USER MOD reduce.3.24.130724 H: found=0, std=0, add=1112, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1112 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 9 MET CE :methyl 168:sc= -0.317 (180deg=-0.615) USER MOD Set 1.2: A 12 MET CE :methyl -174:sc= -1.19 (180deg=-1.22) USER MOD Set 1.3: A 118 CYS SG : rot -150:sc= -2.52! USER MOD Set 2.1: A 15 HIS : no HD1:sc= -0.0152 K(o=-0.17,f=-3.1) USER MOD Set 2.2: A 25 CYS SG : rot 135:sc= 0.163 USER MOD Set 2.3: A 47 ASN : amide:sc= -0.316 K(o=-0.17,f=-2!) USER MOD Set 3.1: A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 1 MET N :NH3+ -146:sc= 1.28 (180deg=0.792) USER MOD Single : A 5 THR OG1 : rot 180:sc= -3.42! USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ -154:sc=-0.00623 (180deg=-0.894) USER MOD Single : A 8 GLN : amide:sc= -0.305 K(o=-0.3,f=-7.7!) USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 22 ASN : amide:sc= 0 K(o=0,f=-0.84) USER MOD Single : A 43 TYR OH : rot 165:sc= -0.289 USER MOD Single : A 46 ASN : amide:sc= 0 K(o=0,f=-0.58) USER MOD Single : A 50 GLN : amide:sc= -0.322 X(o=-0.32,f=-0.4) USER MOD Single : A 51 SER OG : rot 104:sc= 1.18 USER MOD Single : A 54 HIS : no HD1:sc= 0.572 K(o=0.57,f=-6.6!) USER MOD Single : A 56 SER OG : rot -13:sc= 0.887 USER MOD Single : A 57 MET CE :methyl 145:sc= -0.151 (180deg=-0.846) USER MOD Single : A 62 GLN : amide:sc=-0.000897 K(o=-0.0009,f=-0.8) USER MOD Single : A 64 THR OG1 : rot 76:sc= 0.667 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 MET CE :methyl -131:sc= -1.91! (180deg=-4.15) USER MOD Single : A 71 LYS NZ :NH3+ -134:sc= -0.088 (180deg=-0.565) USER MOD Single : A 72 ASN : amide:sc= -1.38! K(o=-1.4!,f=1.1) USER MOD Single : A 76 MET CE :methyl -130:sc= -0.013 (180deg=-0.325) USER MOD Single : A 79 ASN : amide:sc= 0.0334 X(o=0.033,f=0.083) USER MOD Single : A 81 HIS : no HD1:sc= 0.506 K(o=0.51,f=-3.4!) USER MOD Single : A 82 SER OG : rot 24:sc= 0.524 USER MOD Single : A 83 HIS : no HD1:sc= -0.386 K(o=-0.39,f=-1.9) USER MOD Single : A 86 THR OG1 : rot 176:sc= -1.9! USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 95 LYS NZ :NH3+ -139:sc= 0 (180deg=-0.88) USER MOD Single : A 102 SER OG : rot 180:sc= -0.0566 USER MOD Single : A 104 SER OG : rot 90:sc= -0.043 USER MOD Single : A 105 TYR OH : rot 46:sc= 0.367! USER MOD Single : A 109 SER OG : rot 72:sc= 1.19 USER MOD Single : A 114 GLN : amide:sc= 0 X(o=0,f=-0.43) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 LYS NZ :NH3+ 142:sc= 0.0695 (180deg=-0.0491) USER MOD Single : A 120 SER OG : rot -170:sc= -0.232 USER MOD Single : A 124 LYS NZ :NH3+ -113:sc= 0.954 (180deg=-0.0395) USER MOD Single : A 125 LYS NZ :NH3+ -165:sc= -0.0473 (180deg=-0.284) USER MOD Single : A 136 LYS NZ :NH3+ -139:sc= 0.396 (180deg=-0.0604) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -14.127 -3.332 4.220 1.00 0.00 N ATOM 2 CA MET A 1 -13.235 -3.430 3.042 1.00 0.00 C ATOM 3 C MET A 1 -12.292 -2.234 2.984 1.00 0.00 C ATOM 4 O MET A 1 -12.449 -1.271 3.738 1.00 0.00 O ATOM 5 CB MET A 1 -14.056 -3.493 1.746 1.00 0.00 C ATOM 6 CG MET A 1 -14.683 -2.167 1.337 1.00 0.00 C ATOM 7 SD MET A 1 -15.913 -1.568 2.511 1.00 0.00 S ATOM 8 CE MET A 1 -16.321 0.021 1.787 1.00 0.00 C ATOM 0 H1 MET A 1 -14.323 -4.285 4.588 1.00 0.00 H new ATOM 0 H2 MET A 1 -13.665 -2.764 4.959 1.00 0.00 H new ATOM 0 H3 MET A 1 -15.020 -2.878 3.942 1.00 0.00 H new ATOM 0 HA MET A 1 -12.650 -4.344 3.140 1.00 0.00 H new ATOM 0 HB2 MET A 1 -13.412 -3.842 0.938 1.00 0.00 H new ATOM 0 HB3 MET A 1 -14.847 -4.234 1.866 1.00 0.00 H new ATOM 0 HG2 MET A 1 -13.897 -1.419 1.231 1.00 0.00 H new ATOM 0 HG3 MET A 1 -15.150 -2.280 0.358 1.00 0.00 H new ATOM 0 HE1 MET A 1 -17.073 0.518 2.400 1.00 0.00 H new ATOM 0 HE2 MET A 1 -15.425 0.640 1.739 1.00 0.00 H new ATOM 0 HE3 MET A 1 -16.713 -0.128 0.781 1.00 0.00 H new ATOM 20 N ILE A 2 -11.316 -2.302 2.088 1.00 0.00 N ATOM 21 CA ILE A 2 -10.442 -1.174 1.820 1.00 0.00 C ATOM 22 C ILE A 2 -10.695 -0.665 0.403 1.00 0.00 C ATOM 23 O ILE A 2 -10.791 -1.453 -0.545 1.00 0.00 O ATOM 24 CB ILE A 2 -8.948 -1.541 2.015 1.00 0.00 C ATOM 25 CG1 ILE A 2 -8.050 -0.346 1.674 1.00 0.00 C ATOM 26 CG2 ILE A 2 -8.574 -2.761 1.183 1.00 0.00 C ATOM 27 CD1 ILE A 2 -6.574 -0.609 1.888 1.00 0.00 C ATOM 0 H ILE A 2 -11.111 -3.133 1.533 1.00 0.00 H new ATOM 0 HA ILE A 2 -10.669 -0.385 2.537 1.00 0.00 H new ATOM 0 HB ILE A 2 -8.793 -1.793 3.064 1.00 0.00 H new ATOM 0 HG12 ILE A 2 -8.212 -0.067 0.633 1.00 0.00 H new ATOM 0 HG13 ILE A 2 -8.349 0.507 2.283 1.00 0.00 H new ATOM 0 HG21 ILE A 2 -7.521 -2.998 1.337 1.00 0.00 H new ATOM 0 HG22 ILE A 2 -9.185 -3.610 1.487 1.00 0.00 H new ATOM 0 HG23 ILE A 2 -8.747 -2.549 0.128 1.00 0.00 H new ATOM 0 HD11 ILE A 2 -6.004 0.282 1.625 1.00 0.00 H new ATOM 0 HD12 ILE A 2 -6.397 -0.858 2.934 1.00 0.00 H new ATOM 0 HD13 ILE A 2 -6.258 -1.441 1.258 1.00 0.00 H new ATOM 39 N THR A 3 -10.832 0.644 0.265 1.00 0.00 N ATOM 40 CA THR A 3 -11.196 1.235 -1.011 1.00 0.00 C ATOM 41 C THR A 3 -10.127 2.207 -1.502 1.00 0.00 C ATOM 42 O THR A 3 -9.618 3.032 -0.740 1.00 0.00 O ATOM 43 CB THR A 3 -12.551 1.969 -0.905 1.00 0.00 C ATOM 44 OG1 THR A 3 -13.545 1.085 -0.364 1.00 0.00 O ATOM 45 CG2 THR A 3 -13.011 2.478 -2.266 1.00 0.00 C ATOM 0 H THR A 3 -10.697 1.316 1.020 1.00 0.00 H new ATOM 0 HA THR A 3 -11.281 0.422 -1.732 1.00 0.00 H new ATOM 0 HB THR A 3 -12.419 2.825 -0.243 1.00 0.00 H new ATOM 0 HG1 THR A 3 -14.401 1.557 -0.298 1.00 0.00 H new ATOM 0 HG21 THR A 3 -13.967 2.990 -2.159 1.00 0.00 H new ATOM 0 HG22 THR A 3 -12.271 3.172 -2.664 1.00 0.00 H new ATOM 0 HG23 THR A 3 -13.125 1.637 -2.950 1.00 0.00 H new ATOM 53 N LEU A 4 -9.783 2.090 -2.773 1.00 0.00 N ATOM 54 CA LEU A 4 -8.864 3.014 -3.417 1.00 0.00 C ATOM 55 C LEU A 4 -9.309 3.249 -4.848 1.00 0.00 C ATOM 56 O LEU A 4 -10.134 2.505 -5.376 1.00 0.00 O ATOM 57 CB LEU A 4 -7.415 2.502 -3.353 1.00 0.00 C ATOM 58 CG LEU A 4 -7.191 1.042 -3.766 1.00 0.00 C ATOM 59 CD1 LEU A 4 -7.134 0.898 -5.278 1.00 0.00 C ATOM 60 CD2 LEU A 4 -5.920 0.503 -3.132 1.00 0.00 C ATOM 0 H LEU A 4 -10.132 1.354 -3.387 1.00 0.00 H new ATOM 0 HA LEU A 4 -8.883 3.963 -2.882 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -6.800 3.136 -3.991 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -7.052 2.628 -2.333 1.00 0.00 H new ATOM 0 HG LEU A 4 -8.038 0.457 -3.407 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -6.974 -0.148 -5.538 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -8.074 1.240 -5.712 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -6.313 1.499 -5.670 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -5.774 -0.534 -3.434 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -5.069 1.100 -3.460 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -6.004 0.556 -2.047 1.00 0.00 H new ATOM 72 N THR A 5 -8.787 4.282 -5.473 1.00 0.00 N ATOM 73 CA THR A 5 -9.241 4.637 -6.804 1.00 0.00 C ATOM 74 C THR A 5 -8.421 3.928 -7.872 1.00 0.00 C ATOM 75 O THR A 5 -7.332 3.421 -7.599 1.00 0.00 O ATOM 76 CB THR A 5 -9.193 6.160 -7.044 1.00 0.00 C ATOM 77 OG1 THR A 5 -7.838 6.629 -7.040 1.00 0.00 O ATOM 78 CG2 THR A 5 -9.988 6.890 -5.976 1.00 0.00 C ATOM 0 H THR A 5 -8.058 4.884 -5.090 1.00 0.00 H new ATOM 0 HA THR A 5 -10.279 4.312 -6.875 1.00 0.00 H new ATOM 0 HB THR A 5 -9.635 6.363 -8.020 1.00 0.00 H new ATOM 0 HG1 THR A 5 -7.826 7.597 -7.195 1.00 0.00 H new ATOM 0 HG21 THR A 5 -9.944 7.963 -6.160 1.00 0.00 H new ATOM 0 HG22 THR A 5 -11.026 6.559 -6.005 1.00 0.00 H new ATOM 0 HG23 THR A 5 -9.565 6.672 -4.995 1.00 0.00 H new ATOM 86 N LYS A 6 -8.960 3.890 -9.085 1.00 0.00 N ATOM 87 CA LYS A 6 -8.263 3.323 -10.233 1.00 0.00 C ATOM 88 C LYS A 6 -6.917 4.003 -10.423 1.00 0.00 C ATOM 89 O LYS A 6 -5.912 3.371 -10.735 1.00 0.00 O ATOM 90 CB LYS A 6 -9.126 3.495 -11.481 1.00 0.00 C ATOM 91 CG LYS A 6 -9.486 4.938 -11.811 1.00 0.00 C ATOM 92 CD LYS A 6 -10.492 5.020 -12.948 1.00 0.00 C ATOM 93 CE LYS A 6 -9.946 4.400 -14.224 1.00 0.00 C ATOM 94 NZ LYS A 6 -10.966 4.376 -15.301 1.00 0.00 N ATOM 0 H LYS A 6 -9.890 4.250 -9.300 1.00 0.00 H new ATOM 0 HA LYS A 6 -8.087 2.261 -10.060 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -8.601 3.062 -12.332 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -10.046 2.926 -11.351 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -9.897 5.422 -10.925 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -8.583 5.485 -12.083 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -11.411 4.510 -12.659 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -10.751 6.063 -13.131 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -9.076 4.964 -14.559 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -9.608 3.384 -14.020 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -10.558 3.946 -16.156 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -11.786 3.817 -14.990 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -11.270 5.348 -15.513 1.00 0.00 H new ATOM 108 N LYS A 7 -6.934 5.304 -10.231 1.00 0.00 N ATOM 109 CA LYS A 7 -5.733 6.126 -10.271 1.00 0.00 C ATOM 110 C LYS A 7 -4.693 5.625 -9.261 1.00 0.00 C ATOM 111 O LYS A 7 -3.515 5.521 -9.585 1.00 0.00 O ATOM 112 CB LYS A 7 -6.120 7.578 -9.979 1.00 0.00 C ATOM 113 CG LYS A 7 -5.258 8.619 -10.674 1.00 0.00 C ATOM 114 CD LYS A 7 -3.876 8.726 -10.057 1.00 0.00 C ATOM 115 CE LYS A 7 -3.090 9.883 -10.655 1.00 0.00 C ATOM 116 NZ LYS A 7 -1.765 10.057 -10.002 1.00 0.00 N ATOM 0 H LYS A 7 -7.787 5.830 -10.041 1.00 0.00 H new ATOM 0 HA LYS A 7 -5.282 6.061 -11.261 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -7.158 7.729 -10.276 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -6.069 7.744 -8.903 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -5.164 8.364 -11.729 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -5.752 9.589 -10.624 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -3.966 8.864 -8.980 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -3.332 7.795 -10.215 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -2.948 9.711 -11.722 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -3.667 10.803 -10.554 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -1.460 11.047 -10.094 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -1.839 9.810 -8.994 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -1.068 9.436 -10.460 1.00 0.00 H new ATOM 130 N GLN A 8 -5.128 5.303 -8.044 1.00 0.00 N ATOM 131 CA GLN A 8 -4.220 4.773 -7.026 1.00 0.00 C ATOM 132 C GLN A 8 -3.683 3.405 -7.442 1.00 0.00 C ATOM 133 O GLN A 8 -2.538 3.061 -7.149 1.00 0.00 O ATOM 134 CB GLN A 8 -4.929 4.655 -5.677 1.00 0.00 C ATOM 135 CG GLN A 8 -5.582 5.943 -5.199 1.00 0.00 C ATOM 136 CD GLN A 8 -4.640 7.135 -5.179 1.00 0.00 C ATOM 137 OE1 GLN A 8 -3.429 6.997 -5.034 1.00 0.00 O ATOM 138 NE2 GLN A 8 -5.200 8.324 -5.299 1.00 0.00 N ATOM 0 H GLN A 8 -6.097 5.399 -7.739 1.00 0.00 H new ATOM 0 HA GLN A 8 -3.386 5.468 -6.929 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -5.691 3.879 -5.747 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -4.208 4.327 -4.928 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -6.429 6.172 -5.845 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -5.979 5.788 -4.196 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -6.210 8.402 -5.418 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -4.623 9.165 -5.273 1.00 0.00 H new ATOM 147 N MET A 9 -4.519 2.624 -8.119 1.00 0.00 N ATOM 148 CA MET A 9 -4.086 1.349 -8.680 1.00 0.00 C ATOM 149 C MET A 9 -2.997 1.592 -9.717 1.00 0.00 C ATOM 150 O MET A 9 -1.972 0.914 -9.728 1.00 0.00 O ATOM 151 CB MET A 9 -5.272 0.608 -9.311 1.00 0.00 C ATOM 152 CG MET A 9 -4.900 -0.722 -9.953 1.00 0.00 C ATOM 153 SD MET A 9 -4.253 -1.918 -8.764 1.00 0.00 S ATOM 154 CE MET A 9 -5.682 -2.157 -7.708 1.00 0.00 C ATOM 0 H MET A 9 -5.498 2.851 -8.292 1.00 0.00 H new ATOM 0 HA MET A 9 -3.685 0.727 -7.880 1.00 0.00 H new ATOM 0 HB2 MET A 9 -6.026 0.431 -8.544 1.00 0.00 H new ATOM 0 HB3 MET A 9 -5.728 1.249 -10.065 1.00 0.00 H new ATOM 0 HG2 MET A 9 -5.779 -1.142 -10.442 1.00 0.00 H new ATOM 0 HG3 MET A 9 -4.155 -0.549 -10.730 1.00 0.00 H new ATOM 0 HE1 MET A 9 -5.516 -3.017 -7.060 1.00 0.00 H new ATOM 0 HE2 MET A 9 -5.836 -1.267 -7.097 1.00 0.00 H new ATOM 0 HE3 MET A 9 -6.564 -2.332 -8.324 1.00 0.00 H new ATOM 164 N GLU A 10 -3.219 2.590 -10.564 1.00 0.00 N ATOM 165 CA GLU A 10 -2.246 3.012 -11.549 1.00 0.00 C ATOM 166 C GLU A 10 -0.949 3.469 -10.880 1.00 0.00 C ATOM 167 O GLU A 10 0.139 3.262 -11.413 1.00 0.00 O ATOM 168 CB GLU A 10 -2.851 4.144 -12.375 1.00 0.00 C ATOM 169 CG GLU A 10 -3.849 3.680 -13.422 1.00 0.00 C ATOM 170 CD GLU A 10 -3.202 2.871 -14.530 1.00 0.00 C ATOM 171 OE1 GLU A 10 -2.648 3.480 -15.473 1.00 0.00 O ATOM 172 OE2 GLU A 10 -3.256 1.628 -14.474 1.00 0.00 O ATOM 0 H GLU A 10 -4.085 3.128 -10.582 1.00 0.00 H new ATOM 0 HA GLU A 10 -1.998 2.171 -12.197 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -3.345 4.846 -11.703 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -2.047 4.688 -12.870 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -4.620 3.078 -12.941 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -4.346 4.548 -13.854 1.00 0.00 H new ATOM 179 N GLU A 11 -1.079 4.089 -9.713 1.00 0.00 N ATOM 180 CA GLU A 11 0.064 4.526 -8.931 1.00 0.00 C ATOM 181 C GLU A 11 0.891 3.336 -8.465 1.00 0.00 C ATOM 182 O GLU A 11 2.116 3.321 -8.605 1.00 0.00 O ATOM 183 CB GLU A 11 -0.436 5.332 -7.734 1.00 0.00 C ATOM 184 CG GLU A 11 -1.057 6.666 -8.111 1.00 0.00 C ATOM 185 CD GLU A 11 -0.063 7.635 -8.715 1.00 0.00 C ATOM 186 OE1 GLU A 11 0.449 7.368 -9.823 1.00 0.00 O ATOM 187 OE2 GLU A 11 0.197 8.686 -8.089 1.00 0.00 O ATOM 0 H GLU A 11 -1.980 4.301 -9.285 1.00 0.00 H new ATOM 0 HA GLU A 11 0.707 5.150 -9.552 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -1.172 4.740 -7.191 1.00 0.00 H new ATOM 0 HB3 GLU A 11 0.397 5.509 -7.053 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -1.866 6.495 -8.821 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -1.501 7.117 -7.224 1.00 0.00 H new ATOM 194 N MET A 12 0.215 2.331 -7.925 1.00 0.00 N ATOM 195 CA MET A 12 0.882 1.116 -7.475 1.00 0.00 C ATOM 196 C MET A 12 1.463 0.353 -8.659 1.00 0.00 C ATOM 197 O MET A 12 2.602 -0.106 -8.613 1.00 0.00 O ATOM 198 CB MET A 12 -0.086 0.223 -6.696 1.00 0.00 C ATOM 199 CG MET A 12 -0.539 0.820 -5.375 1.00 0.00 C ATOM 200 SD MET A 12 -1.593 -0.298 -4.431 1.00 0.00 S ATOM 201 CE MET A 12 -2.934 -0.559 -5.590 1.00 0.00 C ATOM 0 H MET A 12 -0.796 2.333 -7.788 1.00 0.00 H new ATOM 0 HA MET A 12 1.697 1.404 -6.812 1.00 0.00 H new ATOM 0 HB2 MET A 12 -0.962 0.025 -7.314 1.00 0.00 H new ATOM 0 HB3 MET A 12 0.393 -0.737 -6.505 1.00 0.00 H new ATOM 0 HG2 MET A 12 0.336 1.078 -4.779 1.00 0.00 H new ATOM 0 HG3 MET A 12 -1.079 1.747 -5.566 1.00 0.00 H new ATOM 0 HE1 MET A 12 -3.719 -1.144 -5.112 1.00 0.00 H new ATOM 0 HE2 MET A 12 -3.338 0.404 -5.902 1.00 0.00 H new ATOM 0 HE3 MET A 12 -2.562 -1.096 -6.462 1.00 0.00 H new ATOM 211 N LEU A 13 0.675 0.248 -9.723 1.00 0.00 N ATOM 212 CA LEU A 13 1.091 -0.453 -10.931 1.00 0.00 C ATOM 213 C LEU A 13 2.319 0.195 -11.557 1.00 0.00 C ATOM 214 O LEU A 13 3.230 -0.498 -12.008 1.00 0.00 O ATOM 215 CB LEU A 13 -0.062 -0.492 -11.939 1.00 0.00 C ATOM 216 CG LEU A 13 -1.203 -1.448 -11.582 1.00 0.00 C ATOM 217 CD1 LEU A 13 -2.304 -1.380 -12.628 1.00 0.00 C ATOM 218 CD2 LEU A 13 -0.681 -2.870 -11.450 1.00 0.00 C ATOM 0 H LEU A 13 -0.264 0.644 -9.773 1.00 0.00 H new ATOM 0 HA LEU A 13 1.359 -1.472 -10.653 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -0.470 0.514 -12.041 1.00 0.00 H new ATOM 0 HB3 LEU A 13 0.337 -0.774 -12.913 1.00 0.00 H new ATOM 0 HG LEU A 13 -1.622 -1.142 -10.623 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -3.106 -2.066 -12.357 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -2.697 -0.364 -12.677 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -1.900 -1.660 -13.601 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -1.504 -3.538 -11.196 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -0.238 -3.184 -12.395 1.00 0.00 H new ATOM 0 HD23 LEU A 13 0.074 -2.909 -10.664 1.00 0.00 H new ATOM 230 N ALA A 14 2.343 1.523 -11.576 1.00 0.00 N ATOM 231 CA ALA A 14 3.479 2.260 -12.117 1.00 0.00 C ATOM 232 C ALA A 14 4.744 1.968 -11.320 1.00 0.00 C ATOM 233 O ALA A 14 5.805 1.710 -11.890 1.00 0.00 O ATOM 234 CB ALA A 14 3.195 3.754 -12.120 1.00 0.00 C ATOM 0 H ALA A 14 1.588 2.111 -11.223 1.00 0.00 H new ATOM 0 HA ALA A 14 3.635 1.931 -13.145 1.00 0.00 H new ATOM 0 HB1 ALA A 14 4.054 4.287 -12.527 1.00 0.00 H new ATOM 0 HB2 ALA A 14 2.318 3.956 -12.735 1.00 0.00 H new ATOM 0 HB3 ALA A 14 3.009 4.091 -11.100 1.00 0.00 H new ATOM 240 N HIS A 15 4.624 1.991 -10.000 1.00 0.00 N ATOM 241 CA HIS A 15 5.759 1.696 -9.136 1.00 0.00 C ATOM 242 C HIS A 15 6.193 0.245 -9.307 1.00 0.00 C ATOM 243 O HIS A 15 7.383 -0.059 -9.321 1.00 0.00 O ATOM 244 CB HIS A 15 5.416 1.967 -7.669 1.00 0.00 C ATOM 245 CG HIS A 15 6.602 1.894 -6.756 1.00 0.00 C ATOM 246 ND1 HIS A 15 7.667 2.760 -6.838 1.00 0.00 N ATOM 247 CD2 HIS A 15 6.892 1.044 -5.744 1.00 0.00 C ATOM 248 CE1 HIS A 15 8.561 2.449 -5.920 1.00 0.00 C ATOM 249 NE2 HIS A 15 8.116 1.411 -5.239 1.00 0.00 N ATOM 0 H HIS A 15 3.759 2.209 -9.506 1.00 0.00 H new ATOM 0 HA HIS A 15 6.581 2.351 -9.425 1.00 0.00 H new ATOM 0 HB2 HIS A 15 4.964 2.955 -7.586 1.00 0.00 H new ATOM 0 HB3 HIS A 15 4.668 1.246 -7.339 1.00 0.00 H new ATOM 0 HD2 HIS A 15 6.275 0.228 -5.397 1.00 0.00 H new ATOM 0 HE1 HIS A 15 9.499 2.958 -5.754 1.00 0.00 H new ATOM 0 HE2 HIS A 15 8.600 0.956 -4.465 1.00 0.00 H new ATOM 258 N ALA A 16 5.213 -0.638 -9.434 1.00 0.00 N ATOM 259 CA ALA A 16 5.477 -2.061 -9.606 1.00 0.00 C ATOM 260 C ALA A 16 6.230 -2.334 -10.903 1.00 0.00 C ATOM 261 O ALA A 16 7.286 -2.962 -10.886 1.00 0.00 O ATOM 262 CB ALA A 16 4.177 -2.851 -9.575 1.00 0.00 C ATOM 0 H ALA A 16 4.223 -0.393 -9.421 1.00 0.00 H new ATOM 0 HA ALA A 16 6.107 -2.384 -8.777 1.00 0.00 H new ATOM 0 HB1 ALA A 16 4.393 -3.912 -9.705 1.00 0.00 H new ATOM 0 HB2 ALA A 16 3.680 -2.696 -8.617 1.00 0.00 H new ATOM 0 HB3 ALA A 16 3.526 -2.512 -10.381 1.00 0.00 H new ATOM 268 N ARG A 17 5.703 -1.834 -12.019 1.00 0.00 N ATOM 269 CA ARG A 17 6.310 -2.075 -13.325 1.00 0.00 C ATOM 270 C ARG A 17 7.710 -1.469 -13.407 1.00 0.00 C ATOM 271 O ARG A 17 8.586 -1.999 -14.095 1.00 0.00 O ATOM 272 CB ARG A 17 5.426 -1.543 -14.455 1.00 0.00 C ATOM 273 CG ARG A 17 5.235 -0.044 -14.426 1.00 0.00 C ATOM 274 CD ARG A 17 4.413 0.434 -15.612 1.00 0.00 C ATOM 275 NE ARG A 17 5.038 0.071 -16.884 1.00 0.00 N ATOM 276 CZ ARG A 17 4.366 -0.298 -17.975 1.00 0.00 C ATOM 277 NH1 ARG A 17 3.035 -0.286 -17.977 1.00 0.00 N ATOM 278 NH2 ARG A 17 5.026 -0.677 -19.066 1.00 0.00 N ATOM 0 H ARG A 17 4.859 -1.261 -12.045 1.00 0.00 H new ATOM 0 HA ARG A 17 6.401 -3.154 -13.446 1.00 0.00 H new ATOM 0 HB2 ARG A 17 5.866 -1.825 -15.411 1.00 0.00 H new ATOM 0 HB3 ARG A 17 4.450 -2.025 -14.398 1.00 0.00 H new ATOM 0 HG2 ARG A 17 4.739 0.243 -13.499 1.00 0.00 H new ATOM 0 HG3 ARG A 17 6.207 0.448 -14.433 1.00 0.00 H new ATOM 0 HD2 ARG A 17 3.414 0.001 -15.561 1.00 0.00 H new ATOM 0 HD3 ARG A 17 4.295 1.516 -15.560 1.00 0.00 H new ATOM 0 HE ARG A 17 6.056 0.102 -16.940 1.00 0.00 H new ATOM 0 HH11 ARG A 17 2.526 0.006 -17.142 1.00 0.00 H new ATOM 0 HH12 ARG A 17 2.524 -0.569 -18.813 1.00 0.00 H new ATOM 0 HH21 ARG A 17 6.046 -0.685 -19.068 1.00 0.00 H new ATOM 0 HH22 ARG A 17 4.512 -0.959 -19.901 1.00 0.00 H new ATOM 292 N GLN A 18 7.912 -0.354 -12.712 1.00 0.00 N ATOM 293 CA GLN A 18 9.207 0.308 -12.677 1.00 0.00 C ATOM 294 C GLN A 18 10.233 -0.524 -11.909 1.00 0.00 C ATOM 295 O GLN A 18 11.391 -0.638 -12.320 1.00 0.00 O ATOM 296 CB GLN A 18 9.065 1.685 -12.027 1.00 0.00 C ATOM 297 CG GLN A 18 10.359 2.476 -11.969 1.00 0.00 C ATOM 298 CD GLN A 18 10.169 3.865 -11.390 1.00 0.00 C ATOM 299 OE1 GLN A 18 10.245 4.063 -10.177 1.00 0.00 O ATOM 300 NE2 GLN A 18 9.917 4.836 -12.252 1.00 0.00 N ATOM 0 H GLN A 18 7.189 0.111 -12.163 1.00 0.00 H new ATOM 0 HA GLN A 18 9.560 0.420 -13.702 1.00 0.00 H new ATOM 0 HB2 GLN A 18 8.323 2.262 -12.579 1.00 0.00 H new ATOM 0 HB3 GLN A 18 8.682 1.560 -11.014 1.00 0.00 H new ATOM 0 HG2 GLN A 18 11.086 1.932 -11.367 1.00 0.00 H new ATOM 0 HG3 GLN A 18 10.775 2.559 -12.973 1.00 0.00 H new ATOM 0 HE21 GLN A 18 9.862 4.631 -13.250 1.00 0.00 H new ATOM 0 HE22 GLN A 18 9.778 5.790 -11.919 1.00 0.00 H new ATOM 309 N ALA A 19 9.793 -1.117 -10.810 1.00 0.00 N ATOM 310 CA ALA A 19 10.689 -1.848 -9.917 1.00 0.00 C ATOM 311 C ALA A 19 10.915 -3.289 -10.371 1.00 0.00 C ATOM 312 O ALA A 19 11.793 -3.975 -9.841 1.00 0.00 O ATOM 313 CB ALA A 19 10.151 -1.819 -8.497 1.00 0.00 C ATOM 0 H ALA A 19 8.818 -1.108 -10.511 1.00 0.00 H new ATOM 0 HA ALA A 19 11.657 -1.347 -9.948 1.00 0.00 H new ATOM 0 HB1 ALA A 19 10.827 -2.367 -7.841 1.00 0.00 H new ATOM 0 HB2 ALA A 19 10.074 -0.786 -8.158 1.00 0.00 H new ATOM 0 HB3 ALA A 19 9.165 -2.283 -8.472 1.00 0.00 H new ATOM 319 N LEU A 20 10.129 -3.749 -11.339 1.00 0.00 N ATOM 320 CA LEU A 20 10.284 -5.098 -11.872 1.00 0.00 C ATOM 321 C LEU A 20 11.707 -5.328 -12.382 1.00 0.00 C ATOM 322 O LEU A 20 12.336 -4.417 -12.922 1.00 0.00 O ATOM 323 CB LEU A 20 9.283 -5.347 -13.002 1.00 0.00 C ATOM 324 CG LEU A 20 7.815 -5.404 -12.579 1.00 0.00 C ATOM 325 CD1 LEU A 20 6.926 -5.667 -13.786 1.00 0.00 C ATOM 326 CD2 LEU A 20 7.603 -6.473 -11.516 1.00 0.00 C ATOM 0 H LEU A 20 9.379 -3.208 -11.770 1.00 0.00 H new ATOM 0 HA LEU A 20 10.089 -5.800 -11.061 1.00 0.00 H new ATOM 0 HB2 LEU A 20 9.398 -4.559 -13.746 1.00 0.00 H new ATOM 0 HB3 LEU A 20 9.539 -6.287 -13.490 1.00 0.00 H new ATOM 0 HG LEU A 20 7.542 -4.439 -12.151 1.00 0.00 H new ATOM 0 HD11 LEU A 20 5.884 -5.705 -13.469 1.00 0.00 H new ATOM 0 HD12 LEU A 20 7.055 -4.866 -14.514 1.00 0.00 H new ATOM 0 HD13 LEU A 20 7.202 -6.619 -14.241 1.00 0.00 H new ATOM 0 HD21 LEU A 20 6.552 -6.497 -11.229 1.00 0.00 H new ATOM 0 HD22 LEU A 20 7.893 -7.445 -11.915 1.00 0.00 H new ATOM 0 HD23 LEU A 20 8.213 -6.243 -10.642 1.00 0.00 H new ATOM 338 N PRO A 21 12.230 -6.555 -12.233 1.00 0.00 N ATOM 339 CA PRO A 21 11.509 -7.683 -11.655 1.00 0.00 C ATOM 340 C PRO A 21 11.803 -7.897 -10.169 1.00 0.00 C ATOM 341 O PRO A 21 11.818 -9.031 -9.692 1.00 0.00 O ATOM 342 CB PRO A 21 12.058 -8.845 -12.478 1.00 0.00 C ATOM 343 CG PRO A 21 13.476 -8.465 -12.785 1.00 0.00 C ATOM 344 CD PRO A 21 13.578 -6.959 -12.657 1.00 0.00 C ATOM 0 HA PRO A 21 10.428 -7.551 -11.692 1.00 0.00 H new ATOM 0 HB2 PRO A 21 12.012 -9.781 -11.921 1.00 0.00 H new ATOM 0 HB3 PRO A 21 11.481 -8.989 -13.391 1.00 0.00 H new ATOM 0 HG2 PRO A 21 14.163 -8.956 -12.096 1.00 0.00 H new ATOM 0 HG3 PRO A 21 13.750 -8.784 -13.790 1.00 0.00 H new ATOM 0 HD2 PRO A 21 14.332 -6.669 -11.925 1.00 0.00 H new ATOM 0 HD3 PRO A 21 13.857 -6.494 -13.603 1.00 0.00 H new ATOM 352 N ASN A 22 12.020 -6.810 -9.443 1.00 0.00 N ATOM 353 CA ASN A 22 12.290 -6.895 -8.012 1.00 0.00 C ATOM 354 C ASN A 22 11.075 -6.433 -7.220 1.00 0.00 C ATOM 355 O ASN A 22 10.014 -6.194 -7.795 1.00 0.00 O ATOM 356 CB ASN A 22 13.510 -6.054 -7.629 1.00 0.00 C ATOM 357 CG ASN A 22 14.801 -6.571 -8.234 1.00 0.00 C ATOM 358 OD1 ASN A 22 14.951 -7.764 -8.499 1.00 0.00 O ATOM 359 ND2 ASN A 22 15.752 -5.673 -8.447 1.00 0.00 N ATOM 0 H ASN A 22 12.015 -5.861 -9.818 1.00 0.00 H new ATOM 0 HA ASN A 22 12.503 -7.937 -7.771 1.00 0.00 H new ATOM 0 HB2 ASN A 22 13.351 -5.025 -7.952 1.00 0.00 H new ATOM 0 HB3 ASN A 22 13.606 -6.036 -6.543 1.00 0.00 H new ATOM 0 HD21 ASN A 22 16.646 -5.962 -8.844 1.00 0.00 H new ATOM 0 HD22 ASN A 22 15.590 -4.693 -8.214 1.00 0.00 H new ATOM 366 N GLU A 23 11.232 -6.323 -5.903 1.00 0.00 N ATOM 367 CA GLU A 23 10.153 -5.864 -5.034 1.00 0.00 C ATOM 368 C GLU A 23 9.798 -4.408 -5.301 1.00 0.00 C ATOM 369 O GLU A 23 10.658 -3.590 -5.647 1.00 0.00 O ATOM 370 CB GLU A 23 10.533 -6.040 -3.561 1.00 0.00 C ATOM 371 CG GLU A 23 9.825 -7.194 -2.868 1.00 0.00 C ATOM 372 CD GLU A 23 8.382 -6.879 -2.509 1.00 0.00 C ATOM 373 OE1 GLU A 23 7.784 -5.975 -3.132 1.00 0.00 O ATOM 374 OE2 GLU A 23 7.844 -7.535 -1.589 1.00 0.00 O ATOM 0 H GLU A 23 12.099 -6.546 -5.414 1.00 0.00 H new ATOM 0 HA GLU A 23 9.278 -6.475 -5.256 1.00 0.00 H new ATOM 0 HB2 GLU A 23 11.610 -6.195 -3.491 1.00 0.00 H new ATOM 0 HB3 GLU A 23 10.308 -5.117 -3.027 1.00 0.00 H new ATOM 0 HG2 GLU A 23 9.849 -8.069 -3.517 1.00 0.00 H new ATOM 0 HG3 GLU A 23 10.370 -7.455 -1.961 1.00 0.00 H new ATOM 381 N ALA A 24 8.529 -4.094 -5.114 1.00 0.00 N ATOM 382 CA ALA A 24 8.028 -2.745 -5.304 1.00 0.00 C ATOM 383 C ALA A 24 7.162 -2.348 -4.122 1.00 0.00 C ATOM 384 O ALA A 24 5.991 -2.726 -4.046 1.00 0.00 O ATOM 385 CB ALA A 24 7.241 -2.641 -6.602 1.00 0.00 C ATOM 0 H ALA A 24 7.817 -4.766 -4.827 1.00 0.00 H new ATOM 0 HA ALA A 24 8.875 -2.061 -5.368 1.00 0.00 H new ATOM 0 HB1 ALA A 24 6.875 -1.622 -6.725 1.00 0.00 H new ATOM 0 HB2 ALA A 24 7.888 -2.898 -7.441 1.00 0.00 H new ATOM 0 HB3 ALA A 24 6.396 -3.329 -6.571 1.00 0.00 H new ATOM 391 N CYS A 25 7.733 -1.593 -3.192 1.00 0.00 N ATOM 392 CA CYS A 25 7.018 -1.246 -1.979 1.00 0.00 C ATOM 393 C CYS A 25 6.792 0.257 -1.879 1.00 0.00 C ATOM 394 O CYS A 25 7.435 1.043 -2.575 1.00 0.00 O ATOM 395 CB CYS A 25 7.780 -1.753 -0.754 1.00 0.00 C ATOM 396 SG CYS A 25 9.469 -1.116 -0.617 1.00 0.00 S ATOM 0 H CYS A 25 8.678 -1.215 -3.256 1.00 0.00 H new ATOM 0 HA CYS A 25 6.041 -1.728 -2.014 1.00 0.00 H new ATOM 0 HB2 CYS A 25 7.226 -1.479 0.144 1.00 0.00 H new ATOM 0 HB3 CYS A 25 7.816 -2.842 -0.787 1.00 0.00 H new ATOM 0 HG CYS A 25 9.694 -0.743 0.608 1.00 0.00 H new ATOM 402 N GLY A 26 5.858 0.638 -1.023 1.00 0.00 N ATOM 403 CA GLY A 26 5.544 2.035 -0.815 1.00 0.00 C ATOM 404 C GLY A 26 4.620 2.220 0.370 1.00 0.00 C ATOM 405 O GLY A 26 4.463 1.306 1.172 1.00 0.00 O ATOM 0 H GLY A 26 5.304 -0.007 -0.460 1.00 0.00 H new ATOM 0 HA2 GLY A 26 6.464 2.597 -0.653 1.00 0.00 H new ATOM 0 HA3 GLY A 26 5.076 2.442 -1.711 1.00 0.00 H new ATOM 409 N LEU A 27 3.987 3.381 0.469 1.00 0.00 N ATOM 410 CA LEU A 27 3.113 3.682 1.595 1.00 0.00 C ATOM 411 C LEU A 27 1.722 4.064 1.103 1.00 0.00 C ATOM 412 O LEU A 27 1.561 4.521 -0.027 1.00 0.00 O ATOM 413 CB LEU A 27 3.703 4.824 2.428 1.00 0.00 C ATOM 414 CG LEU A 27 5.079 4.548 3.035 1.00 0.00 C ATOM 415 CD1 LEU A 27 5.611 5.795 3.720 1.00 0.00 C ATOM 416 CD2 LEU A 27 5.008 3.389 4.019 1.00 0.00 C ATOM 0 H LEU A 27 4.063 4.131 -0.218 1.00 0.00 H new ATOM 0 HA LEU A 27 3.031 2.791 2.218 1.00 0.00 H new ATOM 0 HB2 LEU A 27 3.773 5.712 1.799 1.00 0.00 H new ATOM 0 HB3 LEU A 27 3.009 5.059 3.235 1.00 0.00 H new ATOM 0 HG LEU A 27 5.763 4.273 2.232 1.00 0.00 H new ATOM 0 HD11 LEU A 27 6.591 5.585 4.148 1.00 0.00 H new ATOM 0 HD12 LEU A 27 5.698 6.601 2.992 1.00 0.00 H new ATOM 0 HD13 LEU A 27 4.926 6.095 4.513 1.00 0.00 H new ATOM 0 HD21 LEU A 27 5.997 3.208 4.440 1.00 0.00 H new ATOM 0 HD22 LEU A 27 4.312 3.635 4.821 1.00 0.00 H new ATOM 0 HD23 LEU A 27 4.665 2.493 3.502 1.00 0.00 H new ATOM 428 N LEU A 28 0.723 3.871 1.949 1.00 0.00 N ATOM 429 CA LEU A 28 -0.650 4.212 1.604 1.00 0.00 C ATOM 430 C LEU A 28 -1.178 5.292 2.534 1.00 0.00 C ATOM 431 O LEU A 28 -1.095 5.161 3.760 1.00 0.00 O ATOM 432 CB LEU A 28 -1.539 2.971 1.689 1.00 0.00 C ATOM 433 CG LEU A 28 -1.152 1.823 0.752 1.00 0.00 C ATOM 434 CD1 LEU A 28 -2.020 0.606 1.024 1.00 0.00 C ATOM 435 CD2 LEU A 28 -1.282 2.253 -0.702 1.00 0.00 C ATOM 0 H LEU A 28 0.837 3.478 2.884 1.00 0.00 H new ATOM 0 HA LEU A 28 -0.666 4.591 0.582 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -1.523 2.602 2.715 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -2.566 3.265 1.472 1.00 0.00 H new ATOM 0 HG LEU A 28 -0.111 1.559 0.940 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -1.734 -0.202 0.351 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -1.883 0.284 2.056 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -3.067 0.862 0.860 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -1.003 1.424 -1.353 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -2.313 2.542 -0.905 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -0.623 3.101 -0.891 1.00 0.00 H new ATOM 447 N GLY A 29 -1.716 6.351 1.952 1.00 0.00 N ATOM 448 CA GLY A 29 -2.254 7.436 2.736 1.00 0.00 C ATOM 449 C GLY A 29 -3.712 7.696 2.425 1.00 0.00 C ATOM 450 O GLY A 29 -4.139 7.612 1.269 1.00 0.00 O ATOM 0 H GLY A 29 -1.789 6.477 0.942 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -2.146 7.205 3.796 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -1.677 8.341 2.546 1.00 0.00 H new ATOM 454 N GLY A 30 -4.480 7.998 3.454 1.00 0.00 N ATOM 455 CA GLY A 30 -5.887 8.278 3.274 1.00 0.00 C ATOM 456 C GLY A 30 -6.605 8.391 4.596 1.00 0.00 C ATOM 457 O GLY A 30 -6.032 8.864 5.579 1.00 0.00 O ATOM 0 H GLY A 30 -4.153 8.055 4.419 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -6.005 9.206 2.715 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -6.343 7.487 2.678 1.00 0.00 H new ATOM 461 N ARG A 31 -7.849 7.949 4.636 1.00 0.00 N ATOM 462 CA ARG A 31 -8.624 8.006 5.861 1.00 0.00 C ATOM 463 C ARG A 31 -9.121 6.630 6.253 1.00 0.00 C ATOM 464 O ARG A 31 -9.601 5.871 5.413 1.00 0.00 O ATOM 465 CB ARG A 31 -9.837 8.925 5.724 1.00 0.00 C ATOM 466 CG ARG A 31 -9.514 10.382 5.463 1.00 0.00 C ATOM 467 CD ARG A 31 -10.720 11.257 5.764 1.00 0.00 C ATOM 468 NE ARG A 31 -11.920 10.823 5.044 1.00 0.00 N ATOM 469 CZ ARG A 31 -13.068 10.490 5.641 1.00 0.00 C ATOM 470 NH1 ARG A 31 -13.161 10.467 6.967 1.00 0.00 N ATOM 471 NH2 ARG A 31 -14.126 10.169 4.915 1.00 0.00 N ATOM 0 H ARG A 31 -8.342 7.548 3.838 1.00 0.00 H new ATOM 0 HA ARG A 31 -7.957 8.399 6.628 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -10.462 8.556 4.911 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -10.429 8.858 6.637 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -8.671 10.690 6.081 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -9.212 10.513 4.424 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -10.918 11.242 6.836 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -10.492 12.289 5.496 1.00 0.00 H new ATOM 0 HE ARG A 31 -11.876 10.772 4.026 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -12.351 10.705 7.539 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -14.042 10.211 7.412 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -14.067 10.175 3.897 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -15.001 9.915 5.373 1.00 0.00 H new ATOM 485 N ARG A 32 -8.991 6.310 7.522 1.00 0.00 N ATOM 486 CA ARG A 32 -9.682 5.169 8.087 1.00 0.00 C ATOM 487 C ARG A 32 -10.712 5.691 9.072 1.00 0.00 C ATOM 488 O ARG A 32 -10.371 6.387 10.027 1.00 0.00 O ATOM 489 CB ARG A 32 -8.711 4.192 8.761 1.00 0.00 C ATOM 490 CG ARG A 32 -7.700 4.848 9.687 1.00 0.00 C ATOM 491 CD ARG A 32 -6.869 3.805 10.415 1.00 0.00 C ATOM 492 NE ARG A 32 -5.777 4.405 11.176 1.00 0.00 N ATOM 493 CZ ARG A 32 -5.537 4.159 12.462 1.00 0.00 C ATOM 494 NH1 ARG A 32 -6.331 3.351 13.159 1.00 0.00 N ATOM 495 NH2 ARG A 32 -4.497 4.728 13.052 1.00 0.00 N ATOM 0 H ARG A 32 -8.412 6.825 8.185 1.00 0.00 H new ATOM 0 HA ARG A 32 -10.173 4.607 7.293 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -9.286 3.462 9.330 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -8.174 3.642 7.988 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -7.045 5.502 9.111 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -8.219 5.475 10.412 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -7.510 3.237 11.089 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -6.461 3.098 9.692 1.00 0.00 H new ATOM 0 HE ARG A 32 -5.158 5.055 10.691 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -7.134 2.912 12.709 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -6.137 3.170 14.144 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -3.887 5.350 12.521 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -4.306 4.545 14.037 1.00 0.00 H new ATOM 509 N ASP A 33 -11.968 5.367 8.837 1.00 0.00 N ATOM 510 CA ASP A 33 -13.052 5.969 9.608 1.00 0.00 C ATOM 511 C ASP A 33 -13.664 4.938 10.541 1.00 0.00 C ATOM 512 O ASP A 33 -14.861 4.953 10.828 1.00 0.00 O ATOM 513 CB ASP A 33 -14.104 6.543 8.656 1.00 0.00 C ATOM 514 CG ASP A 33 -15.049 7.513 9.340 1.00 0.00 C ATOM 515 OD1 ASP A 33 -14.599 8.260 10.236 1.00 0.00 O ATOM 516 OD2 ASP A 33 -16.245 7.546 8.975 1.00 0.00 O ATOM 0 H ASP A 33 -12.267 4.698 8.127 1.00 0.00 H new ATOM 0 HA ASP A 33 -12.657 6.782 10.217 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -13.603 7.051 7.832 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -14.680 5.725 8.223 1.00 0.00 H new ATOM 521 N GLY A 34 -12.812 4.061 11.038 1.00 0.00 N ATOM 522 CA GLY A 34 -13.254 2.964 11.862 1.00 0.00 C ATOM 523 C GLY A 34 -12.671 1.667 11.371 1.00 0.00 C ATOM 524 O GLY A 34 -11.522 1.340 11.667 1.00 0.00 O ATOM 0 H GLY A 34 -11.805 4.092 10.881 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -12.955 3.135 12.896 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -14.342 2.908 11.850 1.00 0.00 H new ATOM 528 N ASP A 35 -13.452 0.930 10.607 1.00 0.00 N ATOM 529 CA ASP A 35 -12.955 -0.276 9.964 1.00 0.00 C ATOM 530 C ASP A 35 -12.742 -0.008 8.481 1.00 0.00 C ATOM 531 O ASP A 35 -11.899 -0.631 7.833 1.00 0.00 O ATOM 532 CB ASP A 35 -13.934 -1.431 10.154 1.00 0.00 C ATOM 533 CG ASP A 35 -13.229 -2.765 10.296 1.00 0.00 C ATOM 534 OD1 ASP A 35 -12.847 -3.367 9.273 1.00 0.00 O ATOM 535 OD2 ASP A 35 -13.060 -3.223 11.449 1.00 0.00 O ATOM 0 H ASP A 35 -14.431 1.142 10.415 1.00 0.00 H new ATOM 0 HA ASP A 35 -12.006 -0.555 10.423 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -14.541 -1.247 11.040 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -14.615 -1.471 9.304 1.00 0.00 H new ATOM 540 N ASP A 36 -13.499 0.950 7.956 1.00 0.00 N ATOM 541 CA ASP A 36 -13.409 1.318 6.549 1.00 0.00 C ATOM 542 C ASP A 36 -12.226 2.237 6.307 1.00 0.00 C ATOM 543 O ASP A 36 -11.982 3.181 7.060 1.00 0.00 O ATOM 544 CB ASP A 36 -14.694 1.981 6.047 1.00 0.00 C ATOM 545 CG ASP A 36 -15.589 2.469 7.166 1.00 0.00 C ATOM 546 OD1 ASP A 36 -15.305 3.529 7.751 1.00 0.00 O ATOM 547 OD2 ASP A 36 -16.589 1.785 7.472 1.00 0.00 O ATOM 0 H ASP A 36 -14.184 1.487 8.487 1.00 0.00 H new ATOM 0 HA ASP A 36 -13.266 0.395 5.988 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -14.434 2.823 5.405 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -15.246 1.270 5.433 1.00 0.00 H new ATOM 552 N ARG A 37 -11.491 1.931 5.256 1.00 0.00 N ATOM 553 CA ARG A 37 -10.264 2.636 4.923 1.00 0.00 C ATOM 554 C ARG A 37 -10.283 3.075 3.462 1.00 0.00 C ATOM 555 O ARG A 37 -10.373 2.239 2.561 1.00 0.00 O ATOM 556 CB ARG A 37 -9.056 1.733 5.199 1.00 0.00 C ATOM 557 CG ARG A 37 -9.043 1.177 6.617 1.00 0.00 C ATOM 558 CD ARG A 37 -7.857 0.262 6.875 1.00 0.00 C ATOM 559 NE ARG A 37 -7.830 -0.902 5.985 1.00 0.00 N ATOM 560 CZ ARG A 37 -8.563 -2.007 6.158 1.00 0.00 C ATOM 561 NH1 ARG A 37 -9.470 -2.074 7.124 1.00 0.00 N ATOM 562 NH2 ARG A 37 -8.392 -3.050 5.359 1.00 0.00 N ATOM 0 H ARG A 37 -11.727 1.183 4.604 1.00 0.00 H new ATOM 0 HA ARG A 37 -10.186 3.528 5.545 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -9.058 0.905 4.490 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -8.140 2.298 5.027 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -9.021 2.004 7.327 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -9.967 0.627 6.796 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -6.934 0.829 6.752 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -7.886 -0.079 7.910 1.00 0.00 H new ATOM 0 HE ARG A 37 -7.209 -0.867 5.177 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -9.614 -1.277 7.744 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -10.023 -2.922 7.246 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -7.700 -3.011 4.610 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -8.952 -3.892 5.493 1.00 0.00 H new ATOM 576 N TRP A 38 -10.209 4.380 3.236 1.00 0.00 N ATOM 577 CA TRP A 38 -10.209 4.931 1.887 1.00 0.00 C ATOM 578 C TRP A 38 -8.853 5.550 1.559 1.00 0.00 C ATOM 579 O TRP A 38 -8.396 6.468 2.244 1.00 0.00 O ATOM 580 CB TRP A 38 -11.303 5.992 1.730 1.00 0.00 C ATOM 581 CG TRP A 38 -12.694 5.457 1.884 1.00 0.00 C ATOM 582 CD1 TRP A 38 -13.414 4.762 0.954 1.00 0.00 C ATOM 583 CD2 TRP A 38 -13.539 5.581 3.033 1.00 0.00 C ATOM 584 NE1 TRP A 38 -14.653 4.448 1.454 1.00 0.00 N ATOM 585 CE2 TRP A 38 -14.755 4.939 2.726 1.00 0.00 C ATOM 586 CE3 TRP A 38 -13.390 6.175 4.290 1.00 0.00 C ATOM 587 CZ2 TRP A 38 -15.808 4.870 3.632 1.00 0.00 C ATOM 588 CZ3 TRP A 38 -14.437 6.105 5.188 1.00 0.00 C ATOM 589 CH2 TRP A 38 -15.635 5.459 4.853 1.00 0.00 C ATOM 0 H TRP A 38 -10.148 5.081 3.975 1.00 0.00 H new ATOM 0 HA TRP A 38 -10.407 4.112 1.195 1.00 0.00 H new ATOM 0 HB2 TRP A 38 -11.142 6.777 2.469 1.00 0.00 H new ATOM 0 HB3 TRP A 38 -11.209 6.454 0.747 1.00 0.00 H new ATOM 0 HD1 TRP A 38 -13.060 4.498 -0.031 1.00 0.00 H new ATOM 0 HE1 TRP A 38 -15.380 3.932 0.957 1.00 0.00 H new ATOM 0 HE3 TRP A 38 -12.472 6.680 4.554 1.00 0.00 H new ATOM 0 HZ2 TRP A 38 -16.730 4.368 3.379 1.00 0.00 H new ATOM 0 HZ3 TRP A 38 -14.331 6.555 6.164 1.00 0.00 H new ATOM 0 HH2 TRP A 38 -16.438 5.426 5.575 1.00 0.00 H new ATOM 600 N VAL A 39 -8.212 5.042 0.518 1.00 0.00 N ATOM 601 CA VAL A 39 -6.921 5.561 0.089 1.00 0.00 C ATOM 602 C VAL A 39 -7.110 6.685 -0.923 1.00 0.00 C ATOM 603 O VAL A 39 -7.481 6.443 -2.074 1.00 0.00 O ATOM 604 CB VAL A 39 -6.041 4.462 -0.544 1.00 0.00 C ATOM 605 CG1 VAL A 39 -4.683 5.021 -0.949 1.00 0.00 C ATOM 606 CG2 VAL A 39 -5.883 3.283 0.401 1.00 0.00 C ATOM 0 H VAL A 39 -8.565 4.269 -0.047 1.00 0.00 H new ATOM 0 HA VAL A 39 -6.418 5.939 0.979 1.00 0.00 H new ATOM 0 HB VAL A 39 -6.541 4.106 -1.445 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -4.081 4.228 -1.393 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -4.821 5.821 -1.676 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -4.174 5.414 -0.069 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -5.259 2.522 -0.068 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -5.413 3.618 1.326 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -6.863 2.862 0.624 1.00 0.00 H new ATOM 616 N GLU A 40 -6.866 7.914 -0.490 1.00 0.00 N ATOM 617 CA GLU A 40 -7.010 9.064 -1.367 1.00 0.00 C ATOM 618 C GLU A 40 -5.682 9.419 -2.036 1.00 0.00 C ATOM 619 O GLU A 40 -5.662 10.107 -3.058 1.00 0.00 O ATOM 620 CB GLU A 40 -7.565 10.274 -0.602 1.00 0.00 C ATOM 621 CG GLU A 40 -9.010 10.107 -0.146 1.00 0.00 C ATOM 622 CD GLU A 40 -9.558 11.335 0.565 1.00 0.00 C ATOM 623 OE1 GLU A 40 -10.035 12.270 -0.118 1.00 0.00 O ATOM 624 OE2 GLU A 40 -9.531 11.368 1.812 1.00 0.00 O ATOM 0 H GLU A 40 -6.569 8.138 0.460 1.00 0.00 H new ATOM 0 HA GLU A 40 -7.722 8.795 -2.147 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -6.938 10.459 0.270 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -7.495 11.157 -1.238 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -9.635 9.887 -1.012 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -9.077 9.248 0.522 1.00 0.00 H new ATOM 631 N ARG A 41 -4.569 8.949 -1.471 1.00 0.00 N ATOM 632 CA ARG A 41 -3.257 9.225 -2.052 1.00 0.00 C ATOM 633 C ARG A 41 -2.252 8.117 -1.730 1.00 0.00 C ATOM 634 O ARG A 41 -1.919 7.880 -0.569 1.00 0.00 O ATOM 635 CB ARG A 41 -2.733 10.578 -1.553 1.00 0.00 C ATOM 636 CG ARG A 41 -1.428 11.016 -2.199 1.00 0.00 C ATOM 637 CD ARG A 41 -1.011 12.403 -1.726 1.00 0.00 C ATOM 638 NE ARG A 41 0.283 12.805 -2.277 1.00 0.00 N ATOM 639 CZ ARG A 41 1.059 13.757 -1.757 1.00 0.00 C ATOM 640 NH1 ARG A 41 0.648 14.481 -0.722 1.00 0.00 N ATOM 641 NH2 ARG A 41 2.241 14.003 -2.299 1.00 0.00 N ATOM 0 H ARG A 41 -4.550 8.383 -0.623 1.00 0.00 H new ATOM 0 HA ARG A 41 -3.374 9.261 -3.135 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -3.491 11.339 -1.738 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -2.591 10.525 -0.474 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -0.643 10.298 -1.961 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -1.540 11.018 -3.283 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -1.770 13.129 -2.018 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -0.961 12.415 -0.637 1.00 0.00 H new ATOM 0 HE ARG A 41 0.614 12.326 -3.114 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -0.272 14.312 -0.315 1.00 0.00 H new ATOM 0 HH12 ARG A 41 1.252 15.206 -0.335 1.00 0.00 H new ATOM 0 HH21 ARG A 41 2.553 13.466 -3.108 1.00 0.00 H new ATOM 0 HH22 ARG A 41 2.840 14.729 -1.907 1.00 0.00 H new ATOM 655 N VAL A 42 -1.781 7.437 -2.768 1.00 0.00 N ATOM 656 CA VAL A 42 -0.734 6.431 -2.629 1.00 0.00 C ATOM 657 C VAL A 42 0.640 7.092 -2.671 1.00 0.00 C ATOM 658 O VAL A 42 0.871 8.013 -3.455 1.00 0.00 O ATOM 659 CB VAL A 42 -0.824 5.350 -3.735 1.00 0.00 C ATOM 660 CG1 VAL A 42 0.381 4.416 -3.701 1.00 0.00 C ATOM 661 CG2 VAL A 42 -2.109 4.547 -3.590 1.00 0.00 C ATOM 0 H VAL A 42 -2.111 7.566 -3.724 1.00 0.00 H new ATOM 0 HA VAL A 42 -0.878 5.941 -1.666 1.00 0.00 H new ATOM 0 HB VAL A 42 -0.829 5.862 -4.697 1.00 0.00 H new ATOM 0 HG11 VAL A 42 0.285 3.670 -4.490 1.00 0.00 H new ATOM 0 HG12 VAL A 42 1.293 4.993 -3.855 1.00 0.00 H new ATOM 0 HG13 VAL A 42 0.427 3.917 -2.733 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -2.157 3.792 -4.375 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -2.125 4.059 -2.615 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -2.967 5.214 -3.676 1.00 0.00 H new ATOM 671 N TYR A 43 1.534 6.638 -1.803 1.00 0.00 N ATOM 672 CA TYR A 43 2.888 7.173 -1.728 1.00 0.00 C ATOM 673 C TYR A 43 3.917 6.146 -2.201 1.00 0.00 C ATOM 674 O TYR A 43 4.425 5.358 -1.402 1.00 0.00 O ATOM 675 CB TYR A 43 3.222 7.608 -0.299 1.00 0.00 C ATOM 676 CG TYR A 43 2.545 8.891 0.128 1.00 0.00 C ATOM 677 CD1 TYR A 43 1.200 8.916 0.468 1.00 0.00 C ATOM 678 CD2 TYR A 43 3.260 10.079 0.194 1.00 0.00 C ATOM 679 CE1 TYR A 43 0.587 10.089 0.862 1.00 0.00 C ATOM 680 CE2 TYR A 43 2.655 11.254 0.587 1.00 0.00 C ATOM 681 CZ TYR A 43 1.320 11.255 0.920 1.00 0.00 C ATOM 682 OH TYR A 43 0.714 12.427 1.306 1.00 0.00 O ATOM 0 H TYR A 43 1.343 5.892 -1.134 1.00 0.00 H new ATOM 0 HA TYR A 43 2.931 8.041 -2.387 1.00 0.00 H new ATOM 0 HB2 TYR A 43 2.936 6.812 0.388 1.00 0.00 H new ATOM 0 HB3 TYR A 43 4.301 7.732 -0.211 1.00 0.00 H new ATOM 0 HD1 TYR A 43 0.624 8.004 0.424 1.00 0.00 H new ATOM 0 HD2 TYR A 43 4.308 10.083 -0.067 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -0.461 10.093 1.123 1.00 0.00 H new ATOM 0 HE2 TYR A 43 3.226 12.169 0.633 1.00 0.00 H new ATOM 0 HH TYR A 43 1.399 13.094 1.521 1.00 0.00 H new ATOM 692 N PRO A 44 4.205 6.103 -3.511 1.00 0.00 N ATOM 693 CA PRO A 44 5.240 5.227 -4.057 1.00 0.00 C ATOM 694 C PRO A 44 6.628 5.654 -3.587 1.00 0.00 C ATOM 695 O PRO A 44 7.261 6.527 -4.182 1.00 0.00 O ATOM 696 CB PRO A 44 5.109 5.391 -5.579 1.00 0.00 C ATOM 697 CG PRO A 44 3.804 6.083 -5.795 1.00 0.00 C ATOM 698 CD PRO A 44 3.559 6.900 -4.560 1.00 0.00 C ATOM 0 HA PRO A 44 5.118 4.193 -3.733 1.00 0.00 H new ATOM 0 HB2 PRO A 44 5.935 5.976 -5.983 1.00 0.00 H new ATOM 0 HB3 PRO A 44 5.128 4.424 -6.081 1.00 0.00 H new ATOM 0 HG2 PRO A 44 3.841 6.717 -6.681 1.00 0.00 H new ATOM 0 HG3 PRO A 44 3.001 5.362 -5.951 1.00 0.00 H new ATOM 0 HD2 PRO A 44 3.997 7.895 -4.640 1.00 0.00 H new ATOM 0 HD3 PRO A 44 2.494 7.034 -4.368 1.00 0.00 H new ATOM 706 N LEU A 45 7.077 5.057 -2.495 1.00 0.00 N ATOM 707 CA LEU A 45 8.337 5.439 -1.882 1.00 0.00 C ATOM 708 C LEU A 45 9.501 4.743 -2.577 1.00 0.00 C ATOM 709 O LEU A 45 9.309 3.754 -3.285 1.00 0.00 O ATOM 710 CB LEU A 45 8.316 5.099 -0.388 1.00 0.00 C ATOM 711 CG LEU A 45 9.455 5.705 0.438 1.00 0.00 C ATOM 712 CD1 LEU A 45 9.393 7.225 0.400 1.00 0.00 C ATOM 713 CD2 LEU A 45 9.398 5.205 1.874 1.00 0.00 C ATOM 0 H LEU A 45 6.585 4.304 -2.014 1.00 0.00 H new ATOM 0 HA LEU A 45 8.471 6.515 -1.993 1.00 0.00 H new ATOM 0 HB2 LEU A 45 7.367 5.435 0.031 1.00 0.00 H new ATOM 0 HB3 LEU A 45 8.347 4.015 -0.279 1.00 0.00 H new ATOM 0 HG LEU A 45 10.402 5.388 0.001 1.00 0.00 H new ATOM 0 HD11 LEU A 45 10.210 7.637 0.992 1.00 0.00 H new ATOM 0 HD12 LEU A 45 9.484 7.567 -0.631 1.00 0.00 H new ATOM 0 HD13 LEU A 45 8.441 7.561 0.811 1.00 0.00 H new ATOM 0 HD21 LEU A 45 10.215 5.646 2.446 1.00 0.00 H new ATOM 0 HD22 LEU A 45 8.446 5.491 2.321 1.00 0.00 H new ATOM 0 HD23 LEU A 45 9.492 4.119 1.885 1.00 0.00 H new ATOM 725 N ASN A 46 10.699 5.271 -2.383 1.00 0.00 N ATOM 726 CA ASN A 46 11.889 4.717 -3.008 1.00 0.00 C ATOM 727 C ASN A 46 12.279 3.398 -2.354 1.00 0.00 C ATOM 728 O ASN A 46 12.215 3.250 -1.132 1.00 0.00 O ATOM 729 CB ASN A 46 13.046 5.712 -2.913 1.00 0.00 C ATOM 730 CG ASN A 46 14.296 5.248 -3.636 1.00 0.00 C ATOM 731 OD1 ASN A 46 14.228 4.558 -4.655 1.00 0.00 O ATOM 732 ND2 ASN A 46 15.452 5.630 -3.116 1.00 0.00 N ATOM 0 H ASN A 46 10.873 6.086 -1.795 1.00 0.00 H new ATOM 0 HA ASN A 46 11.668 4.528 -4.058 1.00 0.00 H new ATOM 0 HB2 ASN A 46 12.729 6.669 -3.328 1.00 0.00 H new ATOM 0 HB3 ASN A 46 13.284 5.883 -1.863 1.00 0.00 H new ATOM 0 HD21 ASN A 46 16.327 5.353 -3.560 1.00 0.00 H new ATOM 0 HD22 ASN A 46 15.467 6.201 -2.271 1.00 0.00 H new ATOM 739 N ASN A 47 12.678 2.450 -3.183 1.00 0.00 N ATOM 740 CA ASN A 47 13.100 1.138 -2.716 1.00 0.00 C ATOM 741 C ASN A 47 14.571 1.162 -2.341 1.00 0.00 C ATOM 742 O ASN A 47 15.437 1.362 -3.194 1.00 0.00 O ATOM 743 CB ASN A 47 12.847 0.083 -3.794 1.00 0.00 C ATOM 744 CG ASN A 47 11.479 -0.562 -3.675 1.00 0.00 C ATOM 745 OD1 ASN A 47 10.483 -0.049 -4.189 1.00 0.00 O ATOM 746 ND2 ASN A 47 11.421 -1.704 -3.005 1.00 0.00 N ATOM 0 H ASN A 47 12.719 2.565 -4.196 1.00 0.00 H new ATOM 0 HA ASN A 47 12.517 0.880 -1.832 1.00 0.00 H new ATOM 0 HB2 ASN A 47 12.942 0.544 -4.777 1.00 0.00 H new ATOM 0 HB3 ASN A 47 13.614 -0.688 -3.728 1.00 0.00 H new ATOM 0 HD21 ASN A 47 10.530 -2.189 -2.901 1.00 0.00 H new ATOM 0 HD22 ASN A 47 12.267 -2.097 -2.594 1.00 0.00 H new ATOM 753 N LEU A 48 14.842 0.981 -1.056 1.00 0.00 N ATOM 754 CA LEU A 48 16.204 0.984 -0.540 1.00 0.00 C ATOM 755 C LEU A 48 17.010 -0.164 -1.135 1.00 0.00 C ATOM 756 O LEU A 48 17.926 0.053 -1.930 1.00 0.00 O ATOM 757 CB LEU A 48 16.197 0.879 0.991 1.00 0.00 C ATOM 758 CG LEU A 48 15.791 2.147 1.753 1.00 0.00 C ATOM 759 CD1 LEU A 48 16.782 3.270 1.493 1.00 0.00 C ATOM 760 CD2 LEU A 48 14.381 2.590 1.389 1.00 0.00 C ATOM 0 H LEU A 48 14.127 0.829 -0.344 1.00 0.00 H new ATOM 0 HA LEU A 48 16.673 1.925 -0.829 1.00 0.00 H new ATOM 0 HB2 LEU A 48 15.518 0.075 1.277 1.00 0.00 H new ATOM 0 HB3 LEU A 48 17.194 0.586 1.319 1.00 0.00 H new ATOM 0 HG LEU A 48 15.802 1.909 2.817 1.00 0.00 H new ATOM 0 HD11 LEU A 48 16.476 4.160 2.043 1.00 0.00 H new ATOM 0 HD12 LEU A 48 17.774 2.963 1.823 1.00 0.00 H new ATOM 0 HD13 LEU A 48 16.807 3.493 0.426 1.00 0.00 H new ATOM 0 HD21 LEU A 48 14.127 3.491 1.948 1.00 0.00 H new ATOM 0 HD22 LEU A 48 14.330 2.799 0.320 1.00 0.00 H new ATOM 0 HD23 LEU A 48 13.675 1.798 1.638 1.00 0.00 H new ATOM 772 N ASP A 49 16.654 -1.382 -0.759 1.00 0.00 N ATOM 773 CA ASP A 49 17.336 -2.570 -1.257 1.00 0.00 C ATOM 774 C ASP A 49 16.745 -3.000 -2.588 1.00 0.00 C ATOM 775 O ASP A 49 17.478 -3.305 -3.530 1.00 0.00 O ATOM 776 CB ASP A 49 17.224 -3.717 -0.245 1.00 0.00 C ATOM 777 CG ASP A 49 15.795 -3.948 0.205 1.00 0.00 C ATOM 778 OD1 ASP A 49 15.248 -3.077 0.912 1.00 0.00 O ATOM 779 OD2 ASP A 49 15.217 -4.994 -0.148 1.00 0.00 O ATOM 0 H ASP A 49 15.893 -1.576 -0.108 1.00 0.00 H new ATOM 0 HA ASP A 49 18.389 -2.326 -1.398 1.00 0.00 H new ATOM 0 HB2 ASP A 49 17.615 -4.632 -0.691 1.00 0.00 H new ATOM 0 HB3 ASP A 49 17.845 -3.495 0.623 1.00 0.00 H new ATOM 784 N GLN A 50 15.413 -3.002 -2.659 1.00 0.00 N ATOM 785 CA GLN A 50 14.694 -3.466 -3.839 1.00 0.00 C ATOM 786 C GLN A 50 15.105 -4.903 -4.152 1.00 0.00 C ATOM 787 O GLN A 50 15.444 -5.236 -5.286 1.00 0.00 O ATOM 788 CB GLN A 50 14.962 -2.551 -5.043 1.00 0.00 C ATOM 789 CG GLN A 50 13.949 -2.708 -6.171 1.00 0.00 C ATOM 790 CD GLN A 50 14.314 -1.907 -7.404 1.00 0.00 C ATOM 791 OE1 GLN A 50 14.970 -0.867 -7.318 1.00 0.00 O ATOM 792 NE2 GLN A 50 13.879 -2.378 -8.564 1.00 0.00 N ATOM 0 H GLN A 50 14.808 -2.683 -1.902 1.00 0.00 H new ATOM 0 HA GLN A 50 13.624 -3.435 -3.634 1.00 0.00 H new ATOM 0 HB2 GLN A 50 14.960 -1.514 -4.707 1.00 0.00 H new ATOM 0 HB3 GLN A 50 15.959 -2.759 -5.431 1.00 0.00 H new ATOM 0 HG2 GLN A 50 13.870 -3.762 -6.438 1.00 0.00 H new ATOM 0 HG3 GLN A 50 12.967 -2.394 -5.817 1.00 0.00 H new ATOM 0 HE21 GLN A 50 13.339 -3.243 -8.593 1.00 0.00 H new ATOM 0 HE22 GLN A 50 14.084 -1.876 -9.428 1.00 0.00 H new ATOM 801 N SER A 51 15.093 -5.743 -3.126 1.00 0.00 N ATOM 802 CA SER A 51 15.475 -7.136 -3.280 1.00 0.00 C ATOM 803 C SER A 51 14.376 -7.907 -4.014 1.00 0.00 C ATOM 804 O SER A 51 13.215 -7.509 -3.990 1.00 0.00 O ATOM 805 CB SER A 51 15.737 -7.750 -1.904 1.00 0.00 C ATOM 806 OG SER A 51 16.617 -6.935 -1.146 1.00 0.00 O ATOM 0 H SER A 51 14.822 -5.482 -2.178 1.00 0.00 H new ATOM 0 HA SER A 51 16.388 -7.196 -3.873 1.00 0.00 H new ATOM 0 HB2 SER A 51 14.795 -7.870 -1.369 1.00 0.00 H new ATOM 0 HB3 SER A 51 16.166 -8.745 -2.021 1.00 0.00 H new ATOM 0 HG SER A 51 16.106 -6.444 -0.469 1.00 0.00 H new ATOM 812 N PRO A 52 14.727 -9.007 -4.696 1.00 0.00 N ATOM 813 CA PRO A 52 13.751 -9.820 -5.430 1.00 0.00 C ATOM 814 C PRO A 52 12.824 -10.602 -4.500 1.00 0.00 C ATOM 815 O PRO A 52 11.784 -11.109 -4.923 1.00 0.00 O ATOM 816 CB PRO A 52 14.625 -10.777 -6.246 1.00 0.00 C ATOM 817 CG PRO A 52 15.899 -10.875 -5.483 1.00 0.00 C ATOM 818 CD PRO A 52 16.100 -9.532 -4.833 1.00 0.00 C ATOM 0 HA PRO A 52 13.087 -9.205 -6.038 1.00 0.00 H new ATOM 0 HB2 PRO A 52 14.151 -11.753 -6.351 1.00 0.00 H new ATOM 0 HB3 PRO A 52 14.795 -10.396 -7.253 1.00 0.00 H new ATOM 0 HG2 PRO A 52 15.846 -11.666 -4.735 1.00 0.00 H new ATOM 0 HG3 PRO A 52 16.732 -11.117 -6.144 1.00 0.00 H new ATOM 0 HD2 PRO A 52 16.593 -9.624 -3.865 1.00 0.00 H new ATOM 0 HD3 PRO A 52 16.721 -8.878 -5.446 1.00 0.00 H new ATOM 826 N GLU A 53 13.210 -10.705 -3.234 1.00 0.00 N ATOM 827 CA GLU A 53 12.424 -11.449 -2.259 1.00 0.00 C ATOM 828 C GLU A 53 11.744 -10.503 -1.280 1.00 0.00 C ATOM 829 O GLU A 53 10.522 -10.501 -1.144 1.00 0.00 O ATOM 830 CB GLU A 53 13.309 -12.407 -1.462 1.00 0.00 C ATOM 831 CG GLU A 53 14.373 -13.110 -2.278 1.00 0.00 C ATOM 832 CD GLU A 53 15.352 -13.865 -1.403 1.00 0.00 C ATOM 833 OE1 GLU A 53 16.035 -13.220 -0.575 1.00 0.00 O ATOM 834 OE2 GLU A 53 15.454 -15.099 -1.546 1.00 0.00 O ATOM 0 H GLU A 53 14.060 -10.284 -2.860 1.00 0.00 H new ATOM 0 HA GLU A 53 11.674 -12.014 -2.812 1.00 0.00 H new ATOM 0 HB2 GLU A 53 13.794 -11.850 -0.660 1.00 0.00 H new ATOM 0 HB3 GLU A 53 12.676 -13.159 -0.991 1.00 0.00 H new ATOM 0 HG2 GLU A 53 13.898 -13.803 -2.973 1.00 0.00 H new ATOM 0 HG3 GLU A 53 14.913 -12.377 -2.878 1.00 0.00 H new ATOM 841 N HIS A 54 12.556 -9.709 -0.588 1.00 0.00 N ATOM 842 CA HIS A 54 12.073 -8.901 0.526 1.00 0.00 C ATOM 843 C HIS A 54 12.126 -7.416 0.187 1.00 0.00 C ATOM 844 O HIS A 54 12.687 -7.025 -0.832 1.00 0.00 O ATOM 845 CB HIS A 54 12.906 -9.178 1.787 1.00 0.00 C ATOM 846 CG HIS A 54 13.068 -10.637 2.099 1.00 0.00 C ATOM 847 ND1 HIS A 54 14.135 -11.144 2.808 1.00 0.00 N ATOM 848 CD2 HIS A 54 12.308 -11.702 1.762 1.00 0.00 C ATOM 849 CE1 HIS A 54 14.025 -12.455 2.887 1.00 0.00 C ATOM 850 NE2 HIS A 54 12.924 -12.817 2.262 1.00 0.00 N ATOM 0 H HIS A 54 13.553 -9.608 -0.780 1.00 0.00 H new ATOM 0 HA HIS A 54 11.035 -9.175 0.715 1.00 0.00 H new ATOM 0 HB2 HIS A 54 13.892 -8.731 1.665 1.00 0.00 H new ATOM 0 HB3 HIS A 54 12.435 -8.684 2.637 1.00 0.00 H new ATOM 0 HD2 HIS A 54 11.385 -11.678 1.202 1.00 0.00 H new ATOM 0 HE1 HIS A 54 14.719 -13.119 3.380 1.00 0.00 H new ATOM 0 HE2 HIS A 54 12.585 -13.774 2.166 1.00 0.00 H new ATOM 859 N PHE A 55 11.556 -6.600 1.064 1.00 0.00 N ATOM 860 CA PHE A 55 11.459 -5.162 0.842 1.00 0.00 C ATOM 861 C PHE A 55 11.751 -4.414 2.138 1.00 0.00 C ATOM 862 O PHE A 55 11.620 -4.977 3.229 1.00 0.00 O ATOM 863 CB PHE A 55 10.051 -4.804 0.346 1.00 0.00 C ATOM 864 CG PHE A 55 8.977 -5.057 1.373 1.00 0.00 C ATOM 865 CD1 PHE A 55 8.579 -6.350 1.681 1.00 0.00 C ATOM 866 CD2 PHE A 55 8.377 -4.001 2.041 1.00 0.00 C ATOM 867 CE1 PHE A 55 7.607 -6.584 2.632 1.00 0.00 C ATOM 868 CE2 PHE A 55 7.404 -4.230 2.995 1.00 0.00 C ATOM 869 CZ PHE A 55 7.020 -5.523 3.292 1.00 0.00 C ATOM 0 H PHE A 55 11.149 -6.914 1.945 1.00 0.00 H new ATOM 0 HA PHE A 55 12.191 -4.871 0.088 1.00 0.00 H new ATOM 0 HB2 PHE A 55 10.030 -3.752 0.060 1.00 0.00 H new ATOM 0 HB3 PHE A 55 9.831 -5.383 -0.551 1.00 0.00 H new ATOM 0 HD1 PHE A 55 9.036 -7.184 1.170 1.00 0.00 H new ATOM 0 HD2 PHE A 55 8.673 -2.988 1.813 1.00 0.00 H new ATOM 0 HE1 PHE A 55 7.306 -7.596 2.860 1.00 0.00 H new ATOM 0 HE2 PHE A 55 6.944 -3.398 3.508 1.00 0.00 H new ATOM 0 HZ PHE A 55 6.262 -5.704 4.039 1.00 0.00 H new ATOM 879 N SER A 56 12.151 -3.157 2.025 1.00 0.00 N ATOM 880 CA SER A 56 12.399 -2.328 3.193 1.00 0.00 C ATOM 881 C SER A 56 12.258 -0.852 2.841 1.00 0.00 C ATOM 882 O SER A 56 12.628 -0.425 1.743 1.00 0.00 O ATOM 883 CB SER A 56 13.794 -2.606 3.762 1.00 0.00 C ATOM 884 OG SER A 56 13.928 -3.965 4.159 1.00 0.00 O ATOM 0 H SER A 56 12.311 -2.688 1.133 1.00 0.00 H new ATOM 0 HA SER A 56 11.658 -2.576 3.952 1.00 0.00 H new ATOM 0 HB2 SER A 56 14.549 -2.368 3.013 1.00 0.00 H new ATOM 0 HB3 SER A 56 13.977 -1.955 4.617 1.00 0.00 H new ATOM 0 HG SER A 56 13.045 -4.389 4.176 1.00 0.00 H new ATOM 890 N MET A 57 11.699 -0.084 3.764 1.00 0.00 N ATOM 891 CA MET A 57 11.543 1.352 3.582 1.00 0.00 C ATOM 892 C MET A 57 12.357 2.094 4.634 1.00 0.00 C ATOM 893 O MET A 57 12.550 1.594 5.743 1.00 0.00 O ATOM 894 CB MET A 57 10.066 1.764 3.682 1.00 0.00 C ATOM 895 CG MET A 57 9.183 1.256 2.546 1.00 0.00 C ATOM 896 SD MET A 57 8.814 -0.508 2.664 1.00 0.00 S ATOM 897 CE MET A 57 7.856 -0.558 4.179 1.00 0.00 C ATOM 0 H MET A 57 11.343 -0.434 4.653 1.00 0.00 H new ATOM 0 HA MET A 57 11.904 1.613 2.587 1.00 0.00 H new ATOM 0 HB2 MET A 57 9.664 1.399 4.627 1.00 0.00 H new ATOM 0 HB3 MET A 57 10.008 2.852 3.710 1.00 0.00 H new ATOM 0 HG2 MET A 57 8.248 1.816 2.543 1.00 0.00 H new ATOM 0 HG3 MET A 57 9.677 1.454 1.595 1.00 0.00 H new ATOM 0 HE1 MET A 57 7.080 -1.318 4.094 1.00 0.00 H new ATOM 0 HE2 MET A 57 8.511 -0.800 5.016 1.00 0.00 H new ATOM 0 HE3 MET A 57 7.394 0.414 4.350 1.00 0.00 H new ATOM 907 N ASP A 58 12.839 3.278 4.282 1.00 0.00 N ATOM 908 CA ASP A 58 13.630 4.082 5.203 1.00 0.00 C ATOM 909 C ASP A 58 12.693 4.904 6.091 1.00 0.00 C ATOM 910 O ASP A 58 11.697 5.444 5.609 1.00 0.00 O ATOM 911 CB ASP A 58 14.558 4.995 4.386 1.00 0.00 C ATOM 912 CG ASP A 58 15.510 5.818 5.230 1.00 0.00 C ATOM 913 OD1 ASP A 58 15.062 6.792 5.860 1.00 0.00 O ATOM 914 OD2 ASP A 58 16.718 5.521 5.238 1.00 0.00 O ATOM 0 H ASP A 58 12.696 3.703 3.366 1.00 0.00 H new ATOM 0 HA ASP A 58 14.237 3.445 5.846 1.00 0.00 H new ATOM 0 HB2 ASP A 58 15.137 4.383 3.695 1.00 0.00 H new ATOM 0 HB3 ASP A 58 13.949 5.668 3.782 1.00 0.00 H new ATOM 919 N PRO A 59 13.006 5.028 7.393 1.00 0.00 N ATOM 920 CA PRO A 59 12.162 5.756 8.351 1.00 0.00 C ATOM 921 C PRO A 59 12.191 7.264 8.129 1.00 0.00 C ATOM 922 O PRO A 59 11.213 7.963 8.387 1.00 0.00 O ATOM 923 CB PRO A 59 12.769 5.406 9.718 1.00 0.00 C ATOM 924 CG PRO A 59 13.700 4.266 9.461 1.00 0.00 C ATOM 925 CD PRO A 59 14.176 4.436 8.050 1.00 0.00 C ATOM 0 HA PRO A 59 11.114 5.474 8.253 1.00 0.00 H new ATOM 0 HB2 PRO A 59 13.300 6.259 10.142 1.00 0.00 H new ATOM 0 HB3 PRO A 59 11.994 5.127 10.432 1.00 0.00 H new ATOM 0 HG2 PRO A 59 14.536 4.279 10.160 1.00 0.00 H new ATOM 0 HG3 PRO A 59 13.192 3.310 9.590 1.00 0.00 H new ATOM 0 HD2 PRO A 59 15.048 5.087 7.991 1.00 0.00 H new ATOM 0 HD3 PRO A 59 14.458 3.485 7.599 1.00 0.00 H new ATOM 933 N ARG A 60 13.314 7.752 7.633 1.00 0.00 N ATOM 934 CA ARG A 60 13.485 9.166 7.335 1.00 0.00 C ATOM 935 C ARG A 60 12.733 9.523 6.058 1.00 0.00 C ATOM 936 O ARG A 60 12.065 10.558 5.979 1.00 0.00 O ATOM 937 CB ARG A 60 14.979 9.470 7.202 1.00 0.00 C ATOM 938 CG ARG A 60 15.317 10.595 6.244 1.00 0.00 C ATOM 939 CD ARG A 60 16.735 10.439 5.725 1.00 0.00 C ATOM 940 NE ARG A 60 16.979 9.080 5.236 1.00 0.00 N ATOM 941 CZ ARG A 60 17.600 8.795 4.095 1.00 0.00 C ATOM 942 NH1 ARG A 60 18.000 9.769 3.291 1.00 0.00 N ATOM 943 NH2 ARG A 60 17.798 7.532 3.747 1.00 0.00 N ATOM 0 H ARG A 60 14.133 7.181 7.425 1.00 0.00 H new ATOM 0 HA ARG A 60 13.075 9.771 8.143 1.00 0.00 H new ATOM 0 HB2 ARG A 60 15.373 9.720 8.187 1.00 0.00 H new ATOM 0 HB3 ARG A 60 15.491 8.566 6.873 1.00 0.00 H new ATOM 0 HG2 ARG A 60 14.615 10.594 5.410 1.00 0.00 H new ATOM 0 HG3 ARG A 60 15.211 11.555 6.749 1.00 0.00 H new ATOM 0 HD2 ARG A 60 16.910 11.154 4.921 1.00 0.00 H new ATOM 0 HD3 ARG A 60 17.443 10.674 6.520 1.00 0.00 H new ATOM 0 HE ARG A 60 16.651 8.302 5.808 1.00 0.00 H new ATOM 0 HH11 ARG A 60 17.832 10.742 3.546 1.00 0.00 H new ATOM 0 HH12 ARG A 60 18.476 9.546 2.417 1.00 0.00 H new ATOM 0 HH21 ARG A 60 17.474 6.779 4.354 1.00 0.00 H new ATOM 0 HH22 ARG A 60 18.274 7.313 2.872 1.00 0.00 H new ATOM 957 N GLU A 61 12.838 8.651 5.061 1.00 0.00 N ATOM 958 CA GLU A 61 12.080 8.807 3.824 1.00 0.00 C ATOM 959 C GLU A 61 10.585 8.742 4.121 1.00 0.00 C ATOM 960 O GLU A 61 9.798 9.545 3.616 1.00 0.00 O ATOM 961 CB GLU A 61 12.459 7.715 2.821 1.00 0.00 C ATOM 962 CG GLU A 61 13.870 7.837 2.273 1.00 0.00 C ATOM 963 CD GLU A 61 14.067 9.078 1.424 1.00 0.00 C ATOM 964 OE1 GLU A 61 13.080 9.580 0.849 1.00 0.00 O ATOM 965 OE2 GLU A 61 15.216 9.552 1.319 1.00 0.00 O ATOM 0 H GLU A 61 13.441 7.828 5.085 1.00 0.00 H new ATOM 0 HA GLU A 61 12.319 9.777 3.389 1.00 0.00 H new ATOM 0 HB2 GLU A 61 12.350 6.743 3.301 1.00 0.00 H new ATOM 0 HB3 GLU A 61 11.755 7.740 1.990 1.00 0.00 H new ATOM 0 HG2 GLU A 61 14.577 7.854 3.103 1.00 0.00 H new ATOM 0 HG3 GLU A 61 14.101 6.954 1.677 1.00 0.00 H new ATOM 972 N GLN A 62 10.212 7.785 4.963 1.00 0.00 N ATOM 973 CA GLN A 62 8.834 7.598 5.380 1.00 0.00 C ATOM 974 C GLN A 62 8.313 8.822 6.134 1.00 0.00 C ATOM 975 O GLN A 62 7.205 9.291 5.876 1.00 0.00 O ATOM 976 CB GLN A 62 8.743 6.350 6.257 1.00 0.00 C ATOM 977 CG GLN A 62 7.379 6.125 6.865 1.00 0.00 C ATOM 978 CD GLN A 62 7.283 4.809 7.608 1.00 0.00 C ATOM 979 OE1 GLN A 62 6.899 3.790 7.040 1.00 0.00 O ATOM 980 NE2 GLN A 62 7.656 4.819 8.876 1.00 0.00 N ATOM 0 H GLN A 62 10.862 7.116 5.375 1.00 0.00 H new ATOM 0 HA GLN A 62 8.211 7.470 4.495 1.00 0.00 H new ATOM 0 HB2 GLN A 62 9.012 5.478 5.660 1.00 0.00 H new ATOM 0 HB3 GLN A 62 9.478 6.427 7.058 1.00 0.00 H new ATOM 0 HG2 GLN A 62 7.151 6.942 7.550 1.00 0.00 H new ATOM 0 HG3 GLN A 62 6.626 6.149 6.078 1.00 0.00 H new ATOM 0 HE21 GLN A 62 7.968 5.688 9.309 1.00 0.00 H new ATOM 0 HE22 GLN A 62 7.631 3.958 9.422 1.00 0.00 H new ATOM 989 N LEU A 63 9.125 9.341 7.049 1.00 0.00 N ATOM 990 CA LEU A 63 8.747 10.502 7.851 1.00 0.00 C ATOM 991 C LEU A 63 8.381 11.688 6.961 1.00 0.00 C ATOM 992 O LEU A 63 7.375 12.363 7.188 1.00 0.00 O ATOM 993 CB LEU A 63 9.895 10.888 8.785 1.00 0.00 C ATOM 994 CG LEU A 63 9.612 12.071 9.717 1.00 0.00 C ATOM 995 CD1 LEU A 63 8.476 11.744 10.674 1.00 0.00 C ATOM 996 CD2 LEU A 63 10.867 12.453 10.484 1.00 0.00 C ATOM 0 H LEU A 63 10.054 8.974 7.255 1.00 0.00 H new ATOM 0 HA LEU A 63 7.872 10.236 8.444 1.00 0.00 H new ATOM 0 HB2 LEU A 63 10.154 10.021 9.393 1.00 0.00 H new ATOM 0 HB3 LEU A 63 10.770 11.125 8.180 1.00 0.00 H new ATOM 0 HG LEU A 63 9.307 12.922 9.109 1.00 0.00 H new ATOM 0 HD11 LEU A 63 8.292 12.598 11.326 1.00 0.00 H new ATOM 0 HD12 LEU A 63 7.573 11.521 10.105 1.00 0.00 H new ATOM 0 HD13 LEU A 63 8.747 10.878 11.278 1.00 0.00 H new ATOM 0 HD21 LEU A 63 10.650 13.295 11.142 1.00 0.00 H new ATOM 0 HD22 LEU A 63 11.202 11.604 11.080 1.00 0.00 H new ATOM 0 HD23 LEU A 63 11.651 12.735 9.781 1.00 0.00 H new ATOM 1008 N THR A 64 9.192 11.912 5.937 1.00 0.00 N ATOM 1009 CA THR A 64 8.975 13.008 5.001 1.00 0.00 C ATOM 1010 C THR A 64 7.627 12.864 4.292 1.00 0.00 C ATOM 1011 O THR A 64 6.917 13.848 4.074 1.00 0.00 O ATOM 1012 CB THR A 64 10.110 13.058 3.958 1.00 0.00 C ATOM 1013 OG1 THR A 64 11.380 12.960 4.619 1.00 0.00 O ATOM 1014 CG2 THR A 64 10.053 14.348 3.153 1.00 0.00 C ATOM 0 H THR A 64 10.014 11.344 5.732 1.00 0.00 H new ATOM 0 HA THR A 64 8.971 13.938 5.570 1.00 0.00 H new ATOM 0 HB THR A 64 9.985 12.218 3.275 1.00 0.00 H new ATOM 0 HG1 THR A 64 11.532 12.033 4.900 1.00 0.00 H new ATOM 0 HG21 THR A 64 10.864 14.358 2.425 1.00 0.00 H new ATOM 0 HG22 THR A 64 9.097 14.410 2.633 1.00 0.00 H new ATOM 0 HG23 THR A 64 10.157 15.201 3.824 1.00 0.00 H new ATOM 1022 N ALA A 65 7.270 11.631 3.957 1.00 0.00 N ATOM 1023 CA ALA A 65 6.016 11.358 3.271 1.00 0.00 C ATOM 1024 C ALA A 65 4.826 11.506 4.216 1.00 0.00 C ATOM 1025 O ALA A 65 3.819 12.124 3.867 1.00 0.00 O ATOM 1026 CB ALA A 65 6.043 9.963 2.660 1.00 0.00 C ATOM 0 H ALA A 65 7.833 10.803 4.150 1.00 0.00 H new ATOM 0 HA ALA A 65 5.900 12.090 2.472 1.00 0.00 H new ATOM 0 HB1 ALA A 65 5.099 9.771 2.150 1.00 0.00 H new ATOM 0 HB2 ALA A 65 6.863 9.895 1.945 1.00 0.00 H new ATOM 0 HB3 ALA A 65 6.187 9.223 3.448 1.00 0.00 H new ATOM 1032 N VAL A 66 4.952 10.946 5.418 1.00 0.00 N ATOM 1033 CA VAL A 66 3.880 10.999 6.409 1.00 0.00 C ATOM 1034 C VAL A 66 3.596 12.436 6.832 1.00 0.00 C ATOM 1035 O VAL A 66 2.445 12.813 7.054 1.00 0.00 O ATOM 1036 CB VAL A 66 4.218 10.157 7.661 1.00 0.00 C ATOM 1037 CG1 VAL A 66 3.104 10.241 8.694 1.00 0.00 C ATOM 1038 CG2 VAL A 66 4.466 8.709 7.277 1.00 0.00 C ATOM 0 H VAL A 66 5.787 10.450 5.729 1.00 0.00 H new ATOM 0 HA VAL A 66 2.992 10.580 5.935 1.00 0.00 H new ATOM 0 HB VAL A 66 5.127 10.565 8.104 1.00 0.00 H new ATOM 0 HG11 VAL A 66 3.368 9.640 9.564 1.00 0.00 H new ATOM 0 HG12 VAL A 66 2.967 11.279 8.998 1.00 0.00 H new ATOM 0 HG13 VAL A 66 2.177 9.865 8.261 1.00 0.00 H new ATOM 0 HG21 VAL A 66 4.703 8.131 8.170 1.00 0.00 H new ATOM 0 HG22 VAL A 66 3.573 8.299 6.806 1.00 0.00 H new ATOM 0 HG23 VAL A 66 5.301 8.656 6.579 1.00 0.00 H new ATOM 1048 N LYS A 67 4.645 13.240 6.918 1.00 0.00 N ATOM 1049 CA LYS A 67 4.502 14.630 7.324 1.00 0.00 C ATOM 1050 C LYS A 67 3.635 15.394 6.329 1.00 0.00 C ATOM 1051 O LYS A 67 2.771 16.177 6.721 1.00 0.00 O ATOM 1052 CB LYS A 67 5.874 15.291 7.452 1.00 0.00 C ATOM 1053 CG LYS A 67 5.834 16.662 8.110 1.00 0.00 C ATOM 1054 CD LYS A 67 7.207 17.081 8.609 1.00 0.00 C ATOM 1055 CE LYS A 67 7.696 16.162 9.719 1.00 0.00 C ATOM 1056 NZ LYS A 67 9.010 16.593 10.258 1.00 0.00 N ATOM 0 H LYS A 67 5.603 12.955 6.713 1.00 0.00 H new ATOM 0 HA LYS A 67 4.011 14.655 8.297 1.00 0.00 H new ATOM 0 HB2 LYS A 67 6.529 14.639 8.030 1.00 0.00 H new ATOM 0 HB3 LYS A 67 6.315 15.387 6.460 1.00 0.00 H new ATOM 0 HG2 LYS A 67 5.465 17.399 7.396 1.00 0.00 H new ATOM 0 HG3 LYS A 67 5.132 16.646 8.944 1.00 0.00 H new ATOM 0 HD2 LYS A 67 7.917 17.066 7.782 1.00 0.00 H new ATOM 0 HD3 LYS A 67 7.166 18.107 8.975 1.00 0.00 H new ATOM 0 HE2 LYS A 67 6.962 16.144 10.525 1.00 0.00 H new ATOM 0 HE3 LYS A 67 7.777 15.144 9.338 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 9.307 15.941 11.012 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 9.717 16.586 9.495 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 8.928 17.555 10.645 1.00 0.00 H new ATOM 1070 N ASP A 68 3.855 15.145 5.043 1.00 0.00 N ATOM 1071 CA ASP A 68 3.072 15.795 3.989 1.00 0.00 C ATOM 1072 C ASP A 68 1.653 15.244 3.983 1.00 0.00 C ATOM 1073 O ASP A 68 0.680 15.974 3.788 1.00 0.00 O ATOM 1074 CB ASP A 68 3.720 15.555 2.624 1.00 0.00 C ATOM 1075 CG ASP A 68 3.061 16.348 1.507 1.00 0.00 C ATOM 1076 OD1 ASP A 68 2.978 17.591 1.619 1.00 0.00 O ATOM 1077 OD2 ASP A 68 2.657 15.733 0.494 1.00 0.00 O ATOM 0 H ASP A 68 4.567 14.499 4.702 1.00 0.00 H new ATOM 0 HA ASP A 68 3.043 16.867 4.186 1.00 0.00 H new ATOM 0 HB2 ASP A 68 4.776 15.821 2.677 1.00 0.00 H new ATOM 0 HB3 ASP A 68 3.671 14.492 2.386 1.00 0.00 H new ATOM 1082 N MET A 69 1.567 13.944 4.213 1.00 0.00 N ATOM 1083 CA MET A 69 0.295 13.232 4.291 1.00 0.00 C ATOM 1084 C MET A 69 -0.595 13.827 5.374 1.00 0.00 C ATOM 1085 O MET A 69 -1.765 14.137 5.145 1.00 0.00 O ATOM 1086 CB MET A 69 0.576 11.770 4.626 1.00 0.00 C ATOM 1087 CG MET A 69 -0.591 10.828 4.396 1.00 0.00 C ATOM 1088 SD MET A 69 -0.222 9.153 4.950 1.00 0.00 S ATOM 1089 CE MET A 69 1.347 8.869 4.133 1.00 0.00 C ATOM 0 H MET A 69 2.382 13.346 4.352 1.00 0.00 H new ATOM 0 HA MET A 69 -0.219 13.319 3.334 1.00 0.00 H new ATOM 0 HB2 MET A 69 1.422 11.431 4.028 1.00 0.00 H new ATOM 0 HB3 MET A 69 0.878 11.703 5.671 1.00 0.00 H new ATOM 0 HG2 MET A 69 -1.468 11.201 4.925 1.00 0.00 H new ATOM 0 HG3 MET A 69 -0.842 10.813 3.335 1.00 0.00 H new ATOM 0 HE1 MET A 69 1.321 7.908 3.619 1.00 0.00 H new ATOM 0 HE2 MET A 69 1.529 9.663 3.408 1.00 0.00 H new ATOM 0 HE3 MET A 69 2.147 8.863 4.873 1.00 0.00 H new ATOM 1099 N ARG A 70 -0.015 14.005 6.550 1.00 0.00 N ATOM 1100 CA ARG A 70 -0.739 14.551 7.689 1.00 0.00 C ATOM 1101 C ARG A 70 -0.997 16.042 7.501 1.00 0.00 C ATOM 1102 O ARG A 70 -1.978 16.584 8.012 1.00 0.00 O ATOM 1103 CB ARG A 70 0.049 14.311 8.976 1.00 0.00 C ATOM 1104 CG ARG A 70 -0.708 14.699 10.232 1.00 0.00 C ATOM 1105 CD ARG A 70 0.140 14.500 11.473 1.00 0.00 C ATOM 1106 NE ARG A 70 -0.598 14.833 12.686 1.00 0.00 N ATOM 1107 CZ ARG A 70 -0.102 15.565 13.677 1.00 0.00 C ATOM 1108 NH1 ARG A 70 1.121 16.074 13.586 1.00 0.00 N ATOM 1109 NH2 ARG A 70 -0.841 15.803 14.752 1.00 0.00 N ATOM 0 H ARG A 70 0.961 13.778 6.742 1.00 0.00 H new ATOM 0 HA ARG A 70 -1.701 14.043 7.761 1.00 0.00 H new ATOM 0 HB2 ARG A 70 0.319 13.257 9.036 1.00 0.00 H new ATOM 0 HB3 ARG A 70 0.980 14.877 8.933 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -1.018 15.742 10.164 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -1.616 14.101 10.310 1.00 0.00 H new ATOM 0 HD2 ARG A 70 0.475 13.464 11.523 1.00 0.00 H new ATOM 0 HD3 ARG A 70 1.033 15.121 11.408 1.00 0.00 H new ATOM 0 HE ARG A 70 -1.552 14.483 12.779 1.00 0.00 H new ATOM 0 HH11 ARG A 70 1.684 15.903 12.753 1.00 0.00 H new ATOM 0 HH12 ARG A 70 1.498 16.636 14.350 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -1.786 15.424 14.815 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -0.464 16.365 15.516 1.00 0.00 H new ATOM 1123 N LYS A 71 -0.113 16.690 6.754 1.00 0.00 N ATOM 1124 CA LYS A 71 -0.226 18.116 6.467 1.00 0.00 C ATOM 1125 C LYS A 71 -1.472 18.402 5.637 1.00 0.00 C ATOM 1126 O LYS A 71 -2.108 19.446 5.787 1.00 0.00 O ATOM 1127 CB LYS A 71 1.021 18.588 5.720 1.00 0.00 C ATOM 1128 CG LYS A 71 1.049 20.080 5.436 1.00 0.00 C ATOM 1129 CD LYS A 71 2.333 20.481 4.736 1.00 0.00 C ATOM 1130 CE LYS A 71 2.268 21.911 4.231 1.00 0.00 C ATOM 1131 NZ LYS A 71 1.169 22.096 3.245 1.00 0.00 N ATOM 0 H LYS A 71 0.701 16.244 6.330 1.00 0.00 H new ATOM 0 HA LYS A 71 -0.311 18.658 7.409 1.00 0.00 H new ATOM 0 HB2 LYS A 71 1.903 18.324 6.304 1.00 0.00 H new ATOM 0 HB3 LYS A 71 1.091 18.048 4.776 1.00 0.00 H new ATOM 0 HG2 LYS A 71 0.194 20.351 4.817 1.00 0.00 H new ATOM 0 HG3 LYS A 71 0.953 20.633 6.371 1.00 0.00 H new ATOM 0 HD2 LYS A 71 3.172 20.375 5.424 1.00 0.00 H new ATOM 0 HD3 LYS A 71 2.519 19.807 3.900 1.00 0.00 H new ATOM 0 HE2 LYS A 71 2.120 22.588 5.072 1.00 0.00 H new ATOM 0 HE3 LYS A 71 3.219 22.178 3.770 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 1.523 22.631 2.426 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 0.826 21.166 2.929 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 0.388 22.620 3.689 1.00 0.00 H new ATOM 1145 N ASN A 72 -1.810 17.474 4.755 1.00 0.00 N ATOM 1146 CA ASN A 72 -3.005 17.610 3.930 1.00 0.00 C ATOM 1147 C ASN A 72 -4.233 17.094 4.681 1.00 0.00 C ATOM 1148 O ASN A 72 -5.369 17.439 4.354 1.00 0.00 O ATOM 1149 CB ASN A 72 -2.836 16.858 2.608 1.00 0.00 C ATOM 1150 CG ASN A 72 -3.937 17.170 1.607 1.00 0.00 C ATOM 1151 OD1 ASN A 72 -4.305 16.326 0.795 1.00 0.00 O ATOM 1152 ND2 ASN A 72 -4.455 18.388 1.640 1.00 0.00 N ATOM 0 H ASN A 72 -1.277 16.620 4.591 1.00 0.00 H new ATOM 0 HA ASN A 72 -3.150 18.667 3.709 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -1.871 17.114 2.171 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -2.823 15.786 2.804 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -5.184 18.650 0.977 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -4.125 19.064 2.329 1.00 0.00 H new ATOM 1159 N GLY A 73 -3.999 16.278 5.699 1.00 0.00 N ATOM 1160 CA GLY A 73 -5.092 15.785 6.513 1.00 0.00 C ATOM 1161 C GLY A 73 -5.402 14.325 6.259 1.00 0.00 C ATOM 1162 O GLY A 73 -6.569 13.937 6.188 1.00 0.00 O ATOM 0 H GLY A 73 -3.074 15.949 5.976 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -4.845 15.921 7.566 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -5.983 16.380 6.315 1.00 0.00 H new ATOM 1166 N TRP A 74 -4.361 13.519 6.111 1.00 0.00 N ATOM 1167 CA TRP A 74 -4.519 12.081 5.951 1.00 0.00 C ATOM 1168 C TRP A 74 -3.680 11.333 6.973 1.00 0.00 C ATOM 1169 O TRP A 74 -2.836 11.922 7.651 1.00 0.00 O ATOM 1170 CB TRP A 74 -4.116 11.632 4.547 1.00 0.00 C ATOM 1171 CG TRP A 74 -5.106 11.997 3.491 1.00 0.00 C ATOM 1172 CD1 TRP A 74 -6.462 11.869 3.565 1.00 0.00 C ATOM 1173 CD2 TRP A 74 -4.822 12.525 2.193 1.00 0.00 C ATOM 1174 NE1 TRP A 74 -7.038 12.293 2.396 1.00 0.00 N ATOM 1175 CE2 TRP A 74 -6.053 12.700 1.537 1.00 0.00 C ATOM 1176 CE3 TRP A 74 -3.646 12.869 1.522 1.00 0.00 C ATOM 1177 CZ2 TRP A 74 -6.145 13.205 0.245 1.00 0.00 C ATOM 1178 CZ3 TRP A 74 -3.740 13.369 0.238 1.00 0.00 C ATOM 1179 CH2 TRP A 74 -4.980 13.532 -0.389 1.00 0.00 C ATOM 0 H TRP A 74 -3.393 13.839 6.098 1.00 0.00 H new ATOM 0 HA TRP A 74 -5.573 11.851 6.106 1.00 0.00 H new ATOM 0 HB2 TRP A 74 -3.152 12.075 4.297 1.00 0.00 H new ATOM 0 HB3 TRP A 74 -3.980 10.551 4.546 1.00 0.00 H new ATOM 0 HD1 TRP A 74 -7.002 11.489 4.419 1.00 0.00 H new ATOM 0 HE1 TRP A 74 -8.039 12.304 2.198 1.00 0.00 H new ATOM 0 HE3 TRP A 74 -2.684 12.747 1.997 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 -7.102 13.334 -0.239 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 -2.839 13.639 -0.292 1.00 0.00 H new ATOM 0 HH2 TRP A 74 -5.017 13.924 -1.395 1.00 0.00 H new ATOM 1190 N VAL A 75 -3.920 10.035 7.076 1.00 0.00 N ATOM 1191 CA VAL A 75 -3.161 9.178 7.970 1.00 0.00 C ATOM 1192 C VAL A 75 -2.659 7.948 7.223 1.00 0.00 C ATOM 1193 O VAL A 75 -3.152 7.626 6.138 1.00 0.00 O ATOM 1194 CB VAL A 75 -3.997 8.730 9.193 1.00 0.00 C ATOM 1195 CG1 VAL A 75 -4.371 9.926 10.060 1.00 0.00 C ATOM 1196 CG2 VAL A 75 -5.244 7.976 8.749 1.00 0.00 C ATOM 0 H VAL A 75 -4.643 9.549 6.545 1.00 0.00 H new ATOM 0 HA VAL A 75 -2.315 9.762 8.334 1.00 0.00 H new ATOM 0 HB VAL A 75 -3.386 8.054 9.791 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -4.958 9.587 10.914 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -3.464 10.416 10.415 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -4.958 10.632 9.473 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -5.816 7.671 9.625 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -5.857 8.624 8.123 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -4.952 7.093 8.181 1.00 0.00 H new ATOM 1206 N MET A 76 -1.682 7.267 7.806 1.00 0.00 N ATOM 1207 CA MET A 76 -1.111 6.071 7.199 1.00 0.00 C ATOM 1208 C MET A 76 -2.086 4.903 7.303 1.00 0.00 C ATOM 1209 O MET A 76 -2.535 4.554 8.395 1.00 0.00 O ATOM 1210 CB MET A 76 0.217 5.713 7.872 1.00 0.00 C ATOM 1211 CG MET A 76 0.829 4.408 7.378 1.00 0.00 C ATOM 1212 SD MET A 76 2.403 4.029 8.174 1.00 0.00 S ATOM 1213 CE MET A 76 3.456 5.298 7.480 1.00 0.00 C ATOM 0 H MET A 76 -1.267 7.523 8.702 1.00 0.00 H new ATOM 0 HA MET A 76 -0.924 6.275 6.145 1.00 0.00 H new ATOM 0 HB2 MET A 76 0.928 6.522 7.704 1.00 0.00 H new ATOM 0 HB3 MET A 76 0.060 5.645 8.949 1.00 0.00 H new ATOM 0 HG2 MET A 76 0.129 3.592 7.560 1.00 0.00 H new ATOM 0 HG3 MET A 76 0.977 4.467 6.300 1.00 0.00 H new ATOM 0 HE1 MET A 76 4.366 4.842 7.091 1.00 0.00 H new ATOM 0 HE2 MET A 76 2.930 5.806 6.672 1.00 0.00 H new ATOM 0 HE3 MET A 76 3.714 6.020 8.254 1.00 0.00 H new ATOM 1223 N LEU A 77 -2.421 4.316 6.164 1.00 0.00 N ATOM 1224 CA LEU A 77 -3.342 3.186 6.133 1.00 0.00 C ATOM 1225 C LEU A 77 -2.582 1.872 6.032 1.00 0.00 C ATOM 1226 O LEU A 77 -3.152 0.796 6.220 1.00 0.00 O ATOM 1227 CB LEU A 77 -4.316 3.318 4.961 1.00 0.00 C ATOM 1228 CG LEU A 77 -5.183 4.576 4.973 1.00 0.00 C ATOM 1229 CD1 LEU A 77 -6.147 4.565 3.800 1.00 0.00 C ATOM 1230 CD2 LEU A 77 -5.943 4.689 6.286 1.00 0.00 C ATOM 0 H LEU A 77 -2.071 4.601 5.250 1.00 0.00 H new ATOM 0 HA LEU A 77 -3.909 3.189 7.064 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -3.746 3.298 4.032 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -4.970 2.446 4.953 1.00 0.00 H new ATOM 0 HG LEU A 77 -4.532 5.445 4.878 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -6.758 5.468 3.822 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -5.584 4.531 2.867 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -6.792 3.689 3.867 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -6.555 5.591 6.276 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -6.585 3.817 6.411 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -5.235 4.740 7.113 1.00 0.00 H new ATOM 1242 N GLY A 78 -1.296 1.967 5.729 1.00 0.00 N ATOM 1243 CA GLY A 78 -0.471 0.786 5.613 1.00 0.00 C ATOM 1244 C GLY A 78 0.550 0.918 4.510 1.00 0.00 C ATOM 1245 O GLY A 78 0.942 2.033 4.151 1.00 0.00 O ATOM 0 H GLY A 78 -0.808 2.847 5.561 1.00 0.00 H new ATOM 0 HA2 GLY A 78 0.039 0.605 6.559 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -1.103 -0.081 5.420 1.00 0.00 H new ATOM 1249 N ASN A 79 0.961 -0.208 3.957 1.00 0.00 N ATOM 1250 CA ASN A 79 1.955 -0.221 2.899 1.00 0.00 C ATOM 1251 C ASN A 79 1.642 -1.316 1.895 1.00 0.00 C ATOM 1252 O ASN A 79 0.745 -2.132 2.106 1.00 0.00 O ATOM 1253 CB ASN A 79 3.368 -0.418 3.463 1.00 0.00 C ATOM 1254 CG ASN A 79 3.540 -1.726 4.215 1.00 0.00 C ATOM 1255 OD1 ASN A 79 3.837 -2.765 3.615 1.00 0.00 O ATOM 1256 ND2 ASN A 79 3.374 -1.684 5.529 1.00 0.00 N ATOM 0 H ASN A 79 0.620 -1.131 4.225 1.00 0.00 H new ATOM 0 HA ASN A 79 1.920 0.747 2.398 1.00 0.00 H new ATOM 0 HB2 ASN A 79 4.086 -0.381 2.644 1.00 0.00 H new ATOM 0 HB3 ASN A 79 3.603 0.410 4.131 1.00 0.00 H new ATOM 0 HD21 ASN A 79 3.491 -2.531 6.085 1.00 0.00 H new ATOM 0 HD22 ASN A 79 3.129 -0.805 5.984 1.00 0.00 H new ATOM 1263 N PHE A 80 2.383 -1.332 0.803 1.00 0.00 N ATOM 1264 CA PHE A 80 2.178 -2.327 -0.236 1.00 0.00 C ATOM 1265 C PHE A 80 3.510 -2.844 -0.748 1.00 0.00 C ATOM 1266 O PHE A 80 4.531 -2.169 -0.625 1.00 0.00 O ATOM 1267 CB PHE A 80 1.343 -1.751 -1.393 1.00 0.00 C ATOM 1268 CG PHE A 80 2.003 -0.632 -2.156 1.00 0.00 C ATOM 1269 CD1 PHE A 80 1.882 0.681 -1.732 1.00 0.00 C ATOM 1270 CD2 PHE A 80 2.734 -0.896 -3.307 1.00 0.00 C ATOM 1271 CE1 PHE A 80 2.478 1.709 -2.437 1.00 0.00 C ATOM 1272 CE2 PHE A 80 3.333 0.128 -4.014 1.00 0.00 C ATOM 1273 CZ PHE A 80 3.204 1.433 -3.579 1.00 0.00 C ATOM 0 H PHE A 80 3.133 -0.668 0.611 1.00 0.00 H new ATOM 0 HA PHE A 80 1.626 -3.160 0.198 1.00 0.00 H new ATOM 0 HB2 PHE A 80 1.108 -2.557 -2.089 1.00 0.00 H new ATOM 0 HB3 PHE A 80 0.396 -1.389 -0.993 1.00 0.00 H new ATOM 0 HD1 PHE A 80 1.315 0.904 -0.840 1.00 0.00 H new ATOM 0 HD2 PHE A 80 2.835 -1.914 -3.653 1.00 0.00 H new ATOM 0 HE1 PHE A 80 2.376 2.728 -2.095 1.00 0.00 H new ATOM 0 HE2 PHE A 80 3.902 -0.091 -4.906 1.00 0.00 H new ATOM 0 HZ PHE A 80 3.670 2.236 -4.131 1.00 0.00 H new ATOM 1283 N HIS A 81 3.497 -4.054 -1.289 1.00 0.00 N ATOM 1284 CA HIS A 81 4.678 -4.642 -1.904 1.00 0.00 C ATOM 1285 C HIS A 81 4.260 -5.716 -2.901 1.00 0.00 C ATOM 1286 O HIS A 81 3.359 -6.512 -2.632 1.00 0.00 O ATOM 1287 CB HIS A 81 5.654 -5.188 -0.845 1.00 0.00 C ATOM 1288 CG HIS A 81 5.093 -6.223 0.096 1.00 0.00 C ATOM 1289 ND1 HIS A 81 4.345 -5.906 1.210 1.00 0.00 N ATOM 1290 CD2 HIS A 81 5.234 -7.570 0.116 1.00 0.00 C ATOM 1291 CE1 HIS A 81 4.057 -7.014 1.873 1.00 0.00 C ATOM 1292 NE2 HIS A 81 4.585 -8.042 1.234 1.00 0.00 N ATOM 0 H HIS A 81 2.672 -4.653 -1.314 1.00 0.00 H new ATOM 0 HA HIS A 81 5.215 -3.863 -2.446 1.00 0.00 H new ATOM 0 HB2 HIS A 81 6.513 -5.620 -1.359 1.00 0.00 H new ATOM 0 HB3 HIS A 81 6.024 -4.350 -0.254 1.00 0.00 H new ATOM 0 HD2 HIS A 81 5.761 -8.166 -0.614 1.00 0.00 H new ATOM 0 HE1 HIS A 81 3.484 -7.069 2.787 1.00 0.00 H new ATOM 0 HE2 HIS A 81 4.522 -9.019 1.520 1.00 0.00 H new ATOM 1301 N SER A 82 4.901 -5.724 -4.055 1.00 0.00 N ATOM 1302 CA SER A 82 4.464 -6.552 -5.166 1.00 0.00 C ATOM 1303 C SER A 82 5.566 -7.510 -5.603 1.00 0.00 C ATOM 1304 O SER A 82 6.739 -7.151 -5.630 1.00 0.00 O ATOM 1305 CB SER A 82 4.051 -5.656 -6.338 1.00 0.00 C ATOM 1306 OG SER A 82 3.504 -6.410 -7.410 1.00 0.00 O ATOM 0 H SER A 82 5.731 -5.163 -4.249 1.00 0.00 H new ATOM 0 HA SER A 82 3.611 -7.147 -4.841 1.00 0.00 H new ATOM 0 HB2 SER A 82 3.318 -4.925 -5.996 1.00 0.00 H new ATOM 0 HB3 SER A 82 4.918 -5.097 -6.691 1.00 0.00 H new ATOM 0 HG SER A 82 3.156 -7.260 -7.068 1.00 0.00 H new ATOM 1312 N HIS A 83 5.178 -8.731 -5.945 1.00 0.00 N ATOM 1313 CA HIS A 83 6.131 -9.716 -6.433 1.00 0.00 C ATOM 1314 C HIS A 83 5.806 -10.092 -7.872 1.00 0.00 C ATOM 1315 O HIS A 83 4.634 -10.205 -8.240 1.00 0.00 O ATOM 1316 CB HIS A 83 6.121 -10.966 -5.546 1.00 0.00 C ATOM 1317 CG HIS A 83 6.654 -10.728 -4.165 1.00 0.00 C ATOM 1318 ND1 HIS A 83 6.019 -11.166 -3.022 1.00 0.00 N ATOM 1319 CD2 HIS A 83 7.771 -10.089 -3.749 1.00 0.00 C ATOM 1320 CE1 HIS A 83 6.725 -10.802 -1.966 1.00 0.00 C ATOM 1321 NE2 HIS A 83 7.792 -10.145 -2.377 1.00 0.00 N ATOM 0 H HIS A 83 4.214 -9.061 -5.894 1.00 0.00 H new ATOM 0 HA HIS A 83 7.128 -9.277 -6.398 1.00 0.00 H new ATOM 0 HB2 HIS A 83 5.100 -11.341 -5.472 1.00 0.00 H new ATOM 0 HB3 HIS A 83 6.713 -11.746 -6.025 1.00 0.00 H new ATOM 0 HD2 HIS A 83 8.511 -9.620 -4.380 1.00 0.00 H new ATOM 0 HE1 HIS A 83 6.470 -11.008 -0.937 1.00 0.00 H new ATOM 0 HE2 HIS A 83 8.513 -9.745 -1.776 1.00 0.00 H new ATOM 1330 N PRO A 84 6.839 -10.298 -8.702 1.00 0.00 N ATOM 1331 CA PRO A 84 6.656 -10.611 -10.116 1.00 0.00 C ATOM 1332 C PRO A 84 6.417 -12.099 -10.387 1.00 0.00 C ATOM 1333 O PRO A 84 5.415 -12.469 -10.980 1.00 0.00 O ATOM 1334 CB PRO A 84 7.975 -10.150 -10.733 1.00 0.00 C ATOM 1335 CG PRO A 84 8.992 -10.326 -9.656 1.00 0.00 C ATOM 1336 CD PRO A 84 8.264 -10.182 -8.339 1.00 0.00 C ATOM 0 HA PRO A 84 5.771 -10.127 -10.528 1.00 0.00 H new ATOM 0 HB2 PRO A 84 8.227 -10.742 -11.613 1.00 0.00 H new ATOM 0 HB3 PRO A 84 7.917 -9.110 -11.054 1.00 0.00 H new ATOM 0 HG2 PRO A 84 9.468 -11.304 -9.730 1.00 0.00 H new ATOM 0 HG3 PRO A 84 9.782 -9.580 -9.745 1.00 0.00 H new ATOM 0 HD2 PRO A 84 8.560 -10.958 -7.633 1.00 0.00 H new ATOM 0 HD3 PRO A 84 8.479 -9.223 -7.867 1.00 0.00 H new ATOM 1344 N ALA A 85 7.329 -12.947 -9.943 1.00 0.00 N ATOM 1345 CA ALA A 85 7.240 -14.375 -10.225 1.00 0.00 C ATOM 1346 C ALA A 85 6.765 -15.141 -8.997 1.00 0.00 C ATOM 1347 O ALA A 85 7.230 -16.246 -8.721 1.00 0.00 O ATOM 1348 CB ALA A 85 8.596 -14.897 -10.696 1.00 0.00 C ATOM 0 H ALA A 85 8.139 -12.675 -9.386 1.00 0.00 H new ATOM 0 HA ALA A 85 6.509 -14.530 -11.018 1.00 0.00 H new ATOM 0 HB1 ALA A 85 8.522 -15.964 -10.905 1.00 0.00 H new ATOM 0 HB2 ALA A 85 8.894 -14.370 -11.602 1.00 0.00 H new ATOM 0 HB3 ALA A 85 9.340 -14.730 -9.918 1.00 0.00 H new ATOM 1354 N THR A 86 5.824 -14.558 -8.274 1.00 0.00 N ATOM 1355 CA THR A 86 5.328 -15.161 -7.045 1.00 0.00 C ATOM 1356 C THR A 86 3.888 -14.726 -6.768 1.00 0.00 C ATOM 1357 O THR A 86 3.458 -13.665 -7.229 1.00 0.00 O ATOM 1358 CB THR A 86 6.226 -14.785 -5.848 1.00 0.00 C ATOM 1359 OG1 THR A 86 7.171 -13.777 -6.239 1.00 0.00 O ATOM 1360 CG2 THR A 86 6.971 -16.003 -5.316 1.00 0.00 C ATOM 0 H THR A 86 5.387 -13.668 -8.515 1.00 0.00 H new ATOM 0 HA THR A 86 5.350 -16.243 -7.175 1.00 0.00 H new ATOM 0 HB THR A 86 5.585 -14.398 -5.056 1.00 0.00 H new ATOM 0 HG1 THR A 86 7.693 -13.497 -5.458 1.00 0.00 H new ATOM 0 HG21 THR A 86 7.596 -15.708 -4.473 1.00 0.00 H new ATOM 0 HG22 THR A 86 6.253 -16.755 -4.989 1.00 0.00 H new ATOM 0 HG23 THR A 86 7.598 -16.419 -6.104 1.00 0.00 H new ATOM 1368 N PRO A 87 3.127 -15.550 -6.026 1.00 0.00 N ATOM 1369 CA PRO A 87 1.733 -15.255 -5.674 1.00 0.00 C ATOM 1370 C PRO A 87 1.609 -14.094 -4.687 1.00 0.00 C ATOM 1371 O PRO A 87 2.598 -13.646 -4.099 1.00 0.00 O ATOM 1372 CB PRO A 87 1.230 -16.552 -5.024 1.00 0.00 C ATOM 1373 CG PRO A 87 2.258 -17.586 -5.341 1.00 0.00 C ATOM 1374 CD PRO A 87 3.552 -16.848 -5.483 1.00 0.00 C ATOM 0 HA PRO A 87 1.161 -14.952 -6.551 1.00 0.00 H new ATOM 0 HB2 PRO A 87 1.115 -16.431 -3.947 1.00 0.00 H new ATOM 0 HB3 PRO A 87 0.254 -16.835 -5.419 1.00 0.00 H new ATOM 0 HG2 PRO A 87 2.319 -18.332 -4.549 1.00 0.00 H new ATOM 0 HG3 PRO A 87 2.008 -18.116 -6.260 1.00 0.00 H new ATOM 0 HD2 PRO A 87 4.063 -16.739 -4.526 1.00 0.00 H new ATOM 0 HD3 PRO A 87 4.240 -17.362 -6.155 1.00 0.00 H new ATOM 1382 N ALA A 88 0.386 -13.626 -4.492 1.00 0.00 N ATOM 1383 CA ALA A 88 0.134 -12.494 -3.617 1.00 0.00 C ATOM 1384 C ALA A 88 -0.296 -12.946 -2.225 1.00 0.00 C ATOM 1385 O ALA A 88 -1.472 -12.872 -1.874 1.00 0.00 O ATOM 1386 CB ALA A 88 -0.911 -11.574 -4.226 1.00 0.00 C ATOM 0 H ALA A 88 -0.449 -14.015 -4.930 1.00 0.00 H new ATOM 0 HA ALA A 88 1.068 -11.942 -3.511 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -1.088 -10.731 -3.558 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -0.555 -11.206 -5.188 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -1.841 -12.124 -4.370 1.00 0.00 H new ATOM 1392 N ARG A 89 0.663 -13.455 -1.464 1.00 0.00 N ATOM 1393 CA ARG A 89 0.456 -13.805 -0.062 1.00 0.00 C ATOM 1394 C ARG A 89 1.780 -13.743 0.693 1.00 0.00 C ATOM 1395 O ARG A 89 2.841 -13.958 0.104 1.00 0.00 O ATOM 1396 CB ARG A 89 -0.186 -15.193 0.097 1.00 0.00 C ATOM 1397 CG ARG A 89 -1.704 -15.145 0.181 1.00 0.00 C ATOM 1398 CD ARG A 89 -2.296 -16.454 0.681 1.00 0.00 C ATOM 1399 NE ARG A 89 -3.725 -16.316 0.968 1.00 0.00 N ATOM 1400 CZ ARG A 89 -4.396 -17.069 1.842 1.00 0.00 C ATOM 1401 NH1 ARG A 89 -3.799 -18.074 2.464 1.00 0.00 N ATOM 1402 NH2 ARG A 89 -5.674 -16.820 2.091 1.00 0.00 N ATOM 0 H ARG A 89 1.609 -13.638 -1.800 1.00 0.00 H new ATOM 0 HA ARG A 89 -0.236 -13.077 0.361 1.00 0.00 H new ATOM 0 HB2 ARG A 89 0.105 -15.820 -0.746 1.00 0.00 H new ATOM 0 HB3 ARG A 89 0.206 -15.667 0.997 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -2.003 -14.336 0.847 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -2.113 -14.916 -0.803 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -2.147 -17.232 -0.067 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -1.771 -16.773 1.582 1.00 0.00 H new ATOM 0 HE ARG A 89 -4.243 -15.595 0.466 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -2.817 -18.279 2.277 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -4.321 -18.644 3.130 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -6.146 -16.052 1.614 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -6.185 -17.397 2.759 1.00 0.00 H new ATOM 1416 N PRO A 90 1.732 -13.421 1.996 1.00 0.00 N ATOM 1417 CA PRO A 90 2.934 -13.279 2.830 1.00 0.00 C ATOM 1418 C PRO A 90 3.734 -14.574 2.939 1.00 0.00 C ATOM 1419 O PRO A 90 3.184 -15.636 3.228 1.00 0.00 O ATOM 1420 CB PRO A 90 2.381 -12.888 4.209 1.00 0.00 C ATOM 1421 CG PRO A 90 1.006 -12.379 3.945 1.00 0.00 C ATOM 1422 CD PRO A 90 0.504 -13.158 2.766 1.00 0.00 C ATOM 0 HA PRO A 90 3.624 -12.550 2.406 1.00 0.00 H new ATOM 0 HB2 PRO A 90 2.362 -13.744 4.883 1.00 0.00 H new ATOM 0 HB3 PRO A 90 3.000 -12.125 4.680 1.00 0.00 H new ATOM 0 HG2 PRO A 90 0.362 -12.523 4.812 1.00 0.00 H new ATOM 0 HG3 PRO A 90 1.018 -11.310 3.731 1.00 0.00 H new ATOM 0 HD2 PRO A 90 0.014 -14.082 3.072 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -0.222 -12.589 2.186 1.00 0.00 H new ATOM 1430 N SER A 91 5.031 -14.480 2.691 1.00 0.00 N ATOM 1431 CA SER A 91 5.923 -15.619 2.829 1.00 0.00 C ATOM 1432 C SER A 91 6.426 -15.725 4.272 1.00 0.00 C ATOM 1433 O SER A 91 6.033 -14.931 5.133 1.00 0.00 O ATOM 1434 CB SER A 91 7.100 -15.481 1.858 1.00 0.00 C ATOM 1435 OG SER A 91 6.644 -15.363 0.515 1.00 0.00 O ATOM 0 H SER A 91 5.491 -13.620 2.391 1.00 0.00 H new ATOM 0 HA SER A 91 5.376 -16.530 2.587 1.00 0.00 H new ATOM 0 HB2 SER A 91 7.693 -14.606 2.122 1.00 0.00 H new ATOM 0 HB3 SER A 91 7.754 -16.348 1.949 1.00 0.00 H new ATOM 0 HG SER A 91 7.414 -15.274 -0.085 1.00 0.00 H new ATOM 1441 N ALA A 92 7.301 -16.694 4.532 1.00 0.00 N ATOM 1442 CA ALA A 92 7.807 -16.930 5.882 1.00 0.00 C ATOM 1443 C ALA A 92 8.604 -15.732 6.394 1.00 0.00 C ATOM 1444 O ALA A 92 8.462 -15.319 7.546 1.00 0.00 O ATOM 1445 CB ALA A 92 8.662 -18.187 5.909 1.00 0.00 C ATOM 0 H ALA A 92 7.674 -17.328 3.826 1.00 0.00 H new ATOM 0 HA ALA A 92 6.952 -17.068 6.544 1.00 0.00 H new ATOM 0 HB1 ALA A 92 9.034 -18.353 6.920 1.00 0.00 H new ATOM 0 HB2 ALA A 92 8.062 -19.042 5.598 1.00 0.00 H new ATOM 0 HB3 ALA A 92 9.505 -18.069 5.228 1.00 0.00 H new ATOM 1451 N GLU A 93 9.451 -15.186 5.538 1.00 0.00 N ATOM 1452 CA GLU A 93 10.249 -14.018 5.892 1.00 0.00 C ATOM 1453 C GLU A 93 9.383 -12.764 5.917 1.00 0.00 C ATOM 1454 O GLU A 93 9.639 -11.841 6.686 1.00 0.00 O ATOM 1455 CB GLU A 93 11.416 -13.816 4.929 1.00 0.00 C ATOM 1456 CG GLU A 93 11.973 -15.106 4.346 1.00 0.00 C ATOM 1457 CD GLU A 93 11.239 -15.520 3.086 1.00 0.00 C ATOM 1458 OE1 GLU A 93 10.200 -16.200 3.194 1.00 0.00 O ATOM 1459 OE2 GLU A 93 11.688 -15.135 1.988 1.00 0.00 O ATOM 0 H GLU A 93 9.606 -15.531 4.591 1.00 0.00 H new ATOM 0 HA GLU A 93 10.656 -14.197 6.887 1.00 0.00 H new ATOM 0 HB2 GLU A 93 11.091 -13.172 4.112 1.00 0.00 H new ATOM 0 HB3 GLU A 93 12.216 -13.291 5.450 1.00 0.00 H new ATOM 0 HG2 GLU A 93 13.032 -14.976 4.123 1.00 0.00 H new ATOM 0 HG3 GLU A 93 11.899 -15.901 5.088 1.00 0.00 H new ATOM 1466 N ASP A 94 8.373 -12.738 5.052 1.00 0.00 N ATOM 1467 CA ASP A 94 7.437 -11.613 4.976 1.00 0.00 C ATOM 1468 C ASP A 94 6.755 -11.423 6.333 1.00 0.00 C ATOM 1469 O ASP A 94 6.596 -10.301 6.811 1.00 0.00 O ATOM 1470 CB ASP A 94 6.394 -11.876 3.879 1.00 0.00 C ATOM 1471 CG ASP A 94 5.506 -10.677 3.575 1.00 0.00 C ATOM 1472 OD1 ASP A 94 4.570 -10.413 4.350 1.00 0.00 O ATOM 1473 OD2 ASP A 94 5.720 -10.025 2.527 1.00 0.00 O ATOM 0 H ASP A 94 8.178 -13.488 4.388 1.00 0.00 H new ATOM 0 HA ASP A 94 7.980 -10.702 4.725 1.00 0.00 H new ATOM 0 HB2 ASP A 94 6.908 -12.176 2.966 1.00 0.00 H new ATOM 0 HB3 ASP A 94 5.766 -12.714 4.181 1.00 0.00 H new ATOM 1478 N LYS A 95 6.397 -12.545 6.961 1.00 0.00 N ATOM 1479 CA LYS A 95 5.845 -12.551 8.316 1.00 0.00 C ATOM 1480 C LYS A 95 6.794 -11.855 9.300 1.00 0.00 C ATOM 1481 O LYS A 95 6.358 -11.175 10.228 1.00 0.00 O ATOM 1482 CB LYS A 95 5.593 -14.001 8.760 1.00 0.00 C ATOM 1483 CG LYS A 95 5.209 -14.156 10.225 1.00 0.00 C ATOM 1484 CD LYS A 95 3.801 -13.654 10.515 1.00 0.00 C ATOM 1485 CE LYS A 95 2.741 -14.576 9.932 1.00 0.00 C ATOM 1486 NZ LYS A 95 1.370 -14.203 10.381 1.00 0.00 N ATOM 0 H LYS A 95 6.482 -13.473 6.545 1.00 0.00 H new ATOM 0 HA LYS A 95 4.904 -12.002 8.311 1.00 0.00 H new ATOM 0 HB2 LYS A 95 4.800 -14.424 8.143 1.00 0.00 H new ATOM 0 HB3 LYS A 95 6.492 -14.587 8.569 1.00 0.00 H new ATOM 0 HG2 LYS A 95 5.282 -15.206 10.507 1.00 0.00 H new ATOM 0 HG3 LYS A 95 5.921 -13.609 10.844 1.00 0.00 H new ATOM 0 HD2 LYS A 95 3.659 -13.573 11.593 1.00 0.00 H new ATOM 0 HD3 LYS A 95 3.680 -12.653 10.101 1.00 0.00 H new ATOM 0 HE2 LYS A 95 2.788 -14.541 8.844 1.00 0.00 H new ATOM 0 HE3 LYS A 95 2.952 -15.604 10.227 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 0.829 -15.065 10.598 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 1.433 -13.610 11.233 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 0.889 -13.674 9.626 1.00 0.00 H new ATOM 1500 N ARG A 96 8.094 -12.019 9.073 1.00 0.00 N ATOM 1501 CA ARG A 96 9.114 -11.439 9.945 1.00 0.00 C ATOM 1502 C ARG A 96 9.233 -9.932 9.742 1.00 0.00 C ATOM 1503 O ARG A 96 9.782 -9.226 10.588 1.00 0.00 O ATOM 1504 CB ARG A 96 10.477 -12.086 9.687 1.00 0.00 C ATOM 1505 CG ARG A 96 10.597 -13.514 10.187 1.00 0.00 C ATOM 1506 CD ARG A 96 11.944 -14.106 9.805 1.00 0.00 C ATOM 1507 NE ARG A 96 12.255 -15.319 10.556 1.00 0.00 N ATOM 1508 CZ ARG A 96 13.463 -15.876 10.595 1.00 0.00 C ATOM 1509 NH1 ARG A 96 14.447 -15.397 9.839 1.00 0.00 N ATOM 1510 NH2 ARG A 96 13.677 -16.931 11.368 1.00 0.00 N ATOM 0 H ARG A 96 8.469 -12.552 8.288 1.00 0.00 H new ATOM 0 HA ARG A 96 8.804 -11.632 10.972 1.00 0.00 H new ATOM 0 HB2 ARG A 96 10.676 -12.071 8.615 1.00 0.00 H new ATOM 0 HB3 ARG A 96 11.249 -11.481 10.163 1.00 0.00 H new ATOM 0 HG2 ARG A 96 10.478 -13.536 11.270 1.00 0.00 H new ATOM 0 HG3 ARG A 96 9.795 -14.121 9.766 1.00 0.00 H new ATOM 0 HD2 ARG A 96 11.949 -14.332 8.739 1.00 0.00 H new ATOM 0 HD3 ARG A 96 12.725 -13.365 9.978 1.00 0.00 H new ATOM 0 HE ARG A 96 11.503 -15.765 11.081 1.00 0.00 H new ATOM 0 HH11 ARG A 96 14.277 -14.600 9.226 1.00 0.00 H new ATOM 0 HH12 ARG A 96 15.371 -15.827 9.872 1.00 0.00 H new ATOM 0 HH21 ARG A 96 12.917 -17.314 11.931 1.00 0.00 H new ATOM 0 HH22 ARG A 96 14.602 -17.360 11.400 1.00 0.00 H new ATOM 1524 N LEU A 97 8.737 -9.446 8.615 1.00 0.00 N ATOM 1525 CA LEU A 97 8.833 -8.036 8.282 1.00 0.00 C ATOM 1526 C LEU A 97 7.538 -7.305 8.620 1.00 0.00 C ATOM 1527 O LEU A 97 7.433 -6.089 8.442 1.00 0.00 O ATOM 1528 CB LEU A 97 9.156 -7.878 6.794 1.00 0.00 C ATOM 1529 CG LEU A 97 10.506 -8.449 6.356 1.00 0.00 C ATOM 1530 CD1 LEU A 97 10.687 -8.294 4.856 1.00 0.00 C ATOM 1531 CD2 LEU A 97 11.644 -7.767 7.104 1.00 0.00 C ATOM 0 H LEU A 97 8.261 -10.012 7.913 1.00 0.00 H new ATOM 0 HA LEU A 97 9.634 -7.594 8.875 1.00 0.00 H new ATOM 0 HB2 LEU A 97 8.370 -8.362 6.215 1.00 0.00 H new ATOM 0 HB3 LEU A 97 9.130 -6.817 6.544 1.00 0.00 H new ATOM 0 HG LEU A 97 10.525 -9.512 6.598 1.00 0.00 H new ATOM 0 HD11 LEU A 97 11.653 -8.705 4.562 1.00 0.00 H new ATOM 0 HD12 LEU A 97 9.891 -8.828 4.336 1.00 0.00 H new ATOM 0 HD13 LEU A 97 10.647 -7.237 4.592 1.00 0.00 H new ATOM 0 HD21 LEU A 97 12.596 -8.187 6.779 1.00 0.00 H new ATOM 0 HD22 LEU A 97 11.628 -6.698 6.894 1.00 0.00 H new ATOM 0 HD23 LEU A 97 11.523 -7.928 8.175 1.00 0.00 H new ATOM 1543 N ALA A 98 6.561 -8.050 9.120 1.00 0.00 N ATOM 1544 CA ALA A 98 5.265 -7.483 9.454 1.00 0.00 C ATOM 1545 C ALA A 98 5.294 -6.803 10.819 1.00 0.00 C ATOM 1546 O ALA A 98 5.010 -7.422 11.847 1.00 0.00 O ATOM 1547 CB ALA A 98 4.192 -8.557 9.414 1.00 0.00 C ATOM 0 H ALA A 98 6.644 -9.050 9.303 1.00 0.00 H new ATOM 0 HA ALA A 98 5.027 -6.723 8.709 1.00 0.00 H new ATOM 0 HB1 ALA A 98 3.227 -8.117 9.666 1.00 0.00 H new ATOM 0 HB2 ALA A 98 4.144 -8.987 8.413 1.00 0.00 H new ATOM 0 HB3 ALA A 98 4.433 -9.339 10.134 1.00 0.00 H new ATOM 1553 N PHE A 99 5.658 -5.527 10.824 1.00 0.00 N ATOM 1554 CA PHE A 99 5.756 -4.767 12.062 1.00 0.00 C ATOM 1555 C PHE A 99 4.589 -3.799 12.215 1.00 0.00 C ATOM 1556 O PHE A 99 4.478 -3.110 13.230 1.00 0.00 O ATOM 1557 CB PHE A 99 7.080 -4.001 12.121 1.00 0.00 C ATOM 1558 CG PHE A 99 8.286 -4.892 12.225 1.00 0.00 C ATOM 1559 CD1 PHE A 99 8.566 -5.563 13.404 1.00 0.00 C ATOM 1560 CD2 PHE A 99 9.143 -5.054 11.147 1.00 0.00 C ATOM 1561 CE1 PHE A 99 9.676 -6.378 13.507 1.00 0.00 C ATOM 1562 CE2 PHE A 99 10.254 -5.868 11.244 1.00 0.00 C ATOM 1563 CZ PHE A 99 10.522 -6.530 12.425 1.00 0.00 C ATOM 0 H PHE A 99 5.890 -4.997 9.984 1.00 0.00 H new ATOM 0 HA PHE A 99 5.719 -5.479 12.887 1.00 0.00 H new ATOM 0 HB2 PHE A 99 7.172 -3.382 11.229 1.00 0.00 H new ATOM 0 HB3 PHE A 99 7.062 -3.326 12.977 1.00 0.00 H new ATOM 0 HD1 PHE A 99 7.908 -5.447 14.253 1.00 0.00 H new ATOM 0 HD2 PHE A 99 8.939 -4.537 10.221 1.00 0.00 H new ATOM 0 HE1 PHE A 99 9.883 -6.896 14.432 1.00 0.00 H new ATOM 0 HE2 PHE A 99 10.913 -5.987 10.396 1.00 0.00 H new ATOM 0 HZ PHE A 99 11.391 -7.166 12.503 1.00 0.00 H new ATOM 1573 N ASP A 100 3.715 -3.747 11.217 1.00 0.00 N ATOM 1574 CA ASP A 100 2.560 -2.859 11.277 1.00 0.00 C ATOM 1575 C ASP A 100 1.579 -3.365 12.324 1.00 0.00 C ATOM 1576 O ASP A 100 1.405 -4.574 12.483 1.00 0.00 O ATOM 1577 CB ASP A 100 1.868 -2.768 9.910 1.00 0.00 C ATOM 1578 CG ASP A 100 2.704 -2.041 8.871 1.00 0.00 C ATOM 1579 OD1 ASP A 100 3.787 -2.555 8.505 1.00 0.00 O ATOM 1580 OD2 ASP A 100 2.277 -0.967 8.408 1.00 0.00 O ATOM 0 H ASP A 100 3.782 -4.303 10.365 1.00 0.00 H new ATOM 0 HA ASP A 100 2.903 -1.862 11.552 1.00 0.00 H new ATOM 0 HB2 ASP A 100 1.648 -3.774 9.552 1.00 0.00 H new ATOM 0 HB3 ASP A 100 0.914 -2.254 10.025 1.00 0.00 H new ATOM 1585 N PRO A 101 0.934 -2.450 13.063 1.00 0.00 N ATOM 1586 CA PRO A 101 0.013 -2.823 14.139 1.00 0.00 C ATOM 1587 C PRO A 101 -1.308 -3.390 13.620 1.00 0.00 C ATOM 1588 O PRO A 101 -1.709 -4.495 13.983 1.00 0.00 O ATOM 1589 CB PRO A 101 -0.209 -1.506 14.889 1.00 0.00 C ATOM 1590 CG PRO A 101 0.066 -0.433 13.890 1.00 0.00 C ATOM 1591 CD PRO A 101 1.081 -0.987 12.927 1.00 0.00 C ATOM 0 HA PRO A 101 0.420 -3.618 14.764 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -1.228 -1.437 15.270 1.00 0.00 H new ATOM 0 HB3 PRO A 101 0.458 -1.425 15.747 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -0.847 -0.148 13.368 1.00 0.00 H new ATOM 0 HG3 PRO A 101 0.447 0.463 14.380 1.00 0.00 H new ATOM 0 HD2 PRO A 101 0.885 -0.658 11.906 1.00 0.00 H new ATOM 0 HD3 PRO A 101 2.090 -0.661 13.178 1.00 0.00 H new ATOM 1599 N SER A 102 -1.985 -2.627 12.775 1.00 0.00 N ATOM 1600 CA SER A 102 -3.245 -3.061 12.190 1.00 0.00 C ATOM 1601 C SER A 102 -3.412 -2.447 10.810 1.00 0.00 C ATOM 1602 O SER A 102 -4.524 -2.310 10.302 1.00 0.00 O ATOM 1603 CB SER A 102 -4.409 -2.653 13.095 1.00 0.00 C ATOM 1604 OG SER A 102 -4.214 -3.126 14.418 1.00 0.00 O ATOM 0 H SER A 102 -1.681 -1.700 12.478 1.00 0.00 H new ATOM 0 HA SER A 102 -3.239 -4.147 12.094 1.00 0.00 H new ATOM 0 HB2 SER A 102 -4.504 -1.567 13.104 1.00 0.00 H new ATOM 0 HB3 SER A 102 -5.342 -3.052 12.696 1.00 0.00 H new ATOM 0 HG SER A 102 -4.970 -2.852 14.978 1.00 0.00 H new ATOM 1610 N LEU A 103 -2.294 -2.092 10.198 1.00 0.00 N ATOM 1611 CA LEU A 103 -2.315 -1.441 8.903 1.00 0.00 C ATOM 1612 C LEU A 103 -2.411 -2.481 7.794 1.00 0.00 C ATOM 1613 O LEU A 103 -2.124 -3.658 8.011 1.00 0.00 O ATOM 1614 CB LEU A 103 -1.074 -0.566 8.731 1.00 0.00 C ATOM 1615 CG LEU A 103 -0.916 0.541 9.778 1.00 0.00 C ATOM 1616 CD1 LEU A 103 0.339 1.349 9.511 1.00 0.00 C ATOM 1617 CD2 LEU A 103 -2.139 1.448 9.790 1.00 0.00 C ATOM 0 H LEU A 103 -1.361 -2.245 10.580 1.00 0.00 H new ATOM 0 HA LEU A 103 -3.193 -0.798 8.842 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -0.191 -1.204 8.761 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -1.104 -0.109 7.742 1.00 0.00 H new ATOM 0 HG LEU A 103 -0.825 0.074 10.759 1.00 0.00 H new ATOM 0 HD11 LEU A 103 0.435 2.131 10.264 1.00 0.00 H new ATOM 0 HD12 LEU A 103 1.209 0.694 9.554 1.00 0.00 H new ATOM 0 HD13 LEU A 103 0.276 1.804 8.522 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -2.007 2.227 10.540 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -2.262 1.906 8.809 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -3.025 0.861 10.030 1.00 0.00 H new ATOM 1629 N SER A 104 -2.821 -2.046 6.613 1.00 0.00 N ATOM 1630 CA SER A 104 -3.085 -2.962 5.517 1.00 0.00 C ATOM 1631 C SER A 104 -1.826 -3.246 4.705 1.00 0.00 C ATOM 1632 O SER A 104 -1.131 -2.324 4.282 1.00 0.00 O ATOM 1633 CB SER A 104 -4.165 -2.374 4.609 1.00 0.00 C ATOM 1634 OG SER A 104 -5.318 -2.026 5.357 1.00 0.00 O ATOM 0 H SER A 104 -2.978 -1.063 6.390 1.00 0.00 H new ATOM 0 HA SER A 104 -3.428 -3.906 5.941 1.00 0.00 H new ATOM 0 HB2 SER A 104 -3.777 -1.492 4.099 1.00 0.00 H new ATOM 0 HB3 SER A 104 -4.431 -3.097 3.838 1.00 0.00 H new ATOM 0 HG SER A 104 -5.239 -1.100 5.669 1.00 0.00 H new ATOM 1640 N TYR A 105 -1.539 -4.529 4.508 1.00 0.00 N ATOM 1641 CA TYR A 105 -0.476 -4.955 3.611 1.00 0.00 C ATOM 1642 C TYR A 105 -1.065 -5.313 2.257 1.00 0.00 C ATOM 1643 O TYR A 105 -1.706 -6.353 2.111 1.00 0.00 O ATOM 1644 CB TYR A 105 0.264 -6.175 4.168 1.00 0.00 C ATOM 1645 CG TYR A 105 1.148 -5.880 5.351 1.00 0.00 C ATOM 1646 CD1 TYR A 105 2.447 -5.430 5.166 1.00 0.00 C ATOM 1647 CD2 TYR A 105 0.693 -6.065 6.650 1.00 0.00 C ATOM 1648 CE1 TYR A 105 3.270 -5.172 6.243 1.00 0.00 C ATOM 1649 CE2 TYR A 105 1.508 -5.808 7.732 1.00 0.00 C ATOM 1650 CZ TYR A 105 2.796 -5.361 7.523 1.00 0.00 C ATOM 1651 OH TYR A 105 3.613 -5.100 8.597 1.00 0.00 O ATOM 0 H TYR A 105 -2.034 -5.296 4.963 1.00 0.00 H new ATOM 0 HA TYR A 105 0.231 -4.132 3.512 1.00 0.00 H new ATOM 0 HB2 TYR A 105 -0.469 -6.929 4.456 1.00 0.00 H new ATOM 0 HB3 TYR A 105 0.872 -6.609 3.375 1.00 0.00 H new ATOM 0 HD1 TYR A 105 2.820 -5.279 4.164 1.00 0.00 H new ATOM 0 HD2 TYR A 105 -0.315 -6.416 6.815 1.00 0.00 H new ATOM 0 HE1 TYR A 105 4.280 -4.824 6.084 1.00 0.00 H new ATOM 0 HE2 TYR A 105 1.140 -5.956 8.737 1.00 0.00 H new ATOM 0 HH TYR A 105 4.065 -4.241 8.463 1.00 0.00 H new ATOM 1661 N LEU A 106 -0.881 -4.449 1.278 1.00 0.00 N ATOM 1662 CA LEU A 106 -1.351 -4.734 -0.070 1.00 0.00 C ATOM 1663 C LEU A 106 -0.276 -5.472 -0.850 1.00 0.00 C ATOM 1664 O LEU A 106 0.843 -4.982 -1.008 1.00 0.00 O ATOM 1665 CB LEU A 106 -1.757 -3.451 -0.801 1.00 0.00 C ATOM 1666 CG LEU A 106 -3.186 -2.963 -0.535 1.00 0.00 C ATOM 1667 CD1 LEU A 106 -3.382 -2.604 0.929 1.00 0.00 C ATOM 1668 CD2 LEU A 106 -3.513 -1.776 -1.427 1.00 0.00 C ATOM 0 H LEU A 106 -0.413 -3.549 1.386 1.00 0.00 H new ATOM 0 HA LEU A 106 -2.235 -5.367 0.005 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -1.063 -2.659 -0.520 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -1.640 -3.612 -1.873 1.00 0.00 H new ATOM 0 HG LEU A 106 -3.871 -3.777 -0.771 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -4.405 -2.262 1.086 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -3.194 -3.482 1.547 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -2.687 -1.811 1.205 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -4.531 -1.440 -1.227 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -2.816 -0.964 -1.222 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -3.427 -2.072 -2.473 1.00 0.00 H new ATOM 1680 N ILE A 107 -0.608 -6.660 -1.315 1.00 0.00 N ATOM 1681 CA ILE A 107 0.330 -7.468 -2.067 1.00 0.00 C ATOM 1682 C ILE A 107 -0.197 -7.695 -3.474 1.00 0.00 C ATOM 1683 O ILE A 107 -1.312 -8.187 -3.658 1.00 0.00 O ATOM 1684 CB ILE A 107 0.595 -8.828 -1.386 1.00 0.00 C ATOM 1685 CG1 ILE A 107 1.020 -8.619 0.069 1.00 0.00 C ATOM 1686 CG2 ILE A 107 1.668 -9.599 -2.146 1.00 0.00 C ATOM 1687 CD1 ILE A 107 1.238 -9.908 0.833 1.00 0.00 C ATOM 0 H ILE A 107 -1.524 -7.088 -1.184 1.00 0.00 H new ATOM 0 HA ILE A 107 1.275 -6.926 -2.106 1.00 0.00 H new ATOM 0 HB ILE A 107 -0.326 -9.410 -1.399 1.00 0.00 H new ATOM 0 HG12 ILE A 107 1.941 -8.036 0.089 1.00 0.00 H new ATOM 0 HG13 ILE A 107 0.258 -8.030 0.579 1.00 0.00 H new ATOM 0 HG21 ILE A 107 1.845 -10.556 -1.655 1.00 0.00 H new ATOM 0 HG22 ILE A 107 1.335 -9.772 -3.169 1.00 0.00 H new ATOM 0 HG23 ILE A 107 2.592 -9.021 -2.158 1.00 0.00 H new ATOM 0 HD11 ILE A 107 1.537 -9.679 1.856 1.00 0.00 H new ATOM 0 HD12 ILE A 107 0.313 -10.484 0.846 1.00 0.00 H new ATOM 0 HD13 ILE A 107 2.021 -10.490 0.348 1.00 0.00 H new ATOM 1699 N ILE A 108 0.600 -7.312 -4.456 1.00 0.00 N ATOM 1700 CA ILE A 108 0.219 -7.465 -5.849 1.00 0.00 C ATOM 1701 C ILE A 108 1.057 -8.552 -6.515 1.00 0.00 C ATOM 1702 O ILE A 108 2.279 -8.598 -6.351 1.00 0.00 O ATOM 1703 CB ILE A 108 0.382 -6.138 -6.632 1.00 0.00 C ATOM 1704 CG1 ILE A 108 -0.407 -5.016 -5.952 1.00 0.00 C ATOM 1705 CG2 ILE A 108 -0.072 -6.303 -8.081 1.00 0.00 C ATOM 1706 CD1 ILE A 108 -0.206 -3.654 -6.586 1.00 0.00 C ATOM 0 H ILE A 108 1.518 -6.891 -4.314 1.00 0.00 H new ATOM 0 HA ILE A 108 -0.833 -7.751 -5.869 1.00 0.00 H new ATOM 0 HB ILE A 108 1.439 -5.871 -6.633 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -1.468 -5.265 -5.977 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -0.116 -4.964 -4.903 1.00 0.00 H new ATOM 0 HG21 ILE A 108 0.052 -5.359 -8.611 1.00 0.00 H new ATOM 0 HG22 ILE A 108 0.529 -7.072 -8.565 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -1.122 -6.596 -8.102 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -0.797 -2.912 -6.049 1.00 0.00 H new ATOM 0 HD12 ILE A 108 0.848 -3.382 -6.538 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -0.525 -3.687 -7.628 1.00 0.00 H new ATOM 1718 N SER A 109 0.400 -9.433 -7.245 1.00 0.00 N ATOM 1719 CA SER A 109 1.094 -10.469 -7.988 1.00 0.00 C ATOM 1720 C SER A 109 1.185 -10.073 -9.458 1.00 0.00 C ATOM 1721 O SER A 109 0.170 -10.001 -10.155 1.00 0.00 O ATOM 1722 CB SER A 109 0.378 -11.818 -7.839 1.00 0.00 C ATOM 1723 OG SER A 109 1.116 -12.868 -8.449 1.00 0.00 O ATOM 0 H SER A 109 -0.615 -9.452 -7.340 1.00 0.00 H new ATOM 0 HA SER A 109 2.101 -10.576 -7.584 1.00 0.00 H new ATOM 0 HB2 SER A 109 0.233 -12.040 -6.782 1.00 0.00 H new ATOM 0 HB3 SER A 109 -0.612 -11.758 -8.290 1.00 0.00 H new ATOM 0 HG SER A 109 1.913 -13.063 -7.912 1.00 0.00 H new ATOM 1729 N LEU A 110 2.398 -9.804 -9.923 1.00 0.00 N ATOM 1730 CA LEU A 110 2.622 -9.401 -11.306 1.00 0.00 C ATOM 1731 C LEU A 110 2.955 -10.622 -12.158 1.00 0.00 C ATOM 1732 O LEU A 110 3.511 -10.505 -13.249 1.00 0.00 O ATOM 1733 CB LEU A 110 3.759 -8.375 -11.374 1.00 0.00 C ATOM 1734 CG LEU A 110 3.412 -7.054 -12.074 1.00 0.00 C ATOM 1735 CD1 LEU A 110 3.047 -7.290 -13.534 1.00 0.00 C ATOM 1736 CD2 LEU A 110 2.276 -6.348 -11.348 1.00 0.00 C ATOM 0 H LEU A 110 3.246 -9.858 -9.359 1.00 0.00 H new ATOM 0 HA LEU A 110 1.713 -8.942 -11.696 1.00 0.00 H new ATOM 0 HB2 LEU A 110 4.087 -8.153 -10.358 1.00 0.00 H new ATOM 0 HB3 LEU A 110 4.605 -8.829 -11.890 1.00 0.00 H new ATOM 0 HG LEU A 110 4.294 -6.414 -12.045 1.00 0.00 H new ATOM 0 HD11 LEU A 110 2.805 -6.338 -14.007 1.00 0.00 H new ATOM 0 HD12 LEU A 110 3.891 -7.748 -14.050 1.00 0.00 H new ATOM 0 HD13 LEU A 110 2.184 -7.953 -13.591 1.00 0.00 H new ATOM 0 HD21 LEU A 110 2.043 -5.413 -11.858 1.00 0.00 H new ATOM 0 HD22 LEU A 110 1.394 -6.988 -11.343 1.00 0.00 H new ATOM 0 HD23 LEU A 110 2.576 -6.136 -10.322 1.00 0.00 H new ATOM 1748 N ALA A 111 2.601 -11.796 -11.647 1.00 0.00 N ATOM 1749 CA ALA A 111 2.849 -13.052 -12.344 1.00 0.00 C ATOM 1750 C ALA A 111 2.044 -13.120 -13.638 1.00 0.00 C ATOM 1751 O ALA A 111 2.441 -13.773 -14.604 1.00 0.00 O ATOM 1752 CB ALA A 111 2.505 -14.225 -11.441 1.00 0.00 C ATOM 0 H ALA A 111 2.138 -11.904 -10.745 1.00 0.00 H new ATOM 0 HA ALA A 111 3.907 -13.104 -12.601 1.00 0.00 H new ATOM 0 HB1 ALA A 111 2.693 -15.159 -11.970 1.00 0.00 H new ATOM 0 HB2 ALA A 111 3.122 -14.186 -10.543 1.00 0.00 H new ATOM 0 HB3 ALA A 111 1.453 -14.172 -11.161 1.00 0.00 H new ATOM 1758 N GLU A 112 0.914 -12.429 -13.642 1.00 0.00 N ATOM 1759 CA GLU A 112 0.029 -12.380 -14.794 1.00 0.00 C ATOM 1760 C GLU A 112 -0.195 -10.924 -15.200 1.00 0.00 C ATOM 1761 O GLU A 112 -1.105 -10.273 -14.700 1.00 0.00 O ATOM 1762 CB GLU A 112 -1.305 -13.061 -14.474 1.00 0.00 C ATOM 1763 CG GLU A 112 -2.216 -13.234 -15.680 1.00 0.00 C ATOM 1764 CD GLU A 112 -1.611 -14.125 -16.744 1.00 0.00 C ATOM 1765 OE1 GLU A 112 -1.382 -15.318 -16.462 1.00 0.00 O ATOM 1766 OE2 GLU A 112 -1.380 -13.641 -17.873 1.00 0.00 O ATOM 0 H GLU A 112 0.585 -11.885 -12.844 1.00 0.00 H new ATOM 0 HA GLU A 112 0.490 -12.915 -15.624 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -1.106 -14.040 -14.038 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -1.828 -12.476 -13.718 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -3.167 -13.657 -15.355 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -2.433 -12.256 -16.110 1.00 0.00 H new ATOM 1773 N PRO A 113 0.667 -10.383 -16.076 1.00 0.00 N ATOM 1774 CA PRO A 113 0.656 -8.955 -16.445 1.00 0.00 C ATOM 1775 C PRO A 113 -0.667 -8.462 -17.041 1.00 0.00 C ATOM 1776 O PRO A 113 -0.873 -7.256 -17.202 1.00 0.00 O ATOM 1777 CB PRO A 113 1.778 -8.842 -17.484 1.00 0.00 C ATOM 1778 CG PRO A 113 2.648 -10.028 -17.246 1.00 0.00 C ATOM 1779 CD PRO A 113 1.734 -11.120 -16.772 1.00 0.00 C ATOM 0 HA PRO A 113 0.791 -8.334 -15.560 1.00 0.00 H new ATOM 0 HB2 PRO A 113 1.378 -8.844 -18.498 1.00 0.00 H new ATOM 0 HB3 PRO A 113 2.336 -7.913 -17.363 1.00 0.00 H new ATOM 0 HG2 PRO A 113 3.167 -10.321 -18.159 1.00 0.00 H new ATOM 0 HG3 PRO A 113 3.413 -9.808 -16.501 1.00 0.00 H new ATOM 0 HD2 PRO A 113 1.343 -11.707 -17.603 1.00 0.00 H new ATOM 0 HD3 PRO A 113 2.246 -11.813 -16.105 1.00 0.00 H new ATOM 1787 N GLN A 114 -1.554 -9.384 -17.371 1.00 0.00 N ATOM 1788 CA GLN A 114 -2.868 -9.024 -17.889 1.00 0.00 C ATOM 1789 C GLN A 114 -3.878 -8.921 -16.753 1.00 0.00 C ATOM 1790 O GLN A 114 -4.919 -8.273 -16.882 1.00 0.00 O ATOM 1791 CB GLN A 114 -3.340 -10.050 -18.917 1.00 0.00 C ATOM 1792 CG GLN A 114 -2.467 -10.117 -20.157 1.00 0.00 C ATOM 1793 CD GLN A 114 -3.039 -11.037 -21.216 1.00 0.00 C ATOM 1794 OE1 GLN A 114 -3.719 -12.016 -20.904 1.00 0.00 O ATOM 1795 NE2 GLN A 114 -2.777 -10.725 -22.472 1.00 0.00 N ATOM 0 H GLN A 114 -1.391 -10.388 -17.291 1.00 0.00 H new ATOM 0 HA GLN A 114 -2.788 -8.053 -18.377 1.00 0.00 H new ATOM 0 HB2 GLN A 114 -3.367 -11.034 -18.449 1.00 0.00 H new ATOM 0 HB3 GLN A 114 -4.361 -9.810 -19.215 1.00 0.00 H new ATOM 0 HG2 GLN A 114 -2.353 -9.116 -20.572 1.00 0.00 H new ATOM 0 HG3 GLN A 114 -1.471 -10.462 -19.879 1.00 0.00 H new ATOM 0 HE21 GLN A 114 -2.209 -9.905 -22.686 1.00 0.00 H new ATOM 0 HE22 GLN A 114 -3.142 -11.304 -23.228 1.00 0.00 H new ATOM 1804 N LYS A 115 -3.554 -9.554 -15.635 1.00 0.00 N ATOM 1805 CA LYS A 115 -4.426 -9.583 -14.476 1.00 0.00 C ATOM 1806 C LYS A 115 -3.612 -9.429 -13.198 1.00 0.00 C ATOM 1807 O LYS A 115 -3.319 -10.418 -12.521 1.00 0.00 O ATOM 1808 CB LYS A 115 -5.192 -10.904 -14.416 1.00 0.00 C ATOM 1809 CG LYS A 115 -6.149 -11.129 -15.569 1.00 0.00 C ATOM 1810 CD LYS A 115 -6.674 -12.549 -15.561 1.00 0.00 C ATOM 1811 CE LYS A 115 -7.641 -12.795 -16.704 1.00 0.00 C ATOM 1812 NZ LYS A 115 -7.957 -14.237 -16.847 1.00 0.00 N ATOM 0 H LYS A 115 -2.678 -10.061 -15.508 1.00 0.00 H new ATOM 0 HA LYS A 115 -5.131 -8.757 -14.564 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -4.475 -11.724 -14.391 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -5.753 -10.942 -13.482 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -6.981 -10.428 -15.499 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -5.642 -10.929 -16.513 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -5.839 -13.246 -15.634 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -7.173 -12.747 -14.613 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -8.560 -12.235 -16.531 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -7.210 -12.422 -17.633 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -8.620 -14.370 -17.637 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -7.082 -14.767 -17.036 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -8.390 -14.586 -15.968 1.00 0.00 H new ATOM 1826 N PRO A 116 -3.198 -8.200 -12.862 1.00 0.00 N ATOM 1827 CA PRO A 116 -2.449 -7.951 -11.637 1.00 0.00 C ATOM 1828 C PRO A 116 -3.319 -8.147 -10.408 1.00 0.00 C ATOM 1829 O PRO A 116 -4.223 -7.352 -10.134 1.00 0.00 O ATOM 1830 CB PRO A 116 -2.001 -6.499 -11.760 1.00 0.00 C ATOM 1831 CG PRO A 116 -2.946 -5.873 -12.733 1.00 0.00 C ATOM 1832 CD PRO A 116 -3.426 -6.973 -13.642 1.00 0.00 C ATOM 0 HA PRO A 116 -1.612 -8.639 -11.519 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -2.038 -5.993 -10.795 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -0.972 -6.434 -12.114 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -3.784 -5.408 -12.214 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -2.449 -5.089 -13.304 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -4.479 -6.851 -13.896 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -2.871 -6.987 -14.580 1.00 0.00 H new ATOM 1840 N VAL A 117 -3.056 -9.217 -9.682 1.00 0.00 N ATOM 1841 CA VAL A 117 -3.863 -9.546 -8.523 1.00 0.00 C ATOM 1842 C VAL A 117 -3.461 -8.667 -7.349 1.00 0.00 C ATOM 1843 O VAL A 117 -2.315 -8.695 -6.907 1.00 0.00 O ATOM 1844 CB VAL A 117 -3.705 -11.034 -8.130 1.00 0.00 C ATOM 1845 CG1 VAL A 117 -4.614 -11.386 -6.958 1.00 0.00 C ATOM 1846 CG2 VAL A 117 -3.983 -11.943 -9.325 1.00 0.00 C ATOM 0 H VAL A 117 -2.295 -9.869 -9.872 1.00 0.00 H new ATOM 0 HA VAL A 117 -4.907 -9.368 -8.780 1.00 0.00 H new ATOM 0 HB VAL A 117 -2.673 -11.193 -7.816 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -4.485 -12.437 -6.700 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -4.356 -10.767 -6.099 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -5.652 -11.205 -7.236 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -3.866 -12.984 -9.025 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -5.001 -11.779 -9.678 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -3.280 -11.715 -10.127 1.00 0.00 H new ATOM 1856 N CYS A 118 -4.409 -7.893 -6.853 1.00 0.00 N ATOM 1857 CA CYS A 118 -4.176 -7.041 -5.705 1.00 0.00 C ATOM 1858 C CYS A 118 -5.057 -7.486 -4.546 1.00 0.00 C ATOM 1859 O CYS A 118 -6.281 -7.492 -4.660 1.00 0.00 O ATOM 1860 CB CYS A 118 -4.457 -5.578 -6.065 1.00 0.00 C ATOM 1861 SG CYS A 118 -3.962 -4.388 -4.794 1.00 0.00 S ATOM 0 H CYS A 118 -5.354 -7.838 -7.232 1.00 0.00 H new ATOM 0 HA CYS A 118 -3.132 -7.125 -5.404 1.00 0.00 H new ATOM 0 HB2 CYS A 118 -3.937 -5.338 -6.992 1.00 0.00 H new ATOM 0 HB3 CYS A 118 -5.523 -5.462 -6.258 1.00 0.00 H new ATOM 0 HG CYS A 118 -4.742 -3.349 -4.845 1.00 0.00 H new ATOM 1867 N LYS A 119 -4.440 -7.888 -3.447 1.00 0.00 N ATOM 1868 CA LYS A 119 -5.186 -8.268 -2.257 1.00 0.00 C ATOM 1869 C LYS A 119 -4.641 -7.513 -1.056 1.00 0.00 C ATOM 1870 O LYS A 119 -3.515 -7.014 -1.087 1.00 0.00 O ATOM 1871 CB LYS A 119 -5.103 -9.778 -2.007 1.00 0.00 C ATOM 1872 CG LYS A 119 -5.624 -10.636 -3.155 1.00 0.00 C ATOM 1873 CD LYS A 119 -7.145 -10.592 -3.263 1.00 0.00 C ATOM 1874 CE LYS A 119 -7.634 -11.410 -4.450 1.00 0.00 C ATOM 1875 NZ LYS A 119 -9.119 -11.526 -4.491 1.00 0.00 N ATOM 0 H LYS A 119 -3.427 -7.960 -3.353 1.00 0.00 H new ATOM 0 HA LYS A 119 -6.234 -8.011 -2.410 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -4.064 -10.045 -1.812 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -5.668 -10.016 -1.106 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -5.185 -10.292 -4.092 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -5.301 -11.667 -3.011 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -7.589 -10.976 -2.345 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -7.475 -9.559 -3.369 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -7.283 -10.949 -5.374 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -7.196 -12.407 -4.405 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -9.444 -11.475 -5.478 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -9.408 -12.436 -4.077 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -9.543 -10.748 -3.947 1.00 0.00 H new ATOM 1889 N SER A 120 -5.435 -7.443 -0.006 1.00 0.00 N ATOM 1890 CA SER A 120 -5.052 -6.731 1.197 1.00 0.00 C ATOM 1891 C SER A 120 -4.994 -7.706 2.360 1.00 0.00 C ATOM 1892 O SER A 120 -5.931 -8.471 2.584 1.00 0.00 O ATOM 1893 CB SER A 120 -6.055 -5.614 1.495 1.00 0.00 C ATOM 1894 OG SER A 120 -5.585 -4.750 2.519 1.00 0.00 O ATOM 0 H SER A 120 -6.358 -7.875 0.038 1.00 0.00 H new ATOM 0 HA SER A 120 -4.070 -6.281 1.052 1.00 0.00 H new ATOM 0 HB2 SER A 120 -6.239 -5.038 0.588 1.00 0.00 H new ATOM 0 HB3 SER A 120 -7.008 -6.050 1.795 1.00 0.00 H new ATOM 0 HG SER A 120 -6.307 -4.147 2.795 1.00 0.00 H new ATOM 1900 N PHE A 121 -3.892 -7.706 3.081 1.00 0.00 N ATOM 1901 CA PHE A 121 -3.735 -8.605 4.209 1.00 0.00 C ATOM 1902 C PHE A 121 -3.411 -7.836 5.476 1.00 0.00 C ATOM 1903 O PHE A 121 -2.553 -6.955 5.483 1.00 0.00 O ATOM 1904 CB PHE A 121 -2.642 -9.639 3.927 1.00 0.00 C ATOM 1905 CG PHE A 121 -2.954 -10.531 2.761 1.00 0.00 C ATOM 1906 CD1 PHE A 121 -3.770 -11.639 2.923 1.00 0.00 C ATOM 1907 CD2 PHE A 121 -2.440 -10.259 1.505 1.00 0.00 C ATOM 1908 CE1 PHE A 121 -4.067 -12.459 1.851 1.00 0.00 C ATOM 1909 CE2 PHE A 121 -2.733 -11.075 0.431 1.00 0.00 C ATOM 1910 CZ PHE A 121 -3.549 -12.177 0.604 1.00 0.00 C ATOM 0 H PHE A 121 -3.093 -7.096 2.908 1.00 0.00 H new ATOM 0 HA PHE A 121 -4.681 -9.126 4.355 1.00 0.00 H new ATOM 0 HB2 PHE A 121 -1.702 -9.121 3.738 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -2.494 -10.253 4.816 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -4.178 -11.864 3.897 1.00 0.00 H new ATOM 0 HD2 PHE A 121 -1.803 -9.399 1.364 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -4.704 -13.320 1.989 1.00 0.00 H new ATOM 0 HE2 PHE A 121 -2.325 -10.853 -0.544 1.00 0.00 H new ATOM 0 HZ PHE A 121 -3.781 -12.816 -0.235 1.00 0.00 H new ATOM 1920 N LEU A 122 -4.115 -8.159 6.541 1.00 0.00 N ATOM 1921 CA LEU A 122 -3.810 -7.604 7.843 1.00 0.00 C ATOM 1922 C LEU A 122 -3.066 -8.655 8.648 1.00 0.00 C ATOM 1923 O LEU A 122 -3.654 -9.651 9.075 1.00 0.00 O ATOM 1924 CB LEU A 122 -5.090 -7.190 8.573 1.00 0.00 C ATOM 1925 CG LEU A 122 -5.994 -6.215 7.813 1.00 0.00 C ATOM 1926 CD1 LEU A 122 -7.283 -5.971 8.582 1.00 0.00 C ATOM 1927 CD2 LEU A 122 -5.270 -4.904 7.553 1.00 0.00 C ATOM 0 H LEU A 122 -4.904 -8.805 6.530 1.00 0.00 H new ATOM 0 HA LEU A 122 -3.193 -6.713 7.724 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -5.664 -8.088 8.802 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -4.815 -6.736 9.525 1.00 0.00 H new ATOM 0 HG LEU A 122 -6.247 -6.662 6.852 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -7.912 -5.276 8.026 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -7.813 -6.915 8.713 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -7.049 -5.547 9.559 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -5.929 -4.225 7.012 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -4.984 -4.452 8.503 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -4.377 -5.093 6.958 1.00 0.00 H new ATOM 1939 N ILE A 123 -1.776 -8.454 8.840 1.00 0.00 N ATOM 1940 CA ILE A 123 -0.970 -9.441 9.534 1.00 0.00 C ATOM 1941 C ILE A 123 -1.003 -9.194 11.034 1.00 0.00 C ATOM 1942 O ILE A 123 -0.434 -8.226 11.538 1.00 0.00 O ATOM 1943 CB ILE A 123 0.484 -9.462 9.017 1.00 0.00 C ATOM 1944 CG1 ILE A 123 0.492 -9.701 7.502 1.00 0.00 C ATOM 1945 CG2 ILE A 123 1.281 -10.541 9.733 1.00 0.00 C ATOM 1946 CD1 ILE A 123 1.872 -9.682 6.879 1.00 0.00 C ATOM 0 H ILE A 123 -1.268 -7.626 8.529 1.00 0.00 H new ATOM 0 HA ILE A 123 -1.401 -10.421 9.329 1.00 0.00 H new ATOM 0 HB ILE A 123 0.951 -8.499 9.223 1.00 0.00 H new ATOM 0 HG12 ILE A 123 0.025 -10.664 7.295 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -0.122 -8.939 7.022 1.00 0.00 H new ATOM 0 HG21 ILE A 123 2.305 -10.545 9.359 1.00 0.00 H new ATOM 0 HG22 ILE A 123 1.287 -10.339 10.804 1.00 0.00 H new ATOM 0 HG23 ILE A 123 0.824 -11.513 9.550 1.00 0.00 H new ATOM 0 HD11 ILE A 123 1.790 -9.859 5.807 1.00 0.00 H new ATOM 0 HD12 ILE A 123 2.336 -8.711 7.052 1.00 0.00 H new ATOM 0 HD13 ILE A 123 2.485 -10.463 7.329 1.00 0.00 H new ATOM 1958 N LYS A 124 -1.694 -10.080 11.731 1.00 0.00 N ATOM 1959 CA LYS A 124 -1.868 -9.976 13.166 1.00 0.00 C ATOM 1960 C LYS A 124 -1.025 -11.035 13.859 1.00 0.00 C ATOM 1961 O LYS A 124 -0.245 -11.735 13.210 1.00 0.00 O ATOM 1962 CB LYS A 124 -3.348 -10.167 13.515 1.00 0.00 C ATOM 1963 CG LYS A 124 -4.277 -9.222 12.765 1.00 0.00 C ATOM 1964 CD LYS A 124 -5.734 -9.636 12.917 1.00 0.00 C ATOM 1965 CE LYS A 124 -6.666 -8.694 12.170 1.00 0.00 C ATOM 1966 NZ LYS A 124 -8.088 -9.138 12.236 1.00 0.00 N ATOM 0 H LYS A 124 -2.150 -10.892 11.315 1.00 0.00 H new ATOM 0 HA LYS A 124 -1.547 -8.991 13.504 1.00 0.00 H new ATOM 0 HB2 LYS A 124 -3.635 -11.195 13.296 1.00 0.00 H new ATOM 0 HB3 LYS A 124 -3.482 -10.020 14.587 1.00 0.00 H new ATOM 0 HG2 LYS A 124 -4.145 -8.207 13.139 1.00 0.00 H new ATOM 0 HG3 LYS A 124 -4.009 -9.209 11.708 1.00 0.00 H new ATOM 0 HD2 LYS A 124 -5.865 -10.651 12.542 1.00 0.00 H new ATOM 0 HD3 LYS A 124 -6.000 -9.650 13.974 1.00 0.00 H new ATOM 0 HE2 LYS A 124 -6.580 -7.692 12.590 1.00 0.00 H new ATOM 0 HE3 LYS A 124 -6.355 -8.630 11.127 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 -8.408 -9.422 11.288 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 -8.169 -9.947 12.885 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 -8.680 -8.356 12.581 1.00 0.00 H new ATOM 1980 N LYS A 125 -1.172 -11.148 15.170 1.00 0.00 N ATOM 1981 CA LYS A 125 -0.477 -12.179 15.924 1.00 0.00 C ATOM 1982 C LYS A 125 -1.156 -13.519 15.688 1.00 0.00 C ATOM 1983 O LYS A 125 -0.514 -14.501 15.313 1.00 0.00 O ATOM 1984 CB LYS A 125 -0.476 -11.844 17.415 1.00 0.00 C ATOM 1985 CG LYS A 125 0.510 -12.669 18.230 1.00 0.00 C ATOM 1986 CD LYS A 125 1.942 -12.425 17.775 1.00 0.00 C ATOM 1987 CE LYS A 125 2.949 -13.141 18.663 1.00 0.00 C ATOM 1988 NZ LYS A 125 2.915 -12.635 20.060 1.00 0.00 N ATOM 0 H LYS A 125 -1.766 -10.539 15.733 1.00 0.00 H new ATOM 0 HA LYS A 125 0.558 -12.232 15.586 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -0.241 -10.787 17.540 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -1.479 -11.997 17.813 1.00 0.00 H new ATOM 0 HG2 LYS A 125 0.413 -12.417 19.286 1.00 0.00 H new ATOM 0 HG3 LYS A 125 0.270 -13.728 18.132 1.00 0.00 H new ATOM 0 HD2 LYS A 125 2.059 -12.765 16.746 1.00 0.00 H new ATOM 0 HD3 LYS A 125 2.148 -11.355 17.782 1.00 0.00 H new ATOM 0 HE2 LYS A 125 2.740 -14.211 18.659 1.00 0.00 H new ATOM 0 HE3 LYS A 125 3.951 -13.011 18.254 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 3.767 -12.953 20.565 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 2.885 -11.595 20.052 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 2.070 -13.002 20.542 1.00 0.00 H new ATOM 2002 N ASP A 126 -2.462 -13.533 15.921 1.00 0.00 N ATOM 2003 CA ASP A 126 -3.293 -14.726 15.733 1.00 0.00 C ATOM 2004 C ASP A 126 -3.096 -15.337 14.348 1.00 0.00 C ATOM 2005 O ASP A 126 -2.974 -16.555 14.208 1.00 0.00 O ATOM 2006 CB ASP A 126 -4.774 -14.377 15.919 1.00 0.00 C ATOM 2007 CG ASP A 126 -5.096 -13.888 17.315 1.00 0.00 C ATOM 2008 OD1 ASP A 126 -5.409 -14.725 18.186 1.00 0.00 O ATOM 2009 OD2 ASP A 126 -5.044 -12.663 17.549 1.00 0.00 O ATOM 0 H ASP A 126 -2.981 -12.718 16.247 1.00 0.00 H new ATOM 0 HA ASP A 126 -2.985 -15.456 16.482 1.00 0.00 H new ATOM 0 HB2 ASP A 126 -5.054 -13.609 15.198 1.00 0.00 H new ATOM 0 HB3 ASP A 126 -5.379 -15.257 15.700 1.00 0.00 H new ATOM 2014 N GLY A 127 -3.067 -14.484 13.333 1.00 0.00 N ATOM 2015 CA GLY A 127 -2.902 -14.946 11.966 1.00 0.00 C ATOM 2016 C GLY A 127 -2.977 -13.804 10.977 1.00 0.00 C ATOM 2017 O GLY A 127 -2.710 -12.655 11.329 1.00 0.00 O ATOM 0 H GLY A 127 -3.155 -13.473 13.432 1.00 0.00 H new ATOM 0 HA2 GLY A 127 -1.941 -15.452 11.866 1.00 0.00 H new ATOM 0 HA3 GLY A 127 -3.674 -15.680 11.734 1.00 0.00 H new ATOM 2021 N VAL A 128 -3.344 -14.105 9.742 1.00 0.00 N ATOM 2022 CA VAL A 128 -3.449 -13.082 8.717 1.00 0.00 C ATOM 2023 C VAL A 128 -4.901 -12.919 8.269 1.00 0.00 C ATOM 2024 O VAL A 128 -5.602 -13.899 8.020 1.00 0.00 O ATOM 2025 CB VAL A 128 -2.533 -13.388 7.503 1.00 0.00 C ATOM 2026 CG1 VAL A 128 -2.890 -14.720 6.857 1.00 0.00 C ATOM 2027 CG2 VAL A 128 -2.592 -12.264 6.480 1.00 0.00 C ATOM 0 H VAL A 128 -3.574 -15.047 9.426 1.00 0.00 H new ATOM 0 HA VAL A 128 -3.110 -12.143 9.154 1.00 0.00 H new ATOM 0 HB VAL A 128 -1.511 -13.461 7.875 1.00 0.00 H new ATOM 0 HG11 VAL A 128 -2.229 -14.902 6.010 1.00 0.00 H new ATOM 0 HG12 VAL A 128 -2.774 -15.521 7.587 1.00 0.00 H new ATOM 0 HG13 VAL A 128 -3.923 -14.691 6.511 1.00 0.00 H new ATOM 0 HG21 VAL A 128 -1.941 -12.503 5.639 1.00 0.00 H new ATOM 0 HG22 VAL A 128 -3.616 -12.149 6.125 1.00 0.00 H new ATOM 0 HG23 VAL A 128 -2.261 -11.334 6.942 1.00 0.00 H new ATOM 2037 N ASP A 129 -5.351 -11.674 8.211 1.00 0.00 N ATOM 2038 CA ASP A 129 -6.712 -11.360 7.799 1.00 0.00 C ATOM 2039 C ASP A 129 -6.725 -11.020 6.319 1.00 0.00 C ATOM 2040 O ASP A 129 -5.894 -10.237 5.855 1.00 0.00 O ATOM 2041 CB ASP A 129 -7.245 -10.178 8.610 1.00 0.00 C ATOM 2042 CG ASP A 129 -8.759 -10.107 8.649 1.00 0.00 C ATOM 2043 OD1 ASP A 129 -9.400 -10.186 7.584 1.00 0.00 O ATOM 2044 OD2 ASP A 129 -9.313 -9.967 9.760 1.00 0.00 O ATOM 0 H ASP A 129 -4.787 -10.857 8.447 1.00 0.00 H new ATOM 0 HA ASP A 129 -7.351 -12.225 7.978 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -6.866 -10.246 9.630 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -6.856 -9.252 8.187 1.00 0.00 H new ATOM 2049 N GLU A 130 -7.654 -11.605 5.583 1.00 0.00 N ATOM 2050 CA GLU A 130 -7.701 -11.427 4.139 1.00 0.00 C ATOM 2051 C GLU A 130 -8.793 -10.433 3.748 1.00 0.00 C ATOM 2052 O GLU A 130 -9.963 -10.597 4.106 1.00 0.00 O ATOM 2053 CB GLU A 130 -7.917 -12.780 3.451 1.00 0.00 C ATOM 2054 CG GLU A 130 -7.792 -12.728 1.935 1.00 0.00 C ATOM 2055 CD GLU A 130 -7.754 -14.109 1.307 1.00 0.00 C ATOM 2056 OE1 GLU A 130 -8.822 -14.736 1.158 1.00 0.00 O ATOM 2057 OE2 GLU A 130 -6.651 -14.583 0.959 1.00 0.00 O ATOM 0 H GLU A 130 -8.386 -12.207 5.959 1.00 0.00 H new ATOM 0 HA GLU A 130 -6.747 -11.017 3.806 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -7.192 -13.495 3.841 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -8.907 -13.155 3.711 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -8.632 -12.168 1.523 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -6.885 -12.185 1.667 1.00 0.00 H new ATOM 2064 N GLU A 131 -8.395 -9.398 3.022 1.00 0.00 N ATOM 2065 CA GLU A 131 -9.310 -8.365 2.565 1.00 0.00 C ATOM 2066 C GLU A 131 -9.129 -8.138 1.063 1.00 0.00 C ATOM 2067 O GLU A 131 -8.051 -8.385 0.517 1.00 0.00 O ATOM 2068 CB GLU A 131 -9.046 -7.062 3.332 1.00 0.00 C ATOM 2069 CG GLU A 131 -10.010 -5.934 2.995 1.00 0.00 C ATOM 2070 CD GLU A 131 -11.446 -6.283 3.316 1.00 0.00 C ATOM 2071 OE1 GLU A 131 -12.083 -6.983 2.504 1.00 0.00 O ATOM 2072 OE2 GLU A 131 -11.937 -5.864 4.387 1.00 0.00 O ATOM 0 H GLU A 131 -7.428 -9.252 2.734 1.00 0.00 H new ATOM 0 HA GLU A 131 -10.335 -8.685 2.752 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -9.102 -7.265 4.401 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -8.029 -6.730 3.123 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -9.725 -5.039 3.548 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -9.926 -5.694 1.935 1.00 0.00 H new ATOM 2079 N GLU A 132 -10.176 -7.678 0.394 1.00 0.00 N ATOM 2080 CA GLU A 132 -10.117 -7.431 -1.032 1.00 0.00 C ATOM 2081 C GLU A 132 -10.067 -5.936 -1.333 1.00 0.00 C ATOM 2082 O GLU A 132 -10.351 -5.105 -0.470 1.00 0.00 O ATOM 2083 CB GLU A 132 -11.312 -8.073 -1.722 1.00 0.00 C ATOM 2084 CG GLU A 132 -11.288 -9.589 -1.680 1.00 0.00 C ATOM 2085 CD GLU A 132 -12.223 -10.212 -2.690 1.00 0.00 C ATOM 2086 OE1 GLU A 132 -13.432 -10.321 -2.410 1.00 0.00 O ATOM 2087 OE2 GLU A 132 -11.747 -10.596 -3.780 1.00 0.00 O ATOM 0 H GLU A 132 -11.078 -7.469 0.821 1.00 0.00 H new ATOM 0 HA GLU A 132 -9.201 -7.878 -1.418 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -12.228 -7.718 -1.250 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -11.341 -7.746 -2.761 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -10.272 -9.938 -1.867 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -11.562 -9.926 -0.680 1.00 0.00 H new ATOM 2094 N ILE A 133 -9.717 -5.607 -2.568 1.00 0.00 N ATOM 2095 CA ILE A 133 -9.545 -4.224 -2.976 1.00 0.00 C ATOM 2096 C ILE A 133 -10.754 -3.744 -3.764 1.00 0.00 C ATOM 2097 O ILE A 133 -11.131 -4.348 -4.769 1.00 0.00 O ATOM 2098 CB ILE A 133 -8.277 -4.050 -3.841 1.00 0.00 C ATOM 2099 CG1 ILE A 133 -7.038 -4.534 -3.079 1.00 0.00 C ATOM 2100 CG2 ILE A 133 -8.110 -2.599 -4.270 1.00 0.00 C ATOM 2101 CD1 ILE A 133 -6.768 -3.771 -1.800 1.00 0.00 C ATOM 0 H ILE A 133 -9.546 -6.287 -3.309 1.00 0.00 H new ATOM 0 HA ILE A 133 -9.440 -3.628 -2.070 1.00 0.00 H new ATOM 0 HB ILE A 133 -8.389 -4.658 -4.739 1.00 0.00 H new ATOM 0 HG12 ILE A 133 -7.160 -5.591 -2.841 1.00 0.00 H new ATOM 0 HG13 ILE A 133 -6.168 -4.452 -3.730 1.00 0.00 H new ATOM 0 HG21 ILE A 133 -7.211 -2.501 -4.878 1.00 0.00 H new ATOM 0 HG22 ILE A 133 -8.978 -2.290 -4.853 1.00 0.00 H new ATOM 0 HG23 ILE A 133 -8.022 -1.966 -3.387 1.00 0.00 H new ATOM 0 HD11 ILE A 133 -5.876 -4.172 -1.319 1.00 0.00 H new ATOM 0 HD12 ILE A 133 -6.613 -2.717 -2.031 1.00 0.00 H new ATOM 0 HD13 ILE A 133 -7.620 -3.874 -1.128 1.00 0.00 H new ATOM 2113 N ILE A 134 -11.366 -2.671 -3.290 1.00 0.00 N ATOM 2114 CA ILE A 134 -12.485 -2.053 -3.985 1.00 0.00 C ATOM 2115 C ILE A 134 -12.004 -0.795 -4.711 1.00 0.00 C ATOM 2116 O ILE A 134 -11.239 -0.004 -4.155 1.00 0.00 O ATOM 2117 CB ILE A 134 -13.656 -1.708 -3.017 1.00 0.00 C ATOM 2118 CG1 ILE A 134 -14.444 -2.962 -2.615 1.00 0.00 C ATOM 2119 CG2 ILE A 134 -14.602 -0.690 -3.635 1.00 0.00 C ATOM 2120 CD1 ILE A 134 -13.658 -3.945 -1.786 1.00 0.00 C ATOM 0 H ILE A 134 -11.105 -2.207 -2.420 1.00 0.00 H new ATOM 0 HA ILE A 134 -12.870 -2.771 -4.709 1.00 0.00 H new ATOM 0 HB ILE A 134 -13.207 -1.276 -2.122 1.00 0.00 H new ATOM 0 HG12 ILE A 134 -15.329 -2.658 -2.056 1.00 0.00 H new ATOM 0 HG13 ILE A 134 -14.794 -3.463 -3.518 1.00 0.00 H new ATOM 0 HG21 ILE A 134 -15.408 -0.470 -2.935 1.00 0.00 H new ATOM 0 HG22 ILE A 134 -14.055 0.226 -3.858 1.00 0.00 H new ATOM 0 HG23 ILE A 134 -15.022 -1.095 -4.556 1.00 0.00 H new ATOM 0 HD11 ILE A 134 -14.287 -4.802 -1.544 1.00 0.00 H new ATOM 0 HD12 ILE A 134 -12.787 -4.281 -2.349 1.00 0.00 H new ATOM 0 HD13 ILE A 134 -13.331 -3.464 -0.864 1.00 0.00 H new ATOM 2132 N LEU A 135 -12.447 -0.626 -5.952 1.00 0.00 N ATOM 2133 CA LEU A 135 -11.997 0.474 -6.793 1.00 0.00 C ATOM 2134 C LEU A 135 -13.031 1.590 -6.858 1.00 0.00 C ATOM 2135 O LEU A 135 -14.238 1.349 -6.769 1.00 0.00 O ATOM 2136 CB LEU A 135 -11.706 -0.029 -8.210 1.00 0.00 C ATOM 2137 CG LEU A 135 -10.562 -1.039 -8.321 1.00 0.00 C ATOM 2138 CD1 LEU A 135 -10.444 -1.561 -9.741 1.00 0.00 C ATOM 2139 CD2 LEU A 135 -9.250 -0.408 -7.886 1.00 0.00 C ATOM 0 H LEU A 135 -13.124 -1.244 -6.400 1.00 0.00 H new ATOM 0 HA LEU A 135 -11.086 0.875 -6.348 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -12.612 -0.485 -8.610 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -11.475 0.828 -8.842 1.00 0.00 H new ATOM 0 HG LEU A 135 -10.784 -1.877 -7.660 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -9.625 -2.278 -9.798 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -11.375 -2.050 -10.027 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -10.247 -0.730 -10.419 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -8.448 -1.141 -7.972 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -9.029 0.448 -8.524 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -9.331 -0.078 -6.850 1.00 0.00 H new ATOM 2151 N LYS A 136 -12.544 2.812 -7.012 1.00 0.00 N ATOM 2152 CA LYS A 136 -13.406 3.965 -7.200 1.00 0.00 C ATOM 2153 C LYS A 136 -12.889 4.797 -8.370 1.00 0.00 C ATOM 2154 O LYS A 136 -11.681 4.861 -8.613 1.00 0.00 O ATOM 2155 CB LYS A 136 -13.463 4.806 -5.921 1.00 0.00 C ATOM 2156 CG LYS A 136 -14.657 5.742 -5.852 1.00 0.00 C ATOM 2157 CD LYS A 136 -14.739 6.443 -4.505 1.00 0.00 C ATOM 2158 CE LYS A 136 -15.934 7.381 -4.435 1.00 0.00 C ATOM 2159 NZ LYS A 136 -15.864 8.455 -5.461 1.00 0.00 N ATOM 0 H LYS A 136 -11.548 3.030 -7.010 1.00 0.00 H new ATOM 0 HA LYS A 136 -14.418 3.626 -7.423 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -13.487 4.138 -5.060 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -12.548 5.394 -5.843 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -14.584 6.485 -6.646 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -15.573 5.178 -6.026 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -14.812 5.700 -3.711 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -13.822 7.007 -4.331 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -16.852 6.809 -4.572 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -15.984 7.831 -3.443 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -16.171 9.356 -5.042 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -14.886 8.547 -5.801 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -16.487 8.214 -6.258 1.00 0.00 H new ATOM 2173 N GLU A 137 -13.803 5.417 -9.097 1.00 0.00 N ATOM 2174 CA GLU A 137 -13.447 6.202 -10.272 1.00 0.00 C ATOM 2175 C GLU A 137 -12.880 7.560 -9.890 1.00 0.00 C ATOM 2176 O GLU A 137 -12.108 8.159 -10.637 1.00 0.00 O ATOM 2177 CB GLU A 137 -14.664 6.389 -11.174 1.00 0.00 C ATOM 2178 CG GLU A 137 -14.949 5.210 -12.090 1.00 0.00 C ATOM 2179 CD GLU A 137 -15.254 3.934 -11.339 1.00 0.00 C ATOM 2180 OE1 GLU A 137 -16.291 3.883 -10.646 1.00 0.00 O ATOM 2181 OE2 GLU A 137 -14.461 2.973 -11.444 1.00 0.00 O ATOM 0 H GLU A 137 -14.802 5.393 -8.895 1.00 0.00 H new ATOM 0 HA GLU A 137 -12.675 5.652 -10.810 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -15.540 6.570 -10.551 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -14.517 7.281 -11.783 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -15.793 5.455 -12.735 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -14.089 5.046 -12.739 1.00 0.00 H new ATOM 2188 N GLU A 138 -13.253 8.027 -8.721 1.00 0.00 N ATOM 2189 CA GLU A 138 -12.819 9.336 -8.253 1.00 0.00 C ATOM 2190 C GLU A 138 -12.506 9.265 -6.767 1.00 0.00 C ATOM 2191 O GLU A 138 -12.875 8.301 -6.103 1.00 0.00 O ATOM 2192 CB GLU A 138 -13.897 10.393 -8.538 1.00 0.00 C ATOM 2193 CG GLU A 138 -13.390 11.827 -8.456 1.00 0.00 C ATOM 2194 CD GLU A 138 -14.455 12.850 -8.794 1.00 0.00 C ATOM 2195 OE1 GLU A 138 -14.740 13.042 -9.996 1.00 0.00 O ATOM 2196 OE2 GLU A 138 -15.017 13.459 -7.860 1.00 0.00 O ATOM 0 H GLU A 138 -13.857 7.524 -8.071 1.00 0.00 H new ATOM 0 HA GLU A 138 -11.916 9.629 -8.788 1.00 0.00 H new ATOM 0 HB2 GLU A 138 -14.309 10.220 -9.532 1.00 0.00 H new ATOM 0 HB3 GLU A 138 -14.714 10.265 -7.828 1.00 0.00 H new ATOM 0 HG2 GLU A 138 -13.017 12.018 -7.450 1.00 0.00 H new ATOM 0 HG3 GLU A 138 -12.548 11.949 -9.137 1.00 0.00 H new ATOM 2203 N LEU A 139 -11.829 10.277 -6.249 1.00 0.00 N ATOM 2204 CA LEU A 139 -11.389 10.277 -4.861 1.00 0.00 C ATOM 2205 C LEU A 139 -12.571 10.373 -3.900 1.00 0.00 C ATOM 2206 O LEU A 139 -13.729 10.493 -4.318 1.00 0.00 O ATOM 2207 CB LEU A 139 -10.428 11.445 -4.616 1.00 0.00 C ATOM 2208 CG LEU A 139 -9.159 11.443 -5.473 1.00 0.00 C ATOM 2209 CD1 LEU A 139 -8.310 12.668 -5.175 1.00 0.00 C ATOM 2210 CD2 LEU A 139 -8.356 10.172 -5.238 1.00 0.00 C ATOM 0 H LEU A 139 -11.570 11.114 -6.771 1.00 0.00 H new ATOM 0 HA LEU A 139 -10.875 9.334 -4.674 1.00 0.00 H new ATOM 0 HB2 LEU A 139 -10.964 12.377 -4.793 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -10.137 11.439 -3.566 1.00 0.00 H new ATOM 0 HG LEU A 139 -9.456 11.475 -6.521 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -7.413 12.648 -5.794 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -8.882 13.569 -5.394 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -8.025 12.666 -4.123 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -7.458 10.189 -5.856 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -8.072 10.110 -4.187 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -8.961 9.305 -5.502 1.00 0.00 H new