.00 0.00 H new ATOM 0 HA ASP A 63 -7.741 -4.796 11.614 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -6.868 -3.422 13.437 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -5.937 -3.161 11.976 1.00 0.00 H new ATOM 962 N PRO A 64 -10.127 -4.567 12.413 1.00 0.00 N ATOM 963 CA PRO A 64 -11.445 -4.467 13.016 1.00 0.00 C ATOM 964 C PRO A 64 -11.342 -4.319 14.535 1.00 0.00 C ATOM 965 O PRO A 64 -12.064 -3.524 15.136 1.00 0.00 O ATOM 966 CB PRO A 64 -12.169 -5.735 12.591 1.00 0.00 C ATOM 967 CG PRO A 64 -11.085 -6.707 12.156 1.00 0.00 C ATOM 968 CD PRO A 64 -9.794 -5.923 11.988 1.00 0.00 C ATOM 0 HA PRO A 64 -11.992 -3.583 12.688 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -12.754 -6.145 13.414 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -12.863 -5.534 11.775 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -10.959 -7.495 12.899 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -11.361 -7.192 11.220 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -8.993 -6.343 12.596 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -9.451 -5.941 10.953 1.00 0.00 H new ATOM 976 N ASP A 65 -10.439 -5.098 15.114 1.00 0.00 N ATOM 977 CA ASP A 65 -10.233 -5.063 16.552 1.00 0.00 C ATOM 978 C ASP A 65 -8.854 -4.469 16.851 1.00 0.00 C ATOM 979 O ASP A 65 -8.454 -4.373 18.010 1.00 0.00 O ATOM 980 CB ASP A 65 -10.281 -6.471 17.149 1.00 0.00 C ATOM 981 CG ASP A 65 -11.405 -6.708 18.159 1.00 0.00 C ATOM 982 OD1 ASP A 65 -12.258 -5.801 18.281 1.00 0.00 O ATOM 983 OD2 ASP A 65 -11.387 -7.787 18.787 1.00 0.00 O ATOM 0 H ASP A 65 -9.842 -5.757 14.613 1.00 0.00 H new ATOM 0 HA ASP A 65 -11.025 -4.457 16.992 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -10.386 -7.190 16.337 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -9.327 -6.676 17.635 1.00 0.00 H new ATOM 988 N GLY A 66 -8.167 -4.087 15.784 1.00 0.00 N ATOM 989 CA GLY A 66 -6.843 -3.505 15.918 1.00 0.00 C ATOM 990 C GLY A 66 -5.759 -4.517 15.540 1.00 0.00 C ATOM 991 O GLY A 66 -4.712 -4.582 16.184 1.00 0.00 O ATOM 0 H GLY A 66 -8.502 -4.169 14.824 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -6.762 -2.625 15.280 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -6.691 -3.170 16.944 1.00 0.00 H new ATOM 995 N ASN A 67 -6.046 -5.282 14.497 1.00 0.00 N ATOM 996 CA ASN A 67 -5.109 -6.287 14.025 1.00 0.00 C ATOM 997 C ASN A 67 -3.744 -5.636 13.790 1.00 0.00 C ATOM 998 O ASN A 67 -2.709 -6.239 14.065 1.00 0.00 O ATOM 999 CB ASN A 67 -5.576 -6.898 12.703 1.00 0.00 C ATOM 1000 CG ASN A 67 -4.927 -8.263 12.470 1.00 0.00 C ATOM 1001 OD1 ASN A 67 -4.692 -9.032 13.386 1.00 0.00 O ATOM 1002 ND2 ASN A 67 -4.651 -8.520 11.194 1.00 0.00 N ATOM 0 H ASN A 67 -6.915 -5.226 13.965 1.00 0.00 H new ATOM 0 HA ASN A 67 -5.045 -7.070 14.781 1.00 0.00 H new ATOM 0 HB2 ASN A 67 -6.661 -7.004 12.710 1.00 0.00 H new ATOM 0 HB3 ASN A 67 -5.327 -6.228 11.880 1.00 0.00 H new ATOM 0 HD21 ASN A 67 -4.216 -9.406 10.935 1.00 0.00 H new ATOM 0 HD22 ASN A 67 -4.874 -7.831 10.475 1.00 0.00 H new ATOM 1009 N LEU A 68 -3.788 -4.412 13.283 1.00 0.00 N ATOM 1010 CA LEU A 68 -2.568 -3.673 13.008 1.00 0.00 C ATOM 1011 C LEU A 68 -2.913 -2.202 12.760 1.00 0.00 C ATOM 1012 O LEU A 68 -4.071 -1.803 12.883 1.00 0.00 O ATOM 1013 CB LEU A 68 -1.793 -4.325 11.862 1.00 0.00 C ATOM 1014 CG LEU A 68 -2.146 -3.840 10.454 1.00 0.00 C ATOM 1015 CD1 LEU A 68 -3.491 -3.111 10.445 1.00 0.00 C ATOM 1016 CD2 LEU A 68 -1.022 -2.979 9.872 1.00 0.00 C ATOM 0 H LEU A 68 -4.649 -3.914 13.056 1.00 0.00 H new ATOM 0 HA LEU A 68 -1.901 -3.704 13.870 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -0.729 -4.157 12.027 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -1.956 -5.402 11.906 1.00 0.00 H new ATOM 0 HG LEU A 68 -2.250 -4.712 9.809 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -3.717 -2.777 9.432 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -4.274 -3.788 10.787 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -3.442 -2.248 11.109 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -1.299 -2.648 8.871 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -0.861 -2.110 10.510 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -0.105 -3.565 9.819 1.00 0.00 H new ATOM 1028 N HIS A 69 -1.887 -1.437 12.414 1.00 0.00 N ATOM 1029 CA HIS A 69 -2.068 -0.020 12.149 1.00 0.00 C ATOM 1030 C HIS A 69 -1.090 0.426 11.060 1.00 0.00 C ATOM 1031 O HIS A 69 0.124 0.331 11.235 1.00 0.00 O ATOM 1032 CB HIS A 69 -1.935 0.796 13.435 1.00 0.00 C ATOM 1033 CG HIS A 69 -3.123 0.685 14.359 1.00 0.00 C ATOM 1034 ND1 HIS A 69 -3.025 0.837 15.731 1.00 0.00 N ATOM 1035 CD2 HIS A 69 -4.438 0.437 14.094 1.00 0.00 C ATOM 1036 CE1 HIS A 69 -4.231 0.684 16.257 1.00 0.00 C ATOM 1037 NE2 HIS A 69 -5.106 0.435 15.240 1.00 0.00 N ATOM 0 H HIS A 69 -0.929 -1.772 12.311 1.00 0.00 H new ATOM 0 HA HIS A 69 -3.078 0.158 11.779 1.00 0.00 H new ATOM 0 HB2 HIS A 69 -1.042 0.471 13.968 1.00 0.00 H new ATOM 0 HB3 HIS A 69 -1.787 1.844 13.174 1.00 0.00 H new ATOM 0 HD2 HIS A 69 -4.864 0.270 13.116 1.00 0.00 H new ATOM 0 HE1 HIS A 69 -4.478 0.746 17.306 1.00 0.00 H new ATOM 0 HE2 HIS A 69 -6.108 0.274 15.344 1.00 0.00 H new ATOM 1046 N HIS A 70 -1.655 0.901 9.960 1.00 0.00 N ATOM 1047 CA HIS A 70 -0.848 1.361 8.842 1.00 0.00 C ATOM 1048 C HIS A 70 0.338 2.174 9.367 1.00 0.00 C ATOM 1049 O HIS A 70 0.199 2.941 10.317 1.00 0.00 O ATOM 1050 CB HIS A 70 -1.703 2.139 7.840 1.00 0.00 C ATOM 1051 CG HIS A 70 -1.108 2.213 6.454 1.00 0.00 C ATOM 1052 ND1 HIS A 70 -1.390 1.286 5.466 1.00 0.00 N ATOM 1053 CD2 HIS A 70 -0.245 3.113 5.901 1.00 0.00 C ATOM 1054 CE1 HIS A 70 -0.721 1.620 4.373 1.00 0.00 C ATOM 1055 NE2 HIS A 70 -0.012 2.753 4.645 1.00 0.00 N ATOM 0 H HIS A 70 -2.662 0.977 9.819 1.00 0.00 H new ATOM 0 HA HIS A 70 -0.446 0.505 8.301 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -2.686 1.673 7.778 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -1.853 3.152 8.215 1.00 0.00 H new ATOM 0 HD1 HIS A 70 -2.009 0.481 5.563 1.00 0.00 H new ATOM 0 HD2 HIS A 70 0.177 3.973 6.400 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -0.734 1.089 3.433 1.00 0.00 H new ATOM 1064 N GLY A 71 1.479 1.976 8.724 1.00 0.00 N ATOM 1065 CA GLY A 71 2.689 2.681 9.113 1.00 0.00 C ATOM 1066 C GLY A 71 3.356 2.004 10.312 1.00 0.00 C ATOM 1067 O GLY A 71 4.570 1.808 10.323 1.00 0.00 O ATOM 0 H GLY A 71 1.592 1.338 7.936 1.00 0.00 H new ATOM 0 HA2 GLY A 71 3.384 2.709 8.274 1.00 0.00 H new ATOM 0 HA3 GLY A 71 2.448 3.714 9.362 1.00 0.00 H new ATOM 1071 N ASN A 72 2.533 1.664 11.292 1.00 0.00 N ATOM 1072 CA ASN A 72 3.028 1.014 12.493 1.00 0.00 C ATOM 1073 C ASN A 72 2.251 -0.286 12.722 1.00 0.00 C ATOM 1074 O ASN A 72 1.412 -0.363 13.618 1.00 0.00 O ATOM 1075 CB ASN A 72 2.831 1.903 13.723 1.00 0.00 C ATOM 1076 CG ASN A 72 3.265 1.178 14.999 1.00 0.00 C ATOM 1077 OD1 ASN A 72 2.524 0.411 15.590 1.00 0.00 O ATOM 1078 ND2 ASN A 72 4.504 1.464 15.388 1.00 0.00 N ATOM 0 H ASN A 72 1.526 1.826 11.279 1.00 0.00 H new ATOM 0 HA ASN A 72 4.091 0.818 12.355 1.00 0.00 H new ATOM 0 HB2 ASN A 72 3.407 2.821 13.608 1.00 0.00 H new ATOM 0 HB3 ASN A 72 1.783 2.192 13.803 1.00 0.00 H new ATOM 0 HD21 ASN A 72 4.887 1.031 16.228 1.00 0.00 H new ATOM 0 HD22 ASN A 72 5.071 2.116 14.846 1.00 0.00 H new ATOM 1085 N ALA A 73 2.559 -1.274 11.894 1.00 0.00 N ATOM 1086 CA ALA A 73 1.900 -2.566 11.994 1.00 0.00 C ATOM 1087 C ALA A 73 2.179 -3.171 13.371 1.00 0.00 C ATOM 1088 O ALA A 73 3.326 -3.210 13.816 1.00 0.00 O ATOM 1089 CB ALA A 73 2.373 -3.469 10.854 1.00 0.00 C ATOM 0 H ALA A 73 3.255 -1.206 11.152 1.00 0.00 H new ATOM 0 HA ALA A 73 0.820 -2.455 11.896 1.00 0.00 H new ATOM 0 HB1 ALA A 73 1.879 -4.438 10.928 1.00 0.00 H new ATOM 0 HB2 ALA A 73 2.125 -3.008 9.898 1.00 0.00 H new ATOM 0 HB3 ALA A 73 3.452 -3.606 10.922 1.00 0.00 H new ATOM 1095 N LYS A 74 1.112 -3.626 14.010 1.00 0.00 N ATOM 1096 CA LYS A 74 1.227 -4.226 15.328 1.00 0.00 C ATOM 1097 C LYS A 74 2.132 -5.457 15.245 1.00 0.00 C ATOM 1098 O LYS A 74 2.495 -5.893 14.154 1.00 0.00 O ATOM 1099 CB LYS A 74 -0.159 -4.520 15.907 1.00 0.00 C ATOM 1100 CG LYS A 74 -0.753 -3.275 16.567 1.00 0.00 C ATOM 1101 CD LYS A 74 -1.058 -3.531 18.044 1.00 0.00 C ATOM 1102 CE LYS A 74 -2.066 -2.512 18.581 1.00 0.00 C ATOM 1103 NZ LYS A 74 -3.279 -3.197 19.080 1.00 0.00 N ATOM 0 H LYS A 74 0.162 -3.591 13.639 1.00 0.00 H new ATOM 0 HA LYS A 74 1.696 -3.530 16.024 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -0.822 -4.867 15.114 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -0.088 -5.325 16.639 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -0.056 -2.442 16.475 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -1.667 -2.985 16.048 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -1.454 -4.539 18.168 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -0.137 -3.477 18.624 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -1.612 -1.932 19.384 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -2.336 -1.809 17.793 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -3.953 -2.491 19.441 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -3.720 -3.732 18.304 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -3.018 -3.850 19.846 1.00 0.00 H new ATOM 1117 N ASP A 75 2.471 -5.982 16.414 1.00 0.00 N ATOM 1118 CA ASP A 75 3.327 -7.153 16.487 1.00 0.00 C ATOM 1119 C ASP A 75 2.538 -8.385 16.039 1.00 0.00 C ATOM 1120 O ASP A 75 3.036 -9.508 16.115 1.00 0.00 O ATOM 1121 CB ASP A 75 3.808 -7.396 17.919 1.00 0.00 C ATOM 1122 CG ASP A 75 4.839 -6.391 18.435 1.00 0.00 C ATOM 1123 OD1 ASP A 75 5.424 -5.692 17.580 1.00 0.00 O ATOM 1124 OD2 ASP A 75 5.017 -6.344 19.670 1.00 0.00 O ATOM 0 H ASP A 75 2.168 -5.618 17.317 1.00 0.00 H new ATOM 0 HA ASP A 75 4.188 -6.981 15.841 1.00 0.00 H new ATOM 0 HB2 ASP A 75 2.944 -7.381 18.584 1.00 0.00 H new ATOM 0 HB3 ASP A 75 4.237 -8.396 17.977 1.00 0.00 H new ATOM 1129 N PHE A 76 1.320 -8.135 15.580 1.00 0.00 N ATOM 1130 CA PHE A 76 0.458 -9.209 15.120 1.00 0.00 C ATOM 1131 C PHE A 76 0.366 -9.222 13.592 1.00 0.00 C ATOM 1132 O PHE A 76 0.172 -10.275 12.987 1.00 0.00 O ATOM 1133 CB PHE A 76 -0.932 -8.946 15.700 1.00 0.00 C ATOM 1134 CG PHE A 76 -1.724 -10.216 16.019 1.00 0.00 C ATOM 1135 CD1 PHE A 76 -2.300 -10.929 15.015 1.00 0.00 C ATOM 1136 CD2 PHE A 76 -1.851 -10.632 17.308 1.00 0.00 C ATOM 1137 CE1 PHE A 76 -3.034 -12.108 15.312 1.00 0.00 C ATOM 1138 CE2 PHE A 76 -2.585 -11.810 17.604 1.00 0.00 C ATOM 1139 CZ PHE A 76 -3.161 -12.523 16.600 1.00 0.00 C ATOM 0 H PHE A 76 0.910 -7.203 15.517 1.00 0.00 H new ATOM 0 HA PHE A 76 0.858 -10.171 15.442 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -0.829 -8.356 16.611 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -1.501 -8.343 14.993 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -2.199 -10.599 13.992 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -1.393 -10.066 18.106 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -3.491 -12.675 14.514 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -2.686 -12.140 18.627 1.00 0.00 H new ATOM 0 HZ PHE A 76 -3.720 -13.419 16.826 1.00 0.00 H new ATOM 1149 N ALA A 77 0.511 -8.039 13.013 1.00 0.00 N ATOM 1150 CA ALA A 77 0.446 -7.901 11.567 1.00 0.00 C ATOM 1151 C ALA A 77 1.611 -8.666 10.934 1.00 0.00 C ATOM 1152 O ALA A 77 1.429 -9.771 10.426 1.00 0.00 O ATOM 1153 CB ALA A 77 0.453 -6.416 11.196 1.00 0.00 C ATOM 0 H ALA A 77 0.673 -7.168 13.518 1.00 0.00 H new ATOM 0 HA ALA A 77 -0.479 -8.330 11.181 1.00 0.00 H new ATOM 0 HB1 ALA A 77 0.404 -6.312 10.112 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -0.409 -5.924 11.647 1.00 0.00 H new ATOM 0 HB3 ALA A 77 1.369 -5.953 11.564 1.00 0.00 H new ATOM 1159 N MET A 78 2.781 -8.047 10.985 1.00 0.00 N ATOM 1160 CA MET A 78 3.974 -8.656 10.423 1.00 0.00 C ATOM 1161 C MET A 78 4.482 -9.792 11.313 1.00 0.00 C ATOM 1162 O MET A 78 5.684 -9.917 11.541 1.00 0.00 O ATOM 1163 CB MET A 78 5.068 -7.595 10.276 1.00 0.00 C ATOM 1164 CG MET A 78 5.794 -7.369 11.603 1.00 0.00 C ATOM 1165 SD MET A 78 4.609 -7.182 12.923 1.00 0.00 S ATOM 1166 CE MET A 78 5.282 -8.335 14.110 1.00 0.00 C ATOM 0 H MET A 78 2.928 -7.130 11.407 1.00 0.00 H new ATOM 0 HA MET A 78 3.722 -9.070 9.447 1.00 0.00 H new ATOM 0 HB2 MET A 78 5.783 -7.908 9.515 1.00 0.00 H new ATOM 0 HB3 MET A 78 4.628 -6.658 9.934 1.00 0.00 H new ATOM 0 HG2 MET A 78 6.455 -8.210 11.813 1.00 0.00 H new ATOM 0 HG3 MET A 78 6.421 -6.480 11.537 1.00 0.00 H new ATOM 0 HE1 MET A 78 5.483 -7.816 15.047 1.00 0.00 H new ATOM 0 HE2 MET A 78 4.565 -9.137 14.286 1.00 0.00 H new ATOM 0 HE3 MET A 78 6.209 -8.757 13.722 1.00 0.00 H new ATOM 1176 N LYS A 79 3.540 -10.591 11.792 1.00 0.00 N ATOM 1177 CA LYS A 79 3.876 -11.713 12.652 1.00 0.00 C ATOM 1178 C LYS A 79 2.918 -12.872 12.369 1.00 0.00 C ATOM 1179 O LYS A 79 3.352 -14.001 12.145 1.00 0.00 O ATOM 1180 CB LYS A 79 3.898 -11.277 14.118 1.00 0.00 C ATOM 1181 CG LYS A 79 3.932 -12.489 15.051 1.00 0.00 C ATOM 1182 CD LYS A 79 2.711 -12.504 15.973 1.00 0.00 C ATOM 1183 CE LYS A 79 2.188 -13.928 16.167 1.00 0.00 C ATOM 1184 NZ LYS A 79 1.543 -14.069 17.491 1.00 0.00 N ATOM 0 H LYS A 79 2.544 -10.484 11.601 1.00 0.00 H new ATOM 0 HA LYS A 79 4.882 -12.071 12.435 1.00 0.00 H new ATOM 0 HB2 LYS A 79 4.770 -10.648 14.301 1.00 0.00 H new ATOM 0 HB3 LYS A 79 3.018 -10.672 14.334 1.00 0.00 H new ATOM 0 HG2 LYS A 79 3.959 -13.406 14.462 1.00 0.00 H new ATOM 0 HG3 LYS A 79 4.843 -12.467 15.648 1.00 0.00 H new ATOM 0 HD2 LYS A 79 2.975 -12.075 16.940 1.00 0.00 H new ATOM 0 HD3 LYS A 79 1.925 -11.878 15.551 1.00 0.00 H new ATOM 0 HE2 LYS A 79 1.473 -14.169 15.380 1.00 0.00 H new ATOM 0 HE3 LYS A 79 3.010 -14.638 16.079 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 1.194 -15.042 17.605 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 2.235 -13.859 18.238 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 0.746 -13.405 17.561 1.00 0.00 H new ATOM 1198 N HIS A 80 1.632 -12.553 12.391 1.00 0.00 N ATOM 1199 CA HIS A 80 0.609 -13.553 12.140 1.00 0.00 C ATOM 1200 C HIS A 80 0.702 -14.032 10.689 1.00 0.00 C ATOM 1201 O HIS A 80 0.005 -14.964 10.293 1.00 0.00 O ATOM 1202 CB HIS A 80 -0.778 -13.015 12.498 1.00 0.00 C ATOM 1203 CG HIS A 80 -1.401 -12.157 11.423 1.00 0.00 C ATOM 1204 ND1 HIS A 80 -0.665 -11.289 10.636 1.00 0.00 N ATOM 1205 CD2 HIS A 80 -2.695 -12.046 11.010 1.00 0.00 C ATOM 1206 CE1 HIS A 80 -1.489 -10.685 9.793 1.00 0.00 C ATOM 1207 NE2 HIS A 80 -2.748 -11.156 10.027 1.00 0.00 N ATOM 0 H HIS A 80 1.276 -11.616 12.579 1.00 0.00 H new ATOM 0 HA HIS A 80 0.777 -14.417 12.783 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -1.440 -13.856 12.706 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -0.704 -12.432 13.416 1.00 0.00 H new ATOM 0 HD1 HIS A 80 0.342 -11.139 10.695 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -3.535 -12.590 11.414 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -1.213 -9.950 9.052 1.00 0.00 H new ATOM 1216 N GLY A 81 1.570 -13.370 9.937 1.00 0.00 N ATOM 1217 CA GLY A 81 1.764 -13.716 8.539 1.00 0.00 C ATOM 1218 C GLY A 81 3.229 -13.553 8.132 1.00 0.00 C ATOM 1219 O GLY A 81 3.534 -13.377 6.955 1.00 0.00 O ATOM 0 H GLY A 81 2.146 -12.597 10.269 1.00 0.00 H new ATOM 0 HA2 GLY A 81 1.448 -14.745 8.368 1.00 0.00 H new ATOM 0 HA3 GLY A 81 1.136 -13.082 7.913 1.00 0.00 H new ATOM 1223 N ALA A 82 4.098 -13.616 9.130 1.00 0.00 N ATOM 1224 CA ALA A 82 5.524 -13.478 8.892 1.00 0.00 C ATOM 1225 C ALA A 82 6.271 -14.591 9.630 1.00 0.00 C ATOM 1226 O ALA A 82 5.737 -15.189 10.563 1.00 0.00 O ATOM 1227 CB ALA A 82 5.983 -12.084 9.324 1.00 0.00 C ATOM 0 H ALA A 82 3.841 -13.761 10.106 1.00 0.00 H new ATOM 0 HA ALA A 82 5.746 -13.580 7.830 1.00 0.00 H new ATOM 0 HB1 ALA A 82 7.053 -11.982 9.145 1.00 0.00 H new ATOM 0 HB2 ALA A 82 5.445 -11.330 8.750 1.00 0.00 H new ATOM 0 HB3 ALA A 82 5.778 -11.946 10.386 1.00 0.00 H new ATOM 1233 N ASP A 83 7.495 -14.837 9.185 1.00 0.00 N ATOM 1234 CA ASP A 83 8.320 -15.867 9.790 1.00 0.00 C ATOM 1235 C ASP A 83 9.095 -15.267 10.966 1.00 0.00 C ATOM 1236 O ASP A 83 9.448 -14.089 10.945 1.00 0.00 O ATOM 1237 CB ASP A 83 9.334 -16.421 8.789 1.00 0.00 C ATOM 1238 CG ASP A 83 9.064 -16.058 7.328 1.00 0.00 C ATOM 1239 OD1 ASP A 83 9.528 -14.970 6.918 1.00 0.00 O ATOM 1240 OD2 ASP A 83 8.401 -16.874 6.652 1.00 0.00 O ATOM 0 H ASP A 83 7.935 -14.339 8.411 1.00 0.00 H new ATOM 0 HA ASP A 83 7.665 -16.673 10.121 1.00 0.00 H new ATOM 0 HB2 ASP A 83 10.325 -16.058 9.061 1.00 0.00 H new ATOM 0 HB3 ASP A 83 9.356 -17.507 8.880 1.00 0.00 H new ATOM 1245 N GLU A 84 9.339 -16.106 11.962 1.00 0.00 N ATOM 1246 CA GLU A 84 10.067 -15.673 13.143 1.00 0.00 C ATOM 1247 C GLU A 84 11.267 -14.814 12.743 1.00 0.00 C ATOM 1248 O GLU A 84 11.704 -13.957 13.509 1.00 0.00 O ATOM 1249 CB GLU A 84 10.507 -16.873 13.985 1.00 0.00 C ATOM 1250 CG GLU A 84 9.333 -17.448 14.779 1.00 0.00 C ATOM 1251 CD GLU A 84 9.449 -18.968 14.909 1.00 0.00 C ATOM 1252 OE1 GLU A 84 10.597 -19.437 15.071 1.00 0.00 O ATOM 1253 OE2 GLU A 84 8.389 -19.626 14.844 1.00 0.00 O ATOM 0 H GLU A 84 9.046 -17.083 11.976 1.00 0.00 H new ATOM 0 HA GLU A 84 9.400 -15.066 13.755 1.00 0.00 H new ATOM 0 HB2 GLU A 84 10.923 -17.643 13.336 1.00 0.00 H new ATOM 0 HB3 GLU A 84 11.299 -16.570 14.669 1.00 0.00 H new ATOM 0 HG2 GLU A 84 9.304 -16.996 15.770 1.00 0.00 H new ATOM 0 HG3 GLU A 84 8.396 -17.192 14.285 1.00 0.00 H new ATOM 1260 N THR A 85 11.765 -15.072 11.543 1.00 0.00 N ATOM 1261 CA THR A 85 12.906 -14.333 11.030 1.00 0.00 C ATOM 1262 C THR A 85 12.512 -12.886 10.729 1.00 0.00 C ATOM 1263 O THR A 85 13.282 -11.962 10.985 1.00 0.00 O ATOM 1264 CB THR A 85 13.447 -15.082 9.811 1.00 0.00 C ATOM 1265 OG1 THR A 85 14.767 -14.572 9.647 1.00 0.00 O ATOM 1266 CG2 THR A 85 12.732 -14.688 8.517 1.00 0.00 C ATOM 0 H THR A 85 11.399 -15.783 10.910 1.00 0.00 H new ATOM 0 HA THR A 85 13.703 -14.273 11.771 1.00 0.00 H new ATOM 0 HB THR A 85 13.344 -16.155 9.970 1.00 0.00 H new ATOM 0 HG1 THR A 85 15.192 -15.006 8.878 1.00 0.00 H new ATOM 0 HG21 THR A 85 13.154 -15.248 7.683 1.00 0.00 H new ATOM 0 HG22 THR A 85 11.669 -14.914 8.605 1.00 0.00 H new ATOM 0 HG23 THR A 85 12.862 -13.620 8.340 1.00 0.00 H new ATOM 1274 N MET A 86 11.312 -12.733 10.189 1.00 0.00 N ATOM 1275 CA MET A 86 10.805 -11.414 9.850 1.00 0.00 C ATOM 1276 C MET A 86 11.008 -10.435 11.008 1.00 0.00 C ATOM 1277 O MET A 86 11.309 -9.264 10.788 1.00 0.00 O ATOM 1278 CB MET A 86 9.315 -11.509 9.517 1.00 0.00 C ATOM 1279 CG MET A 86 8.469 -10.809 10.581 1.00 0.00 C ATOM 1280 SD MET A 86 8.131 -11.930 11.928 1.00 0.00 S ATOM 1281 CE MET A 86 7.513 -10.778 13.144 1.00 0.00 C ATOM 0 H MET A 86 10.675 -13.501 9.978 1.00 0.00 H new ATOM 0 HA MET A 86 11.356 -11.045 8.985 1.00 0.00 H new ATOM 0 HB2 MET A 86 9.127 -11.057 8.543 1.00 0.00 H new ATOM 0 HB3 MET A 86 9.021 -12.556 9.445 1.00 0.00 H new ATOM 0 HG2 MET A 86 8.993 -9.929 10.953 1.00 0.00 H new ATOM 0 HG3 MET A 86 7.533 -10.462 10.143 1.00 0.00 H new ATOM 0 HE1 MET A 86 7.898 -11.046 14.128 1.00 0.00 H new ATOM 0 HE2 MET A 86 7.840 -9.770 12.889 1.00 0.00 H new ATOM 0 HE3 MET A 86 6.424 -10.813 13.158 1.00 0.00 H new ATOM 1291 N ALA A 87 10.833 -10.952 12.216 1.00 0.00 N ATOM 1292 CA ALA A 87 10.992 -10.138 13.409 1.00 0.00 C ATOM 1293 C ALA A 87 12.350 -9.432 13.361 1.00 0.00 C ATOM 1294 O ALA A 87 12.435 -8.227 13.587 1.00 0.00 O ATOM 1295 CB ALA A 87 10.835 -11.015 14.651 1.00 0.00 C ATOM 0 H ALA A 87 10.583 -11.925 12.394 1.00 0.00 H new ATOM 0 HA ALA A 87 10.221 -9.369 13.455 1.00 0.00 H new ATOM 0 HB1 ALA A 87 10.954 -10.404 15.546 1.00 0.00 H new ATOM 0 HB2 ALA A 87 9.845 -11.470 14.652 1.00 0.00 H new ATOM 0 HB3 ALA A 87 11.594 -11.797 14.642 1.00 0.00 H new ATOM 1301 N GLN A 88 13.377 -10.215 13.067 1.00 0.00 N ATOM 1302 CA GLN A 88 14.727 -9.681 12.987 1.00 0.00 C ATOM 1303 C GLN A 88 15.010 -9.164 11.576 1.00 0.00 C ATOM 1304 O GLN A 88 15.440 -8.025 11.403 1.00 0.00 O ATOM 1305 CB GLN A 88 15.757 -10.732 13.402 1.00 0.00 C ATOM 1306 CG GLN A 88 17.182 -10.201 13.228 1.00 0.00 C ATOM 1307 CD GLN A 88 17.974 -11.069 12.249 1.00 0.00 C ATOM 1308 OE1 GLN A 88 18.852 -11.831 12.624 1.00 0.00 O ATOM 1309 NE2 GLN A 88 17.617 -10.915 10.978 1.00 0.00 N ATOM 0 H GLN A 88 13.302 -11.215 12.881 1.00 0.00 H new ATOM 0 HA GLN A 88 14.808 -8.845 13.682 1.00 0.00 H new ATOM 0 HB2 GLN A 88 15.595 -11.015 14.442 1.00 0.00 H new ATOM 0 HB3 GLN A 88 15.625 -11.633 12.803 1.00 0.00 H new ATOM 0 HG2 GLN A 88 17.149 -9.174 12.865 1.00 0.00 H new ATOM 0 HG3 GLN A 88 17.687 -10.182 14.194 1.00 0.00 H new ATOM 0 HE21 GLN A 88 16.874 -10.260 10.733 1.00 0.00 H new ATOM 0 HE22 GLN A 88 18.086 -11.451 10.248 1.00 0.00 H new ATOM 1318 N GLN A 89 14.757 -10.026 10.602 1.00 0.00 N ATOM 1319 CA GLN A 89 14.979 -9.669 9.211 1.00 0.00 C ATOM 1320 C GLN A 89 14.519 -8.234 8.950 1.00 0.00 C ATOM 1321 O GLN A 89 15.326 -7.375 8.596 1.00 0.00 O ATOM 1322 CB GLN A 89 14.271 -10.651 8.274 1.00 0.00 C ATOM 1323 CG GLN A 89 15.063 -11.954 8.144 1.00 0.00 C ATOM 1324 CD GLN A 89 16.499 -11.679 7.693 1.00 0.00 C ATOM 1325 OE1 GLN A 89 17.448 -11.786 8.454 1.00 0.00 O ATOM 1326 NE2 GLN A 89 16.606 -11.321 6.417 1.00 0.00 N ATOM 0 H GLN A 89 14.401 -10.970 10.749 1.00 0.00 H new ATOM 0 HA GLN A 89 16.048 -9.729 9.007 1.00 0.00 H new ATOM 0 HB2 GLN A 89 13.272 -10.865 8.654 1.00 0.00 H new ATOM 0 HB3 GLN A 89 14.148 -10.197 7.291 1.00 0.00 H new ATOM 0 HG2 GLN A 89 15.072 -12.476 9.101 1.00 0.00 H new ATOM 0 HG3 GLN A 89 14.572 -12.612 7.427 1.00 0.00 H new ATOM 0 HE21 GLN A 89 15.771 -11.251 5.835 1.00 0.00 H new ATOM 0 HE22 GLN A 89 17.523 -11.117 6.020 1.00 0.00 H new ATOM 1335 N LEU A 90 13.226 -8.017 9.133 1.00 0.00 N ATOM 1336 CA LEU A 90 12.650 -6.701 8.923 1.00 0.00 C ATOM 1337 C LEU A 90 13.488 -5.657 9.664 1.00 0.00 C ATOM 1338 O LEU A 90 13.807 -4.606 9.112 1.00 0.00 O ATOM 1339 CB LEU A 90 11.171 -6.694 9.316 1.00 0.00 C ATOM 1340 CG LEU A 90 10.198 -7.253 8.276 1.00 0.00 C ATOM 1341 CD1 LEU A 90 10.745 -8.534 7.646 1.00 0.00 C ATOM 1342 CD2 LEU A 90 8.808 -7.460 8.880 1.00 0.00 C ATOM 0 H LEU A 90 12.560 -8.732 9.425 1.00 0.00 H new ATOM 0 HA LEU A 90 12.676 -6.439 7.865 1.00 0.00 H new ATOM 0 HB2 LEU A 90 11.057 -7.267 10.236 1.00 0.00 H new ATOM 0 HB3 LEU A 90 10.880 -5.668 9.542 1.00 0.00 H new ATOM 0 HG LEU A 90 10.095 -6.519 7.476 1.00 0.00 H new ATOM 0 HD11 LEU A 90 10.034 -8.910 6.911 1.00 0.00 H new ATOM 0 HD12 LEU A 90 11.695 -8.322 7.156 1.00 0.00 H new ATOM 0 HD13 LEU A 90 10.896 -9.285 8.421 1.00 0.00 H new ATOM 0 HD21 LEU A 90 8.136 -7.858 8.119 1.00 0.00 H new ATOM 0 HD22 LEU A 90 8.873 -8.163 9.710 1.00 0.00 H new ATOM 0 HD23 LEU A 90 8.423 -6.507 9.241 1.00 0.00 H new ATOM 1354 N VAL A 91 13.820 -5.985 10.905 1.00 0.00 N ATOM 1355 CA VAL A 91 14.615 -5.089 11.726 1.00 0.00 C ATOM 1356 C VAL A 91 15.915 -4.751 10.996 1.00 0.00 C ATOM 1357 O VAL A 91 16.590 -3.781 11.338 1.00 0.00 O ATOM 1358 CB VAL A 91 14.849 -5.712 13.104 1.00 0.00 C ATOM 1359 CG1 VAL A 91 16.321 -5.613 13.508 1.00 0.00 C ATOM 1360 CG2 VAL A 91 13.947 -5.068 14.159 1.00 0.00 C ATOM 0 H VAL A 91 13.553 -6.858 11.360 1.00 0.00 H new ATOM 0 HA VAL A 91 14.083 -4.152 11.892 1.00 0.00 H new ATOM 0 HB VAL A 91 14.589 -6.769 13.041 1.00 0.00 H new ATOM 0 HG11 VAL A 91 16.460 -6.063 14.491 1.00 0.00 H new ATOM 0 HG12 VAL A 91 16.935 -6.140 12.778 1.00 0.00 H new ATOM 0 HG13 VAL A 91 16.619 -4.565 13.544 1.00 0.00 H new ATOM 0 HG21 VAL A 91 14.134 -5.530 15.129 1.00 0.00 H new ATOM 0 HG22 VAL A 91 14.161 -4.001 14.218 1.00 0.00 H new ATOM 0 HG23 VAL A 91 12.903 -5.214 13.883 1.00 0.00 H new ATOM 1370 N ASP A 92 16.228 -5.568 10.001 1.00 0.00 N ATOM 1371 CA ASP A 92 17.435 -5.368 9.218 1.00 0.00 C ATOM 1372 C ASP A 92 17.226 -4.196 8.257 1.00 0.00 C ATOM 1373 O ASP A 92 17.845 -3.143 8.411 1.00 0.00 O ATOM 1374 CB ASP A 92 17.765 -6.609 8.386 1.00 0.00 C ATOM 1375 CG ASP A 92 19.202 -6.678 7.868 1.00 0.00 C ATOM 1376 OD1 ASP A 92 20.072 -6.063 8.523 1.00 0.00 O ATOM 1377 OD2 ASP A 92 19.401 -7.343 6.830 1.00 0.00 O ATOM 0 H ASP A 92 15.666 -6.371 9.719 1.00 0.00 H new ATOM 0 HA ASP A 92 18.255 -5.169 9.908 1.00 0.00 H new ATOM 0 HB2 ASP A 92 17.570 -7.495 8.990 1.00 0.00 H new ATOM 0 HB3 ASP A 92 17.086 -6.648 7.534 1.00 0.00 H new ATOM 1382 N ILE A 93 16.352 -4.418 7.287 1.00 0.00 N ATOM 1383 CA ILE A 93 16.053 -3.392 6.300 1.00 0.00 C ATOM 1384 C ILE A 93 15.334 -2.228 6.982 1.00 0.00 C ATOM 1385 O ILE A 93 15.686 -1.068 6.776 1.00 0.00 O ATOM 1386 CB ILE A 93 15.279 -3.990 5.124 1.00 0.00 C ATOM 1387 CG1 ILE A 93 13.770 -3.859 5.339 1.00 0.00 C ATOM 1388 CG2 ILE A 93 15.698 -5.440 4.871 1.00 0.00 C ATOM 1389 CD1 ILE A 93 13.255 -4.943 6.289 1.00 0.00 C ATOM 0 H ILE A 93 15.841 -5.292 7.162 1.00 0.00 H new ATOM 0 HA ILE A 93 16.974 -2.992 5.875 1.00 0.00 H new ATOM 0 HB ILE A 93 15.528 -3.422 4.227 1.00 0.00 H new ATOM 0 HG12 ILE A 93 13.541 -2.874 5.747 1.00 0.00 H new ATOM 0 HG13 ILE A 93 13.255 -3.935 4.381 1.00 0.00 H new ATOM 0 HG21 ILE A 93 15.132 -5.841 4.030 1.00 0.00 H new ATOM 0 HG22 ILE A 93 16.763 -5.476 4.642 1.00 0.00 H new ATOM 0 HG23 ILE A 93 15.497 -6.037 5.760 1.00 0.00 H new ATOM 0 HD11 ILE A 93 12.180 -4.827 6.425 1.00 0.00 H new ATOM 0 HD12 ILE A 93 13.464 -5.926 5.867 1.00 0.00 H new ATOM 0 HD13 ILE A 93 13.755 -4.849 7.253 1.00 0.00 H new ATOM 1401 N ILE A 94 14.338 -2.578 7.784 1.00 0.00 N ATOM 1402 CA ILE A 94 13.565 -1.577 8.498 1.00 0.00 C ATOM 1403 C ILE A 94 14.516 -0.659 9.271 1.00 0.00 C ATOM 1404 O ILE A 94 14.183 0.490 9.555 1.00 0.00 O ATOM 1405 CB ILE A 94 12.505 -2.244 9.378 1.00 0.00 C ATOM 1406 CG1 ILE A 94 11.552 -3.094 8.535 1.00 0.00 C ATOM 1407 CG2 ILE A 94 11.758 -1.207 10.219 1.00 0.00 C ATOM 1408 CD1 ILE A 94 10.093 -2.797 8.892 1.00 0.00 C ATOM 0 H ILE A 94 14.049 -3.541 7.955 1.00 0.00 H new ATOM 0 HA ILE A 94 13.015 -0.950 7.796 1.00 0.00 H new ATOM 0 HB ILE A 94 13.009 -2.916 10.072 1.00 0.00 H new ATOM 0 HG12 ILE A 94 11.719 -2.894 7.477 1.00 0.00 H new ATOM 0 HG13 ILE A 94 11.762 -4.151 8.697 1.00 0.00 H new ATOM 0 HG21 ILE A 94 11.011 -1.708 10.835 1.00 0.00 H new ATOM 0 HG22 ILE A 94 12.465 -0.682 10.861 1.00 0.00 H new ATOM 0 HG23 ILE A 94 11.265 -0.491 9.561 1.00 0.00 H new ATOM 0 HD11 ILE A 94 9.436 -3.414 8.279 1.00 0.00 H new ATOM 0 HD12 ILE A 94 9.923 -3.021 9.945 1.00 0.00 H new ATOM 0 HD13 ILE A 94 9.880 -1.744 8.706 1.00 0.00 H new ATOM 1420 N HIS A 95 15.682 -1.203 9.589 1.00 0.00 N ATOM 1421 CA HIS A 95 16.684 -0.449 10.324 1.00 0.00 C ATOM 1422 C HIS A 95 17.364 0.549 9.384 1.00 0.00 C ATOM 1423 O HIS A 95 17.772 1.630 9.809 1.00 0.00 O ATOM 1424 CB HIS A 95 17.677 -1.389 11.008 1.00 0.00 C ATOM 1425 CG HIS A 95 17.396 -1.615 12.475 1.00 0.00 C ATOM 1426 ND1 HIS A 95 18.380 -1.544 13.447 1.00 0.00 N ATOM 1427 CD2 HIS A 95 16.234 -1.912 13.125 1.00 0.00 C ATOM 1428 CE1 HIS A 95 17.822 -1.789 14.624 1.00 0.00 C ATOM 1429 NE2 HIS A 95 16.493 -2.016 14.422 1.00 0.00 N ATOM 0 H HIS A 95 15.955 -2.157 9.351 1.00 0.00 H new ATOM 0 HA HIS A 95 16.205 0.121 11.120 1.00 0.00 H new ATOM 0 HB2 HIS A 95 17.666 -2.350 10.494 1.00 0.00 H new ATOM 0 HB3 HIS A 95 18.682 -0.981 10.899 1.00 0.00 H new ATOM 0 HD2 HIS A 95 15.267 -2.041 12.662 1.00 0.00 H new ATOM 0 HE1 HIS A 95 18.331 -1.806 15.576 1.00 0.00 H new ATOM 0 HE2 HIS A 95 15.810 -2.231 15.149 1.00 0.00 H new ATOM 1438 N GLY A 96 17.467 0.154 8.124 1.00 0.00 N ATOM 1439 CA GLY A 96 18.090 0.999 7.122 1.00 0.00 C ATOM 1440 C GLY A 96 17.058 1.910 6.453 1.00 0.00 C ATOM 1441 O GLY A 96 17.405 2.965 5.924 1.00 0.00 O ATOM 0 H GLY A 96 17.128 -0.742 7.774 1.00 0.00 H new ATOM 0 HA2 GLY A 96 18.869 1.605 7.585 1.00 0.00 H new ATOM 0 HA3 GLY A 96 18.575 0.378 6.369 1.00 0.00 H new ATOM 1445 N CYS A 97 15.809 1.468 6.499 1.00 0.00 N ATOM 1446 CA CYS A 97 14.725 2.230 5.904 1.00 0.00 C ATOM 1447 C CYS A 97 14.170 3.185 6.965 1.00 0.00 C ATOM 1448 O CYS A 97 14.230 4.402 6.800 1.00 0.00 O ATOM 1449 CB CYS A 97 13.637 1.316 5.335 1.00 0.00 C ATOM 1450 SG CYS A 97 13.490 1.344 3.510 1.00 0.00 S ATOM 0 H CYS A 97 15.525 0.593 6.939 1.00 0.00 H new ATOM 0 HA CYS A 97 15.103 2.806 5.059 1.00 0.00 H new ATOM 0 HB2 CYS A 97 13.838 0.293 5.654 1.00 0.00 H new ATOM 0 HB3 CYS A 97 12.678 1.602 5.767 1.00 0.00 H new ATOM 1455 N GLU A 98 13.643 2.596 8.027 1.00 0.00 N ATOM 1456 CA GLU A 98 13.079 3.377 9.114 1.00 0.00 C ATOM 1457 C GLU A 98 14.011 4.535 9.474 1.00 0.00 C ATOM 1458 O GLU A 98 13.551 5.617 9.836 1.00 0.00 O ATOM 1459 CB GLU A 98 12.799 2.498 10.335 1.00 0.00 C ATOM 1460 CG GLU A 98 11.859 3.203 11.314 1.00 0.00 C ATOM 1461 CD GLU A 98 12.333 3.021 12.757 1.00 0.00 C ATOM 1462 OE1 GLU A 98 13.559 3.141 12.970 1.00 0.00 O ATOM 1463 OE2 GLU A 98 11.459 2.768 13.614 1.00 0.00 O ATOM 0 H GLU A 98 13.594 1.586 8.158 1.00 0.00 H new ATOM 0 HA GLU A 98 12.127 3.792 8.781 1.00 0.00 H new ATOM 0 HB2 GLU A 98 12.356 1.555 10.015 1.00 0.00 H new ATOM 0 HB3 GLU A 98 13.736 2.256 10.836 1.00 0.00 H new ATOM 0 HG2 GLU A 98 11.809 4.265 11.075 1.00 0.00 H new ATOM 0 HG3 GLU A 98 10.850 2.805 11.206 1.00 0.00 H new ATOM 1470 N LYS A 99 15.304 4.269 9.362 1.00 0.00 N ATOM 1471 CA LYS A 99 16.305 5.276 9.671 1.00 0.00 C ATOM 1472 C LYS A 99 16.307 6.341 8.572 1.00 0.00 C ATOM 1473 O LYS A 99 16.600 7.507 8.834 1.00 0.00 O ATOM 1474 CB LYS A 99 17.670 4.622 9.896 1.00 0.00 C ATOM 1475 CG LYS A 99 18.343 4.284 8.565 1.00 0.00 C ATOM 1476 CD LYS A 99 19.642 5.072 8.391 1.00 0.00 C ATOM 1477 CE LYS A 99 20.188 4.923 6.969 1.00 0.00 C ATOM 1478 NZ LYS A 99 21.667 4.943 6.977 1.00 0.00 N ATOM 0 H LYS A 99 15.682 3.370 9.061 1.00 0.00 H new ATOM 0 HA LYS A 99 16.061 5.782 10.605 1.00 0.00 H new ATOM 0 HB2 LYS A 99 18.309 5.293 10.470 1.00 0.00 H new ATOM 0 HB3 LYS A 99 17.549 3.714 10.487 1.00 0.00 H new ATOM 0 HG2 LYS A 99 18.553 3.215 8.521 1.00 0.00 H new ATOM 0 HG3 LYS A 99 17.664 4.509 7.743 1.00 0.00 H new ATOM 0 HD2 LYS A 99 19.464 6.125 8.608 1.00 0.00 H new ATOM 0 HD3 LYS A 99 20.384 4.720 9.108 1.00 0.00 H new ATOM 0 HE2 LYS A 99 19.833 3.989 6.533 1.00 0.00 H new ATOM 0 HE3 LYS A 99 19.811 5.731 6.342 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 22.021 4.858 6.003 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 22.000 5.838 7.389 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 22.022 4.147 7.545 1.00 0.00 H new ATOM 1492 N SER A 100 15.978 5.903 7.366 1.00 0.00 N ATOM 1493 CA SER A 100 15.937 6.805 6.227 1.00 0.00 C ATOM 1494 C SER A 100 14.505 7.287 5.992 1.00 0.00 C ATOM 1495 O SER A 100 14.272 8.177 5.176 1.00 0.00 O ATOM 1496 CB SER A 100 16.482 6.126 4.969 1.00 0.00 C ATOM 1497 OG SER A 100 17.582 6.838 4.411 1.00 0.00 O ATOM 0 H SER A 100 15.737 4.935 7.152 1.00 0.00 H new ATOM 0 HA SER A 100 16.570 7.664 6.448 1.00 0.00 H new ATOM 0 HB2 SER A 100 16.794 5.110 5.212 1.00 0.00 H new ATOM 0 HB3 SER A 100 15.688 6.047 4.227 1.00 0.00 H new ATOM 0 HG SER A 100 17.486 6.877 3.436 1.00 0.00 H new ATOM 1503 N ALA A 101 13.582 6.679 6.722 1.00 0.00 N ATOM 1504 CA ALA A 101 12.178 7.036 6.603 1.00 0.00 C ATOM 1505 C ALA A 101 11.684 7.591 7.940 1.00 0.00 C ATOM 1506 O ALA A 101 11.054 6.876 8.718 1.00 0.00 O ATOM 1507 CB ALA A 101 11.379 5.815 6.146 1.00 0.00 C ATOM 0 H ALA A 101 13.779 5.941 7.398 1.00 0.00 H new ATOM 0 HA ALA A 101 12.040 7.814 5.852 1.00 0.00 H new ATOM 0 HB1 ALA A 101 10.326 6.082 6.057 1.00 0.00 H new ATOM 0 HB2 ALA A 101 11.751 5.478 5.179 1.00 0.00 H new ATOM 0 HB3 ALA A 101 11.489 5.014 6.877 1.00 0.00 H new ATOM 1513 N PRO A 102 11.993 8.896 8.172 1.00 0.00 N ATOM 1514 CA PRO A 102 11.586 9.553 9.401 1.00 0.00 C ATOM 1515 C PRO A 102 10.091 9.879 9.380 1.00 0.00 C ATOM 1516 O PRO A 102 9.433 9.727 8.351 1.00 0.00 O ATOM 1517 CB PRO A 102 12.460 10.795 9.490 1.00 0.00 C ATOM 1518 CG PRO A 102 12.994 11.030 8.087 1.00 0.00 C ATOM 1519 CD PRO A 102 12.736 9.773 7.273 1.00 0.00 C ATOM 0 HA PRO A 102 11.720 8.921 10.279 1.00 0.00 H new ATOM 0 HB2 PRO A 102 11.885 11.653 9.838 1.00 0.00 H new ATOM 0 HB3 PRO A 102 13.275 10.649 10.199 1.00 0.00 H new ATOM 0 HG2 PRO A 102 12.502 11.888 7.630 1.00 0.00 H new ATOM 0 HG3 PRO A 102 14.061 11.253 8.117 1.00 0.00 H new ATOM 0 HD2 PRO A 102 12.163 9.995 6.373 1.00 0.00 H new ATOM 0 HD3 PRO A 102 13.669 9.311 6.951 1.00 0.00 H new ATOM 1527 N PRO A 103 9.584 10.328 10.560 1.00 0.00 N ATOM 1528 CA PRO A 103 8.178 10.673 10.687 1.00 0.00 C ATOM 1529 C PRO A 103 7.879 12.012 10.008 1.00 0.00 C ATOM 1530 O PRO A 103 7.156 12.840 10.556 1.00 0.00 O ATOM 1531 CB PRO A 103 7.913 10.694 12.184 1.00 0.00 C ATOM 1532 CG PRO A 103 9.274 10.816 12.847 1.00 0.00 C ATOM 1533 CD PRO A 103 10.333 10.519 11.798 1.00 0.00 C ATOM 0 HA PRO A 103 7.522 9.959 10.189 1.00 0.00 H new ATOM 0 HB2 PRO A 103 7.270 11.532 12.455 1.00 0.00 H new ATOM 0 HB3 PRO A 103 7.403 9.785 12.503 1.00 0.00 H new ATOM 0 HG2 PRO A 103 9.411 11.817 13.255 1.00 0.00 H new ATOM 0 HG3 PRO A 103 9.356 10.118 13.680 1.00 0.00 H new ATOM 0 HD2 PRO A 103 11.043 11.341 11.708 1.00 0.00 H new ATOM 0 HD3 PRO A 103 10.907 9.629 12.055 1.00 0.00 H new ATOM 1541 N ASN A 104 8.451 12.180 8.825 1.00 0.00 N ATOM 1542 CA ASN A 104 8.256 13.403 8.066 1.00 0.00 C ATOM 1543 C ASN A 104 6.772 13.555 7.726 1.00 0.00 C ATOM 1544 O ASN A 104 6.060 12.562 7.577 1.00 0.00 O ATOM 1545 CB ASN A 104 9.040 13.368 6.752 1.00 0.00 C ATOM 1546 CG ASN A 104 9.331 14.782 6.250 1.00 0.00 C ATOM 1547 OD1 ASN A 104 8.442 15.540 5.896 1.00 0.00 O ATOM 1548 ND2 ASN A 104 10.624 15.098 6.238 1.00 0.00 N ATOM 0 H ASN A 104 9.050 11.489 8.373 1.00 0.00 H new ATOM 0 HA ASN A 104 8.608 14.236 8.674 1.00 0.00 H new ATOM 0 HB2 ASN A 104 9.977 12.830 6.898 1.00 0.00 H new ATOM 0 HB3 ASN A 104 8.472 12.821 6.000 1.00 0.00 H new ATOM 0 HD21 ASN A 104 10.921 16.021 5.920 1.00 0.00 H new ATOM 0 HD22 ASN A 104 11.318 14.418 6.547 1.00 0.00 H new ATOM 1555 N ASP A 105 6.348 14.805 7.614 1.00 0.00 N ATOM 1556 CA ASP A 105 4.961 15.100 7.294 1.00 0.00 C ATOM 1557 C ASP A 105 4.577 14.381 5.999 1.00 0.00 C ATOM 1558 O ASP A 105 3.397 14.151 5.740 1.00 0.00 O ATOM 1559 CB ASP A 105 4.752 16.600 7.083 1.00 0.00 C ATOM 1560 CG ASP A 105 4.482 17.401 8.356 1.00 0.00 C ATOM 1561 OD1 ASP A 105 4.634 16.806 9.445 1.00 0.00 O ATOM 1562 OD2 ASP A 105 4.130 18.593 8.215 1.00 0.00 O ATOM 0 H ASP A 105 6.940 15.626 7.739 1.00 0.00 H new ATOM 0 HA ASP A 105 4.343 14.764 8.127 1.00 0.00 H new ATOM 0 HB2 ASP A 105 5.637 17.009 6.595 1.00 0.00 H new ATOM 0 HB3 ASP A 105 3.916 16.742 6.398 1.00 0.00 H new ATOM 1567 N ASP A 106 5.596 14.048 5.220 1.00 0.00 N ATOM 1568 CA ASP A 106 5.379 13.360 3.959 1.00 0.00 C ATOM 1569 C ASP A 106 5.247 11.858 4.217 1.00 0.00 C ATOM 1570 O ASP A 106 5.605 11.044 3.367 1.00 0.00 O ATOM 1571 CB ASP A 106 6.557 13.574 3.005 1.00 0.00 C ATOM 1572 CG ASP A 106 6.192 14.177 1.649 1.00 0.00 C ATOM 1573 OD1 ASP A 106 5.087 14.756 1.564 1.00 0.00 O ATOM 1574 OD2 ASP A 106 7.024 14.045 0.725 1.00 0.00 O ATOM 0 H ASP A 106 6.573 14.242 5.438 1.00 0.00 H new ATOM 0 HA ASP A 106 4.471 13.762 3.508 1.00 0.00 H new ATOM 0 HB2 ASP A 106 7.284 14.225 3.491 1.00 0.00 H new ATOM 0 HB3 ASP A 106 7.048 12.615 2.838 1.00 0.00 H new ATOM 1579 N LYS A 107 4.730 11.537 5.394 1.00 0.00 N ATOM 1580 CA LYS A 107 4.546 10.147 5.775 1.00 0.00 C ATOM 1581 C LYS A 107 4.057 9.351 4.563 1.00 0.00 C ATOM 1582 O LYS A 107 4.334 8.158 4.448 1.00 0.00 O ATOM 1583 CB LYS A 107 3.623 10.043 6.992 1.00 0.00 C ATOM 1584 CG LYS A 107 2.220 10.558 6.661 1.00 0.00 C ATOM 1585 CD LYS A 107 1.319 10.522 7.896 1.00 0.00 C ATOM 1586 CE LYS A 107 1.038 9.082 8.329 1.00 0.00 C ATOM 1587 NZ LYS A 107 1.388 8.891 9.754 1.00 0.00 N ATOM 0 H LYS A 107 4.433 12.215 6.096 1.00 0.00 H new ATOM 0 HA LYS A 107 5.494 9.708 6.084 1.00 0.00 H new ATOM 0 HB2 LYS A 107 3.565 9.006 7.322 1.00 0.00 H new ATOM 0 HB3 LYS A 107 4.040 10.618 7.819 1.00 0.00 H new ATOM 0 HG2 LYS A 107 2.283 11.578 6.282 1.00 0.00 H new ATOM 0 HG3 LYS A 107 1.783 9.950 5.869 1.00 0.00 H new ATOM 0 HD2 LYS A 107 1.794 11.065 8.713 1.00 0.00 H new ATOM 0 HD3 LYS A 107 0.379 11.030 7.680 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -0.015 8.848 8.173 1.00 0.00 H new ATOM 0 HE3 LYS A 107 1.613 8.392 7.712 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 1.191 7.908 10.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 2.398 9.094 9.894 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 0.821 9.536 10.340 1.00 0.00 H new ATOM 1601 N CYS A 108 3.340 10.043 3.691 1.00 0.00 N ATOM 1602 CA CYS A 108 2.811 9.415 2.492 1.00 0.00 C ATOM 1603 C CYS A 108 3.956 8.689 1.784 1.00 0.00 C ATOM 1604 O CYS A 108 3.825 7.519 1.426 1.00 0.00 O ATOM 1605 CB CYS A 108 2.127 10.432 1.576 1.00 0.00 C ATOM 1606 SG CYS A 108 0.810 9.741 0.509 1.00 0.00 S ATOM 0 H CYS A 108 3.113 11.032 3.790 1.00 0.00 H new ATOM 0 HA CYS A 108 2.040 8.695 2.766 1.00 0.00 H new ATOM 0 HB2 CYS A 108 1.699 11.223 2.191 1.00 0.00 H new ATOM 0 HB3 CYS A 108 2.883 10.895 0.942 1.00 0.00 H new ATOM 1611 N MET A 109 5.052 9.412 1.605 1.00 0.00 N ATOM 1612 CA MET A 109 6.219 8.850 0.947 1.00 0.00 C ATOM 1613 C MET A 109 7.306 8.497 1.964 1.00 0.00 C ATOM 1614 O MET A 109 8.334 7.924 1.607 1.00 0.00 O ATOM 1615 CB MET A 109 6.772 9.860 -0.061 1.00 0.00 C ATOM 1616 CG MET A 109 7.596 9.160 -1.143 1.00 0.00 C ATOM 1617 SD MET A 109 8.344 10.372 -2.219 1.00 0.00 S ATOM 1618 CE MET A 109 9.957 9.639 -2.437 1.00 0.00 C ATOM 0 H MET A 109 5.156 10.382 1.904 1.00 0.00 H new ATOM 0 HA MET A 109 5.918 7.937 0.433 1.00 0.00 H new ATOM 0 HB2 MET A 109 5.949 10.407 -0.522 1.00 0.00 H new ATOM 0 HB3 MET A 109 7.392 10.593 0.456 1.00 0.00 H new ATOM 0 HG2 MET A 109 8.369 8.544 -0.682 1.00 0.00 H new ATOM 0 HG3 MET A 109 6.959 8.492 -1.722 1.00 0.00 H new ATOM 0 HE1 MET A 109 10.289 9.789 -3.464 1.00 0.00 H new ATOM 0 HE2 MET A 109 10.665 10.108 -1.754 1.00 0.00 H new ATOM 0 HE3 MET A 109 9.903 8.571 -2.226 1.00 0.00 H new ATOM 1628 N LYS A 110 7.040 8.853 3.212 1.00 0.00 N ATOM 1629 CA LYS A 110 7.982 8.580 4.284 1.00 0.00 C ATOM 1630 C LYS A 110 7.701 7.193 4.866 1.00 0.00 C ATOM 1631 O LYS A 110 8.431 6.242 4.595 1.00 0.00 O ATOM 1632 CB LYS A 110 7.949 9.701 5.325 1.00 0.00 C ATOM 1633 CG LYS A 110 9.269 10.475 5.341 1.00 0.00 C ATOM 1634 CD LYS A 110 9.351 11.444 4.160 1.00 0.00 C ATOM 1635 CE LYS A 110 10.602 12.319 4.254 1.00 0.00 C ATOM 1636 NZ LYS A 110 11.561 11.968 3.184 1.00 0.00 N ATOM 0 H LYS A 110 6.186 9.328 3.505 1.00 0.00 H new ATOM 0 HA LYS A 110 9.001 8.563 3.898 1.00 0.00 H new ATOM 0 HB2 LYS A 110 7.127 10.382 5.105 1.00 0.00 H new ATOM 0 HB3 LYS A 110 7.759 9.280 6.312 1.00 0.00 H new ATOM 0 HG2 LYS A 110 9.359 11.028 6.276 1.00 0.00 H new ATOM 0 HG3 LYS A 110 10.105 9.776 5.301 1.00 0.00 H new ATOM 0 HD2 LYS A 110 9.365 10.883 3.225 1.00 0.00 H new ATOM 0 HD3 LYS A 110 8.462 12.075 4.140 1.00 0.00 H new ATOM 0 HE2 LYS A 110 10.325 13.370 4.172 1.00 0.00 H new ATOM 0 HE3 LYS A 110 11.072 12.189 5.229 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 12.405 12.571 3.262 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 11.839 10.970 3.280 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 11.115 12.115 2.256 1.00 0.00 H new ATOM 1650 N THR A 111 6.638 7.123 5.655 1.00 0.00 N ATOM 1651 CA THR A 111 6.250 5.868 6.277 1.00 0.00 C ATOM 1652 C THR A 111 6.174 4.755 5.230 1.00 0.00 C ATOM 1653 O THR A 111 6.663 3.649 5.457 1.00 0.00 O ATOM 1654 CB THR A 111 4.931 6.096 7.018 1.00 0.00 C ATOM 1655 OG1 THR A 111 5.116 7.343 7.682 1.00 0.00 O ATOM 1656 CG2 THR A 111 4.718 5.095 8.157 1.00 0.00 C ATOM 0 H THR A 111 6.034 7.914 5.877 1.00 0.00 H new ATOM 0 HA THR A 111 6.994 5.539 7.002 1.00 0.00 H new ATOM 0 HB THR A 111 4.103 6.026 6.313 1.00 0.00 H new ATOM 0 HG1 THR A 111 4.473 7.421 8.417 1.00 0.00 H new ATOM 0 HG21 THR A 111 3.768 5.301 8.650 1.00 0.00 H new ATOM 0 HG22 THR A 111 4.706 4.082 7.754 1.00 0.00 H new ATOM 0 HG23 THR A 111 5.529 5.188 8.879 1.00 0.00 H new ATOM 1664 N ILE A 112 5.557 5.084 4.105 1.00 0.00 N ATOM 1665 CA ILE A 112 5.411 4.127 3.022 1.00 0.00 C ATOM 1666 C ILE A 112 6.764 3.469 2.744 1.00 0.00 C ATOM 1667 O ILE A 112 6.846 2.251 2.596 1.00 0.00 O ATOM 1668 CB ILE A 112 4.788 4.796 1.795 1.00 0.00 C ATOM 1669 CG1 ILE A 112 4.118 3.763 0.887 1.00 0.00 C ATOM 1670 CG2 ILE A 112 5.823 5.634 1.044 1.00 0.00 C ATOM 1671 CD1 ILE A 112 5.122 2.704 0.428 1.00 0.00 C ATOM 0 H ILE A 112 5.152 6.002 3.920 1.00 0.00 H new ATOM 0 HA ILE A 112 4.721 3.332 3.306 1.00 0.00 H new ATOM 0 HB ILE A 112 4.008 5.477 2.136 1.00 0.00 H new ATOM 0 HG12 ILE A 112 3.296 3.284 1.420 1.00 0.00 H new ATOM 0 HG13 ILE A 112 3.687 4.262 0.019 1.00 0.00 H new ATOM 0 HG21 ILE A 112 5.355 6.099 0.176 1.00 0.00 H new ATOM 0 HG22 ILE A 112 6.212 6.409 1.704 1.00 0.00 H new ATOM 0 HG23 ILE A 112 6.641 4.993 0.715 1.00 0.00 H new ATOM 0 HD11 ILE A 112 4.620 1.982 -0.216 1.00 0.00 H new ATOM 0 HD12 ILE A 112 5.930 3.184 -0.125 1.00 0.00 H new ATOM 0 HD13 ILE A 112 5.533 2.191 1.298 1.00 0.00 H new ATOM 1683 N ASP A 113 7.790 4.305 2.681 1.00 0.00 N ATOM 1684 CA ASP A 113 9.135 3.819 2.421 1.00 0.00 C ATOM 1685 C ASP A 113 9.374 2.539 3.227 1.00 0.00 C ATOM 1686 O ASP A 113 9.852 1.543 2.687 1.00 0.00 O ATOM 1687 CB ASP A 113 10.183 4.849 2.847 1.00 0.00 C ATOM 1688 CG ASP A 113 11.422 4.917 1.954 1.00 0.00 C ATOM 1689 OD1 ASP A 113 11.945 3.830 1.622 1.00 0.00 O ATOM 1690 OD2 ASP A 113 11.821 6.055 1.621 1.00 0.00 O ATOM 0 H ASP A 113 7.717 5.315 2.805 1.00 0.00 H new ATOM 0 HA ASP A 113 9.227 3.632 1.351 1.00 0.00 H new ATOM 0 HB2 ASP A 113 9.715 5.833 2.869 1.00 0.00 H new ATOM 0 HB3 ASP A 113 10.499 4.623 3.865 1.00 0.00 H new ATOM 1695 N VAL A 114 9.032 2.609 4.504 1.00 0.00 N ATOM 1696 CA VAL A 114 9.204 1.469 5.389 1.00 0.00 C ATOM 1697 C VAL A 114 8.089 0.454 5.126 1.00 0.00 C ATOM 1698 O VAL A 114 8.356 -0.732 4.939 1.00 0.00 O ATOM 1699 CB VAL A 114 9.254 1.939 6.844 1.00 0.00 C ATOM 1700 CG1 VAL A 114 10.246 1.103 7.655 1.00 0.00 C ATOM 1701 CG2 VAL A 114 9.594 3.428 6.928 1.00 0.00 C ATOM 0 H VAL A 114 8.636 3.438 4.948 1.00 0.00 H new ATOM 0 HA VAL A 114 10.152 0.970 5.191 1.00 0.00 H new ATOM 0 HB VAL A 114 8.264 1.797 7.277 1.00 0.00 H new ATOM 0 HG11 VAL A 114 10.263 1.457 8.686 1.00 0.00 H new ATOM 0 HG12 VAL A 114 9.941 0.057 7.636 1.00 0.00 H new ATOM 0 HG13 VAL A 114 11.242 1.199 7.222 1.00 0.00 H new ATOM 0 HG21 VAL A 114 9.623 3.736 7.973 1.00 0.00 H new ATOM 0 HG22 VAL A 114 10.567 3.605 6.470 1.00 0.00 H new ATOM 0 HG23 VAL A 114 8.834 4.005 6.401 1.00 0.00 H new ATOM 1711 N ALA A 115 6.863 0.958 5.121 1.00 0.00 N ATOM 1712 CA ALA A 115 5.707 0.109 4.885 1.00 0.00 C ATOM 1713 C ALA A 115 5.940 -0.724 3.624 1.00 0.00 C ATOM 1714 O ALA A 115 5.309 -1.763 3.436 1.00 0.00 O ATOM 1715 CB ALA A 115 4.449 0.975 4.789 1.00 0.00 C ATOM 0 H ALA A 115 6.645 1.942 5.276 1.00 0.00 H new ATOM 0 HA ALA A 115 5.563 -0.583 5.714 1.00 0.00 H new ATOM 0 HB1 ALA A 115 3.582 0.339 4.612 1.00 0.00 H new ATOM 0 HB2 ALA A 115 4.313 1.523 5.721 1.00 0.00 H new ATOM 0 HB3 ALA A 115 4.555 1.681 3.965 1.00 0.00 H new ATOM 1721 N MET A 116 6.849 -0.236 2.791 1.00 0.00 N ATOM 1722 CA MET A 116 7.172 -0.923 1.551 1.00 0.00 C ATOM 1723 C MET A 116 8.508 -1.658 1.666 1.00 0.00 C ATOM 1724 O MET A 116 8.678 -2.737 1.099 1.00 0.00 O ATOM 1725 CB MET A 116 7.244 0.094 0.409 1.00 0.00 C ATOM 1726 CG MET A 116 6.324 -0.312 -0.744 1.00 0.00 C ATOM 1727 SD MET A 116 4.633 -0.383 -0.180 1.00 0.00 S ATOM 1728 CE MET A 116 4.232 -2.069 -0.610 1.00 0.00 C ATOM 0 H MET A 116 7.371 0.626 2.950 1.00 0.00 H new ATOM 0 HA MET A 116 6.391 -1.656 1.348 1.00 0.00 H new ATOM 0 HB2 MET A 116 6.959 1.080 0.777 1.00 0.00 H new ATOM 0 HB3 MET A 116 8.270 0.172 0.050 1.00 0.00 H new ATOM 0 HG2 MET A 116 6.414 0.404 -1.561 1.00 0.00 H new ATOM 0 HG3 MET A 116 6.626 -1.283 -1.136 1.00 0.00 H new ATOM 0 HE1 MET A 116 3.530 -2.473 0.119 1.00 0.00 H new ATOM 0 HE2 MET A 116 3.780 -2.094 -1.601 1.00 0.00 H new ATOM 0 HE3 MET A 116 5.141 -2.670 -0.611 1.00 0.00 H new ATOM 1738 N CYS A 117 9.423 -1.046 2.404 1.00 0.00 N ATOM 1739 CA CYS A 117 10.740 -1.630 2.600 1.00 0.00 C ATOM 1740 C CYS A 117 10.559 -3.096 3.002 1.00 0.00 C ATOM 1741 O CYS A 117 11.166 -3.985 2.406 1.00 0.00 O ATOM 1742 CB CYS A 117 11.555 -0.851 3.633 1.00 0.00 C ATOM 1743 SG CYS A 117 13.359 -0.823 3.322 1.00 0.00 S ATOM 0 H CYS A 117 9.279 -0.152 2.873 1.00 0.00 H new ATOM 0 HA CYS A 117 11.308 -1.576 1.671 1.00 0.00 H new ATOM 0 HB2 CYS A 117 11.190 0.175 3.665 1.00 0.00 H new ATOM 0 HB3 CYS A 117 11.377 -1.283 4.618 1.00 0.00 H new ATOM 1748 N PHE A 118 9.723 -3.302 4.008 1.00 0.00 N ATOM 1749 CA PHE A 118 9.456 -4.644 4.498 1.00 0.00 C ATOM 1750 C PHE A 118 8.746 -5.483 3.434 1.00 0.00 C ATOM 1751 O PHE A 118 9.005 -6.679 3.307 1.00 0.00 O ATOM 1752 CB PHE A 118 8.541 -4.502 5.715 1.00 0.00 C ATOM 1753 CG PHE A 118 7.747 -5.769 6.047 1.00 0.00 C ATOM 1754 CD1 PHE A 118 8.312 -6.991 5.864 1.00 0.00 C ATOM 1755 CD2 PHE A 118 6.479 -5.669 6.527 1.00 0.00 C ATOM 1756 CE1 PHE A 118 7.577 -8.167 6.173 1.00 0.00 C ATOM 1757 CE2 PHE A 118 5.743 -6.844 6.835 1.00 0.00 C ATOM 1758 CZ PHE A 118 6.308 -8.068 6.653 1.00 0.00 C ATOM 0 H PHE A 118 9.221 -2.562 4.498 1.00 0.00 H new ATOM 0 HA PHE A 118 10.392 -5.142 4.750 1.00 0.00 H new ATOM 0 HB2 PHE A 118 9.144 -4.226 6.580 1.00 0.00 H new ATOM 0 HB3 PHE A 118 7.843 -3.684 5.539 1.00 0.00 H new ATOM 0 HD1 PHE A 118 9.320 -7.068 5.484 1.00 0.00 H new ATOM 0 HD2 PHE A 118 6.032 -4.697 6.674 1.00 0.00 H new ATOM 0 HE1 PHE A 118 8.025 -9.139 6.027 1.00 0.00 H new ATOM 0 HE2 PHE A 118 4.735 -6.766 7.214 1.00 0.00 H new ATOM 0 HZ PHE A 118 5.749 -8.961 6.890 1.00 0.00 H new ATOM 1768 N LYS A 119 7.864 -4.823 2.698 1.00 0.00 N ATOM 1769 CA LYS A 119 7.114 -5.494 1.649 1.00 0.00 C ATOM 1770 C LYS A 119 8.065 -5.887 0.519 1.00 0.00 C ATOM 1771 O LYS A 119 7.846 -6.886 -0.164 1.00 0.00 O ATOM 1772 CB LYS A 119 5.940 -4.625 1.191 1.00 0.00 C ATOM 1773 CG LYS A 119 4.787 -4.686 2.196 1.00 0.00 C ATOM 1774 CD LYS A 119 3.485 -5.102 1.511 1.00 0.00 C ATOM 1775 CE LYS A 119 2.446 -5.554 2.539 1.00 0.00 C ATOM 1776 NZ LYS A 119 2.290 -7.027 2.505 1.00 0.00 N ATOM 0 H LYS A 119 7.652 -3.831 2.807 1.00 0.00 H new ATOM 0 HA LYS A 119 6.671 -6.415 2.027 1.00 0.00 H new ATOM 0 HB2 LYS A 119 6.271 -3.593 1.074 1.00 0.00 H new ATOM 0 HB3 LYS A 119 5.593 -4.961 0.214 1.00 0.00 H new ATOM 0 HG2 LYS A 119 5.028 -5.395 2.989 1.00 0.00 H new ATOM 0 HG3 LYS A 119 4.659 -3.712 2.668 1.00 0.00 H new ATOM 0 HD2 LYS A 119 3.091 -4.266 0.933 1.00 0.00 H new ATOM 0 HD3 LYS A 119 3.682 -5.911 0.808 1.00 0.00 H new ATOM 0 HE2 LYS A 119 2.751 -5.238 3.536 1.00 0.00 H new ATOM 0 HE3 LYS A 119 1.489 -5.076 2.332 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 1.581 -7.317 3.209 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 1.978 -7.321 1.558 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 3.201 -7.478 2.725 1.00 0.00 H new ATOM 1790 N LYS A 120 9.104 -5.082 0.355 1.00 0.00 N ATOM 1791 CA LYS A 120 10.092 -5.333 -0.681 1.00 0.00 C ATOM 1792 C LYS A 120 10.782 -6.670 -0.408 1.00 0.00 C ATOM 1793 O LYS A 120 11.190 -7.363 -1.339 1.00 0.00 O ATOM 1794 CB LYS A 120 11.060 -4.154 -0.797 1.00 0.00 C ATOM 1795 CG LYS A 120 10.819 -3.372 -2.089 1.00 0.00 C ATOM 1796 CD LYS A 120 12.037 -2.521 -2.452 1.00 0.00 C ATOM 1797 CE LYS A 120 12.757 -3.090 -3.676 1.00 0.00 C ATOM 1798 NZ LYS A 120 13.973 -3.826 -3.266 1.00 0.00 N ATOM 0 H LYS A 120 9.284 -4.254 0.923 1.00 0.00 H new ATOM 0 HA LYS A 120 9.609 -5.415 -1.655 1.00 0.00 H new ATOM 0 HB2 LYS A 120 10.938 -3.493 0.061 1.00 0.00 H new ATOM 0 HB3 LYS A 120 12.087 -4.518 -0.775 1.00 0.00 H new ATOM 0 HG2 LYS A 120 10.600 -4.065 -2.902 1.00 0.00 H new ATOM 0 HG3 LYS A 120 9.945 -2.731 -1.972 1.00 0.00 H new ATOM 0 HD2 LYS A 120 11.723 -1.497 -2.654 1.00 0.00 H new ATOM 0 HD3 LYS A 120 12.724 -2.483 -1.606 1.00 0.00 H new ATOM 0 HE2 LYS A 120 12.088 -3.756 -4.222 1.00 0.00 H new ATOM 0 HE3 LYS A 120 13.026 -2.281 -4.356 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 14.504 -4.118 -4.111 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 14.570 -3.210 -2.678 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 13.701 -4.668 -2.720 1.00 0.00 H new ATOM 1812 N GLU A 121 10.891 -6.993 0.872 1.00 0.00 N ATOM 1813 CA GLU A 121 11.526 -8.235 1.280 1.00 0.00 C ATOM 1814 C GLU A 121 10.794 -9.431 0.666 1.00 0.00 C ATOM 1815 O GLU A 121 11.399 -10.473 0.418 1.00 0.00 O ATOM 1816 CB GLU A 121 11.579 -8.349 2.804 1.00 0.00 C ATOM 1817 CG GLU A 121 12.265 -7.131 3.423 1.00 0.00 C ATOM 1818 CD GLU A 121 13.770 -7.150 3.147 1.00 0.00 C ATOM 1819 OE1 GLU A 121 14.449 -7.998 3.765 1.00 0.00 O ATOM 1820 OE2 GLU A 121 14.208 -6.319 2.323 1.00 0.00 O ATOM 0 H GLU A 121 10.550 -6.416 1.641 1.00 0.00 H new ATOM 0 HA GLU A 121 12.552 -8.233 0.913 1.00 0.00 H new ATOM 0 HB2 GLU A 121 10.568 -8.441 3.200 1.00 0.00 H new ATOM 0 HB3 GLU A 121 12.116 -9.255 3.086 1.00 0.00 H new ATOM 0 HG2 GLU A 121 11.829 -6.218 3.017 1.00 0.00 H new ATOM 0 HG3 GLU A 121 12.089 -7.118 4.499 1.00 0.00 H new ATOM 1827 N ILE A 122 9.503 -9.239 0.435 1.00 0.00 N ATOM 1828 CA ILE A 122 8.684 -10.290 -0.146 1.00 0.00 C ATOM 1829 C ILE A 122 8.931 -10.348 -1.655 1.00 0.00 C ATOM 1830 O ILE A 122 8.966 -11.429 -2.241 1.00 0.00 O ATOM 1831 CB ILE A 122 7.214 -10.091 0.229 1.00 0.00 C ATOM 1832 CG1 ILE A 122 7.082 -9.470 1.621 1.00 0.00 C ATOM 1833 CG2 ILE A 122 6.435 -11.402 0.110 1.00 0.00 C ATOM 1834 CD1 ILE A 122 8.030 -10.145 2.615 1.00 0.00 C ATOM 0 H ILE A 122 9.005 -8.373 0.639 1.00 0.00 H new ATOM 0 HA ILE A 122 8.965 -11.261 0.261 1.00 0.00 H new ATOM 0 HB ILE A 122 6.773 -9.390 -0.479 1.00 0.00 H new ATOM 0 HG12 ILE A 122 7.302 -8.404 1.570 1.00 0.00 H new ATOM 0 HG13 ILE A 122 6.054 -9.567 1.970 1.00 0.00 H new ATOM 0 HG21 ILE A 122 5.393 -11.232 0.382 1.00 0.00 H new ATOM 0 HG22 ILE A 122 6.487 -11.764 -0.917 1.00 0.00 H new ATOM 0 HG23 ILE A 122 6.869 -12.145 0.780 1.00 0.00 H new ATOM 0 HD11 ILE A 122 7.916 -9.685 3.596 1.00 0.00 H new ATOM 0 HD12 ILE A 122 7.791 -11.206 2.682 1.00 0.00 H new ATOM 0 HD13 ILE A 122 9.059 -10.025 2.275 1.00 0.00 H new ATOM 1846 N HIS A 123 9.097 -9.171 -2.240 1.00 0.00 N ATOM 1847 CA HIS A 123 9.341 -9.074 -3.669 1.00 0.00 C ATOM 1848 C HIS A 123 10.418 -10.081 -4.077 1.00 0.00 C ATOM 1849 O HIS A 123 10.523 -10.446 -5.246 1.00 0.00 O ATOM 1850 CB HIS A 123 9.691 -7.639 -4.065 1.00 0.00 C ATOM 1851 CG HIS A 123 11.128 -7.453 -4.491 1.00 0.00 C ATOM 1852 ND1 HIS A 123 12.017 -6.646 -3.801 1.00 0.00 N ATOM 1853 CD2 HIS A 123 11.822 -7.977 -5.542 1.00 0.00 C ATOM 1854 CE1 HIS A 123 13.187 -6.690 -4.418 1.00 0.00 C ATOM 1855 NE2 HIS A 123 13.064 -7.515 -5.498 1.00 0.00 N ATOM 0 H HIS A 123 9.067 -8.277 -1.750 1.00 0.00 H new ATOM 0 HA HIS A 123 8.431 -9.328 -4.213 1.00 0.00 H new ATOM 0 HB2 HIS A 123 9.038 -7.328 -4.880 1.00 0.00 H new ATOM 0 HB3 HIS A 123 9.484 -6.980 -3.222 1.00 0.00 H new ATOM 0 HD1 HIS A 123 11.806 -6.109 -2.960 1.00 0.00 H new ATOM 0 HD2 HIS A 123 11.426 -8.654 -6.285 1.00 0.00 H new ATOM 0 HE1 HIS A 123 14.082 -6.165 -4.119 1.00 0.00 H new ATOM 1864 N LYS A 124 11.192 -10.503 -3.086 1.00 0.00 N ATOM 1865 CA LYS A 124 12.257 -11.461 -3.327 1.00 0.00 C ATOM 1866 C LYS A 124 11.758 -12.868 -2.990 1.00 0.00 C ATOM 1867 O LYS A 124 12.547 -13.739 -2.626 1.00 0.00 O ATOM 1868 CB LYS A 124 13.521 -11.058 -2.564 1.00 0.00 C ATOM 1869 CG LYS A 124 13.785 -9.557 -2.693 1.00 0.00 C ATOM 1870 CD LYS A 124 14.874 -9.104 -1.717 1.00 0.00 C ATOM 1871 CE LYS A 124 14.434 -9.320 -0.268 1.00 0.00 C ATOM 1872 NZ LYS A 124 15.251 -10.378 0.368 1.00 0.00 N ATOM 0 H LYS A 124 11.102 -10.199 -2.117 1.00 0.00 H new ATOM 0 HA LYS A 124 12.535 -11.465 -4.381 1.00 0.00 H new ATOM 0 HB2 LYS A 124 13.415 -11.323 -1.512 1.00 0.00 H new ATOM 0 HB3 LYS A 124 14.375 -11.615 -2.948 1.00 0.00 H new ATOM 0 HG2 LYS A 124 14.087 -9.324 -3.714 1.00 0.00 H new ATOM 0 HG3 LYS A 124 12.866 -9.005 -2.499 1.00 0.00 H new ATOM 0 HD2 LYS A 124 15.793 -9.658 -1.909 1.00 0.00 H new ATOM 0 HD3 LYS A 124 15.098 -8.050 -1.880 1.00 0.00 H new ATOM 0 HE2 LYS A 124 14.533 -8.390 0.291 1.00 0.00 H new ATOM 0 HE3 LYS A 124 13.381 -9.599 -0.239 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 14.790 -10.692 1.246 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 15.342 -11.184 -0.282 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 16.195 -10.002 0.588 1.00 0.00 H new ATOM 1886 N LEU A 125 10.453 -13.045 -3.123 1.00 0.00 N ATOM 1887 CA LEU A 125 9.839 -14.331 -2.837 1.00 0.00 C ATOM 1888 C LEU A 125 10.680 -15.443 -3.468 1.00 0.00 C ATOM 1889 O LEU A 125 11.653 -15.903 -2.873 1.00 0.00 O ATOM 1890 CB LEU A 125 8.376 -14.337 -3.284 1.00 0.00 C ATOM 1891 CG LEU A 125 7.993 -13.300 -4.343 1.00 0.00 C ATOM 1892 CD1 LEU A 125 9.051 -13.226 -5.444 1.00 0.00 C ATOM 1893 CD2 LEU A 125 6.598 -13.582 -4.905 1.00 0.00 C ATOM 0 H LEU A 125 9.803 -12.320 -3.425 1.00 0.00 H new ATOM 0 HA LEU A 125 9.820 -14.515 -1.763 1.00 0.00 H new ATOM 0 HB2 LEU A 125 8.140 -15.328 -3.672 1.00 0.00 H new ATOM 0 HB3 LEU A 125 7.748 -14.180 -2.407 1.00 0.00 H new ATOM 0 HG LEU A 125 7.956 -12.320 -3.866 1.00 0.00 H new ATOM 0 HD11 LEU A 125 8.755 -12.482 -6.184 1.00 0.00 H new ATOM 0 HD12 LEU A 125 10.010 -12.944 -5.009 1.00 0.00 H new ATOM 0 HD13 LEU A 125 9.144 -14.199 -5.926 1.00 0.00 H new ATOM 0 HD21 LEU A 125 6.349 -12.831 -5.655 1.00 0.00 H new ATOM 0 HD22 LEU A 125 6.583 -14.571 -5.363 1.00 0.00 H new ATOM 0 HD23 LEU A 125 5.866 -13.545 -4.098 1.00 0.00 H new ATOM 1905 N ASN A 126 10.272 -15.843 -4.663 1.00 0.00 N ATOM 1906 CA ASN A 126 10.975 -16.893 -5.381 1.00 0.00 C ATOM 1907 C ASN A 126 11.772 -16.273 -6.531 1.00 0.00 C ATOM 1908 O ASN A 126 12.492 -16.973 -7.241 1.00 0.00 O ATOM 1909 CB ASN A 126 9.995 -17.906 -5.976 1.00 0.00 C ATOM 1910 CG ASN A 126 10.685 -18.792 -7.015 1.00 0.00 C ATOM 1911 OD1 ASN A 126 11.201 -19.857 -6.715 1.00 0.00 O ATOM 1912 ND2 ASN A 126 10.667 -18.296 -8.249 1.00 0.00 N ATOM 0 H ASN A 126 9.464 -15.459 -5.152 1.00 0.00 H new ATOM 0 HA ASN A 126 11.633 -17.401 -4.676 1.00 0.00 H new ATOM 0 HB2 ASN A 126 9.581 -18.527 -5.181 1.00 0.00 H new ATOM 0 HB3 ASN A 126 9.159 -17.381 -6.438 1.00 0.00 H new ATOM 0 HD21 ASN A 126 11.102 -18.813 -9.013 1.00 0.00 H new ATOM 0 HD22 ASN A 126 10.218 -17.399 -8.431 1.00 0.00 H new ATOM 1919 N TRP A 127 11.615 -14.966 -6.680 1.00 0.00 N ATOM 1920 CA TRP A 127 12.310 -14.244 -7.731 1.00 0.00 C ATOM 1921 C TRP A 127 13.666 -13.797 -7.182 1.00 0.00 C ATOM 1922 O TRP A 127 13.824 -13.627 -5.973 1.00 0.00 O ATOM 1923 CB TRP A 127 11.463 -13.081 -8.252 1.00 0.00 C ATOM 1924 CG TRP A 127 9.960 -13.369 -8.274 1.00 0.00 C ATOM 1925 CD1 TRP A 127 9.348 -14.552 -8.412 1.00 0.00 C ATOM 1926 CD2 TRP A 127 8.898 -12.399 -8.151 1.00 0.00 C ATOM 1927 NE1 TRP A 127 7.975 -14.419 -8.386 1.00 0.00 N ATOM 1928 CE2 TRP A 127 7.692 -13.068 -8.221 1.00 0.00 C ATOM 1929 CE3 TRP A 127 8.954 -11.004 -7.984 1.00 0.00 C ATOM 1930 CZ2 TRP A 127 6.452 -12.423 -8.134 1.00 0.00 C ATOM 1931 CZ3 TRP A 127 7.705 -10.375 -7.899 1.00 0.00 C ATOM 1932 CH2 TRP A 127 6.483 -11.034 -7.969 1.00 0.00 C ATOM 0 H TRP A 127 11.016 -14.388 -6.090 1.00 0.00 H new ATOM 0 HA TRP A 127 12.479 -14.889 -8.593 1.00 0.00 H new ATOM 0 HB2 TRP A 127 11.646 -12.204 -7.631 1.00 0.00 H new ATOM 0 HB3 TRP A 127 11.790 -12.830 -9.261 1.00 0.00 H new ATOM 0 HD1 TRP A 127 9.865 -15.493 -8.529 1.00 0.00 H new ATOM 0 HE1 TRP A 127 7.293 -15.173 -8.472 1.00 0.00 H new ATOM 0 HE3 TRP A 127 9.886 -10.461 -7.926 1.00 0.00 H new ATOM 0 HZ2 TRP A 127 5.522 -12.969 -8.191 1.00 0.00 H new ATOM 0 HZ3 TRP A 127 7.691 -9.303 -7.770 1.00 0.00 H new ATOM 0 HH2 TRP A 127 5.561 -10.476 -7.896 1.00 0.00 H new ATOM 1943 N VAL A 128 14.609 -13.618 -8.094 1.00 0.00 N ATOM 1944 CA VAL A 128 15.946 -13.193 -7.716 1.00 0.00 C ATOM 1945 C VAL A 128 16.071 -11.681 -7.914 1.00 0.00 C ATOM 1946 O VAL A 128 15.944 -11.185 -9.032 1.00 0.00 O ATOM 1947 CB VAL A 128 16.991 -13.987 -8.502 1.00 0.00 C ATOM 1948 CG1 VAL A 128 17.067 -13.507 -9.953 1.00 0.00 C ATOM 1949 CG2 VAL A 128 18.360 -13.911 -7.827 1.00 0.00 C ATOM 0 H VAL A 128 14.474 -13.760 -9.095 1.00 0.00 H new ATOM 0 HA VAL A 128 16.127 -13.399 -6.661 1.00 0.00 H new ATOM 0 HB VAL A 128 16.680 -15.032 -8.511 1.00 0.00 H new ATOM 0 HG11 VAL A 128 17.817 -14.088 -10.490 1.00 0.00 H new ATOM 0 HG12 VAL A 128 16.096 -13.638 -10.431 1.00 0.00 H new ATOM 0 HG13 VAL A 128 17.342 -12.452 -9.973 1.00 0.00 H new ATOM 0 HG21 VAL A 128 19.084 -14.484 -8.407 1.00 0.00 H new ATOM 0 HG22 VAL A 128 18.681 -12.871 -7.772 1.00 0.00 H new ATOM 0 HG23 VAL A 128 18.293 -14.324 -6.820 1.00 0.00 H new ATOM 1959 N PRO A 129 16.328 -10.972 -6.781 1.00 0.00 N ATOM 1960 CA PRO A 129 16.471 -9.527 -6.820 1.00 0.00 C ATOM 1961 C PRO A 129 17.822 -9.127 -7.419 1.00 0.00 C ATOM 1962 O PRO A 129 18.555 -8.333 -6.828 1.00 0.00 O ATOM 1963 CB PRO A 129 16.303 -9.076 -5.378 1.00 0.00 C ATOM 1964 CG PRO A 129 16.534 -10.312 -4.525 1.00 0.00 C ATOM 1965 CD PRO A 129 16.486 -11.526 -5.441 1.00 0.00 C ATOM 0 HA PRO A 129 15.732 -9.047 -7.461 1.00 0.00 H new ATOM 0 HB2 PRO A 129 17.017 -8.291 -5.129 1.00 0.00 H new ATOM 0 HB3 PRO A 129 15.307 -8.666 -5.210 1.00 0.00 H new ATOM 0 HG2 PRO A 129 17.498 -10.253 -4.020 1.00 0.00 H new ATOM 0 HG3 PRO A 129 15.772 -10.389 -3.749 1.00 0.00 H new ATOM 0 HD2 PRO A 129 17.398 -12.118 -5.362 1.00 0.00 H new ATOM 0 HD3 PRO A 129 15.656 -12.184 -5.184 1.00 0.00 H new ATOM 1973 N ASN A 130 18.110 -9.693 -8.581 1.00 0.00 N ATOM 1974 CA ASN A 130 19.359 -9.405 -9.264 1.00 0.00 C ATOM 1975 C ASN A 130 19.643 -7.903 -9.188 1.00 0.00 C ATOM 1976 O ASN A 130 20.799 -7.483 -9.234 1.00 0.00 O ATOM 1977 CB ASN A 130 19.281 -9.796 -10.741 1.00 0.00 C ATOM 1978 CG ASN A 130 20.680 -9.960 -11.340 1.00 0.00 C ATOM 1979 OD1 ASN A 130 21.512 -10.702 -10.844 1.00 0.00 O ATOM 1980 ND2 ASN A 130 20.892 -9.227 -12.430 1.00 0.00 N ATOM 0 H ASN A 130 17.500 -10.350 -9.067 1.00 0.00 H new ATOM 0 HA ASN A 130 20.149 -9.979 -8.779 1.00 0.00 H new ATOM 0 HB2 ASN A 130 18.725 -10.728 -10.845 1.00 0.00 H new ATOM 0 HB3 ASN A 130 18.732 -9.034 -11.294 1.00 0.00 H new ATOM 0 HD21 ASN A 130 21.795 -9.266 -12.903 1.00 0.00 H new ATOM 0 HD22 ASN A 130 20.152 -8.626 -12.793 1.00 0.00 H new ATOM 1987 N MET A 131 18.569 -7.135 -9.070 1.00 0.00 N ATOM 1988 CA MET A 131 18.690 -5.690 -8.985 1.00 0.00 C ATOM 1989 C MET A 131 18.750 -5.229 -7.528 1.00 0.00 C ATOM 1990 O MET A 131 17.726 -5.156 -6.852 1.00 0.00 O ATOM 1991 CB MET A 131 17.491 -5.037 -9.679 1.00 0.00 C ATOM 1992 CG MET A 131 17.632 -3.514 -9.697 1.00 0.00 C ATOM 1993 SD MET A 131 17.098 -2.870 -11.275 1.00 0.00 S ATOM 1994 CE MET A 131 15.331 -2.862 -11.023 1.00 0.00 C ATOM 0 H MET A 131 17.612 -7.486 -9.031 1.00 0.00 H new ATOM 0 HA MET A 131 19.615 -5.391 -9.478 1.00 0.00 H new ATOM 0 HB2 MET A 131 17.409 -5.410 -10.700 1.00 0.00 H new ATOM 0 HB3 MET A 131 16.572 -5.315 -9.163 1.00 0.00 H new ATOM 0 HG2 MET A 131 17.037 -3.076 -8.896 1.00 0.00 H new ATOM 0 HG3 MET A 131 18.669 -3.234 -9.513 1.00 0.00 H new ATOM 0 HE1 MET A 131 14.837 -2.485 -11.919 1.00 0.00 H new ATOM 0 HE2 MET A 131 14.988 -3.876 -10.819 1.00 0.00 H new ATOM 0 HE3 MET A 131 15.087 -2.220 -10.177 1.00 0.00 H new ATOM 2004 N ASP A 132 19.964 -4.929 -7.086 1.00 0.00 N ATOM 2005 CA ASP A 132 20.171 -4.475 -5.721 1.00 0.00 C ATOM 2006 C ASP A 132 20.975 -3.175 -5.738 1.00 0.00 C ATOM 2007 O ASP A 132 22.051 -3.112 -6.332 1.00 0.00 O ATOM 2008 CB ASP A 132 20.959 -5.508 -4.913 1.00 0.00 C ATOM 2009 CG ASP A 132 22.443 -5.618 -5.274 1.00 0.00 C ATOM 2010 OD1 ASP A 132 22.721 -6.111 -6.388 1.00 0.00 O ATOM 2011 OD2 ASP A 132 23.265 -5.206 -4.427 1.00 0.00 O ATOM 0 H ASP A 132 20.813 -4.992 -7.649 1.00 0.00 H new ATOM 0 HA ASP A 132 19.194 -4.326 -5.262 1.00 0.00 H new ATOM 0 HB2 ASP A 132 20.876 -5.260 -3.855 1.00 0.00 H new ATOM 0 HB3 ASP A 132 20.494 -6.485 -5.049 1.00 0.00 H new ATOM 2016 N LEU A 133 20.424 -2.166 -5.078 1.00 0.00 N ATOM 2017 CA LEU A 133 21.076 -0.870 -5.008 1.00 0.00 C ATOM 2018 C LEU A 133 22.593 -1.066 -5.024 1.00 0.00 C ATOM 2019 O LEU A 133 23.146 -1.737 -4.150 1.00 0.00 O ATOM 2020 CB LEU A 133 20.571 -0.080 -3.800 1.00 0.00 C ATOM 2021 CG LEU A 133 21.060 -0.559 -2.433 1.00 0.00 C ATOM 2022 CD1 LEU A 133 20.887 -2.072 -2.288 1.00 0.00 C ATOM 2023 CD2 LEU A 133 22.503 -0.119 -2.181 1.00 0.00 C ATOM 0 H LEU A 133 19.532 -2.221 -4.586 1.00 0.00 H new ATOM 0 HA LEU A 133 20.822 -0.269 -5.881 1.00 0.00 H new ATOM 0 HB2 LEU A 133 20.865 0.962 -3.924 1.00 0.00 H new ATOM 0 HB3 LEU A 133 19.481 -0.106 -3.804 1.00 0.00 H new ATOM 0 HG LEU A 133 20.443 -0.090 -1.666 1.00 0.00 H new ATOM 0 HD11 LEU A 133 21.243 -2.386 -1.307 1.00 0.00 H new ATOM 0 HD12 LEU A 133 19.833 -2.329 -2.392 1.00 0.00 H new ATOM 0 HD13 LEU A 133 21.462 -2.580 -3.062 1.00 0.00 H new ATOM 0 HD21 LEU A 133 22.826 -0.473 -1.202 1.00 0.00 H new ATOM 0 HD22 LEU A 133 23.151 -0.539 -2.950 1.00 0.00 H new ATOM 0 HD23 LEU A 133 22.562 0.969 -2.211 1.00 0.00 H new ATOM 2035 N VAL A 134 23.226 -0.471 -6.023 1.00 0.00 N ATOM 2036 CA VAL A 134 24.668 -0.571 -6.162 1.00 0.00 C ATOM 2037 C VAL A 134 25.291 0.817 -5.997 1.00 0.00 C ATOM 2038 O VAL A 134 26.486 0.997 -6.229 1.00 0.00 O ATOM 2039 CB VAL A 134 25.021 -1.228 -7.499 1.00 0.00 C ATOM 2040 CG1 VAL A 134 25.027 -2.753 -7.376 1.00 0.00 C ATOM 2041 CG2 VAL A 134 24.065 -0.772 -8.603 1.00 0.00 C ATOM 0 H VAL A 134 22.766 0.083 -6.745 1.00 0.00 H new ATOM 0 HA VAL A 134 25.082 -1.209 -5.381 1.00 0.00 H new ATOM 0 HB VAL A 134 26.027 -0.910 -7.773 1.00 0.00 H new ATOM 0 HG11 VAL A 134 25.281 -3.195 -8.340 1.00 0.00 H new ATOM 0 HG12 VAL A 134 25.765 -3.055 -6.633 1.00 0.00 H new ATOM 0 HG13 VAL A 134 24.040 -3.097 -7.068 1.00 0.00 H new ATOM 0 HG21 VAL A 134 24.338 -1.253 -9.542 1.00 0.00 H new ATOM 0 HG22 VAL A 134 23.044 -1.047 -8.337 1.00 0.00 H new ATOM 0 HG23 VAL A 134 24.131 0.310 -8.717 1.00 0.00 H new ATOM 2051 N ILE A 135 24.453 1.763 -5.596 1.00 0.00 N ATOM 2052 CA ILE A 135 24.906 3.128 -5.396 1.00 0.00 C ATOM 2053 C ILE A 135 25.211 3.348 -3.914 1.00 0.00 C ATOM 2054 O ILE A 135 25.804 4.360 -3.541 1.00 0.00 O ATOM 2055 CB ILE A 135 23.890 4.119 -5.968 1.00 0.00 C ATOM 2056 CG1 ILE A 135 22.460 3.613 -5.772 1.00 0.00 C ATOM 2057 CG2 ILE A 135 24.192 4.427 -7.435 1.00 0.00 C ATOM 2058 CD1 ILE A 135 22.054 2.664 -6.901 1.00 0.00 C ATOM 0 H ILE A 135 23.463 1.610 -5.404 1.00 0.00 H new ATOM 0 HA ILE A 135 25.832 3.305 -5.942 1.00 0.00 H new ATOM 0 HB ILE A 135 23.979 5.055 -5.417 1.00 0.00 H new ATOM 0 HG12 ILE A 135 22.381 3.099 -4.814 1.00 0.00 H new ATOM 0 HG13 ILE A 135 21.773 4.458 -5.738 1.00 0.00 H new ATOM 0 HG21 ILE A 135 23.455 5.134 -7.818 1.00 0.00 H new ATOM 0 HG22 ILE A 135 25.188 4.861 -7.518 1.00 0.00 H new ATOM 0 HG23 ILE A 135 24.148 3.506 -8.017 1.00 0.00 H new ATOM 0 HD11 ILE A 135 21.033 2.319 -6.737 1.00 0.00 H new ATOM 0 HD12 ILE A 135 22.111 3.188 -7.855 1.00 0.00 H new ATOM 0 HD13 ILE A 135 22.728 1.808 -6.917 1.00 0.00 H new ATOM 2070 N GLY A 136 24.791 2.384 -3.106 1.00 0.00 N ATOM 2071 CA GLY A 136 25.014 2.459 -1.673 1.00 0.00 C ATOM 2072 C GLY A 136 23.913 3.277 -0.991 1.00 0.00 C ATOM 2073 O GLY A 136 24.164 3.951 0.007 1.00 0.00 O ATOM 0 H GLY A 136 24.298 1.547 -3.418 1.00 0.00 H new ATOM 0 HA2 GLY A 136 25.040 1.454 -1.252 1.00 0.00 H new ATOM 0 HA3 GLY A 136 25.985 2.913 -1.475 1.00 0.00 H new ATOM 2077 N GLU A 137 22.718 3.189 -1.556 1.00 0.00 N ATOM 2078 CA GLU A 137 21.579 3.911 -1.016 1.00 0.00 C ATOM 2079 C GLU A 137 20.661 2.956 -0.250 1.00 0.00 C ATOM 2080 O GLU A 137 20.353 1.867 -0.730 1.00 0.00 O ATOM 2081 CB GLU A 137 20.814 4.638 -2.124 1.00 0.00 C ATOM 2082 CG GLU A 137 20.107 5.879 -1.577 1.00 0.00 C ATOM 2083 CD GLU A 137 18.658 5.562 -1.198 1.00 0.00 C ATOM 2084 OE1 GLU A 137 18.005 4.855 -1.994 1.00 0.00 O ATOM 2085 OE2 GLU A 137 18.238 6.037 -0.120 1.00 0.00 O ATOM 0 H GLU A 137 22.514 2.628 -2.383 1.00 0.00 H new ATOM 0 HA GLU A 137 21.948 4.665 -0.321 1.00 0.00 H new ATOM 0 HB2 GLU A 137 21.503 4.927 -2.917 1.00 0.00 H new ATOM 0 HB3 GLU A 137 20.082 3.964 -2.568 1.00 0.00 H new ATOM 0 HG2 GLU A 137 20.642 6.251 -0.703 1.00 0.00 H new ATOM 0 HG3 GLU A 137 20.126 6.672 -2.325 1.00 0.00 H new ATOM 2092 N VAL A 138 20.248 3.401 0.927 1.00 0.00 N ATOM 2093 CA VAL A 138 19.370 2.600 1.765 1.00 0.00 C ATOM 2094 C VAL A 138 18.010 2.456 1.078 1.00 0.00 C ATOM 2095 O VAL A 138 17.263 3.427 0.965 1.00 0.00 O ATOM 2096 CB VAL A 138 19.273 3.215 3.162 1.00 0.00 C ATOM 2097 CG1 VAL A 138 20.663 3.426 3.767 1.00 0.00 C ATOM 2098 CG2 VAL A 138 18.486 4.529 3.128 1.00 0.00 C ATOM 0 H VAL A 138 20.505 4.306 1.321 1.00 0.00 H new ATOM 0 HA VAL A 138 19.777 1.597 1.895 1.00 0.00 H new ATOM 0 HB VAL A 138 18.733 2.515 3.799 1.00 0.00 H new ATOM 0 HG11 VAL A 138 20.565 3.864 4.760 1.00 0.00 H new ATOM 0 HG12 VAL A 138 21.176 2.467 3.843 1.00 0.00 H new ATOM 0 HG13 VAL A 138 21.239 4.097 3.130 1.00 0.00 H new ATOM 0 HG21 VAL A 138 18.431 4.946 4.133 1.00 0.00 H new ATOM 0 HG22 VAL A 138 18.988 5.237 2.468 1.00 0.00 H new ATOM 0 HG23 VAL A 138 17.478 4.340 2.758 1.00 0.00 H new ATOM 2108 N LEU A 139 17.731 1.238 0.638 1.00 0.00 N ATOM 2109 CA LEU A 139 16.475 0.955 -0.034 1.00 0.00 C ATOM 2110 C LEU A 139 16.396 -0.541 -0.350 1.00 0.00 C ATOM 2111 O LEU A 139 15.682 -1.284 0.323 1.00 0.00 O ATOM 2112 CB LEU A 139 16.309 1.852 -1.261 1.00 0.00 C ATOM 2113 CG LEU A 139 15.306 1.373 -2.312 1.00 0.00 C ATOM 2114 CD1 LEU A 139 13.919 1.176 -1.697 1.00 0.00 C ATOM 2115 CD2 LEU A 139 15.272 2.323 -3.511 1.00 0.00 C ATOM 0 H LEU A 139 18.354 0.436 0.734 1.00 0.00 H new ATOM 0 HA LEU A 139 15.634 1.189 0.618 1.00 0.00 H new ATOM 0 HB2 LEU A 139 16.006 2.843 -0.923 1.00 0.00 H new ATOM 0 HB3 LEU A 139 17.282 1.962 -1.740 1.00 0.00 H new ATOM 0 HG LEU A 139 15.635 0.402 -2.680 1.00 0.00 H new ATOM 0 HD11 LEU A 139 13.225 0.835 -2.466 1.00 0.00 H new ATOM 0 HD12 LEU A 139 13.975 0.431 -0.903 1.00 0.00 H new ATOM 0 HD13 LEU A 139 13.567 2.121 -1.283 1.00 0.00 H new ATOM 0 HD21 LEU A 139 14.551 1.959 -4.243 1.00 0.00 H new ATOM 0 HD22 LEU A 139 14.980 3.319 -3.178 1.00 0.00 H new ATOM 0 HD23 LEU A 139 16.261 2.369 -3.967 1.00 0.00 H new ATOM 2127 N ALA A 140 17.140 -0.937 -1.372 1.00 0.00 N ATOM 2128 CA ALA A 140 17.162 -2.329 -1.786 1.00 0.00 C ATOM 2129 C ALA A 140 18.063 -3.122 -0.837 1.00 0.00 C ATOM 2130 O ALA A 140 18.835 -2.541 -0.077 1.00 0.00 O ATOM 2131 CB ALA A 140 17.622 -2.422 -3.242 1.00 0.00 C ATOM 0 H ALA A 140 17.732 -0.318 -1.926 1.00 0.00 H new ATOM 0 HA ALA A 140 16.163 -2.762 -1.733 1.00 0.00 H new ATOM 0 HB1 ALA A 140 17.638 -3.467 -3.552 1.00 0.00 H new ATOM 0 HB2 ALA A 140 16.933 -1.865 -3.877 1.00 0.00 H new ATOM 0 HB3 ALA A 140 18.623 -2.000 -3.335 1.00 0.00 H new ATOM 2137 N GLU A 141 17.935 -4.440 -0.915 1.00 0.00 N ATOM 2138 CA GLU A 141 18.728 -5.319 -0.073 1.00 0.00 C ATOM 2139 C GLU A 141 20.184 -5.333 -0.543 1.00 0.00 C ATOM 2140 O GLU A 141 20.566 -6.163 -1.368 1.00 0.00 O ATOM 2141 CB GLU A 141 18.145 -6.732 -0.053 1.00 0.00 C ATOM 2142 CG GLU A 141 18.296 -7.369 1.331 1.00 0.00 C ATOM 2143 CD GLU A 141 19.036 -8.705 1.242 1.00 0.00 C ATOM 2144 OE1 GLU A 141 20.265 -8.658 1.021 1.00 0.00 O ATOM 2145 OE2 GLU A 141 18.355 -9.742 1.397 1.00 0.00 O ATOM 0 H GLU A 141 17.294 -4.919 -1.548 1.00 0.00 H new ATOM 0 HA GLU A 141 18.700 -4.936 0.947 1.00 0.00 H new ATOM 0 HB2 GLU A 141 17.091 -6.698 -0.328 1.00 0.00 H new ATOM 0 HB3 GLU A 141 18.649 -7.348 -0.798 1.00 0.00 H new ATOM 0 HG2 GLU A 141 18.839 -6.692 1.990 1.00 0.00 H new ATOM 0 HG3 GLU A 141 17.312 -7.523 1.774 1.00 0.00 H new ATOM 2152 N VAL A 142 20.958 -4.406 0.001 1.00 0.00 N ATOM 2153 CA VAL A 142 22.364 -4.302 -0.353 1.00 0.00 C ATOM 2154 C VAL A 142 23.038 -5.660 -0.152 1.00 0.00 C ATOM 2155 O VAL A 142 23.970 -6.009 -0.875 1.00 0.00 O ATOM 2156 CB VAL A 142 23.024 -3.182 0.452 1.00 0.00 C ATOM 2157 CG1 VAL A 142 23.222 -3.597 1.911 1.00 0.00 C ATOM 2158 CG2 VAL A 142 24.352 -2.760 -0.182 1.00 0.00 C ATOM 0 H VAL A 142 20.639 -3.720 0.685 1.00 0.00 H new ATOM 0 HA VAL A 142 22.475 -4.037 -1.405 1.00 0.00 H new ATOM 0 HB VAL A 142 22.356 -2.321 0.436 1.00 0.00 H new ATOM 0 HG11 VAL A 142 23.693 -2.782 2.460 1.00 0.00 H new ATOM 0 HG12 VAL A 142 22.255 -3.825 2.359 1.00 0.00 H new ATOM 0 HG13 VAL A 142 23.859 -4.480 1.955 1.00 0.00 H new ATOM 0 HG21 VAL A 142 24.801 -1.962 0.410 1.00 0.00 H new ATOM 0 HG22 VAL A 142 25.029 -3.614 -0.212 1.00 0.00 H new ATOM 0 HG23 VAL A 142 24.174 -2.403 -1.196 1.00 0.00 H new TER 2168 VAL A 142