USER MOD reduce.3.24.130724 H: found=0, std=0, add=1078, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 1078 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 74 SER OG : rot -134:sc= 0.915 USER MOD Set 1.2: A 85 HIS : no HE2:sc= 0.677 K(o=3.5,f=0.39!) USER MOD Set 1.3: A 87 HIS : no HD1:sc= 1.93 K(o=3.5,f=-5.2!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 MET CE :methyl 160:sc= -0.164 (180deg=-0.723) USER MOD Single : A 7 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0431) USER MOD Single : A 8 MET CE :methyl 142:sc= -0.335 (180deg=-1.22!) USER MOD Single : A 21 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.0811) USER MOD Single : A 26 GLN : amide:sc= 0 X(o=0,f=-0.47) USER MOD Single : A 30 GLN : amide:sc= 0 K(o=0,f=-0.59) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= -1.3! K(o=-1.3!,f=-0.34) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 SER OG : rot 180:sc= -0.0676 USER MOD Single : A 50 GLN : amide:sc= 0.247 K(o=0.25,f=-6.4!) USER MOD Single : A 52 GLN : amide:sc= -3.12! K(o=-3.1!,f=-0.004) USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 TYR OH : rot -30:sc= 1.25 USER MOD Single : A 75 HIS : no HD1:sc= -0.62 K(o=-0.62,f=-1.7) USER MOD Single : A 76 GLN : amide:sc= 0 K(o=0,f=-0.78) USER MOD Single : A 80 SER OG : rot 46:sc= 0.0637 USER MOD Single : A 90 HIS : no HD1:sc= -1.25 K(o=-1.3,f=-8.6!) USER MOD Single : A 95 HIS : no HE2:sc= 1.2 K(o=1.2,f=-5.1!) USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 101 HIS : no HD1:sc= 0 X(o=0,f=-0.0098) USER MOD Single : A 103 HIS : no HD1:sc= -2.46! C(o=-1.2!,f=-13!) USER MOD Single : A 104 GLN : amide:sc= -0.0136 K(o=-0.014,f=-0.62) USER MOD Single : A 109 CYS SG : rot 23:sc= -1.72 USER MOD Single : A 110 SER OG : rot 180:sc= -0.0487 USER MOD Single : A 116 GLN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : A 117 TYR OH : rot 180:sc= 0 USER MOD Single : A 131 MET CE :methyl -162:sc= -0.112 (180deg=-0.51) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -28.585 -16.761 -11.078 1.00 0.00 N ATOM 2 CA GLY A 1 -27.320 -17.507 -11.276 1.00 0.00 C ATOM 3 C GLY A 1 -26.650 -17.848 -9.962 1.00 0.00 C ATOM 4 O GLY A 1 -27.183 -18.639 -9.183 1.00 0.00 O ATOM 0 H1 GLY A 1 -29.011 -16.548 -12.003 1.00 0.00 H new ATOM 0 H2 GLY A 1 -29.244 -17.338 -10.518 1.00 0.00 H new ATOM 0 H3 GLY A 1 -28.389 -15.873 -10.574 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -27.523 -18.425 -11.828 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -26.640 -16.912 -11.886 1.00 0.00 H new ATOM 10 N PRO A 2 -25.477 -17.263 -9.684 1.00 0.00 N ATOM 11 CA PRO A 2 -24.746 -17.521 -8.444 1.00 0.00 C ATOM 12 C PRO A 2 -25.416 -16.877 -7.232 1.00 0.00 C ATOM 13 O PRO A 2 -25.482 -15.650 -7.123 1.00 0.00 O ATOM 14 CB PRO A 2 -23.376 -16.889 -8.701 1.00 0.00 C ATOM 15 CG PRO A 2 -23.636 -15.814 -9.700 1.00 0.00 C ATOM 16 CD PRO A 2 -24.770 -16.306 -10.555 1.00 0.00 C ATOM 0 HA PRO A 2 -24.700 -18.585 -8.210 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -22.949 -16.483 -7.784 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -22.667 -17.623 -9.085 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -23.898 -14.878 -9.206 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -22.749 -15.619 -10.303 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -25.422 -15.489 -10.864 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -24.407 -16.785 -11.464 1.00 0.00 H new ATOM 24 N LEU A 3 -25.922 -17.708 -6.326 1.00 0.00 N ATOM 25 CA LEU A 3 -26.532 -17.211 -5.095 1.00 0.00 C ATOM 26 C LEU A 3 -25.474 -16.578 -4.204 1.00 0.00 C ATOM 27 O LEU A 3 -25.785 -15.771 -3.329 1.00 0.00 O ATOM 28 CB LEU A 3 -27.258 -18.327 -4.331 1.00 0.00 C ATOM 29 CG LEU A 3 -28.601 -18.786 -4.919 1.00 0.00 C ATOM 30 CD1 LEU A 3 -29.527 -17.598 -5.138 1.00 0.00 C ATOM 31 CD2 LEU A 3 -28.398 -19.558 -6.215 1.00 0.00 C ATOM 0 H LEU A 3 -25.923 -18.724 -6.419 1.00 0.00 H new ATOM 0 HA LEU A 3 -27.271 -16.459 -5.373 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -26.595 -19.191 -4.274 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -27.429 -17.988 -3.309 1.00 0.00 H new ATOM 0 HG LEU A 3 -29.070 -19.458 -4.200 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -30.472 -17.945 -5.555 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -29.711 -17.100 -4.186 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -29.061 -16.896 -5.830 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -29.366 -19.870 -6.608 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -27.899 -18.920 -6.944 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -27.784 -20.438 -6.022 1.00 0.00 H new ATOM 43 N GLY A 4 -24.225 -16.952 -4.431 1.00 0.00 N ATOM 44 CA GLY A 4 -23.126 -16.362 -3.701 1.00 0.00 C ATOM 45 C GLY A 4 -22.417 -15.308 -4.523 1.00 0.00 C ATOM 46 O GLY A 4 -21.359 -15.566 -5.097 1.00 0.00 O ATOM 0 H GLY A 4 -23.952 -17.659 -5.113 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -23.498 -15.916 -2.779 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -22.418 -17.140 -3.416 1.00 0.00 H new ATOM 50 N SER A 5 -23.006 -14.125 -4.602 1.00 0.00 N ATOM 51 CA SER A 5 -22.414 -13.030 -5.348 1.00 0.00 C ATOM 52 C SER A 5 -21.548 -12.181 -4.425 1.00 0.00 C ATOM 53 O SER A 5 -22.041 -11.557 -3.488 1.00 0.00 O ATOM 54 CB SER A 5 -23.512 -12.187 -5.997 1.00 0.00 C ATOM 55 OG SER A 5 -24.343 -12.997 -6.814 1.00 0.00 O ATOM 0 H SER A 5 -23.896 -13.900 -4.157 1.00 0.00 H new ATOM 0 HA SER A 5 -21.780 -13.432 -6.138 1.00 0.00 H new ATOM 0 HB2 SER A 5 -24.111 -11.703 -5.226 1.00 0.00 H new ATOM 0 HB3 SER A 5 -23.064 -11.395 -6.596 1.00 0.00 H new ATOM 0 HG SER A 5 -25.042 -12.443 -7.221 1.00 0.00 H new ATOM 61 N MET A 6 -20.257 -12.163 -4.698 1.00 0.00 N ATOM 62 CA MET A 6 -19.308 -11.485 -3.831 1.00 0.00 C ATOM 63 C MET A 6 -19.219 -10.000 -4.159 1.00 0.00 C ATOM 64 O MET A 6 -19.313 -9.601 -5.321 1.00 0.00 O ATOM 65 CB MET A 6 -17.927 -12.131 -3.951 1.00 0.00 C ATOM 66 CG MET A 6 -17.370 -12.138 -5.368 1.00 0.00 C ATOM 67 SD MET A 6 -15.748 -12.922 -5.484 1.00 0.00 S ATOM 68 CE MET A 6 -16.114 -14.574 -4.888 1.00 0.00 C ATOM 0 H MET A 6 -19.840 -12.610 -5.514 1.00 0.00 H new ATOM 0 HA MET A 6 -19.663 -11.584 -2.805 1.00 0.00 H new ATOM 0 HB2 MET A 6 -17.231 -11.601 -3.300 1.00 0.00 H new ATOM 0 HB3 MET A 6 -17.984 -13.157 -3.588 1.00 0.00 H new ATOM 0 HG2 MET A 6 -18.067 -12.659 -6.024 1.00 0.00 H new ATOM 0 HG3 MET A 6 -17.298 -11.112 -5.729 1.00 0.00 H new ATOM 0 HE1 MET A 6 -15.337 -15.262 -5.222 1.00 0.00 H new ATOM 0 HE2 MET A 6 -16.149 -14.568 -3.799 1.00 0.00 H new ATOM 0 HE3 MET A 6 -17.078 -14.897 -5.280 1.00 0.00 H new ATOM 78 N LYS A 7 -19.051 -9.186 -3.124 1.00 0.00 N ATOM 79 CA LYS A 7 -18.818 -7.760 -3.302 1.00 0.00 C ATOM 80 C LYS A 7 -17.319 -7.528 -3.380 1.00 0.00 C ATOM 81 O LYS A 7 -16.568 -8.129 -2.621 1.00 0.00 O ATOM 82 CB LYS A 7 -19.395 -6.933 -2.139 1.00 0.00 C ATOM 83 CG LYS A 7 -20.916 -6.937 -2.026 1.00 0.00 C ATOM 84 CD LYS A 7 -21.442 -8.213 -1.387 1.00 0.00 C ATOM 85 CE LYS A 7 -22.919 -8.094 -1.027 1.00 0.00 C ATOM 86 NZ LYS A 7 -23.769 -7.796 -2.209 1.00 0.00 N ATOM 0 H LYS A 7 -19.072 -9.491 -2.151 1.00 0.00 H new ATOM 0 HA LYS A 7 -19.318 -7.440 -4.216 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -18.977 -7.309 -1.205 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -19.058 -5.902 -2.246 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -21.237 -6.078 -1.436 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -21.353 -6.823 -3.018 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -21.300 -9.049 -2.072 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -20.865 -8.435 -0.489 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -23.254 -9.024 -0.567 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -23.047 -7.307 -0.284 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -24.770 -7.809 -1.929 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -23.526 -6.857 -2.583 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -23.606 -8.514 -2.944 1.00 0.00 H new ATOM 100 N MET A 8 -16.871 -6.684 -4.289 1.00 0.00 N ATOM 101 CA MET A 8 -15.444 -6.441 -4.418 1.00 0.00 C ATOM 102 C MET A 8 -15.040 -5.097 -3.840 1.00 0.00 C ATOM 103 O MET A 8 -15.694 -4.076 -4.056 1.00 0.00 O ATOM 104 CB MET A 8 -14.983 -6.556 -5.867 1.00 0.00 C ATOM 105 CG MET A 8 -14.756 -7.989 -6.321 1.00 0.00 C ATOM 106 SD MET A 8 -14.000 -8.081 -7.956 1.00 0.00 S ATOM 107 CE MET A 8 -12.494 -7.147 -7.676 1.00 0.00 C ATOM 0 H MET A 8 -17.460 -6.163 -4.939 1.00 0.00 H new ATOM 0 HA MET A 8 -14.945 -7.217 -3.838 1.00 0.00 H new ATOM 0 HB2 MET A 8 -15.727 -6.092 -6.514 1.00 0.00 H new ATOM 0 HB3 MET A 8 -14.058 -5.993 -5.991 1.00 0.00 H new ATOM 0 HG2 MET A 8 -14.118 -8.499 -5.599 1.00 0.00 H new ATOM 0 HG3 MET A 8 -15.709 -8.518 -6.334 1.00 0.00 H new ATOM 0 HE1 MET A 8 -11.672 -7.610 -8.222 1.00 0.00 H new ATOM 0 HE2 MET A 8 -12.630 -6.124 -8.025 1.00 0.00 H new ATOM 0 HE3 MET A 8 -12.264 -7.139 -6.611 1.00 0.00 H new ATOM 117 N ILE A 9 -13.967 -5.131 -3.074 1.00 0.00 N ATOM 118 CA ILE A 9 -13.377 -3.944 -2.494 1.00 0.00 C ATOM 119 C ILE A 9 -11.988 -3.740 -3.079 1.00 0.00 C ATOM 120 O ILE A 9 -11.093 -4.552 -2.870 1.00 0.00 O ATOM 121 CB ILE A 9 -13.270 -4.083 -0.961 1.00 0.00 C ATOM 122 CG1 ILE A 9 -14.650 -4.333 -0.350 1.00 0.00 C ATOM 123 CG2 ILE A 9 -12.612 -2.866 -0.322 1.00 0.00 C ATOM 124 CD1 ILE A 9 -14.648 -4.357 1.163 1.00 0.00 C ATOM 0 H ILE A 9 -13.477 -5.993 -2.835 1.00 0.00 H new ATOM 0 HA ILE A 9 -14.011 -3.088 -2.723 1.00 0.00 H new ATOM 0 HB ILE A 9 -12.631 -4.942 -0.754 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -15.335 -3.557 -0.692 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -15.035 -5.284 -0.720 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -12.557 -3.007 0.757 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -11.606 -2.744 -0.723 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -13.201 -1.976 -0.542 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -15.660 -4.539 1.525 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -13.989 -5.151 1.513 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -14.294 -3.398 1.542 1.00 0.00 H new ATOM 136 N GLU A 10 -11.811 -2.669 -3.815 1.00 0.00 N ATOM 137 CA GLU A 10 -10.530 -2.389 -4.439 1.00 0.00 C ATOM 138 C GLU A 10 -9.735 -1.471 -3.533 1.00 0.00 C ATOM 139 O GLU A 10 -10.237 -0.433 -3.111 1.00 0.00 O ATOM 140 CB GLU A 10 -10.723 -1.740 -5.815 1.00 0.00 C ATOM 141 CG GLU A 10 -11.172 -2.695 -6.915 1.00 0.00 C ATOM 142 CD GLU A 10 -10.010 -3.398 -7.597 1.00 0.00 C ATOM 143 OE1 GLU A 10 -9.079 -2.703 -8.063 1.00 0.00 O ATOM 144 OE2 GLU A 10 -10.020 -4.643 -7.688 1.00 0.00 O ATOM 0 H GLU A 10 -12.535 -1.974 -3.999 1.00 0.00 H new ATOM 0 HA GLU A 10 -9.990 -3.324 -4.585 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -11.459 -0.941 -5.724 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -9.784 -1.276 -6.117 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -11.843 -3.441 -6.490 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -11.743 -2.141 -7.660 1.00 0.00 H new ATOM 151 N VAL A 11 -8.512 -1.855 -3.211 1.00 0.00 N ATOM 152 CA VAL A 11 -7.677 -1.059 -2.330 1.00 0.00 C ATOM 153 C VAL A 11 -6.292 -0.906 -2.933 1.00 0.00 C ATOM 154 O VAL A 11 -5.679 -1.881 -3.361 1.00 0.00 O ATOM 155 CB VAL A 11 -7.557 -1.691 -0.920 1.00 0.00 C ATOM 156 CG1 VAL A 11 -6.620 -0.877 -0.036 1.00 0.00 C ATOM 157 CG2 VAL A 11 -8.926 -1.814 -0.266 1.00 0.00 C ATOM 0 H VAL A 11 -8.075 -2.714 -3.547 1.00 0.00 H new ATOM 0 HA VAL A 11 -8.150 -0.083 -2.222 1.00 0.00 H new ATOM 0 HB VAL A 11 -7.137 -2.690 -1.036 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -6.553 -1.341 0.948 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -5.629 -0.843 -0.490 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -7.006 0.137 0.067 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -8.818 -2.260 0.723 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -9.374 -0.825 -0.171 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -9.568 -2.445 -0.881 1.00 0.00 H new ATOM 167 N VAL A 12 -5.814 0.316 -2.990 1.00 0.00 N ATOM 168 CA VAL A 12 -4.475 0.575 -3.473 1.00 0.00 C ATOM 169 C VAL A 12 -3.559 0.926 -2.318 1.00 0.00 C ATOM 170 O VAL A 12 -3.931 1.682 -1.419 1.00 0.00 O ATOM 171 CB VAL A 12 -4.440 1.699 -4.529 1.00 0.00 C ATOM 172 CG1 VAL A 12 -4.816 1.158 -5.898 1.00 0.00 C ATOM 173 CG2 VAL A 12 -5.359 2.847 -4.129 1.00 0.00 C ATOM 0 H VAL A 12 -6.332 1.148 -2.708 1.00 0.00 H new ATOM 0 HA VAL A 12 -4.126 -0.339 -3.954 1.00 0.00 H new ATOM 0 HB VAL A 12 -3.422 2.085 -4.583 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -4.786 1.966 -6.629 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -4.110 0.379 -6.188 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -5.822 0.740 -5.860 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -5.318 3.628 -4.889 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -6.382 2.480 -4.040 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -5.036 3.255 -3.171 1.00 0.00 H new ATOM 183 N ALA A 13 -2.376 0.348 -2.335 1.00 0.00 N ATOM 184 CA ALA A 13 -1.368 0.625 -1.340 1.00 0.00 C ATOM 185 C ALA A 13 -0.164 1.236 -2.032 1.00 0.00 C ATOM 186 O ALA A 13 0.288 0.733 -3.063 1.00 0.00 O ATOM 187 CB ALA A 13 -0.980 -0.651 -0.603 1.00 0.00 C ATOM 0 H ALA A 13 -2.088 -0.328 -3.042 1.00 0.00 H new ATOM 0 HA ALA A 13 -1.759 1.325 -0.601 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -0.219 -0.423 0.143 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -1.858 -1.068 -0.110 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -0.585 -1.376 -1.314 1.00 0.00 H new ATOM 193 N ALA A 14 0.346 2.314 -1.480 1.00 0.00 N ATOM 194 CA ALA A 14 1.447 3.015 -2.099 1.00 0.00 C ATOM 195 C ALA A 14 2.738 2.682 -1.398 1.00 0.00 C ATOM 196 O ALA A 14 2.874 2.874 -0.189 1.00 0.00 O ATOM 197 CB ALA A 14 1.221 4.518 -2.073 1.00 0.00 C ATOM 0 H ALA A 14 0.017 2.723 -0.606 1.00 0.00 H new ATOM 0 HA ALA A 14 1.508 2.693 -3.138 1.00 0.00 H new ATOM 0 HB1 ALA A 14 2.065 5.021 -2.545 1.00 0.00 H new ATOM 0 HB2 ALA A 14 0.306 4.758 -2.615 1.00 0.00 H new ATOM 0 HB3 ALA A 14 1.130 4.854 -1.040 1.00 0.00 H new ATOM 203 N ILE A 15 3.694 2.195 -2.158 1.00 0.00 N ATOM 204 CA ILE A 15 4.991 1.905 -1.615 1.00 0.00 C ATOM 205 C ILE A 15 5.877 3.106 -1.858 1.00 0.00 C ATOM 206 O ILE A 15 6.379 3.314 -2.967 1.00 0.00 O ATOM 207 CB ILE A 15 5.608 0.639 -2.241 1.00 0.00 C ATOM 208 CG1 ILE A 15 4.722 -0.575 -1.934 1.00 0.00 C ATOM 209 CG2 ILE A 15 7.021 0.423 -1.726 1.00 0.00 C ATOM 210 CD1 ILE A 15 5.452 -1.898 -2.008 1.00 0.00 C ATOM 0 H ILE A 15 3.592 1.994 -3.153 1.00 0.00 H new ATOM 0 HA ILE A 15 4.897 1.707 -0.547 1.00 0.00 H new ATOM 0 HB ILE A 15 5.663 0.767 -3.322 1.00 0.00 H new ATOM 0 HG12 ILE A 15 4.297 -0.460 -0.937 1.00 0.00 H new ATOM 0 HG13 ILE A 15 3.888 -0.591 -2.636 1.00 0.00 H new ATOM 0 HG21 ILE A 15 7.440 -0.475 -2.179 1.00 0.00 H new ATOM 0 HG22 ILE A 15 7.639 1.283 -1.986 1.00 0.00 H new ATOM 0 HG23 ILE A 15 7.000 0.307 -0.642 1.00 0.00 H new ATOM 0 HD11 ILE A 15 4.760 -2.709 -1.779 1.00 0.00 H new ATOM 0 HD12 ILE A 15 5.853 -2.036 -3.012 1.00 0.00 H new ATOM 0 HD13 ILE A 15 6.269 -1.904 -1.287 1.00 0.00 H new ATOM 222 N ILE A 16 6.034 3.915 -0.827 1.00 0.00 N ATOM 223 CA ILE A 16 6.755 5.160 -0.943 1.00 0.00 C ATOM 224 C ILE A 16 8.193 4.943 -0.531 1.00 0.00 C ATOM 225 O ILE A 16 8.479 4.699 0.640 1.00 0.00 O ATOM 226 CB ILE A 16 6.110 6.255 -0.065 1.00 0.00 C ATOM 227 CG1 ILE A 16 4.606 6.322 -0.346 1.00 0.00 C ATOM 228 CG2 ILE A 16 6.763 7.607 -0.323 1.00 0.00 C ATOM 229 CD1 ILE A 16 3.876 7.355 0.474 1.00 0.00 C ATOM 0 H ILE A 16 5.667 3.726 0.106 1.00 0.00 H new ATOM 0 HA ILE A 16 6.716 5.494 -1.980 1.00 0.00 H new ATOM 0 HB ILE A 16 6.265 6.002 0.984 1.00 0.00 H new ATOM 0 HG12 ILE A 16 4.453 6.538 -1.403 1.00 0.00 H new ATOM 0 HG13 ILE A 16 4.167 5.343 -0.154 1.00 0.00 H new ATOM 0 HG21 ILE A 16 6.294 8.364 0.306 1.00 0.00 H new ATOM 0 HG22 ILE A 16 7.826 7.548 -0.088 1.00 0.00 H new ATOM 0 HG23 ILE A 16 6.637 7.878 -1.371 1.00 0.00 H new ATOM 0 HD11 ILE A 16 2.817 7.341 0.218 1.00 0.00 H new ATOM 0 HD12 ILE A 16 3.996 7.129 1.534 1.00 0.00 H new ATOM 0 HD13 ILE A 16 4.287 8.343 0.265 1.00 0.00 H new ATOM 241 N GLU A 17 9.086 4.995 -1.499 1.00 0.00 N ATOM 242 CA GLU A 17 10.476 4.691 -1.251 1.00 0.00 C ATOM 243 C GLU A 17 11.308 5.957 -1.264 1.00 0.00 C ATOM 244 O GLU A 17 11.155 6.809 -2.141 1.00 0.00 O ATOM 245 CB GLU A 17 11.010 3.722 -2.301 1.00 0.00 C ATOM 246 CG GLU A 17 12.427 3.246 -2.027 1.00 0.00 C ATOM 247 CD GLU A 17 13.017 2.504 -3.205 1.00 0.00 C ATOM 248 OE1 GLU A 17 12.246 2.112 -4.100 1.00 0.00 O ATOM 249 OE2 GLU A 17 14.250 2.316 -3.249 1.00 0.00 O ATOM 0 H GLU A 17 8.871 5.245 -2.464 1.00 0.00 H new ATOM 0 HA GLU A 17 10.547 4.226 -0.268 1.00 0.00 H new ATOM 0 HB2 GLU A 17 10.349 2.857 -2.354 1.00 0.00 H new ATOM 0 HB3 GLU A 17 10.981 4.206 -3.277 1.00 0.00 H new ATOM 0 HG2 GLU A 17 13.056 4.103 -1.787 1.00 0.00 H new ATOM 0 HG3 GLU A 17 12.427 2.595 -1.153 1.00 0.00 H new ATOM 256 N ARG A 18 12.175 6.078 -0.282 1.00 0.00 N ATOM 257 CA ARG A 18 13.100 7.182 -0.226 1.00 0.00 C ATOM 258 C ARG A 18 14.426 6.689 0.323 1.00 0.00 C ATOM 259 O ARG A 18 14.481 6.129 1.419 1.00 0.00 O ATOM 260 CB ARG A 18 12.533 8.301 0.643 1.00 0.00 C ATOM 261 CG ARG A 18 13.012 9.684 0.243 1.00 0.00 C ATOM 262 CD ARG A 18 12.543 10.042 -1.159 1.00 0.00 C ATOM 263 NE ARG A 18 12.735 11.459 -1.458 1.00 0.00 N ATOM 264 CZ ARG A 18 12.348 12.045 -2.593 1.00 0.00 C ATOM 265 NH1 ARG A 18 11.808 11.325 -3.571 1.00 0.00 N ATOM 266 NH2 ARG A 18 12.508 13.353 -2.745 1.00 0.00 N ATOM 0 H ARG A 18 12.256 5.419 0.492 1.00 0.00 H new ATOM 0 HA ARG A 18 13.257 7.583 -1.227 1.00 0.00 H new ATOM 0 HB2 ARG A 18 11.445 8.274 0.591 1.00 0.00 H new ATOM 0 HB3 ARG A 18 12.807 8.117 1.682 1.00 0.00 H new ATOM 0 HG2 ARG A 18 12.639 10.421 0.954 1.00 0.00 H new ATOM 0 HG3 ARG A 18 14.100 9.722 0.286 1.00 0.00 H new ATOM 0 HD2 ARG A 18 13.088 9.441 -1.887 1.00 0.00 H new ATOM 0 HD3 ARG A 18 11.488 9.790 -1.263 1.00 0.00 H new ATOM 0 HE ARG A 18 13.194 12.037 -0.754 1.00 0.00 H new ATOM 0 HH11 ARG A 18 11.687 10.319 -3.457 1.00 0.00 H new ATOM 0 HH12 ARG A 18 11.514 11.779 -4.436 1.00 0.00 H new ATOM 0 HH21 ARG A 18 12.925 13.906 -1.996 1.00 0.00 H new ATOM 0 HH22 ARG A 18 12.214 13.806 -3.610 1.00 0.00 H new ATOM 280 N ASP A 19 15.475 6.848 -0.478 1.00 0.00 N ATOM 281 CA ASP A 19 16.832 6.428 -0.108 1.00 0.00 C ATOM 282 C ASP A 19 16.956 4.914 0.028 1.00 0.00 C ATOM 283 O ASP A 19 17.977 4.415 0.507 1.00 0.00 O ATOM 284 CB ASP A 19 17.285 7.090 1.196 1.00 0.00 C ATOM 285 CG ASP A 19 17.443 8.590 1.063 1.00 0.00 C ATOM 286 OD1 ASP A 19 18.401 9.028 0.389 1.00 0.00 O ATOM 287 OD2 ASP A 19 16.613 9.341 1.624 1.00 0.00 O ATOM 0 H ASP A 19 15.413 7.272 -1.404 1.00 0.00 H new ATOM 0 HA ASP A 19 17.479 6.752 -0.923 1.00 0.00 H new ATOM 0 HB2 ASP A 19 16.560 6.873 1.980 1.00 0.00 H new ATOM 0 HB3 ASP A 19 18.234 6.655 1.510 1.00 0.00 H new ATOM 292 N GLY A 20 15.945 4.174 -0.406 1.00 0.00 N ATOM 293 CA GLY A 20 15.998 2.730 -0.293 1.00 0.00 C ATOM 294 C GLY A 20 15.117 2.209 0.824 1.00 0.00 C ATOM 295 O GLY A 20 15.080 1.009 1.090 1.00 0.00 O ATOM 0 H GLY A 20 15.095 4.544 -0.831 1.00 0.00 H new ATOM 0 HA2 GLY A 20 15.687 2.282 -1.237 1.00 0.00 H new ATOM 0 HA3 GLY A 20 17.028 2.419 -0.116 1.00 0.00 H new ATOM 299 N LYS A 21 14.407 3.116 1.484 1.00 0.00 N ATOM 300 CA LYS A 21 13.527 2.741 2.580 1.00 0.00 C ATOM 301 C LYS A 21 12.078 3.025 2.211 1.00 0.00 C ATOM 302 O LYS A 21 11.800 3.923 1.418 1.00 0.00 O ATOM 303 CB LYS A 21 13.908 3.498 3.856 1.00 0.00 C ATOM 304 CG LYS A 21 15.394 3.448 4.166 1.00 0.00 C ATOM 305 CD LYS A 21 15.644 3.112 5.626 1.00 0.00 C ATOM 306 CE LYS A 21 17.093 2.730 5.872 1.00 0.00 C ATOM 307 NZ LYS A 21 18.037 3.742 5.330 1.00 0.00 N ATOM 0 H LYS A 21 14.424 4.115 1.278 1.00 0.00 H new ATOM 0 HA LYS A 21 13.639 1.673 2.765 1.00 0.00 H new ATOM 0 HB2 LYS A 21 13.600 4.539 3.758 1.00 0.00 H new ATOM 0 HB3 LYS A 21 13.355 3.080 4.697 1.00 0.00 H new ATOM 0 HG2 LYS A 21 15.875 2.703 3.532 1.00 0.00 H new ATOM 0 HG3 LYS A 21 15.849 4.410 3.929 1.00 0.00 H new ATOM 0 HD2 LYS A 21 15.383 3.969 6.247 1.00 0.00 H new ATOM 0 HD3 LYS A 21 14.994 2.290 5.927 1.00 0.00 H new ATOM 0 HE2 LYS A 21 17.261 2.615 6.943 1.00 0.00 H new ATOM 0 HE3 LYS A 21 17.296 1.763 5.412 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 18.994 3.553 5.691 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 18.042 3.691 4.291 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 17.736 4.692 5.628 1.00 0.00 H new ATOM 321 N ILE A 22 11.164 2.257 2.785 1.00 0.00 N ATOM 322 CA ILE A 22 9.746 2.396 2.490 1.00 0.00 C ATOM 323 C ILE A 22 9.044 3.104 3.648 1.00 0.00 C ATOM 324 O ILE A 22 9.454 2.971 4.803 1.00 0.00 O ATOM 325 CB ILE A 22 9.082 1.016 2.249 1.00 0.00 C ATOM 326 CG1 ILE A 22 10.011 0.108 1.444 1.00 0.00 C ATOM 327 CG2 ILE A 22 7.751 1.174 1.519 1.00 0.00 C ATOM 328 CD1 ILE A 22 9.449 -1.279 1.231 1.00 0.00 C ATOM 0 H ILE A 22 11.381 1.526 3.462 1.00 0.00 H new ATOM 0 HA ILE A 22 9.648 2.987 1.579 1.00 0.00 H new ATOM 0 HB ILE A 22 8.894 0.559 3.221 1.00 0.00 H new ATOM 0 HG12 ILE A 22 10.207 0.567 0.475 1.00 0.00 H new ATOM 0 HG13 ILE A 22 10.968 0.030 1.959 1.00 0.00 H new ATOM 0 HG21 ILE A 22 7.304 0.193 1.361 1.00 0.00 H new ATOM 0 HG22 ILE A 22 7.078 1.787 2.118 1.00 0.00 H new ATOM 0 HG23 ILE A 22 7.919 1.655 0.556 1.00 0.00 H new ATOM 0 HD11 ILE A 22 10.157 -1.873 0.653 1.00 0.00 H new ATOM 0 HD12 ILE A 22 9.279 -1.755 2.197 1.00 0.00 H new ATOM 0 HD13 ILE A 22 8.506 -1.210 0.689 1.00 0.00 H new ATOM 340 N LEU A 23 8.009 3.870 3.330 1.00 0.00 N ATOM 341 CA LEU A 23 7.260 4.611 4.336 1.00 0.00 C ATOM 342 C LEU A 23 6.163 3.745 4.958 1.00 0.00 C ATOM 343 O LEU A 23 5.243 3.301 4.270 1.00 0.00 O ATOM 344 CB LEU A 23 6.639 5.863 3.712 1.00 0.00 C ATOM 345 CG LEU A 23 5.897 6.777 4.688 1.00 0.00 C ATOM 346 CD1 LEU A 23 6.854 7.340 5.723 1.00 0.00 C ATOM 347 CD2 LEU A 23 5.196 7.902 3.947 1.00 0.00 C ATOM 0 H LEU A 23 7.667 3.995 2.377 1.00 0.00 H new ATOM 0 HA LEU A 23 7.954 4.904 5.124 1.00 0.00 H new ATOM 0 HB2 LEU A 23 7.429 6.439 3.229 1.00 0.00 H new ATOM 0 HB3 LEU A 23 5.946 5.554 2.930 1.00 0.00 H new ATOM 0 HG LEU A 23 5.141 6.183 5.202 1.00 0.00 H new ATOM 0 HD11 LEU A 23 6.308 7.988 6.409 1.00 0.00 H new ATOM 0 HD12 LEU A 23 7.309 6.522 6.281 1.00 0.00 H new ATOM 0 HD13 LEU A 23 7.633 7.915 5.223 1.00 0.00 H new ATOM 0 HD21 LEU A 23 4.675 8.539 4.662 1.00 0.00 H new ATOM 0 HD22 LEU A 23 5.932 8.494 3.403 1.00 0.00 H new ATOM 0 HD23 LEU A 23 4.477 7.482 3.244 1.00 0.00 H new ATOM 359 N LEU A 24 6.273 3.512 6.260 1.00 0.00 N ATOM 360 CA LEU A 24 5.268 2.751 6.997 1.00 0.00 C ATOM 361 C LEU A 24 4.494 3.673 7.930 1.00 0.00 C ATOM 362 O LEU A 24 5.074 4.556 8.560 1.00 0.00 O ATOM 363 CB LEU A 24 5.906 1.613 7.806 1.00 0.00 C ATOM 364 CG LEU A 24 6.411 0.409 6.998 1.00 0.00 C ATOM 365 CD1 LEU A 24 7.617 0.766 6.152 1.00 0.00 C ATOM 366 CD2 LEU A 24 6.738 -0.745 7.929 1.00 0.00 C ATOM 0 H LEU A 24 7.052 3.840 6.831 1.00 0.00 H new ATOM 0 HA LEU A 24 4.586 2.310 6.270 1.00 0.00 H new ATOM 0 HB2 LEU A 24 6.743 2.022 8.371 1.00 0.00 H new ATOM 0 HB3 LEU A 24 5.175 1.257 8.532 1.00 0.00 H new ATOM 0 HG LEU A 24 5.614 0.106 6.319 1.00 0.00 H new ATOM 0 HD11 LEU A 24 7.944 -0.112 5.596 1.00 0.00 H new ATOM 0 HD12 LEU A 24 7.350 1.559 5.454 1.00 0.00 H new ATOM 0 HD13 LEU A 24 8.426 1.108 6.798 1.00 0.00 H new ATOM 0 HD21 LEU A 24 7.095 -1.593 7.345 1.00 0.00 H new ATOM 0 HD22 LEU A 24 7.512 -0.437 8.632 1.00 0.00 H new ATOM 0 HD23 LEU A 24 5.842 -1.034 8.479 1.00 0.00 H new ATOM 378 N ALA A 25 3.186 3.470 8.010 1.00 0.00 N ATOM 379 CA ALA A 25 2.342 4.296 8.861 1.00 0.00 C ATOM 380 C ALA A 25 1.627 3.460 9.921 1.00 0.00 C ATOM 381 O ALA A 25 0.895 2.524 9.599 1.00 0.00 O ATOM 382 CB ALA A 25 1.345 5.069 8.014 1.00 0.00 C ATOM 0 H ALA A 25 2.688 2.742 7.497 1.00 0.00 H new ATOM 0 HA ALA A 25 2.980 5.006 9.386 1.00 0.00 H new ATOM 0 HB1 ALA A 25 0.718 5.684 8.660 1.00 0.00 H new ATOM 0 HB2 ALA A 25 1.882 5.709 7.313 1.00 0.00 H new ATOM 0 HB3 ALA A 25 0.719 4.370 7.460 1.00 0.00 H new ATOM 388 N GLN A 26 1.858 3.799 11.184 1.00 0.00 N ATOM 389 CA GLN A 26 1.270 3.069 12.306 1.00 0.00 C ATOM 390 C GLN A 26 -0.240 3.289 12.403 1.00 0.00 C ATOM 391 O GLN A 26 -0.689 4.388 12.732 1.00 0.00 O ATOM 392 CB GLN A 26 1.929 3.484 13.625 1.00 0.00 C ATOM 393 CG GLN A 26 1.356 2.766 14.836 1.00 0.00 C ATOM 394 CD GLN A 26 1.947 3.248 16.145 1.00 0.00 C ATOM 395 OE1 GLN A 26 3.098 3.671 16.208 1.00 0.00 O ATOM 396 NE2 GLN A 26 1.151 3.195 17.202 1.00 0.00 N ATOM 0 H GLN A 26 2.453 4.580 11.460 1.00 0.00 H new ATOM 0 HA GLN A 26 1.450 2.009 12.124 1.00 0.00 H new ATOM 0 HB2 GLN A 26 2.999 3.286 13.567 1.00 0.00 H new ATOM 0 HB3 GLN A 26 1.811 4.559 13.759 1.00 0.00 H new ATOM 0 HG2 GLN A 26 0.275 2.908 14.858 1.00 0.00 H new ATOM 0 HG3 GLN A 26 1.535 1.696 14.735 1.00 0.00 H new ATOM 0 HE21 GLN A 26 0.201 2.837 17.107 1.00 0.00 H new ATOM 0 HE22 GLN A 26 1.488 3.513 18.111 1.00 0.00 H new ATOM 405 N ARG A 27 -0.989 2.227 12.096 1.00 0.00 N ATOM 406 CA ARG A 27 -2.454 2.167 12.212 1.00 0.00 C ATOM 407 C ARG A 27 -2.971 1.096 11.268 1.00 0.00 C ATOM 408 O ARG A 27 -2.574 1.074 10.112 1.00 0.00 O ATOM 409 CB ARG A 27 -3.143 3.491 11.849 1.00 0.00 C ATOM 410 CG ARG A 27 -4.660 3.389 11.801 1.00 0.00 C ATOM 411 CD ARG A 27 -5.271 4.573 11.081 1.00 0.00 C ATOM 412 NE ARG A 27 -6.687 4.373 10.801 1.00 0.00 N ATOM 413 CZ ARG A 27 -7.230 4.494 9.592 1.00 0.00 C ATOM 414 NH1 ARG A 27 -6.463 4.750 8.537 1.00 0.00 N ATOM 415 NH2 ARG A 27 -8.534 4.324 9.439 1.00 0.00 N ATOM 0 H ARG A 27 -0.584 1.358 11.749 1.00 0.00 H new ATOM 0 HA ARG A 27 -2.684 1.947 13.255 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -2.860 4.251 12.577 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -2.778 3.828 10.879 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -4.948 2.466 11.297 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -5.055 3.335 12.816 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -5.145 5.470 11.687 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -4.737 4.743 10.146 1.00 0.00 H new ATOM 0 HE ARG A 27 -7.299 4.125 11.579 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -5.455 4.854 8.653 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -6.882 4.842 7.612 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -9.117 4.101 10.246 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -8.955 4.416 8.515 1.00 0.00 H new ATOM 429 N PRO A 28 -3.843 0.196 11.737 1.00 0.00 N ATOM 430 CA PRO A 28 -4.483 -0.792 10.880 1.00 0.00 C ATOM 431 C PRO A 28 -5.786 -0.244 10.297 1.00 0.00 C ATOM 432 O PRO A 28 -5.903 0.957 10.048 1.00 0.00 O ATOM 433 CB PRO A 28 -4.738 -1.934 11.861 1.00 0.00 C ATOM 434 CG PRO A 28 -5.056 -1.246 13.140 1.00 0.00 C ATOM 435 CD PRO A 28 -4.283 0.055 13.137 1.00 0.00 C ATOM 0 HA PRO A 28 -3.892 -1.087 10.013 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -5.563 -2.566 11.532 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -3.864 -2.577 11.961 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -6.127 -1.060 13.224 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -4.772 -1.863 13.993 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -4.908 0.893 13.447 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -3.436 0.019 13.822 1.00 0.00 H new ATOM 443 N ALA A 29 -6.766 -1.108 10.088 1.00 0.00 N ATOM 444 CA ALA A 29 -8.040 -0.676 9.537 1.00 0.00 C ATOM 445 C ALA A 29 -9.081 -0.485 10.637 1.00 0.00 C ATOM 446 O ALA A 29 -9.421 0.644 10.991 1.00 0.00 O ATOM 447 CB ALA A 29 -8.531 -1.669 8.495 1.00 0.00 C ATOM 0 H ALA A 29 -6.705 -2.106 10.290 1.00 0.00 H new ATOM 0 HA ALA A 29 -7.890 0.289 9.052 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -9.486 -1.331 8.092 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -7.802 -1.740 7.688 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -8.658 -2.648 8.957 1.00 0.00 H new ATOM 453 N GLN A 30 -9.587 -1.587 11.180 1.00 0.00 N ATOM 454 CA GLN A 30 -10.596 -1.520 12.235 1.00 0.00 C ATOM 455 C GLN A 30 -10.066 -2.086 13.545 1.00 0.00 C ATOM 456 O GLN A 30 -10.741 -2.031 14.575 1.00 0.00 O ATOM 457 CB GLN A 30 -11.857 -2.279 11.823 1.00 0.00 C ATOM 458 CG GLN A 30 -12.627 -1.621 10.694 1.00 0.00 C ATOM 459 CD GLN A 30 -13.892 -2.373 10.339 1.00 0.00 C ATOM 460 OE1 GLN A 30 -13.959 -3.597 10.466 1.00 0.00 O ATOM 461 NE2 GLN A 30 -14.905 -1.647 9.897 1.00 0.00 N ATOM 0 H GLN A 30 -9.318 -2.533 10.910 1.00 0.00 H new ATOM 0 HA GLN A 30 -10.842 -0.469 12.386 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -11.579 -3.289 11.521 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -12.512 -2.374 12.689 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -12.883 -0.601 10.980 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -11.988 -1.555 9.813 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -14.807 -0.636 9.807 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -15.785 -2.098 9.646 1.00 0.00 H new ATOM 470 N SER A 31 -8.862 -2.637 13.502 1.00 0.00 N ATOM 471 CA SER A 31 -8.261 -3.247 14.676 1.00 0.00 C ATOM 472 C SER A 31 -7.912 -2.186 15.718 1.00 0.00 C ATOM 473 O SER A 31 -7.437 -1.102 15.379 1.00 0.00 O ATOM 474 CB SER A 31 -7.009 -4.021 14.268 1.00 0.00 C ATOM 475 OG SER A 31 -7.271 -4.841 13.141 1.00 0.00 O ATOM 0 H SER A 31 -8.282 -2.674 12.664 1.00 0.00 H new ATOM 0 HA SER A 31 -8.980 -3.935 15.121 1.00 0.00 H new ATOM 0 HB2 SER A 31 -6.204 -3.324 14.037 1.00 0.00 H new ATOM 0 HB3 SER A 31 -6.669 -4.637 15.101 1.00 0.00 H new ATOM 0 HG SER A 31 -6.457 -5.327 12.894 1.00 0.00 H new ATOM 481 N ASP A 32 -8.150 -2.506 16.981 1.00 0.00 N ATOM 482 CA ASP A 32 -7.855 -1.588 18.071 1.00 0.00 C ATOM 483 C ASP A 32 -6.412 -1.752 18.507 1.00 0.00 C ATOM 484 O ASP A 32 -5.854 -0.889 19.189 1.00 0.00 O ATOM 485 CB ASP A 32 -8.774 -1.839 19.269 1.00 0.00 C ATOM 486 CG ASP A 32 -10.235 -1.585 18.965 1.00 0.00 C ATOM 487 OD1 ASP A 32 -10.663 -0.412 19.009 1.00 0.00 O ATOM 488 OD2 ASP A 32 -10.967 -2.561 18.702 1.00 0.00 O ATOM 0 H ASP A 32 -8.548 -3.397 17.277 1.00 0.00 H new ATOM 0 HA ASP A 32 -8.022 -0.573 17.710 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -8.653 -2.870 19.602 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -8.465 -1.199 20.096 1.00 0.00 H new ATOM 493 N GLN A 33 -5.823 -2.884 18.141 1.00 0.00 N ATOM 494 CA GLN A 33 -4.429 -3.158 18.454 1.00 0.00 C ATOM 495 C GLN A 33 -3.506 -2.186 17.723 1.00 0.00 C ATOM 496 O GLN A 33 -3.201 -2.351 16.541 1.00 0.00 O ATOM 497 CB GLN A 33 -4.071 -4.613 18.121 1.00 0.00 C ATOM 498 CG GLN A 33 -4.531 -5.076 16.745 1.00 0.00 C ATOM 499 CD GLN A 33 -4.219 -6.537 16.486 1.00 0.00 C ATOM 500 OE1 GLN A 33 -3.994 -6.945 15.345 1.00 0.00 O ATOM 501 NE2 GLN A 33 -4.213 -7.335 17.540 1.00 0.00 N ATOM 0 H GLN A 33 -6.292 -3.628 17.625 1.00 0.00 H new ATOM 0 HA GLN A 33 -4.287 -3.013 19.525 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -2.990 -4.733 18.188 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -4.511 -5.264 18.876 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -5.605 -4.916 16.652 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -4.051 -4.465 15.981 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -4.404 -6.956 18.468 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -4.017 -8.329 17.426 1.00 0.00 H new ATOM 510 N ALA A 34 -3.097 -1.148 18.433 1.00 0.00 N ATOM 511 CA ALA A 34 -2.204 -0.149 17.881 1.00 0.00 C ATOM 512 C ALA A 34 -0.765 -0.626 17.962 1.00 0.00 C ATOM 513 O ALA A 34 -0.427 -1.479 18.784 1.00 0.00 O ATOM 514 CB ALA A 34 -2.371 1.173 18.612 1.00 0.00 C ATOM 0 H ALA A 34 -3.373 -0.977 19.400 1.00 0.00 H new ATOM 0 HA ALA A 34 -2.458 0.004 16.832 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -1.693 1.913 18.186 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -3.399 1.520 18.507 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -2.140 1.036 19.669 1.00 0.00 H new ATOM 520 N GLY A 35 0.075 -0.076 17.105 1.00 0.00 N ATOM 521 CA GLY A 35 1.466 -0.468 17.077 1.00 0.00 C ATOM 522 C GLY A 35 1.822 -1.147 15.785 1.00 0.00 C ATOM 523 O GLY A 35 2.990 -1.237 15.418 1.00 0.00 O ATOM 0 H GLY A 35 -0.182 0.639 16.424 1.00 0.00 H new ATOM 0 HA2 GLY A 35 2.096 0.412 17.212 1.00 0.00 H new ATOM 0 HA3 GLY A 35 1.673 -1.139 17.911 1.00 0.00 H new ATOM 527 N LEU A 36 0.806 -1.634 15.102 1.00 0.00 N ATOM 528 CA LEU A 36 0.980 -2.264 13.810 1.00 0.00 C ATOM 529 C LEU A 36 1.194 -1.220 12.725 1.00 0.00 C ATOM 530 O LEU A 36 0.687 -0.100 12.814 1.00 0.00 O ATOM 531 CB LEU A 36 -0.255 -3.104 13.481 1.00 0.00 C ATOM 532 CG LEU A 36 -0.384 -4.445 14.221 1.00 0.00 C ATOM 533 CD1 LEU A 36 -0.231 -4.291 15.729 1.00 0.00 C ATOM 534 CD2 LEU A 36 -1.728 -5.052 13.913 1.00 0.00 C ATOM 0 H LEU A 36 -0.161 -1.604 15.426 1.00 0.00 H new ATOM 0 HA LEU A 36 1.861 -2.905 13.851 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -1.142 -2.508 13.697 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -0.258 -3.303 12.409 1.00 0.00 H new ATOM 0 HG LEU A 36 0.421 -5.094 13.875 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -0.330 -5.266 16.206 1.00 0.00 H new ATOM 0 HD12 LEU A 36 0.751 -3.875 15.954 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -1.004 -3.622 16.107 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -1.826 -6.004 14.435 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -2.517 -4.375 14.242 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -1.815 -5.217 12.839 1.00 0.00 H new ATOM 546 N TRP A 37 1.946 -1.597 11.706 1.00 0.00 N ATOM 547 CA TRP A 37 2.272 -0.696 10.615 1.00 0.00 C ATOM 548 C TRP A 37 1.708 -1.232 9.306 1.00 0.00 C ATOM 549 O TRP A 37 1.484 -2.434 9.167 1.00 0.00 O ATOM 550 CB TRP A 37 3.792 -0.536 10.494 1.00 0.00 C ATOM 551 CG TRP A 37 4.460 -0.111 11.768 1.00 0.00 C ATOM 552 CD1 TRP A 37 4.834 -0.918 12.800 1.00 0.00 C ATOM 553 CD2 TRP A 37 4.840 1.219 12.142 1.00 0.00 C ATOM 554 NE1 TRP A 37 5.412 -0.176 13.797 1.00 0.00 N ATOM 555 CE2 TRP A 37 5.429 1.139 13.419 1.00 0.00 C ATOM 556 CE3 TRP A 37 4.735 2.470 11.527 1.00 0.00 C ATOM 557 CZ2 TRP A 37 5.914 2.260 14.086 1.00 0.00 C ATOM 558 CZ3 TRP A 37 5.217 3.582 12.191 1.00 0.00 C ATOM 559 CH2 TRP A 37 5.799 3.471 13.460 1.00 0.00 C ATOM 0 H TRP A 37 2.346 -2.531 11.612 1.00 0.00 H new ATOM 0 HA TRP A 37 1.828 0.277 10.825 1.00 0.00 H new ATOM 0 HB2 TRP A 37 4.223 -1.483 10.167 1.00 0.00 H new ATOM 0 HB3 TRP A 37 4.010 0.198 9.718 1.00 0.00 H new ATOM 0 HD1 TRP A 37 4.695 -1.989 12.828 1.00 0.00 H new ATOM 0 HE1 TRP A 37 5.771 -0.544 14.678 1.00 0.00 H new ATOM 0 HE3 TRP A 37 4.285 2.566 10.550 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 6.365 2.177 15.064 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 5.144 4.553 11.724 1.00 0.00 H new ATOM 0 HH2 TRP A 37 6.164 4.359 13.954 1.00 0.00 H new ATOM 570 N GLU A 38 1.464 -0.335 8.369 1.00 0.00 N ATOM 571 CA GLU A 38 1.033 -0.708 7.029 1.00 0.00 C ATOM 572 C GLU A 38 1.431 0.387 6.055 1.00 0.00 C ATOM 573 O GLU A 38 1.748 1.510 6.474 1.00 0.00 O ATOM 574 CB GLU A 38 -0.484 -0.932 6.977 1.00 0.00 C ATOM 575 CG GLU A 38 -1.293 0.262 7.454 1.00 0.00 C ATOM 576 CD GLU A 38 -2.789 0.075 7.292 1.00 0.00 C ATOM 577 OE1 GLU A 38 -3.316 -0.982 7.699 1.00 0.00 O ATOM 578 OE2 GLU A 38 -3.447 1.003 6.764 1.00 0.00 O ATOM 0 H GLU A 38 1.558 0.671 8.512 1.00 0.00 H new ATOM 0 HA GLU A 38 1.518 -1.644 6.753 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -0.773 -1.170 5.953 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -0.736 -1.798 7.589 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -1.069 0.448 8.504 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -0.982 1.148 6.900 1.00 0.00 H new ATOM 585 N PHE A 39 1.440 0.069 4.773 1.00 0.00 N ATOM 586 CA PHE A 39 1.736 1.065 3.758 1.00 0.00 C ATOM 587 C PHE A 39 0.489 1.894 3.482 1.00 0.00 C ATOM 588 O PHE A 39 -0.622 1.367 3.431 1.00 0.00 O ATOM 589 CB PHE A 39 2.248 0.410 2.469 1.00 0.00 C ATOM 590 CG PHE A 39 3.547 -0.315 2.616 1.00 0.00 C ATOM 591 CD1 PHE A 39 4.214 -0.364 3.829 1.00 0.00 C ATOM 592 CD2 PHE A 39 4.098 -0.957 1.531 1.00 0.00 C ATOM 593 CE1 PHE A 39 5.405 -1.041 3.949 1.00 0.00 C ATOM 594 CE2 PHE A 39 5.287 -1.633 1.643 1.00 0.00 C ATOM 595 CZ PHE A 39 5.946 -1.679 2.855 1.00 0.00 C ATOM 0 H PHE A 39 1.247 -0.865 4.411 1.00 0.00 H new ATOM 0 HA PHE A 39 2.527 1.717 4.129 1.00 0.00 H new ATOM 0 HB2 PHE A 39 1.494 -0.290 2.108 1.00 0.00 H new ATOM 0 HB3 PHE A 39 2.360 1.179 1.705 1.00 0.00 H new ATOM 0 HD1 PHE A 39 3.794 0.135 4.690 1.00 0.00 H new ATOM 0 HD2 PHE A 39 3.588 -0.929 0.579 1.00 0.00 H new ATOM 0 HE1 PHE A 39 5.916 -1.072 4.900 1.00 0.00 H new ATOM 0 HE2 PHE A 39 5.708 -2.130 0.781 1.00 0.00 H new ATOM 0 HZ PHE A 39 6.881 -2.212 2.945 1.00 0.00 H new ATOM 605 N ALA A 40 0.671 3.196 3.323 1.00 0.00 N ATOM 606 CA ALA A 40 -0.454 4.100 3.142 1.00 0.00 C ATOM 607 C ALA A 40 -1.117 3.896 1.785 1.00 0.00 C ATOM 608 O ALA A 40 -0.523 3.329 0.870 1.00 0.00 O ATOM 609 CB ALA A 40 -0.005 5.541 3.306 1.00 0.00 C ATOM 0 H ALA A 40 1.585 3.649 3.316 1.00 0.00 H new ATOM 0 HA ALA A 40 -1.194 3.874 3.910 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -0.858 6.206 3.168 1.00 0.00 H new ATOM 0 HB2 ALA A 40 0.407 5.682 4.305 1.00 0.00 H new ATOM 0 HB3 ALA A 40 0.759 5.771 2.563 1.00 0.00 H new ATOM 615 N GLY A 41 -2.343 4.374 1.660 1.00 0.00 N ATOM 616 CA GLY A 41 -3.090 4.204 0.436 1.00 0.00 C ATOM 617 C GLY A 41 -4.556 4.497 0.643 1.00 0.00 C ATOM 618 O GLY A 41 -4.902 5.491 1.278 1.00 0.00 O ATOM 0 H GLY A 41 -2.838 4.882 2.393 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -2.690 4.866 -0.332 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -2.969 3.184 0.072 1.00 0.00 H new ATOM 622 N GLY A 42 -5.410 3.628 0.133 1.00 0.00 N ATOM 623 CA GLY A 42 -6.833 3.825 0.295 1.00 0.00 C ATOM 624 C GLY A 42 -7.661 2.957 -0.626 1.00 0.00 C ATOM 625 O GLY A 42 -7.127 2.213 -1.448 1.00 0.00 O ATOM 0 H GLY A 42 -5.146 2.792 -0.389 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -7.108 3.613 1.328 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -7.072 4.872 0.110 1.00 0.00 H new ATOM 629 N LYS A 43 -8.972 3.045 -0.469 1.00 0.00 N ATOM 630 CA LYS A 43 -9.903 2.292 -1.297 1.00 0.00 C ATOM 631 C LYS A 43 -10.059 2.968 -2.655 1.00 0.00 C ATOM 632 O LYS A 43 -9.957 4.191 -2.763 1.00 0.00 O ATOM 633 CB LYS A 43 -11.258 2.175 -0.590 1.00 0.00 C ATOM 634 CG LYS A 43 -12.300 1.379 -1.357 1.00 0.00 C ATOM 635 CD LYS A 43 -13.613 1.322 -0.595 1.00 0.00 C ATOM 636 CE LYS A 43 -14.649 0.479 -1.319 1.00 0.00 C ATOM 637 NZ LYS A 43 -15.956 0.485 -0.612 1.00 0.00 N ATOM 0 H LYS A 43 -9.420 3.636 0.231 1.00 0.00 H new ATOM 0 HA LYS A 43 -9.509 1.288 -1.455 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -11.107 1.709 0.384 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -11.646 3.177 -0.407 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -12.462 1.833 -2.334 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -11.933 0.368 -1.532 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -13.439 0.910 0.399 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -13.998 2.333 -0.458 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -14.782 0.858 -2.332 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -14.288 -0.546 -1.406 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -16.637 -0.101 -1.136 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -15.834 0.100 0.347 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -16.313 1.460 -0.551 1.00 0.00 H new ATOM 651 N VAL A 44 -10.303 2.169 -3.682 1.00 0.00 N ATOM 652 CA VAL A 44 -10.442 2.681 -5.032 1.00 0.00 C ATOM 653 C VAL A 44 -11.909 2.779 -5.397 1.00 0.00 C ATOM 654 O VAL A 44 -12.588 1.759 -5.529 1.00 0.00 O ATOM 655 CB VAL A 44 -9.745 1.779 -6.071 1.00 0.00 C ATOM 656 CG1 VAL A 44 -9.782 2.421 -7.449 1.00 0.00 C ATOM 657 CG2 VAL A 44 -8.321 1.473 -5.661 1.00 0.00 C ATOM 0 H VAL A 44 -10.409 1.158 -3.603 1.00 0.00 H new ATOM 0 HA VAL A 44 -9.969 3.663 -5.050 1.00 0.00 H new ATOM 0 HB VAL A 44 -10.290 0.836 -6.116 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -9.285 1.769 -8.168 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -10.818 2.572 -7.752 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -9.269 3.382 -7.416 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -7.855 0.836 -6.412 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -7.759 2.403 -5.575 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -8.322 0.960 -4.699 1.00 0.00 H new ATOM 667 N GLU A 45 -12.402 3.992 -5.536 1.00 0.00 N ATOM 668 CA GLU A 45 -13.765 4.197 -5.973 1.00 0.00 C ATOM 669 C GLU A 45 -13.880 3.904 -7.465 1.00 0.00 C ATOM 670 O GLU A 45 -12.963 4.189 -8.232 1.00 0.00 O ATOM 671 CB GLU A 45 -14.203 5.623 -5.658 1.00 0.00 C ATOM 672 CG GLU A 45 -14.299 5.898 -4.168 1.00 0.00 C ATOM 673 CD GLU A 45 -15.375 5.067 -3.499 1.00 0.00 C ATOM 674 OE1 GLU A 45 -15.091 3.920 -3.096 1.00 0.00 O ATOM 675 OE2 GLU A 45 -16.518 5.559 -3.380 1.00 0.00 O ATOM 0 H GLU A 45 -11.880 4.849 -5.353 1.00 0.00 H new ATOM 0 HA GLU A 45 -14.425 3.513 -5.439 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -13.497 6.322 -6.106 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -15.173 5.810 -6.120 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -13.337 5.689 -3.699 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -14.508 6.956 -4.009 1.00 0.00 H new ATOM 682 N PRO A 46 -15.004 3.322 -7.902 1.00 0.00 N ATOM 683 CA PRO A 46 -15.196 2.924 -9.303 1.00 0.00 C ATOM 684 C PRO A 46 -15.191 4.112 -10.263 1.00 0.00 C ATOM 685 O PRO A 46 -15.138 3.940 -11.482 1.00 0.00 O ATOM 686 CB PRO A 46 -16.567 2.241 -9.299 1.00 0.00 C ATOM 687 CG PRO A 46 -17.252 2.754 -8.081 1.00 0.00 C ATOM 688 CD PRO A 46 -16.170 2.991 -7.070 1.00 0.00 C ATOM 0 HA PRO A 46 -14.386 2.283 -9.652 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -17.131 2.483 -10.200 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -16.467 1.156 -9.268 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -17.794 3.675 -8.296 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -17.982 2.034 -7.711 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -16.424 3.804 -6.390 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -15.990 2.108 -6.457 1.00 0.00 H new ATOM 696 N ASP A 47 -15.207 5.318 -9.713 1.00 0.00 N ATOM 697 CA ASP A 47 -15.232 6.527 -10.523 1.00 0.00 C ATOM 698 C ASP A 47 -13.825 7.099 -10.656 1.00 0.00 C ATOM 699 O ASP A 47 -13.602 8.078 -11.364 1.00 0.00 O ATOM 700 CB ASP A 47 -16.180 7.567 -9.914 1.00 0.00 C ATOM 701 CG ASP A 47 -15.710 8.088 -8.568 1.00 0.00 C ATOM 702 OD1 ASP A 47 -15.951 7.411 -7.549 1.00 0.00 O ATOM 703 OD2 ASP A 47 -15.121 9.188 -8.524 1.00 0.00 O ATOM 0 H ASP A 47 -15.203 5.485 -8.707 1.00 0.00 H new ATOM 0 HA ASP A 47 -15.601 6.272 -11.516 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -16.283 8.404 -10.605 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -17.170 7.124 -9.800 1.00 0.00 H new ATOM 708 N GLU A 48 -12.880 6.460 -9.986 1.00 0.00 N ATOM 709 CA GLU A 48 -11.488 6.877 -10.040 1.00 0.00 C ATOM 710 C GLU A 48 -10.594 5.705 -10.421 1.00 0.00 C ATOM 711 O GLU A 48 -10.989 4.543 -10.305 1.00 0.00 O ATOM 712 CB GLU A 48 -11.047 7.496 -8.706 1.00 0.00 C ATOM 713 CG GLU A 48 -11.024 6.526 -7.538 1.00 0.00 C ATOM 714 CD GLU A 48 -10.671 7.205 -6.231 1.00 0.00 C ATOM 715 OE1 GLU A 48 -10.169 8.352 -6.269 1.00 0.00 O ATOM 716 OE2 GLU A 48 -10.895 6.601 -5.166 1.00 0.00 O ATOM 0 H GLU A 48 -13.053 5.646 -9.395 1.00 0.00 H new ATOM 0 HA GLU A 48 -11.391 7.643 -10.809 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -10.051 7.920 -8.829 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -11.717 8.321 -8.464 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -12.000 6.050 -7.445 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -10.302 5.735 -7.740 1.00 0.00 H new ATOM 723 N SER A 49 -9.407 6.008 -10.913 1.00 0.00 N ATOM 724 CA SER A 49 -8.486 4.975 -11.337 1.00 0.00 C ATOM 725 C SER A 49 -7.472 4.650 -10.242 1.00 0.00 C ATOM 726 O SER A 49 -7.358 5.378 -9.260 1.00 0.00 O ATOM 727 CB SER A 49 -7.803 5.396 -12.632 1.00 0.00 C ATOM 728 OG SER A 49 -7.445 6.764 -12.590 1.00 0.00 O ATOM 0 H SER A 49 -9.060 6.960 -11.028 1.00 0.00 H new ATOM 0 HA SER A 49 -9.047 4.059 -11.525 1.00 0.00 H new ATOM 0 HB2 SER A 49 -6.913 4.788 -12.793 1.00 0.00 H new ATOM 0 HB3 SER A 49 -8.470 5.216 -13.475 1.00 0.00 H new ATOM 0 HG SER A 49 -7.006 7.013 -13.430 1.00 0.00 H new ATOM 734 N GLN A 50 -6.736 3.555 -10.422 1.00 0.00 N ATOM 735 CA GLN A 50 -5.839 3.043 -9.387 1.00 0.00 C ATOM 736 C GLN A 50 -4.753 4.047 -9.000 1.00 0.00 C ATOM 737 O GLN A 50 -4.595 4.362 -7.820 1.00 0.00 O ATOM 738 CB GLN A 50 -5.201 1.731 -9.836 1.00 0.00 C ATOM 739 CG GLN A 50 -6.200 0.595 -9.989 1.00 0.00 C ATOM 740 CD GLN A 50 -5.527 -0.725 -10.278 1.00 0.00 C ATOM 741 OE1 GLN A 50 -4.400 -0.964 -9.852 1.00 0.00 O ATOM 742 NE2 GLN A 50 -6.219 -1.594 -10.991 1.00 0.00 N ATOM 0 H GLN A 50 -6.743 3.003 -11.279 1.00 0.00 H new ATOM 0 HA GLN A 50 -6.449 2.869 -8.500 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -4.694 1.889 -10.788 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -4.439 1.440 -9.113 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -6.790 0.507 -9.077 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -6.894 0.831 -10.796 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -7.152 -1.352 -11.324 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -5.821 -2.507 -11.209 1.00 0.00 H new ATOM 751 N ARG A 51 -4.007 4.549 -9.981 1.00 0.00 N ATOM 752 CA ARG A 51 -2.951 5.522 -9.698 1.00 0.00 C ATOM 753 C ARG A 51 -3.564 6.786 -9.121 1.00 0.00 C ATOM 754 O ARG A 51 -2.997 7.431 -8.244 1.00 0.00 O ATOM 755 CB ARG A 51 -2.160 5.888 -10.958 1.00 0.00 C ATOM 756 CG ARG A 51 -1.564 4.706 -11.710 1.00 0.00 C ATOM 757 CD ARG A 51 -0.679 5.184 -12.850 1.00 0.00 C ATOM 758 NE ARG A 51 -0.141 4.079 -13.648 1.00 0.00 N ATOM 759 CZ ARG A 51 0.970 4.164 -14.385 1.00 0.00 C ATOM 760 NH1 ARG A 51 1.697 5.274 -14.379 1.00 0.00 N ATOM 761 NH2 ARG A 51 1.353 3.129 -15.122 1.00 0.00 N ATOM 0 H ARG A 51 -4.110 4.304 -10.966 1.00 0.00 H new ATOM 0 HA ARG A 51 -2.267 5.065 -8.983 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -2.816 6.436 -11.634 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -1.353 6.565 -10.678 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -0.982 4.089 -11.025 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -2.364 4.078 -12.103 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -1.253 5.848 -13.496 1.00 0.00 H new ATOM 0 HD3 ARG A 51 0.146 5.769 -12.444 1.00 0.00 H new ATOM 0 HE ARG A 51 -0.645 3.192 -13.640 1.00 0.00 H new ATOM 0 HH11 ARG A 51 1.409 6.069 -13.809 1.00 0.00 H new ATOM 0 HH12 ARG A 51 2.544 5.332 -14.944 1.00 0.00 H new ATOM 0 HH21 ARG A 51 0.800 2.272 -15.125 1.00 0.00 H new ATOM 0 HH22 ARG A 51 2.201 3.190 -15.686 1.00 0.00 H new ATOM 775 N GLN A 52 -4.755 7.097 -9.605 1.00 0.00 N ATOM 776 CA GLN A 52 -5.460 8.306 -9.233 1.00 0.00 C ATOM 777 C GLN A 52 -5.903 8.232 -7.779 1.00 0.00 C ATOM 778 O GLN A 52 -5.772 9.201 -7.029 1.00 0.00 O ATOM 779 CB GLN A 52 -6.660 8.474 -10.163 1.00 0.00 C ATOM 780 CG GLN A 52 -7.461 9.735 -9.933 1.00 0.00 C ATOM 781 CD GLN A 52 -8.462 9.974 -11.039 1.00 0.00 C ATOM 782 OE1 GLN A 52 -8.140 10.570 -12.065 1.00 0.00 O ATOM 783 NE2 GLN A 52 -9.689 9.537 -10.825 1.00 0.00 N ATOM 0 H GLN A 52 -5.260 6.512 -10.271 1.00 0.00 H new ATOM 0 HA GLN A 52 -4.802 9.169 -9.333 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -6.308 8.466 -11.195 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -7.319 7.614 -10.044 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -7.983 9.665 -8.979 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -6.785 10.587 -9.864 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -9.912 9.047 -9.959 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -10.414 9.689 -11.526 1.00 0.00 H new ATOM 792 N ALA A 53 -6.402 7.066 -7.387 1.00 0.00 N ATOM 793 CA ALA A 53 -6.828 6.831 -6.016 1.00 0.00 C ATOM 794 C ALA A 53 -5.664 7.008 -5.053 1.00 0.00 C ATOM 795 O ALA A 53 -5.798 7.675 -4.034 1.00 0.00 O ATOM 796 CB ALA A 53 -7.433 5.442 -5.876 1.00 0.00 C ATOM 0 H ALA A 53 -6.521 6.264 -8.006 1.00 0.00 H new ATOM 0 HA ALA A 53 -7.593 7.566 -5.764 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -7.746 5.284 -4.844 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -8.297 5.353 -6.535 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -6.690 4.692 -6.149 1.00 0.00 H new ATOM 802 N LEU A 54 -4.512 6.439 -5.390 1.00 0.00 N ATOM 803 CA LEU A 54 -3.326 6.580 -4.552 1.00 0.00 C ATOM 804 C LEU A 54 -2.933 8.040 -4.411 1.00 0.00 C ATOM 805 O LEU A 54 -2.677 8.521 -3.311 1.00 0.00 O ATOM 806 CB LEU A 54 -2.149 5.794 -5.131 1.00 0.00 C ATOM 807 CG LEU A 54 -2.168 4.293 -4.855 1.00 0.00 C ATOM 808 CD1 LEU A 54 -0.954 3.619 -5.473 1.00 0.00 C ATOM 809 CD2 LEU A 54 -2.216 4.043 -3.356 1.00 0.00 C ATOM 0 H LEU A 54 -4.374 5.879 -6.232 1.00 0.00 H new ATOM 0 HA LEU A 54 -3.572 6.179 -3.569 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -2.126 5.948 -6.210 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -1.224 6.209 -4.730 1.00 0.00 H new ATOM 0 HG LEU A 54 -3.060 3.863 -5.311 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -0.986 2.550 -5.265 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -0.958 3.779 -6.551 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -0.045 4.044 -5.047 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -2.229 2.970 -3.166 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -1.337 4.484 -2.885 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -3.116 4.496 -2.940 1.00 0.00 H new ATOM 821 N VAL A 55 -2.910 8.740 -5.532 1.00 0.00 N ATOM 822 CA VAL A 55 -2.499 10.134 -5.559 1.00 0.00 C ATOM 823 C VAL A 55 -3.399 10.995 -4.675 1.00 0.00 C ATOM 824 O VAL A 55 -2.907 11.835 -3.920 1.00 0.00 O ATOM 825 CB VAL A 55 -2.474 10.681 -7.002 1.00 0.00 C ATOM 826 CG1 VAL A 55 -2.276 12.188 -7.009 1.00 0.00 C ATOM 827 CG2 VAL A 55 -1.369 10.001 -7.797 1.00 0.00 C ATOM 0 H VAL A 55 -3.173 8.363 -6.442 1.00 0.00 H new ATOM 0 HA VAL A 55 -1.486 10.182 -5.159 1.00 0.00 H new ATOM 0 HB VAL A 55 -3.435 10.464 -7.468 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -2.262 12.548 -8.038 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -3.094 12.665 -6.468 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -1.330 12.433 -6.526 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -1.359 10.393 -8.814 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -0.407 10.196 -7.323 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -1.549 8.926 -7.824 1.00 0.00 H new ATOM 837 N ARG A 56 -4.709 10.779 -4.741 1.00 0.00 N ATOM 838 CA ARG A 56 -5.620 11.542 -3.901 1.00 0.00 C ATOM 839 C ARG A 56 -5.510 11.101 -2.443 1.00 0.00 C ATOM 840 O ARG A 56 -5.403 11.936 -1.551 1.00 0.00 O ATOM 841 CB ARG A 56 -7.075 11.486 -4.421 1.00 0.00 C ATOM 842 CG ARG A 56 -7.671 10.097 -4.568 1.00 0.00 C ATOM 843 CD ARG A 56 -8.249 9.567 -3.267 1.00 0.00 C ATOM 844 NE ARG A 56 -9.408 10.318 -2.794 1.00 0.00 N ATOM 845 CZ ARG A 56 -10.606 9.771 -2.585 1.00 0.00 C ATOM 846 NH1 ARG A 56 -10.840 8.509 -2.931 1.00 0.00 N ATOM 847 NH2 ARG A 56 -11.581 10.496 -2.056 1.00 0.00 N ATOM 0 H ARG A 56 -5.155 10.097 -5.354 1.00 0.00 H new ATOM 0 HA ARG A 56 -5.320 12.589 -3.952 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -7.706 12.062 -3.743 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -7.114 11.982 -5.391 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -8.454 10.120 -5.326 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -6.902 9.412 -4.925 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -8.534 8.524 -3.404 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -7.475 9.588 -2.500 1.00 0.00 H new ATOM 0 HE ARG A 56 -9.295 11.316 -2.614 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -10.101 7.952 -3.359 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -11.759 8.097 -2.768 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -11.415 11.472 -1.809 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -12.498 10.078 -1.896 1.00 0.00 H new ATOM 861 N GLU A 57 -5.483 9.793 -2.209 1.00 0.00 N ATOM 862 CA GLU A 57 -5.452 9.260 -0.849 1.00 0.00 C ATOM 863 C GLU A 57 -4.204 9.702 -0.091 1.00 0.00 C ATOM 864 O GLU A 57 -4.282 10.080 1.075 1.00 0.00 O ATOM 865 CB GLU A 57 -5.548 7.733 -0.862 1.00 0.00 C ATOM 866 CG GLU A 57 -6.926 7.202 -1.233 1.00 0.00 C ATOM 867 CD GLU A 57 -7.975 7.459 -0.165 1.00 0.00 C ATOM 868 OE1 GLU A 57 -8.089 8.609 0.312 1.00 0.00 O ATOM 869 OE2 GLU A 57 -8.707 6.511 0.191 1.00 0.00 O ATOM 0 H GLU A 57 -5.482 9.083 -2.941 1.00 0.00 H new ATOM 0 HA GLU A 57 -6.319 9.665 -0.327 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -4.816 7.339 -1.567 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -5.277 7.354 0.123 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -7.247 7.664 -2.167 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -6.858 6.130 -1.415 1.00 0.00 H new ATOM 876 N LEU A 58 -3.050 9.669 -0.747 1.00 0.00 N ATOM 877 CA LEU A 58 -1.818 10.080 -0.086 1.00 0.00 C ATOM 878 C LEU A 58 -1.824 11.578 0.151 1.00 0.00 C ATOM 879 O LEU A 58 -1.200 12.061 1.081 1.00 0.00 O ATOM 880 CB LEU A 58 -0.578 9.706 -0.891 1.00 0.00 C ATOM 881 CG LEU A 58 -0.511 8.254 -1.357 1.00 0.00 C ATOM 882 CD1 LEU A 58 0.776 7.995 -2.122 1.00 0.00 C ATOM 883 CD2 LEU A 58 -0.633 7.297 -0.184 1.00 0.00 C ATOM 0 H LEU A 58 -2.942 9.369 -1.716 1.00 0.00 H new ATOM 0 HA LEU A 58 -1.776 9.549 0.865 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -0.526 10.353 -1.766 1.00 0.00 H new ATOM 0 HB3 LEU A 58 0.304 9.916 -0.286 1.00 0.00 H new ATOM 0 HG LEU A 58 -1.353 8.078 -2.026 1.00 0.00 H new ATOM 0 HD11 LEU A 58 0.804 6.954 -2.445 1.00 0.00 H new ATOM 0 HD12 LEU A 58 0.818 8.647 -2.994 1.00 0.00 H new ATOM 0 HD13 LEU A 58 1.630 8.197 -1.476 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -0.582 6.270 -0.546 1.00 0.00 H new ATOM 0 HD22 LEU A 58 0.182 7.476 0.518 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -1.587 7.458 0.319 1.00 0.00 H new ATOM 895 N ARG A 59 -2.498 12.328 -0.704 1.00 0.00 N ATOM 896 CA ARG A 59 -2.651 13.750 -0.457 1.00 0.00 C ATOM 897 C ARG A 59 -3.556 13.994 0.744 1.00 0.00 C ATOM 898 O ARG A 59 -3.302 14.882 1.554 1.00 0.00 O ATOM 899 CB ARG A 59 -3.199 14.479 -1.683 1.00 0.00 C ATOM 900 CG ARG A 59 -3.321 15.974 -1.456 1.00 0.00 C ATOM 901 CD ARG A 59 -3.657 16.728 -2.731 1.00 0.00 C ATOM 902 NE ARG A 59 -3.531 18.171 -2.536 1.00 0.00 N ATOM 903 CZ ARG A 59 -3.004 19.003 -3.435 1.00 0.00 C ATOM 904 NH1 ARG A 59 -2.716 18.571 -4.657 1.00 0.00 N ATOM 905 NH2 ARG A 59 -2.810 20.278 -3.125 1.00 0.00 N ATOM 0 H ARG A 59 -2.939 11.985 -1.557 1.00 0.00 H new ATOM 0 HA ARG A 59 -1.660 14.150 -0.242 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -2.545 14.295 -2.535 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -4.177 14.071 -1.938 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -4.093 16.164 -0.711 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -2.384 16.354 -1.048 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -2.993 16.407 -3.533 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -4.673 16.487 -3.043 1.00 0.00 H new ATOM 0 HE ARG A 59 -3.867 18.566 -1.658 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -2.898 17.600 -4.911 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -2.313 19.210 -5.342 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -3.064 20.622 -2.199 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -2.407 20.914 -3.813 1.00 0.00 H new ATOM 919 N GLU A 60 -4.606 13.199 0.864 1.00 0.00 N ATOM 920 CA GLU A 60 -5.580 13.396 1.924 1.00 0.00 C ATOM 921 C GLU A 60 -5.087 12.849 3.267 1.00 0.00 C ATOM 922 O GLU A 60 -5.414 13.400 4.318 1.00 0.00 O ATOM 923 CB GLU A 60 -6.921 12.776 1.519 1.00 0.00 C ATOM 924 CG GLU A 60 -7.413 13.299 0.176 1.00 0.00 C ATOM 925 CD GLU A 60 -8.802 12.821 -0.202 1.00 0.00 C ATOM 926 OE1 GLU A 60 -9.648 12.646 0.695 1.00 0.00 O ATOM 927 OE2 GLU A 60 -9.060 12.636 -1.413 1.00 0.00 O ATOM 0 H GLU A 60 -4.805 12.414 0.243 1.00 0.00 H new ATOM 0 HA GLU A 60 -5.720 14.468 2.064 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -6.818 11.692 1.470 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -7.665 12.991 2.286 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -7.409 14.389 0.199 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -6.711 12.994 -0.600 1.00 0.00 H new ATOM 934 N GLU A 61 -4.317 11.767 3.244 1.00 0.00 N ATOM 935 CA GLU A 61 -3.686 11.281 4.471 1.00 0.00 C ATOM 936 C GLU A 61 -2.321 11.910 4.691 1.00 0.00 C ATOM 937 O GLU A 61 -2.058 12.461 5.758 1.00 0.00 O ATOM 938 CB GLU A 61 -3.506 9.761 4.490 1.00 0.00 C ATOM 939 CG GLU A 61 -4.726 8.990 4.923 1.00 0.00 C ATOM 940 CD GLU A 61 -4.349 7.782 5.757 1.00 0.00 C ATOM 941 OE1 GLU A 61 -3.714 7.963 6.829 1.00 0.00 O ATOM 942 OE2 GLU A 61 -4.659 6.649 5.350 1.00 0.00 O ATOM 0 H GLU A 61 -4.116 11.217 2.409 1.00 0.00 H new ATOM 0 HA GLU A 61 -4.371 11.570 5.269 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -3.218 9.430 3.492 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -2.681 9.514 5.158 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -5.384 9.641 5.499 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -5.285 8.668 4.045 1.00 0.00 H new ATOM 949 N LEU A 62 -1.461 11.841 3.682 1.00 0.00 N ATOM 950 CA LEU A 62 -0.052 12.153 3.874 1.00 0.00 C ATOM 951 C LEU A 62 0.301 13.550 3.384 1.00 0.00 C ATOM 952 O LEU A 62 1.466 13.933 3.417 1.00 0.00 O ATOM 953 CB LEU A 62 0.821 11.128 3.148 1.00 0.00 C ATOM 954 CG LEU A 62 0.434 9.663 3.358 1.00 0.00 C ATOM 955 CD1 LEU A 62 1.396 8.761 2.609 1.00 0.00 C ATOM 956 CD2 LEU A 62 0.420 9.309 4.838 1.00 0.00 C ATOM 0 H LEU A 62 -1.713 11.574 2.730 1.00 0.00 H new ATOM 0 HA LEU A 62 0.139 12.114 4.946 1.00 0.00 H new ATOM 0 HB2 LEU A 62 0.791 11.344 2.080 1.00 0.00 H new ATOM 0 HB3 LEU A 62 1.853 11.262 3.472 1.00 0.00 H new ATOM 0 HG LEU A 62 -0.572 9.514 2.967 1.00 0.00 H new ATOM 0 HD11 LEU A 62 1.114 7.720 2.764 1.00 0.00 H new ATOM 0 HD12 LEU A 62 1.358 8.993 1.545 1.00 0.00 H new ATOM 0 HD13 LEU A 62 2.408 8.921 2.980 1.00 0.00 H new ATOM 0 HD21 LEU A 62 0.142 8.262 4.959 1.00 0.00 H new ATOM 0 HD22 LEU A 62 1.411 9.472 5.261 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -0.303 9.939 5.356 1.00 0.00 H new ATOM 968 N GLY A 63 -0.706 14.320 2.981 1.00 0.00 N ATOM 969 CA GLY A 63 -0.472 15.635 2.396 1.00 0.00 C ATOM 970 C GLY A 63 0.641 15.685 1.356 1.00 0.00 C ATOM 971 O GLY A 63 1.339 16.697 1.251 1.00 0.00 O ATOM 0 H GLY A 63 -1.689 14.056 3.049 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -1.397 15.981 1.934 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -0.234 16.336 3.196 1.00 0.00 H new ATOM 975 N ILE A 64 0.815 14.621 0.576 1.00 0.00 N ATOM 976 CA ILE A 64 1.863 14.611 -0.439 1.00 0.00 C ATOM 977 C ILE A 64 1.305 14.336 -1.827 1.00 0.00 C ATOM 978 O ILE A 64 0.344 13.581 -1.995 1.00 0.00 O ATOM 979 CB ILE A 64 2.988 13.588 -0.143 1.00 0.00 C ATOM 980 CG1 ILE A 64 2.434 12.160 -0.051 1.00 0.00 C ATOM 981 CG2 ILE A 64 3.737 13.962 1.126 1.00 0.00 C ATOM 982 CD1 ILE A 64 3.504 11.109 0.180 1.00 0.00 C ATOM 0 H ILE A 64 0.255 13.770 0.625 1.00 0.00 H new ATOM 0 HA ILE A 64 2.294 15.612 -0.408 1.00 0.00 H new ATOM 0 HB ILE A 64 3.691 13.617 -0.975 1.00 0.00 H new ATOM 0 HG12 ILE A 64 1.708 12.112 0.760 1.00 0.00 H new ATOM 0 HG13 ILE A 64 1.899 11.926 -0.972 1.00 0.00 H new ATOM 0 HG21 ILE A 64 4.522 13.230 1.314 1.00 0.00 H new ATOM 0 HG22 ILE A 64 4.183 14.950 1.008 1.00 0.00 H new ATOM 0 HG23 ILE A 64 3.044 13.975 1.967 1.00 0.00 H new ATOM 0 HD11 ILE A 64 3.041 10.124 0.235 1.00 0.00 H new ATOM 0 HD12 ILE A 64 4.218 11.129 -0.644 1.00 0.00 H new ATOM 0 HD13 ILE A 64 4.023 11.318 1.115 1.00 0.00 H new ATOM 994 N GLU A 65 1.915 14.970 -2.814 1.00 0.00 N ATOM 995 CA GLU A 65 1.582 14.741 -4.209 1.00 0.00 C ATOM 996 C GLU A 65 2.456 13.623 -4.749 1.00 0.00 C ATOM 997 O GLU A 65 3.603 13.853 -5.137 1.00 0.00 O ATOM 998 CB GLU A 65 1.810 16.011 -5.030 1.00 0.00 C ATOM 999 CG GLU A 65 1.052 17.224 -4.518 1.00 0.00 C ATOM 1000 CD GLU A 65 1.451 18.492 -5.242 1.00 0.00 C ATOM 1001 OE1 GLU A 65 2.404 19.161 -4.790 1.00 0.00 O ATOM 1002 OE2 GLU A 65 0.820 18.826 -6.265 1.00 0.00 O ATOM 0 H GLU A 65 2.655 15.658 -2.671 1.00 0.00 H new ATOM 0 HA GLU A 65 0.531 14.464 -4.284 1.00 0.00 H new ATOM 0 HB2 GLU A 65 2.876 16.239 -5.039 1.00 0.00 H new ATOM 0 HB3 GLU A 65 1.516 15.821 -6.062 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -0.019 17.060 -4.639 1.00 0.00 H new ATOM 0 HG3 GLU A 65 1.238 17.343 -3.451 1.00 0.00 H new ATOM 1009 N ALA A 66 1.934 12.412 -4.741 1.00 0.00 N ATOM 1010 CA ALA A 66 2.712 11.255 -5.152 1.00 0.00 C ATOM 1011 C ALA A 66 2.619 11.026 -6.652 1.00 0.00 C ATOM 1012 O ALA A 66 1.651 11.433 -7.297 1.00 0.00 O ATOM 1013 CB ALA A 66 2.251 10.016 -4.407 1.00 0.00 C ATOM 0 H ALA A 66 0.978 12.202 -4.456 1.00 0.00 H new ATOM 0 HA ALA A 66 3.755 11.453 -4.905 1.00 0.00 H new ATOM 0 HB1 ALA A 66 2.843 9.158 -4.726 1.00 0.00 H new ATOM 0 HB2 ALA A 66 2.379 10.167 -3.335 1.00 0.00 H new ATOM 0 HB3 ALA A 66 1.199 9.831 -4.624 1.00 0.00 H new ATOM 1019 N THR A 67 3.634 10.383 -7.198 1.00 0.00 N ATOM 1020 CA THR A 67 3.641 10.003 -8.597 1.00 0.00 C ATOM 1021 C THR A 67 3.668 8.482 -8.719 1.00 0.00 C ATOM 1022 O THR A 67 4.662 7.841 -8.381 1.00 0.00 O ATOM 1023 CB THR A 67 4.854 10.611 -9.328 1.00 0.00 C ATOM 1024 OG1 THR A 67 4.839 12.035 -9.170 1.00 0.00 O ATOM 1025 CG2 THR A 67 4.838 10.259 -10.808 1.00 0.00 C ATOM 0 H THR A 67 4.473 10.111 -6.686 1.00 0.00 H new ATOM 0 HA THR A 67 2.734 10.389 -9.063 1.00 0.00 H new ATOM 0 HB THR A 67 5.763 10.197 -8.891 1.00 0.00 H new ATOM 0 HG1 THR A 67 5.611 12.424 -9.633 1.00 0.00 H new ATOM 0 HG21 THR A 67 5.706 10.702 -11.297 1.00 0.00 H new ATOM 0 HG22 THR A 67 4.869 9.176 -10.925 1.00 0.00 H new ATOM 0 HG23 THR A 67 3.927 10.647 -11.264 1.00 0.00 H new ATOM 1033 N VAL A 68 2.564 7.909 -9.175 1.00 0.00 N ATOM 1034 CA VAL A 68 2.463 6.464 -9.304 1.00 0.00 C ATOM 1035 C VAL A 68 3.033 6.023 -10.643 1.00 0.00 C ATOM 1036 O VAL A 68 2.568 6.459 -11.698 1.00 0.00 O ATOM 1037 CB VAL A 68 1.005 5.975 -9.173 1.00 0.00 C ATOM 1038 CG1 VAL A 68 0.948 4.455 -9.170 1.00 0.00 C ATOM 1039 CG2 VAL A 68 0.361 6.541 -7.917 1.00 0.00 C ATOM 0 H VAL A 68 1.729 8.420 -9.461 1.00 0.00 H new ATOM 0 HA VAL A 68 3.038 6.020 -8.492 1.00 0.00 H new ATOM 0 HB VAL A 68 0.444 6.335 -10.035 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -0.088 4.130 -9.077 1.00 0.00 H new ATOM 0 HG12 VAL A 68 1.366 4.073 -10.102 1.00 0.00 H new ATOM 0 HG13 VAL A 68 1.526 4.071 -8.329 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -0.666 6.185 -7.843 1.00 0.00 H new ATOM 0 HG22 VAL A 68 0.922 6.215 -7.042 1.00 0.00 H new ATOM 0 HG23 VAL A 68 0.365 7.630 -7.965 1.00 0.00 H new ATOM 1049 N GLY A 69 4.034 5.154 -10.599 1.00 0.00 N ATOM 1050 CA GLY A 69 4.720 4.771 -11.811 1.00 0.00 C ATOM 1051 C GLY A 69 4.727 3.276 -12.039 1.00 0.00 C ATOM 1052 O GLY A 69 3.880 2.745 -12.756 1.00 0.00 O ATOM 0 H GLY A 69 4.380 4.711 -9.748 1.00 0.00 H new ATOM 0 HA2 GLY A 69 4.245 5.260 -12.661 1.00 0.00 H new ATOM 0 HA3 GLY A 69 5.748 5.131 -11.770 1.00 0.00 H new ATOM 1056 N GLU A 70 5.676 2.595 -11.416 1.00 0.00 N ATOM 1057 CA GLU A 70 5.881 1.175 -11.662 1.00 0.00 C ATOM 1058 C GLU A 70 5.035 0.313 -10.726 1.00 0.00 C ATOM 1059 O GLU A 70 4.956 0.561 -9.518 1.00 0.00 O ATOM 1060 CB GLU A 70 7.364 0.830 -11.520 1.00 0.00 C ATOM 1061 CG GLU A 70 7.947 1.202 -10.169 1.00 0.00 C ATOM 1062 CD GLU A 70 9.436 0.954 -10.084 1.00 0.00 C ATOM 1063 OE1 GLU A 70 9.872 -0.187 -10.326 1.00 0.00 O ATOM 1064 OE2 GLU A 70 10.179 1.905 -9.763 1.00 0.00 O ATOM 0 H GLU A 70 6.317 3.003 -10.736 1.00 0.00 H new ATOM 0 HA GLU A 70 5.560 0.959 -12.681 1.00 0.00 H new ATOM 0 HB2 GLU A 70 7.497 -0.240 -11.682 1.00 0.00 H new ATOM 0 HB3 GLU A 70 7.924 1.343 -12.302 1.00 0.00 H new ATOM 0 HG2 GLU A 70 7.747 2.255 -9.970 1.00 0.00 H new ATOM 0 HG3 GLU A 70 7.443 0.629 -9.391 1.00 0.00 H new ATOM 1071 N TYR A 71 4.389 -0.686 -11.306 1.00 0.00 N ATOM 1072 CA TYR A 71 3.560 -1.615 -10.564 1.00 0.00 C ATOM 1073 C TYR A 71 4.408 -2.699 -9.897 1.00 0.00 C ATOM 1074 O TYR A 71 5.278 -3.288 -10.539 1.00 0.00 O ATOM 1075 CB TYR A 71 2.562 -2.263 -11.525 1.00 0.00 C ATOM 1076 CG TYR A 71 1.700 -1.281 -12.289 1.00 0.00 C ATOM 1077 CD1 TYR A 71 0.789 -0.463 -11.632 1.00 0.00 C ATOM 1078 CD2 TYR A 71 1.792 -1.181 -13.671 1.00 0.00 C ATOM 1079 CE1 TYR A 71 -0.007 0.422 -12.330 1.00 0.00 C ATOM 1080 CE2 TYR A 71 1.002 -0.295 -14.375 1.00 0.00 C ATOM 1081 CZ TYR A 71 0.105 0.504 -13.699 1.00 0.00 C ATOM 1082 OH TYR A 71 -0.687 1.385 -14.399 1.00 0.00 O ATOM 0 H TYR A 71 4.427 -0.874 -12.308 1.00 0.00 H new ATOM 0 HA TYR A 71 3.033 -1.069 -9.781 1.00 0.00 H new ATOM 0 HB2 TYR A 71 3.110 -2.878 -12.239 1.00 0.00 H new ATOM 0 HB3 TYR A 71 1.914 -2.933 -10.959 1.00 0.00 H new ATOM 0 HD1 TYR A 71 0.702 -0.521 -10.557 1.00 0.00 H new ATOM 0 HD2 TYR A 71 2.493 -1.807 -14.203 1.00 0.00 H new ATOM 0 HE1 TYR A 71 -0.714 1.047 -11.805 1.00 0.00 H new ATOM 0 HE2 TYR A 71 1.086 -0.228 -15.450 1.00 0.00 H new ATOM 0 HH TYR A 71 -1.538 1.505 -13.928 1.00 0.00 H new ATOM 1092 N VAL A 72 4.154 -2.964 -8.613 1.00 0.00 N ATOM 1093 CA VAL A 72 4.875 -4.017 -7.898 1.00 0.00 C ATOM 1094 C VAL A 72 4.102 -5.329 -7.939 1.00 0.00 C ATOM 1095 O VAL A 72 4.488 -6.267 -8.641 1.00 0.00 O ATOM 1096 CB VAL A 72 5.113 -3.642 -6.417 1.00 0.00 C ATOM 1097 CG1 VAL A 72 5.756 -4.793 -5.648 1.00 0.00 C ATOM 1098 CG2 VAL A 72 5.956 -2.384 -6.311 1.00 0.00 C ATOM 0 H VAL A 72 3.461 -2.468 -8.052 1.00 0.00 H new ATOM 0 HA VAL A 72 5.836 -4.132 -8.400 1.00 0.00 H new ATOM 0 HB VAL A 72 4.142 -3.444 -5.963 1.00 0.00 H new ATOM 0 HG11 VAL A 72 5.910 -4.496 -4.610 1.00 0.00 H new ATOM 0 HG12 VAL A 72 5.102 -5.664 -5.683 1.00 0.00 H new ATOM 0 HG13 VAL A 72 6.716 -5.041 -6.100 1.00 0.00 H new ATOM 0 HG21 VAL A 72 6.112 -2.138 -5.261 1.00 0.00 H new ATOM 0 HG22 VAL A 72 6.920 -2.551 -6.791 1.00 0.00 H new ATOM 0 HG23 VAL A 72 5.442 -1.559 -6.805 1.00 0.00 H new ATOM 1108 N ALA A 73 2.989 -5.376 -7.210 1.00 0.00 N ATOM 1109 CA ALA A 73 2.167 -6.580 -7.154 1.00 0.00 C ATOM 1110 C ALA A 73 0.778 -6.282 -6.602 1.00 0.00 C ATOM 1111 O ALA A 73 0.457 -5.142 -6.272 1.00 0.00 O ATOM 1112 CB ALA A 73 2.849 -7.642 -6.300 1.00 0.00 C ATOM 0 H ALA A 73 2.638 -4.597 -6.653 1.00 0.00 H new ATOM 0 HA ALA A 73 2.052 -6.953 -8.172 1.00 0.00 H new ATOM 0 HB1 ALA A 73 2.226 -8.536 -6.265 1.00 0.00 H new ATOM 0 HB2 ALA A 73 3.818 -7.891 -6.734 1.00 0.00 H new ATOM 0 HB3 ALA A 73 2.992 -7.260 -5.289 1.00 0.00 H new ATOM 1118 N SER A 74 -0.043 -7.317 -6.518 1.00 0.00 N ATOM 1119 CA SER A 74 -1.381 -7.203 -5.958 1.00 0.00 C ATOM 1120 C SER A 74 -1.742 -8.488 -5.218 1.00 0.00 C ATOM 1121 O SER A 74 -1.235 -9.560 -5.550 1.00 0.00 O ATOM 1122 CB SER A 74 -2.402 -6.923 -7.066 1.00 0.00 C ATOM 1123 OG SER A 74 -2.159 -5.664 -7.677 1.00 0.00 O ATOM 0 H SER A 74 0.198 -8.256 -6.835 1.00 0.00 H new ATOM 0 HA SER A 74 -1.400 -6.370 -5.255 1.00 0.00 H new ATOM 0 HB2 SER A 74 -2.354 -7.711 -7.817 1.00 0.00 H new ATOM 0 HB3 SER A 74 -3.409 -6.941 -6.650 1.00 0.00 H new ATOM 0 HG SER A 74 -3.004 -5.175 -7.767 1.00 0.00 H new ATOM 1129 N HIS A 75 -2.597 -8.380 -4.209 1.00 0.00 N ATOM 1130 CA HIS A 75 -3.002 -9.547 -3.435 1.00 0.00 C ATOM 1131 C HIS A 75 -4.500 -9.502 -3.154 1.00 0.00 C ATOM 1132 O HIS A 75 -5.077 -8.423 -3.005 1.00 0.00 O ATOM 1133 CB HIS A 75 -2.224 -9.629 -2.123 1.00 0.00 C ATOM 1134 CG HIS A 75 -2.267 -10.997 -1.508 1.00 0.00 C ATOM 1135 ND1 HIS A 75 -1.371 -11.992 -1.834 1.00 0.00 N ATOM 1136 CD2 HIS A 75 -3.116 -11.541 -0.607 1.00 0.00 C ATOM 1137 CE1 HIS A 75 -1.669 -13.088 -1.161 1.00 0.00 C ATOM 1138 NE2 HIS A 75 -2.724 -12.842 -0.409 1.00 0.00 N ATOM 0 H HIS A 75 -3.021 -7.502 -3.909 1.00 0.00 H new ATOM 0 HA HIS A 75 -2.778 -10.437 -4.022 1.00 0.00 H new ATOM 0 HB2 HIS A 75 -1.186 -9.349 -2.303 1.00 0.00 H new ATOM 0 HB3 HIS A 75 -2.632 -8.905 -1.418 1.00 0.00 H new ATOM 0 HD2 HIS A 75 -3.948 -11.044 -0.131 1.00 0.00 H new ATOM 0 HE1 HIS A 75 -1.139 -14.027 -1.217 1.00 0.00 H new ATOM 0 HE2 HIS A 75 -3.175 -13.509 0.217 1.00 0.00 H new ATOM 1147 N GLN A 76 -5.124 -10.670 -3.089 1.00 0.00 N ATOM 1148 CA GLN A 76 -6.547 -10.763 -2.803 1.00 0.00 C ATOM 1149 C GLN A 76 -6.807 -11.404 -1.452 1.00 0.00 C ATOM 1150 O GLN A 76 -6.088 -12.309 -1.023 1.00 0.00 O ATOM 1151 CB GLN A 76 -7.268 -11.560 -3.888 1.00 0.00 C ATOM 1152 CG GLN A 76 -7.498 -10.778 -5.163 1.00 0.00 C ATOM 1153 CD GLN A 76 -8.169 -11.607 -6.240 1.00 0.00 C ATOM 1154 OE1 GLN A 76 -8.000 -12.824 -6.299 1.00 0.00 O ATOM 1155 NE2 GLN A 76 -8.936 -10.957 -7.100 1.00 0.00 N ATOM 0 H GLN A 76 -4.664 -11.569 -3.231 1.00 0.00 H new ATOM 0 HA GLN A 76 -6.935 -9.744 -2.783 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -6.686 -12.452 -4.119 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -8.229 -11.898 -3.501 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -8.114 -9.906 -4.944 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -6.543 -10.408 -5.536 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -9.051 -9.947 -7.018 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -9.412 -11.466 -7.845 1.00 0.00 H new ATOM 1164 N ARG A 77 -7.834 -10.913 -0.790 1.00 0.00 N ATOM 1165 CA ARG A 77 -8.315 -11.493 0.453 1.00 0.00 C ATOM 1166 C ARG A 77 -9.780 -11.123 0.591 1.00 0.00 C ATOM 1167 O ARG A 77 -10.287 -10.355 -0.217 1.00 0.00 O ATOM 1168 CB ARG A 77 -7.519 -10.985 1.666 1.00 0.00 C ATOM 1169 CG ARG A 77 -7.782 -9.526 2.009 1.00 0.00 C ATOM 1170 CD ARG A 77 -7.173 -9.146 3.350 1.00 0.00 C ATOM 1171 NE ARG A 77 -7.656 -7.845 3.822 1.00 0.00 N ATOM 1172 CZ ARG A 77 -7.840 -7.543 5.113 1.00 0.00 C ATOM 1173 NH1 ARG A 77 -7.516 -8.416 6.053 1.00 0.00 N ATOM 1174 NH2 ARG A 77 -8.340 -6.359 5.460 1.00 0.00 N ATOM 0 H ARG A 77 -8.363 -10.097 -1.098 1.00 0.00 H new ATOM 0 HA ARG A 77 -8.185 -12.575 0.425 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -7.762 -11.601 2.532 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -6.455 -11.116 1.470 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -7.369 -8.888 1.228 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -8.857 -9.346 2.033 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -7.413 -9.912 4.088 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -6.087 -9.119 3.261 1.00 0.00 H new ATOM 0 HE ARG A 77 -7.864 -7.128 3.127 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -7.125 -9.322 5.795 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -7.657 -8.183 7.036 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -8.584 -5.678 4.741 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -8.479 -6.133 6.445 1.00 0.00 H new ATOM 1188 N GLU A 78 -10.466 -11.643 1.587 1.00 0.00 N ATOM 1189 CA GLU A 78 -11.855 -11.276 1.766 1.00 0.00 C ATOM 1190 C GLU A 78 -12.077 -10.622 3.119 1.00 0.00 C ATOM 1191 O GLU A 78 -11.344 -10.866 4.078 1.00 0.00 O ATOM 1192 CB GLU A 78 -12.792 -12.477 1.597 1.00 0.00 C ATOM 1193 CG GLU A 78 -12.854 -13.395 2.803 1.00 0.00 C ATOM 1194 CD GLU A 78 -14.021 -14.352 2.736 1.00 0.00 C ATOM 1195 OE1 GLU A 78 -13.877 -15.445 2.152 1.00 0.00 O ATOM 1196 OE2 GLU A 78 -15.097 -14.011 3.271 1.00 0.00 O ATOM 0 H GLU A 78 -10.097 -12.305 2.270 1.00 0.00 H new ATOM 0 HA GLU A 78 -12.095 -10.555 0.985 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -13.796 -12.112 1.381 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -12.470 -13.055 0.731 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -11.926 -13.962 2.873 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -12.931 -12.795 3.710 1.00 0.00 H new ATOM 1203 N VAL A 79 -13.072 -9.761 3.161 1.00 0.00 N ATOM 1204 CA VAL A 79 -13.535 -9.171 4.396 1.00 0.00 C ATOM 1205 C VAL A 79 -15.018 -9.497 4.558 1.00 0.00 C ATOM 1206 O VAL A 79 -15.886 -8.823 3.997 1.00 0.00 O ATOM 1207 CB VAL A 79 -13.293 -7.638 4.458 1.00 0.00 C ATOM 1208 CG1 VAL A 79 -13.821 -6.936 3.213 1.00 0.00 C ATOM 1209 CG2 VAL A 79 -13.909 -7.040 5.714 1.00 0.00 C ATOM 0 H VAL A 79 -13.584 -9.450 2.335 1.00 0.00 H new ATOM 0 HA VAL A 79 -12.960 -9.595 5.219 1.00 0.00 H new ATOM 0 HB VAL A 79 -12.215 -7.480 4.495 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -13.634 -5.865 3.292 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -13.314 -7.329 2.331 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -14.893 -7.111 3.123 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -13.725 -5.966 5.733 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -14.983 -7.225 5.716 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -13.460 -7.501 6.594 1.00 0.00 H new ATOM 1219 N SER A 80 -15.291 -10.569 5.297 1.00 0.00 N ATOM 1220 CA SER A 80 -16.648 -11.081 5.489 1.00 0.00 C ATOM 1221 C SER A 80 -17.435 -11.138 4.172 1.00 0.00 C ATOM 1222 O SER A 80 -18.382 -10.380 3.965 1.00 0.00 O ATOM 1223 CB SER A 80 -17.402 -10.259 6.550 1.00 0.00 C ATOM 1224 OG SER A 80 -17.327 -8.868 6.283 1.00 0.00 O ATOM 0 H SER A 80 -14.575 -11.110 5.782 1.00 0.00 H new ATOM 0 HA SER A 80 -16.557 -12.105 5.852 1.00 0.00 H new ATOM 0 HB2 SER A 80 -18.447 -10.569 6.577 1.00 0.00 H new ATOM 0 HB3 SER A 80 -16.983 -10.464 7.535 1.00 0.00 H new ATOM 0 HG SER A 80 -17.504 -8.707 5.333 1.00 0.00 H new ATOM 1230 N GLY A 81 -17.017 -12.025 3.275 1.00 0.00 N ATOM 1231 CA GLY A 81 -17.731 -12.220 2.023 1.00 0.00 C ATOM 1232 C GLY A 81 -17.339 -11.249 0.919 1.00 0.00 C ATOM 1233 O GLY A 81 -17.599 -11.507 -0.257 1.00 0.00 O ATOM 0 H GLY A 81 -16.193 -12.615 3.392 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -17.557 -13.238 1.674 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -18.801 -12.126 2.210 1.00 0.00 H new ATOM 1237 N ARG A 82 -16.727 -10.129 1.276 1.00 0.00 N ATOM 1238 CA ARG A 82 -16.315 -9.150 0.277 1.00 0.00 C ATOM 1239 C ARG A 82 -14.859 -9.365 -0.095 1.00 0.00 C ATOM 1240 O ARG A 82 -14.011 -9.500 0.772 1.00 0.00 O ATOM 1241 CB ARG A 82 -16.496 -7.728 0.796 1.00 0.00 C ATOM 1242 CG ARG A 82 -17.825 -7.485 1.482 1.00 0.00 C ATOM 1243 CD ARG A 82 -17.959 -6.037 1.911 1.00 0.00 C ATOM 1244 NE ARG A 82 -18.949 -5.879 2.973 1.00 0.00 N ATOM 1245 CZ ARG A 82 -19.278 -4.715 3.527 1.00 0.00 C ATOM 1246 NH1 ARG A 82 -18.818 -3.577 3.023 1.00 0.00 N ATOM 1247 NH2 ARG A 82 -20.092 -4.686 4.573 1.00 0.00 N ATOM 0 H ARG A 82 -16.506 -9.876 2.239 1.00 0.00 H new ATOM 0 HA ARG A 82 -16.944 -9.285 -0.603 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -15.691 -7.503 1.496 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -16.397 -7.033 -0.038 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -18.640 -7.745 0.806 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -17.913 -8.135 2.352 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -16.993 -5.669 2.256 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -18.245 -5.428 1.053 1.00 0.00 H new ATOM 0 HE ARG A 82 -19.420 -6.718 3.313 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -18.208 -3.591 2.206 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -19.074 -2.688 3.453 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -20.466 -5.556 4.953 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -20.345 -3.794 4.998 1.00 0.00 H new ATOM 1261 N ILE A 83 -14.568 -9.360 -1.377 1.00 0.00 N ATOM 1262 CA ILE A 83 -13.221 -9.656 -1.845 1.00 0.00 C ATOM 1263 C ILE A 83 -12.427 -8.371 -2.026 1.00 0.00 C ATOM 1264 O ILE A 83 -12.749 -7.540 -2.875 1.00 0.00 O ATOM 1265 CB ILE A 83 -13.232 -10.479 -3.163 1.00 0.00 C ATOM 1266 CG1 ILE A 83 -13.446 -11.969 -2.870 1.00 0.00 C ATOM 1267 CG2 ILE A 83 -11.931 -10.299 -3.935 1.00 0.00 C ATOM 1268 CD1 ILE A 83 -14.725 -12.288 -2.133 1.00 0.00 C ATOM 0 H ILE A 83 -15.240 -9.156 -2.117 1.00 0.00 H new ATOM 0 HA ILE A 83 -12.737 -10.267 -1.083 1.00 0.00 H new ATOM 0 HB ILE A 83 -14.057 -10.109 -3.772 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -13.440 -12.516 -3.813 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -12.603 -12.335 -2.284 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -11.968 -10.887 -4.852 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -11.798 -9.246 -4.184 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -11.095 -10.635 -3.322 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -14.792 -13.364 -1.969 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -14.729 -11.774 -1.172 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -15.578 -11.957 -2.725 1.00 0.00 H new ATOM 1280 N ILE A 84 -11.411 -8.202 -1.195 1.00 0.00 N ATOM 1281 CA ILE A 84 -10.556 -7.038 -1.276 1.00 0.00 C ATOM 1282 C ILE A 84 -9.378 -7.304 -2.190 1.00 0.00 C ATOM 1283 O ILE A 84 -8.693 -8.323 -2.071 1.00 0.00 O ATOM 1284 CB ILE A 84 -10.023 -6.576 0.096 1.00 0.00 C ATOM 1285 CG1 ILE A 84 -10.585 -7.419 1.232 1.00 0.00 C ATOM 1286 CG2 ILE A 84 -10.369 -5.122 0.339 1.00 0.00 C ATOM 1287 CD1 ILE A 84 -10.530 -6.702 2.558 1.00 0.00 C ATOM 0 H ILE A 84 -11.161 -8.860 -0.457 1.00 0.00 H new ATOM 0 HA ILE A 84 -11.180 -6.239 -1.677 1.00 0.00 H new ATOM 0 HB ILE A 84 -8.940 -6.699 0.076 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -11.618 -7.685 1.008 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -10.024 -8.351 1.302 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -9.985 -4.814 1.312 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -9.920 -4.506 -0.440 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -11.452 -4.998 0.321 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -10.942 -7.344 3.336 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -9.495 -6.460 2.798 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -11.113 -5.783 2.499 1.00 0.00 H new ATOM 1299 N HIS A 85 -9.150 -6.377 -3.094 1.00 0.00 N ATOM 1300 CA HIS A 85 -8.095 -6.501 -4.071 1.00 0.00 C ATOM 1301 C HIS A 85 -7.078 -5.389 -3.856 1.00 0.00 C ATOM 1302 O HIS A 85 -7.273 -4.260 -4.311 1.00 0.00 O ATOM 1303 CB HIS A 85 -8.699 -6.421 -5.472 1.00 0.00 C ATOM 1304 CG HIS A 85 -7.797 -6.884 -6.571 1.00 0.00 C ATOM 1305 ND1 HIS A 85 -8.019 -6.575 -7.892 1.00 0.00 N ATOM 1306 CD2 HIS A 85 -6.692 -7.665 -6.550 1.00 0.00 C ATOM 1307 CE1 HIS A 85 -7.094 -7.147 -8.639 1.00 0.00 C ATOM 1308 NE2 HIS A 85 -6.275 -7.814 -7.848 1.00 0.00 N ATOM 0 H HIS A 85 -9.692 -5.516 -3.171 1.00 0.00 H new ATOM 0 HA HIS A 85 -7.589 -7.460 -3.962 1.00 0.00 H new ATOM 0 HB2 HIS A 85 -9.611 -7.018 -5.494 1.00 0.00 H new ATOM 0 HB3 HIS A 85 -8.989 -5.389 -5.669 1.00 0.00 H new ATOM 0 HD1 HIS A 85 -8.781 -5.993 -8.241 1.00 0.00 H new ATOM 0 HD2 HIS A 85 -6.225 -8.091 -5.674 1.00 0.00 H new ATOM 0 HE1 HIS A 85 -7.020 -7.081 -9.714 1.00 0.00 H new ATOM 1317 N LEU A 86 -6.003 -5.708 -3.150 1.00 0.00 N ATOM 1318 CA LEU A 86 -4.996 -4.715 -2.811 1.00 0.00 C ATOM 1319 C LEU A 86 -3.923 -4.639 -3.880 1.00 0.00 C ATOM 1320 O LEU A 86 -3.385 -5.658 -4.308 1.00 0.00 O ATOM 1321 CB LEU A 86 -4.355 -5.004 -1.451 1.00 0.00 C ATOM 1322 CG LEU A 86 -5.161 -4.534 -0.237 1.00 0.00 C ATOM 1323 CD1 LEU A 86 -6.263 -5.523 0.106 1.00 0.00 C ATOM 1324 CD2 LEU A 86 -4.241 -4.305 0.950 1.00 0.00 C ATOM 0 H LEU A 86 -5.806 -6.646 -2.801 1.00 0.00 H new ATOM 0 HA LEU A 86 -5.504 -3.753 -2.753 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -4.192 -6.078 -1.365 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -3.374 -4.530 -1.421 1.00 0.00 H new ATOM 0 HG LEU A 86 -5.639 -3.587 -0.488 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -6.818 -5.163 0.972 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -6.939 -5.623 -0.743 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -5.823 -6.493 0.335 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -4.828 -3.971 1.806 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -3.731 -5.235 1.200 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -3.503 -3.544 0.697 1.00 0.00 H new ATOM 1336 N HIS A 87 -3.636 -3.425 -4.317 1.00 0.00 N ATOM 1337 CA HIS A 87 -2.623 -3.183 -5.333 1.00 0.00 C ATOM 1338 C HIS A 87 -1.462 -2.407 -4.729 1.00 0.00 C ATOM 1339 O HIS A 87 -1.633 -1.255 -4.343 1.00 0.00 O ATOM 1340 CB HIS A 87 -3.203 -2.361 -6.488 1.00 0.00 C ATOM 1341 CG HIS A 87 -4.467 -2.901 -7.081 1.00 0.00 C ATOM 1342 ND1 HIS A 87 -4.491 -3.843 -8.084 1.00 0.00 N ATOM 1343 CD2 HIS A 87 -5.762 -2.590 -6.827 1.00 0.00 C ATOM 1344 CE1 HIS A 87 -5.744 -4.083 -8.427 1.00 0.00 C ATOM 1345 NE2 HIS A 87 -6.535 -3.336 -7.679 1.00 0.00 N ATOM 0 H HIS A 87 -4.097 -2.580 -3.979 1.00 0.00 H new ATOM 0 HA HIS A 87 -2.281 -4.148 -5.707 1.00 0.00 H new ATOM 0 HB2 HIS A 87 -3.391 -1.347 -6.134 1.00 0.00 H new ATOM 0 HB3 HIS A 87 -2.452 -2.290 -7.275 1.00 0.00 H new ATOM 0 HD2 HIS A 87 -6.119 -1.885 -6.090 1.00 0.00 H new ATOM 0 HE1 HIS A 87 -6.067 -4.774 -9.191 1.00 0.00 H new ATOM 0 HE2 HIS A 87 -7.554 -3.317 -7.727 1.00 0.00 H new ATOM 1354 N ALA A 88 -0.295 -3.023 -4.640 1.00 0.00 N ATOM 1355 CA ALA A 88 0.877 -2.331 -4.117 1.00 0.00 C ATOM 1356 C ALA A 88 1.679 -1.725 -5.256 1.00 0.00 C ATOM 1357 O ALA A 88 2.378 -2.435 -5.983 1.00 0.00 O ATOM 1358 CB ALA A 88 1.752 -3.277 -3.303 1.00 0.00 C ATOM 0 H ALA A 88 -0.132 -3.990 -4.919 1.00 0.00 H new ATOM 0 HA ALA A 88 0.535 -1.533 -3.458 1.00 0.00 H new ATOM 0 HB1 ALA A 88 2.619 -2.736 -2.925 1.00 0.00 H new ATOM 0 HB2 ALA A 88 1.178 -3.674 -2.466 1.00 0.00 H new ATOM 0 HB3 ALA A 88 2.086 -4.099 -3.936 1.00 0.00 H new ATOM 1364 N TRP A 89 1.581 -0.414 -5.406 1.00 0.00 N ATOM 1365 CA TRP A 89 2.270 0.280 -6.483 1.00 0.00 C ATOM 1366 C TRP A 89 3.418 1.109 -5.919 1.00 0.00 C ATOM 1367 O TRP A 89 3.306 1.690 -4.839 1.00 0.00 O ATOM 1368 CB TRP A 89 1.307 1.182 -7.268 1.00 0.00 C ATOM 1369 CG TRP A 89 0.139 0.469 -7.905 1.00 0.00 C ATOM 1370 CD1 TRP A 89 -1.100 0.997 -8.137 1.00 0.00 C ATOM 1371 CD2 TRP A 89 0.087 -0.886 -8.391 1.00 0.00 C ATOM 1372 NE1 TRP A 89 -1.908 0.065 -8.743 1.00 0.00 N ATOM 1373 CE2 TRP A 89 -1.205 -1.094 -8.908 1.00 0.00 C ATOM 1374 CE3 TRP A 89 1.001 -1.941 -8.447 1.00 0.00 C ATOM 1375 CZ2 TRP A 89 -1.601 -2.308 -9.466 1.00 0.00 C ATOM 1376 CZ3 TRP A 89 0.605 -3.144 -8.998 1.00 0.00 C ATOM 1377 CH2 TRP A 89 -0.685 -3.318 -9.505 1.00 0.00 C ATOM 0 H TRP A 89 1.031 0.191 -4.796 1.00 0.00 H new ATOM 0 HA TRP A 89 2.668 -0.469 -7.168 1.00 0.00 H new ATOM 0 HB2 TRP A 89 0.922 1.949 -6.596 1.00 0.00 H new ATOM 0 HB3 TRP A 89 1.869 1.695 -8.048 1.00 0.00 H new ATOM 0 HD1 TRP A 89 -1.401 2.002 -7.881 1.00 0.00 H new ATOM 0 HE1 TRP A 89 -2.877 0.215 -9.024 1.00 0.00 H new ATOM 0 HE3 TRP A 89 2.004 -1.818 -8.065 1.00 0.00 H new ATOM 0 HZ2 TRP A 89 -2.599 -2.445 -9.854 1.00 0.00 H new ATOM 0 HZ3 TRP A 89 1.305 -3.965 -9.038 1.00 0.00 H new ATOM 0 HH2 TRP A 89 -0.962 -4.269 -9.935 1.00 0.00 H new ATOM 1388 N HIS A 90 4.521 1.159 -6.647 1.00 0.00 N ATOM 1389 CA HIS A 90 5.703 1.871 -6.189 1.00 0.00 C ATOM 1390 C HIS A 90 5.674 3.314 -6.672 1.00 0.00 C ATOM 1391 O HIS A 90 5.674 3.572 -7.878 1.00 0.00 O ATOM 1392 CB HIS A 90 6.970 1.167 -6.698 1.00 0.00 C ATOM 1393 CG HIS A 90 8.257 1.821 -6.287 1.00 0.00 C ATOM 1394 ND1 HIS A 90 9.154 2.352 -7.189 1.00 0.00 N ATOM 1395 CD2 HIS A 90 8.806 2.009 -5.066 1.00 0.00 C ATOM 1396 CE1 HIS A 90 10.193 2.834 -6.541 1.00 0.00 C ATOM 1397 NE2 HIS A 90 10.012 2.640 -5.249 1.00 0.00 N ATOM 0 H HIS A 90 4.623 0.714 -7.559 1.00 0.00 H new ATOM 0 HA HIS A 90 5.711 1.871 -5.099 1.00 0.00 H new ATOM 0 HB2 HIS A 90 6.969 0.139 -6.336 1.00 0.00 H new ATOM 0 HB3 HIS A 90 6.932 1.122 -7.786 1.00 0.00 H new ATOM 0 HD2 HIS A 90 8.375 1.717 -4.120 1.00 0.00 H new ATOM 0 HE1 HIS A 90 11.051 3.309 -6.992 1.00 0.00 H new ATOM 0 HE2 HIS A 90 10.659 2.913 -4.510 1.00 0.00 H new ATOM 1406 N VAL A 91 5.637 4.249 -5.735 1.00 0.00 N ATOM 1407 CA VAL A 91 5.736 5.659 -6.072 1.00 0.00 C ATOM 1408 C VAL A 91 7.190 6.112 -5.938 1.00 0.00 C ATOM 1409 O VAL A 91 7.722 6.218 -4.834 1.00 0.00 O ATOM 1410 CB VAL A 91 4.803 6.540 -5.207 1.00 0.00 C ATOM 1411 CG1 VAL A 91 3.351 6.311 -5.598 1.00 0.00 C ATOM 1412 CG2 VAL A 91 4.993 6.264 -3.725 1.00 0.00 C ATOM 0 H VAL A 91 5.539 4.057 -4.738 1.00 0.00 H new ATOM 0 HA VAL A 91 5.407 5.782 -7.104 1.00 0.00 H new ATOM 0 HB VAL A 91 5.065 7.582 -5.391 1.00 0.00 H new ATOM 0 HG11 VAL A 91 2.705 6.937 -4.982 1.00 0.00 H new ATOM 0 HG12 VAL A 91 3.212 6.569 -6.648 1.00 0.00 H new ATOM 0 HG13 VAL A 91 3.094 5.263 -5.445 1.00 0.00 H new ATOM 0 HG21 VAL A 91 4.322 6.900 -3.148 1.00 0.00 H new ATOM 0 HG22 VAL A 91 4.769 5.218 -3.518 1.00 0.00 H new ATOM 0 HG23 VAL A 91 6.025 6.476 -3.445 1.00 0.00 H new ATOM 1422 N PRO A 92 7.863 6.342 -7.074 1.00 0.00 N ATOM 1423 CA PRO A 92 9.291 6.675 -7.096 1.00 0.00 C ATOM 1424 C PRO A 92 9.584 8.078 -6.571 1.00 0.00 C ATOM 1425 O PRO A 92 10.731 8.404 -6.262 1.00 0.00 O ATOM 1426 CB PRO A 92 9.652 6.561 -8.579 1.00 0.00 C ATOM 1427 CG PRO A 92 8.381 6.844 -9.299 1.00 0.00 C ATOM 1428 CD PRO A 92 7.288 6.288 -8.430 1.00 0.00 C ATOM 0 HA PRO A 92 9.871 6.019 -6.448 1.00 0.00 H new ATOM 0 HB2 PRO A 92 10.430 7.274 -8.853 1.00 0.00 H new ATOM 0 HB3 PRO A 92 10.031 5.568 -8.819 1.00 0.00 H new ATOM 0 HG2 PRO A 92 8.250 7.915 -9.456 1.00 0.00 H new ATOM 0 HG3 PRO A 92 8.376 6.375 -10.283 1.00 0.00 H new ATOM 0 HD2 PRO A 92 6.377 6.881 -8.503 1.00 0.00 H new ATOM 0 HD3 PRO A 92 7.028 5.269 -8.715 1.00 0.00 H new ATOM 1436 N ASP A 93 8.549 8.899 -6.459 1.00 0.00 N ATOM 1437 CA ASP A 93 8.724 10.264 -5.979 1.00 0.00 C ATOM 1438 C ASP A 93 7.421 10.833 -5.441 1.00 0.00 C ATOM 1439 O ASP A 93 6.329 10.430 -5.856 1.00 0.00 O ATOM 1440 CB ASP A 93 9.272 11.168 -7.084 1.00 0.00 C ATOM 1441 CG ASP A 93 9.804 12.477 -6.534 1.00 0.00 C ATOM 1442 OD1 ASP A 93 10.831 12.449 -5.821 1.00 0.00 O ATOM 1443 OD2 ASP A 93 9.200 13.536 -6.804 1.00 0.00 O ATOM 0 H ASP A 93 7.588 8.648 -6.691 1.00 0.00 H new ATOM 0 HA ASP A 93 9.447 10.230 -5.164 1.00 0.00 H new ATOM 0 HB2 ASP A 93 10.068 10.648 -7.616 1.00 0.00 H new ATOM 0 HB3 ASP A 93 8.484 11.373 -7.809 1.00 0.00 H new ATOM 1448 N PHE A 94 7.550 11.765 -4.510 1.00 0.00 N ATOM 1449 CA PHE A 94 6.412 12.431 -3.905 1.00 0.00 C ATOM 1450 C PHE A 94 6.768 13.884 -3.620 1.00 0.00 C ATOM 1451 O PHE A 94 7.896 14.186 -3.225 1.00 0.00 O ATOM 1452 CB PHE A 94 5.992 11.715 -2.612 1.00 0.00 C ATOM 1453 CG PHE A 94 7.066 11.677 -1.558 1.00 0.00 C ATOM 1454 CD1 PHE A 94 8.063 10.717 -1.601 1.00 0.00 C ATOM 1455 CD2 PHE A 94 7.079 12.604 -0.529 1.00 0.00 C ATOM 1456 CE1 PHE A 94 9.054 10.682 -0.639 1.00 0.00 C ATOM 1457 CE2 PHE A 94 8.067 12.575 0.435 1.00 0.00 C ATOM 1458 CZ PHE A 94 9.056 11.613 0.380 1.00 0.00 C ATOM 0 H PHE A 94 8.452 12.081 -4.153 1.00 0.00 H new ATOM 0 HA PHE A 94 5.570 12.398 -4.596 1.00 0.00 H new ATOM 0 HB2 PHE A 94 5.113 12.212 -2.203 1.00 0.00 H new ATOM 0 HB3 PHE A 94 5.697 10.694 -2.853 1.00 0.00 H new ATOM 0 HD1 PHE A 94 8.066 9.987 -2.396 1.00 0.00 H new ATOM 0 HD2 PHE A 94 6.307 13.358 -0.480 1.00 0.00 H new ATOM 0 HE1 PHE A 94 9.826 9.928 -0.684 1.00 0.00 H new ATOM 0 HE2 PHE A 94 8.066 13.304 1.232 1.00 0.00 H new ATOM 0 HZ PHE A 94 9.830 11.589 1.133 1.00 0.00 H new ATOM 1468 N HIS A 95 5.830 14.785 -3.850 1.00 0.00 N ATOM 1469 CA HIS A 95 6.067 16.200 -3.612 1.00 0.00 C ATOM 1470 C HIS A 95 5.291 16.674 -2.390 1.00 0.00 C ATOM 1471 O HIS A 95 4.075 16.507 -2.315 1.00 0.00 O ATOM 1472 CB HIS A 95 5.667 17.020 -4.844 1.00 0.00 C ATOM 1473 CG HIS A 95 6.006 18.477 -4.736 1.00 0.00 C ATOM 1474 ND1 HIS A 95 5.053 19.466 -4.623 1.00 0.00 N ATOM 1475 CD2 HIS A 95 7.204 19.111 -4.736 1.00 0.00 C ATOM 1476 CE1 HIS A 95 5.650 20.642 -4.556 1.00 0.00 C ATOM 1477 NE2 HIS A 95 6.954 20.454 -4.620 1.00 0.00 N ATOM 0 H HIS A 95 4.898 14.564 -4.201 1.00 0.00 H new ATOM 0 HA HIS A 95 7.131 16.345 -3.424 1.00 0.00 H new ATOM 0 HB2 HIS A 95 6.162 16.605 -5.722 1.00 0.00 H new ATOM 0 HB3 HIS A 95 4.594 16.917 -5.005 1.00 0.00 H new ATOM 0 HD1 HIS A 95 4.045 19.314 -4.595 1.00 0.00 H new ATOM 0 HD2 HIS A 95 8.175 18.645 -4.813 1.00 0.00 H new ATOM 0 HE1 HIS A 95 5.154 21.597 -4.464 1.00 0.00 H new ATOM 1486 N GLY A 96 5.997 17.259 -1.436 1.00 0.00 N ATOM 1487 CA GLY A 96 5.349 17.780 -0.253 1.00 0.00 C ATOM 1488 C GLY A 96 5.932 17.213 1.023 1.00 0.00 C ATOM 1489 O GLY A 96 6.996 16.591 1.003 1.00 0.00 O ATOM 0 H GLY A 96 7.009 17.382 -1.460 1.00 0.00 H new ATOM 0 HA2 GLY A 96 5.442 18.866 -0.240 1.00 0.00 H new ATOM 0 HA3 GLY A 96 4.284 17.551 -0.295 1.00 0.00 H new ATOM 1493 N THR A 97 5.231 17.415 2.129 1.00 0.00 N ATOM 1494 CA THR A 97 5.680 16.940 3.421 1.00 0.00 C ATOM 1495 C THR A 97 4.701 15.898 3.935 1.00 0.00 C ATOM 1496 O THR A 97 3.529 16.200 4.161 1.00 0.00 O ATOM 1497 CB THR A 97 5.789 18.100 4.432 1.00 0.00 C ATOM 1498 OG1 THR A 97 6.522 19.190 3.850 1.00 0.00 O ATOM 1499 CG2 THR A 97 6.482 17.649 5.710 1.00 0.00 C ATOM 0 H THR A 97 4.340 17.911 2.152 1.00 0.00 H new ATOM 0 HA THR A 97 6.670 16.498 3.307 1.00 0.00 H new ATOM 0 HB THR A 97 4.779 18.427 4.681 1.00 0.00 H new ATOM 0 HG1 THR A 97 6.586 19.924 4.497 1.00 0.00 H new ATOM 0 HG21 THR A 97 6.545 18.487 6.405 1.00 0.00 H new ATOM 0 HG22 THR A 97 5.912 16.841 6.167 1.00 0.00 H new ATOM 0 HG23 THR A 97 7.486 17.296 5.474 1.00 0.00 H new ATOM 1507 N LEU A 98 5.181 14.675 4.110 1.00 0.00 N ATOM 1508 CA LEU A 98 4.302 13.573 4.463 1.00 0.00 C ATOM 1509 C LEU A 98 3.859 13.672 5.907 1.00 0.00 C ATOM 1510 O LEU A 98 4.670 13.768 6.828 1.00 0.00 O ATOM 1511 CB LEU A 98 4.946 12.217 4.157 1.00 0.00 C ATOM 1512 CG LEU A 98 6.423 12.078 4.512 1.00 0.00 C ATOM 1513 CD1 LEU A 98 6.603 11.485 5.903 1.00 0.00 C ATOM 1514 CD2 LEU A 98 7.116 11.231 3.465 1.00 0.00 C ATOM 0 H LEU A 98 6.165 14.424 4.014 1.00 0.00 H new ATOM 0 HA LEU A 98 3.410 13.648 3.841 1.00 0.00 H new ATOM 0 HB2 LEU A 98 4.391 11.446 4.691 1.00 0.00 H new ATOM 0 HB3 LEU A 98 4.829 12.014 3.092 1.00 0.00 H new ATOM 0 HG LEU A 98 6.877 13.069 4.524 1.00 0.00 H new ATOM 0 HD11 LEU A 98 7.666 11.398 6.127 1.00 0.00 H new ATOM 0 HD12 LEU A 98 6.129 12.134 6.639 1.00 0.00 H new ATOM 0 HD13 LEU A 98 6.143 10.498 5.940 1.00 0.00 H new ATOM 0 HD21 LEU A 98 8.172 11.131 3.718 1.00 0.00 H new ATOM 0 HD22 LEU A 98 6.656 10.244 3.433 1.00 0.00 H new ATOM 0 HD23 LEU A 98 7.020 11.708 2.490 1.00 0.00 H new ATOM 1526 N GLN A 99 2.557 13.676 6.083 1.00 0.00 N ATOM 1527 CA GLN A 99 1.954 13.819 7.386 1.00 0.00 C ATOM 1528 C GLN A 99 1.015 12.643 7.621 1.00 0.00 C ATOM 1529 O GLN A 99 0.614 11.978 6.672 1.00 0.00 O ATOM 1530 CB GLN A 99 1.197 15.151 7.451 1.00 0.00 C ATOM 1531 CG GLN A 99 -0.082 15.173 6.626 1.00 0.00 C ATOM 1532 CD GLN A 99 -0.798 16.507 6.691 1.00 0.00 C ATOM 1533 OE1 GLN A 99 -0.559 17.398 5.874 1.00 0.00 O ATOM 1534 NE2 GLN A 99 -1.677 16.656 7.665 1.00 0.00 N ATOM 0 H GLN A 99 1.885 13.580 5.322 1.00 0.00 H new ATOM 0 HA GLN A 99 2.717 13.822 8.165 1.00 0.00 H new ATOM 0 HB2 GLN A 99 0.951 15.368 8.491 1.00 0.00 H new ATOM 0 HB3 GLN A 99 1.855 15.949 7.106 1.00 0.00 H new ATOM 0 HG2 GLN A 99 0.157 14.944 5.587 1.00 0.00 H new ATOM 0 HG3 GLN A 99 -0.751 14.389 6.980 1.00 0.00 H new ATOM 0 HE21 GLN A 99 -1.846 15.893 8.321 1.00 0.00 H new ATOM 0 HE22 GLN A 99 -2.187 17.534 7.761 1.00 0.00 H new ATOM 1543 N ALA A 100 0.695 12.357 8.865 1.00 0.00 N ATOM 1544 CA ALA A 100 -0.240 11.285 9.156 1.00 0.00 C ATOM 1545 C ALA A 100 -1.576 11.851 9.608 1.00 0.00 C ATOM 1546 O ALA A 100 -1.693 12.387 10.711 1.00 0.00 O ATOM 1547 CB ALA A 100 0.334 10.344 10.202 1.00 0.00 C ATOM 0 H ALA A 100 1.062 12.843 9.683 1.00 0.00 H new ATOM 0 HA ALA A 100 -0.406 10.713 8.243 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -0.381 9.547 10.407 1.00 0.00 H new ATOM 0 HB2 ALA A 100 1.263 9.911 9.831 1.00 0.00 H new ATOM 0 HB3 ALA A 100 0.533 10.898 11.120 1.00 0.00 H new ATOM 1553 N HIS A 101 -2.582 11.766 8.744 1.00 0.00 N ATOM 1554 CA HIS A 101 -3.907 12.262 9.081 1.00 0.00 C ATOM 1555 C HIS A 101 -4.728 11.169 9.750 1.00 0.00 C ATOM 1556 O HIS A 101 -5.223 11.346 10.861 1.00 0.00 O ATOM 1557 CB HIS A 101 -4.632 12.780 7.833 1.00 0.00 C ATOM 1558 CG HIS A 101 -5.929 13.471 8.142 1.00 0.00 C ATOM 1559 ND1 HIS A 101 -7.141 13.078 7.615 1.00 0.00 N ATOM 1560 CD2 HIS A 101 -6.197 14.535 8.938 1.00 0.00 C ATOM 1561 CE1 HIS A 101 -8.095 13.867 8.074 1.00 0.00 C ATOM 1562 NE2 HIS A 101 -7.548 14.758 8.879 1.00 0.00 N ATOM 0 H HIS A 101 -2.504 11.361 7.811 1.00 0.00 H new ATOM 0 HA HIS A 101 -3.791 13.092 9.778 1.00 0.00 H new ATOM 0 HB2 HIS A 101 -3.978 13.472 7.302 1.00 0.00 H new ATOM 0 HB3 HIS A 101 -4.825 11.944 7.161 1.00 0.00 H new ATOM 0 HD2 HIS A 101 -5.479 15.102 9.512 1.00 0.00 H new ATOM 0 HE1 HIS A 101 -9.145 13.795 7.832 1.00 0.00 H new ATOM 0 HE2 HIS A 101 -8.049 15.494 9.377 1.00 0.00 H new ATOM 1571 N GLU A 102 -4.876 10.041 9.069 1.00 0.00 N ATOM 1572 CA GLU A 102 -5.600 8.913 9.628 1.00 0.00 C ATOM 1573 C GLU A 102 -4.670 8.028 10.444 1.00 0.00 C ATOM 1574 O GLU A 102 -4.960 7.702 11.594 1.00 0.00 O ATOM 1575 CB GLU A 102 -6.265 8.097 8.526 1.00 0.00 C ATOM 1576 CG GLU A 102 -7.547 8.712 8.000 1.00 0.00 C ATOM 1577 CD GLU A 102 -8.487 7.664 7.446 1.00 0.00 C ATOM 1578 OE1 GLU A 102 -9.231 7.056 8.241 1.00 0.00 O ATOM 1579 OE2 GLU A 102 -8.478 7.433 6.222 1.00 0.00 O ATOM 0 H GLU A 102 -4.505 9.885 8.132 1.00 0.00 H new ATOM 0 HA GLU A 102 -6.375 9.305 10.286 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -5.564 7.979 7.700 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -6.481 7.098 8.906 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -8.044 9.258 8.802 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -7.310 9.436 7.220 1.00 0.00 H new ATOM 1586 N HIS A 103 -3.554 7.638 9.843 1.00 0.00 N ATOM 1587 CA HIS A 103 -2.552 6.840 10.543 1.00 0.00 C ATOM 1588 C HIS A 103 -1.862 7.696 11.611 1.00 0.00 C ATOM 1589 O HIS A 103 -1.974 8.920 11.592 1.00 0.00 O ATOM 1590 CB HIS A 103 -1.537 6.258 9.549 1.00 0.00 C ATOM 1591 CG HIS A 103 -2.117 5.227 8.610 1.00 0.00 C ATOM 1592 ND1 HIS A 103 -2.867 5.548 7.495 1.00 0.00 N ATOM 1593 CD2 HIS A 103 -2.050 3.871 8.629 1.00 0.00 C ATOM 1594 CE1 HIS A 103 -3.232 4.438 6.876 1.00 0.00 C ATOM 1595 NE2 HIS A 103 -2.751 3.412 7.542 1.00 0.00 N ATOM 0 H HIS A 103 -3.319 7.859 8.876 1.00 0.00 H new ATOM 0 HA HIS A 103 -3.042 6.002 11.039 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -1.113 7.072 8.961 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -0.717 5.806 10.106 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -1.540 3.266 9.363 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -3.825 4.384 5.975 1.00 0.00 H new ATOM 0 HE2 HIS A 103 -2.878 2.432 7.291 1.00 0.00 H new ATOM 1604 N GLN A 104 -1.169 7.058 12.548 1.00 0.00 N ATOM 1605 CA GLN A 104 -0.600 7.769 13.693 1.00 0.00 C ATOM 1606 C GLN A 104 0.784 8.345 13.389 1.00 0.00 C ATOM 1607 O GLN A 104 0.978 9.562 13.409 1.00 0.00 O ATOM 1608 CB GLN A 104 -0.516 6.840 14.908 1.00 0.00 C ATOM 1609 CG GLN A 104 -0.012 7.531 16.166 1.00 0.00 C ATOM 1610 CD GLN A 104 -0.976 8.586 16.675 1.00 0.00 C ATOM 1611 OE1 GLN A 104 -2.194 8.445 16.549 1.00 0.00 O ATOM 1612 NE2 GLN A 104 -0.434 9.658 17.231 1.00 0.00 N ATOM 0 H GLN A 104 -0.987 6.054 12.540 1.00 0.00 H new ATOM 0 HA GLN A 104 -1.266 8.604 13.912 1.00 0.00 H new ATOM 0 HB2 GLN A 104 -1.503 6.421 15.104 1.00 0.00 H new ATOM 0 HB3 GLN A 104 0.144 6.005 14.672 1.00 0.00 H new ATOM 0 HG2 GLN A 104 0.151 6.786 16.945 1.00 0.00 H new ATOM 0 HG3 GLN A 104 0.953 7.994 15.960 1.00 0.00 H new ATOM 0 HE21 GLN A 104 0.580 9.732 17.314 1.00 0.00 H new ATOM 0 HE22 GLN A 104 -1.030 10.410 17.576 1.00 0.00 H new ATOM 1621 N ALA A 105 1.748 7.474 13.123 1.00 0.00 N ATOM 1622 CA ALA A 105 3.124 7.905 12.916 1.00 0.00 C ATOM 1623 C ALA A 105 3.712 7.278 11.662 1.00 0.00 C ATOM 1624 O ALA A 105 3.136 6.343 11.104 1.00 0.00 O ATOM 1625 CB ALA A 105 3.971 7.554 14.129 1.00 0.00 C ATOM 0 H ALA A 105 1.603 6.467 13.046 1.00 0.00 H new ATOM 0 HA ALA A 105 3.125 8.987 12.783 1.00 0.00 H new ATOM 0 HB1 ALA A 105 4.997 7.881 13.963 1.00 0.00 H new ATOM 0 HB2 ALA A 105 3.569 8.054 15.010 1.00 0.00 H new ATOM 0 HB3 ALA A 105 3.954 6.475 14.285 1.00 0.00 H new ATOM 1631 N LEU A 106 4.866 7.782 11.232 1.00 0.00 N ATOM 1632 CA LEU A 106 5.528 7.296 10.027 1.00 0.00 C ATOM 1633 C LEU A 106 6.926 6.800 10.372 1.00 0.00 C ATOM 1634 O LEU A 106 7.620 7.414 11.182 1.00 0.00 O ATOM 1635 CB LEU A 106 5.663 8.409 8.971 1.00 0.00 C ATOM 1636 CG LEU A 106 4.370 9.028 8.423 1.00 0.00 C ATOM 1637 CD1 LEU A 106 3.353 7.954 8.078 1.00 0.00 C ATOM 1638 CD2 LEU A 106 3.791 10.045 9.396 1.00 0.00 C ATOM 0 H LEU A 106 5.365 8.534 11.707 1.00 0.00 H new ATOM 0 HA LEU A 106 4.918 6.489 9.621 1.00 0.00 H new ATOM 0 HB2 LEU A 106 6.263 9.210 9.402 1.00 0.00 H new ATOM 0 HB3 LEU A 106 6.226 8.007 8.129 1.00 0.00 H new ATOM 0 HG LEU A 106 4.618 9.557 7.503 1.00 0.00 H new ATOM 0 HD11 LEU A 106 2.447 8.421 7.692 1.00 0.00 H new ATOM 0 HD12 LEU A 106 3.769 7.289 7.321 1.00 0.00 H new ATOM 0 HD13 LEU A 106 3.112 7.380 8.973 1.00 0.00 H new ATOM 0 HD21 LEU A 106 2.876 10.466 8.980 1.00 0.00 H new ATOM 0 HD22 LEU A 106 3.567 9.555 10.344 1.00 0.00 H new ATOM 0 HD23 LEU A 106 4.515 10.843 9.562 1.00 0.00 H new ATOM 1650 N VAL A 107 7.331 5.688 9.781 1.00 0.00 N ATOM 1651 CA VAL A 107 8.695 5.204 9.944 1.00 0.00 C ATOM 1652 C VAL A 107 9.283 4.764 8.605 1.00 0.00 C ATOM 1653 O VAL A 107 8.589 4.175 7.771 1.00 0.00 O ATOM 1654 CB VAL A 107 8.778 4.043 10.966 1.00 0.00 C ATOM 1655 CG1 VAL A 107 8.107 2.781 10.440 1.00 0.00 C ATOM 1656 CG2 VAL A 107 10.222 3.765 11.352 1.00 0.00 C ATOM 0 H VAL A 107 6.740 5.106 9.187 1.00 0.00 H new ATOM 0 HA VAL A 107 9.282 6.036 10.332 1.00 0.00 H new ATOM 0 HB VAL A 107 8.236 4.354 11.859 1.00 0.00 H new ATOM 0 HG11 VAL A 107 8.186 1.989 11.185 1.00 0.00 H new ATOM 0 HG12 VAL A 107 7.056 2.985 10.238 1.00 0.00 H new ATOM 0 HG13 VAL A 107 8.599 2.464 9.520 1.00 0.00 H new ATOM 0 HG21 VAL A 107 10.255 2.946 12.070 1.00 0.00 H new ATOM 0 HG22 VAL A 107 10.790 3.491 10.463 1.00 0.00 H new ATOM 0 HG23 VAL A 107 10.657 4.658 11.800 1.00 0.00 H new ATOM 1666 N TRP A 108 10.550 5.089 8.392 1.00 0.00 N ATOM 1667 CA TRP A 108 11.269 4.643 7.211 1.00 0.00 C ATOM 1668 C TRP A 108 12.101 3.413 7.534 1.00 0.00 C ATOM 1669 O TRP A 108 13.001 3.463 8.376 1.00 0.00 O ATOM 1670 CB TRP A 108 12.195 5.741 6.679 1.00 0.00 C ATOM 1671 CG TRP A 108 11.489 6.967 6.190 1.00 0.00 C ATOM 1672 CD1 TRP A 108 11.319 8.136 6.870 1.00 0.00 C ATOM 1673 CD2 TRP A 108 10.870 7.150 4.912 1.00 0.00 C ATOM 1674 NE1 TRP A 108 10.633 9.037 6.094 1.00 0.00 N ATOM 1675 CE2 TRP A 108 10.346 8.454 4.886 1.00 0.00 C ATOM 1676 CE3 TRP A 108 10.711 6.336 3.788 1.00 0.00 C ATOM 1677 CZ2 TRP A 108 9.672 8.963 3.779 1.00 0.00 C ATOM 1678 CZ3 TRP A 108 10.043 6.841 2.690 1.00 0.00 C ATOM 1679 CH2 TRP A 108 9.531 8.145 2.691 1.00 0.00 C ATOM 0 H TRP A 108 11.103 5.664 9.028 1.00 0.00 H new ATOM 0 HA TRP A 108 10.529 4.402 6.448 1.00 0.00 H new ATOM 0 HB2 TRP A 108 12.889 6.028 7.469 1.00 0.00 H new ATOM 0 HB3 TRP A 108 12.792 5.332 5.864 1.00 0.00 H new ATOM 0 HD1 TRP A 108 11.672 8.326 7.873 1.00 0.00 H new ATOM 0 HE1 TRP A 108 10.378 9.985 6.371 1.00 0.00 H new ATOM 0 HE3 TRP A 108 11.103 5.330 3.778 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 9.275 9.967 3.779 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 9.913 6.220 1.816 1.00 0.00 H new ATOM 0 HH2 TRP A 108 9.015 8.512 1.816 1.00 0.00 H new ATOM 1690 N CYS A 109 11.801 2.307 6.881 1.00 0.00 N ATOM 1691 CA CYS A 109 12.609 1.109 7.023 1.00 0.00 C ATOM 1692 C CYS A 109 12.770 0.425 5.675 1.00 0.00 C ATOM 1693 O CYS A 109 11.951 0.614 4.776 1.00 0.00 O ATOM 1694 CB CYS A 109 12.003 0.152 8.053 1.00 0.00 C ATOM 1695 SG CYS A 109 10.324 -0.388 7.677 1.00 0.00 S ATOM 0 H CYS A 109 11.006 2.212 6.249 1.00 0.00 H new ATOM 0 HA CYS A 109 13.595 1.400 7.386 1.00 0.00 H new ATOM 0 HB2 CYS A 109 12.644 -0.726 8.135 1.00 0.00 H new ATOM 0 HB3 CYS A 109 12.004 0.640 9.028 1.00 0.00 H new ATOM 0 HG CYS A 109 10.108 -0.275 6.400 1.00 0.00 H new ATOM 1701 N SER A 110 13.828 -0.351 5.533 1.00 0.00 N ATOM 1702 CA SER A 110 14.125 -1.018 4.276 1.00 0.00 C ATOM 1703 C SER A 110 13.140 -2.173 4.052 1.00 0.00 C ATOM 1704 O SER A 110 12.565 -2.683 5.012 1.00 0.00 O ATOM 1705 CB SER A 110 15.567 -1.521 4.316 1.00 0.00 C ATOM 1706 OG SER A 110 16.426 -0.505 4.806 1.00 0.00 O ATOM 0 H SER A 110 14.501 -0.537 6.277 1.00 0.00 H new ATOM 0 HA SER A 110 14.016 -0.322 3.444 1.00 0.00 H new ATOM 0 HB2 SER A 110 15.635 -2.403 4.953 1.00 0.00 H new ATOM 0 HB3 SER A 110 15.882 -1.824 3.317 1.00 0.00 H new ATOM 0 HG SER A 110 17.347 -0.839 4.829 1.00 0.00 H new ATOM 1712 N PRO A 111 12.928 -2.593 2.786 1.00 0.00 N ATOM 1713 CA PRO A 111 11.963 -3.647 2.431 1.00 0.00 C ATOM 1714 C PRO A 111 12.056 -4.883 3.328 1.00 0.00 C ATOM 1715 O PRO A 111 11.052 -5.357 3.851 1.00 0.00 O ATOM 1716 CB PRO A 111 12.331 -4.011 0.980 1.00 0.00 C ATOM 1717 CG PRO A 111 13.585 -3.257 0.673 1.00 0.00 C ATOM 1718 CD PRO A 111 13.595 -2.070 1.590 1.00 0.00 C ATOM 0 HA PRO A 111 10.939 -3.295 2.554 1.00 0.00 H new ATOM 0 HB2 PRO A 111 12.485 -5.085 0.874 1.00 0.00 H new ATOM 0 HB3 PRO A 111 11.531 -3.734 0.293 1.00 0.00 H new ATOM 0 HG2 PRO A 111 14.464 -3.881 0.835 1.00 0.00 H new ATOM 0 HG3 PRO A 111 13.605 -2.943 -0.371 1.00 0.00 H new ATOM 0 HD2 PRO A 111 14.608 -1.731 1.805 1.00 0.00 H new ATOM 0 HD3 PRO A 111 13.059 -1.222 1.163 1.00 0.00 H new ATOM 1726 N GLU A 112 13.268 -5.386 3.516 1.00 0.00 N ATOM 1727 CA GLU A 112 13.483 -6.593 4.306 1.00 0.00 C ATOM 1728 C GLU A 112 13.139 -6.362 5.779 1.00 0.00 C ATOM 1729 O GLU A 112 12.612 -7.254 6.449 1.00 0.00 O ATOM 1730 CB GLU A 112 14.931 -7.062 4.151 1.00 0.00 C ATOM 1731 CG GLU A 112 15.962 -5.969 4.387 1.00 0.00 C ATOM 1732 CD GLU A 112 17.365 -6.412 4.035 1.00 0.00 C ATOM 1733 OE1 GLU A 112 18.022 -7.053 4.879 1.00 0.00 O ATOM 1734 OE2 GLU A 112 17.812 -6.132 2.903 1.00 0.00 O ATOM 0 H GLU A 112 14.120 -4.977 3.132 1.00 0.00 H new ATOM 0 HA GLU A 112 12.817 -7.372 3.935 1.00 0.00 H new ATOM 0 HB2 GLU A 112 15.115 -7.878 4.850 1.00 0.00 H new ATOM 0 HB3 GLU A 112 15.067 -7.465 3.147 1.00 0.00 H new ATOM 0 HG2 GLU A 112 15.701 -5.093 3.793 1.00 0.00 H new ATOM 0 HG3 GLU A 112 15.932 -5.665 5.433 1.00 0.00 H new ATOM 1741 N GLU A 113 13.424 -5.159 6.264 1.00 0.00 N ATOM 1742 CA GLU A 113 13.139 -4.791 7.645 1.00 0.00 C ATOM 1743 C GLU A 113 11.635 -4.654 7.870 1.00 0.00 C ATOM 1744 O GLU A 113 11.111 -5.070 8.901 1.00 0.00 O ATOM 1745 CB GLU A 113 13.830 -3.467 7.986 1.00 0.00 C ATOM 1746 CG GLU A 113 15.343 -3.490 7.817 1.00 0.00 C ATOM 1747 CD GLU A 113 16.029 -4.447 8.771 1.00 0.00 C ATOM 1748 OE1 GLU A 113 15.846 -4.301 9.998 1.00 0.00 O ATOM 1749 OE2 GLU A 113 16.758 -5.344 8.300 1.00 0.00 O ATOM 0 H GLU A 113 13.856 -4.416 5.715 1.00 0.00 H new ATOM 0 HA GLU A 113 13.519 -5.580 8.294 1.00 0.00 H new ATOM 0 HB2 GLU A 113 13.417 -2.681 7.353 1.00 0.00 H new ATOM 0 HB3 GLU A 113 13.595 -3.203 9.017 1.00 0.00 H new ATOM 0 HG2 GLU A 113 15.585 -3.771 6.792 1.00 0.00 H new ATOM 0 HG3 GLU A 113 15.736 -2.485 7.973 1.00 0.00 H new ATOM 1756 N ALA A 114 10.950 -4.088 6.877 1.00 0.00 N ATOM 1757 CA ALA A 114 9.516 -3.805 6.964 1.00 0.00 C ATOM 1758 C ALA A 114 8.703 -5.054 7.272 1.00 0.00 C ATOM 1759 O ALA A 114 7.763 -5.010 8.061 1.00 0.00 O ATOM 1760 CB ALA A 114 9.028 -3.173 5.666 1.00 0.00 C ATOM 0 H ALA A 114 11.372 -3.813 5.990 1.00 0.00 H new ATOM 0 HA ALA A 114 9.371 -3.107 7.789 1.00 0.00 H new ATOM 0 HB1 ALA A 114 7.960 -2.966 5.741 1.00 0.00 H new ATOM 0 HB2 ALA A 114 9.566 -2.242 5.490 1.00 0.00 H new ATOM 0 HB3 ALA A 114 9.208 -3.858 4.838 1.00 0.00 H new ATOM 1766 N LEU A 115 9.089 -6.170 6.678 1.00 0.00 N ATOM 1767 CA LEU A 115 8.326 -7.403 6.815 1.00 0.00 C ATOM 1768 C LEU A 115 8.492 -7.985 8.221 1.00 0.00 C ATOM 1769 O LEU A 115 7.722 -8.851 8.642 1.00 0.00 O ATOM 1770 CB LEU A 115 8.757 -8.402 5.734 1.00 0.00 C ATOM 1771 CG LEU A 115 7.626 -9.208 5.075 1.00 0.00 C ATOM 1772 CD1 LEU A 115 7.199 -10.375 5.946 1.00 0.00 C ATOM 1773 CD2 LEU A 115 6.425 -8.316 4.784 1.00 0.00 C ATOM 0 H LEU A 115 9.924 -6.250 6.097 1.00 0.00 H new ATOM 0 HA LEU A 115 7.266 -7.188 6.676 1.00 0.00 H new ATOM 0 HB2 LEU A 115 9.290 -7.857 4.955 1.00 0.00 H new ATOM 0 HB3 LEU A 115 9.466 -9.102 6.176 1.00 0.00 H new ATOM 0 HG LEU A 115 8.012 -9.602 4.135 1.00 0.00 H new ATOM 0 HD11 LEU A 115 6.398 -10.924 5.451 1.00 0.00 H new ATOM 0 HD12 LEU A 115 8.048 -11.039 6.107 1.00 0.00 H new ATOM 0 HD13 LEU A 115 6.843 -10.001 6.906 1.00 0.00 H new ATOM 0 HD21 LEU A 115 5.637 -8.907 4.318 1.00 0.00 H new ATOM 0 HD22 LEU A 115 6.055 -7.889 5.716 1.00 0.00 H new ATOM 0 HD23 LEU A 115 6.723 -7.513 4.110 1.00 0.00 H new ATOM 1785 N GLN A 116 9.480 -7.486 8.958 1.00 0.00 N ATOM 1786 CA GLN A 116 9.690 -7.912 10.336 1.00 0.00 C ATOM 1787 C GLN A 116 8.850 -7.073 11.290 1.00 0.00 C ATOM 1788 O GLN A 116 8.766 -7.365 12.485 1.00 0.00 O ATOM 1789 CB GLN A 116 11.163 -7.806 10.719 1.00 0.00 C ATOM 1790 CG GLN A 116 12.078 -8.643 9.842 1.00 0.00 C ATOM 1791 CD GLN A 116 13.500 -8.691 10.359 1.00 0.00 C ATOM 1792 OE1 GLN A 116 14.330 -7.855 10.012 1.00 0.00 O ATOM 1793 NE2 GLN A 116 13.789 -9.674 11.198 1.00 0.00 N ATOM 0 H GLN A 116 10.145 -6.788 8.625 1.00 0.00 H new ATOM 0 HA GLN A 116 9.382 -8.955 10.414 1.00 0.00 H new ATOM 0 HB2 GLN A 116 11.471 -6.762 10.660 1.00 0.00 H new ATOM 0 HB3 GLN A 116 11.284 -8.116 11.757 1.00 0.00 H new ATOM 0 HG2 GLN A 116 11.685 -9.658 9.778 1.00 0.00 H new ATOM 0 HG3 GLN A 116 12.077 -8.236 8.831 1.00 0.00 H new ATOM 0 HE21 GLN A 116 13.070 -10.348 11.461 1.00 0.00 H new ATOM 0 HE22 GLN A 116 14.731 -9.757 11.581 1.00 0.00 H new ATOM 1802 N TYR A 117 8.226 -6.035 10.756 1.00 0.00 N ATOM 1803 CA TYR A 117 7.342 -5.194 11.542 1.00 0.00 C ATOM 1804 C TYR A 117 5.960 -5.826 11.598 1.00 0.00 C ATOM 1805 O TYR A 117 5.643 -6.688 10.777 1.00 0.00 O ATOM 1806 CB TYR A 117 7.244 -3.788 10.938 1.00 0.00 C ATOM 1807 CG TYR A 117 8.375 -2.867 11.325 1.00 0.00 C ATOM 1808 CD1 TYR A 117 9.642 -3.020 10.785 1.00 0.00 C ATOM 1809 CD2 TYR A 117 8.166 -1.834 12.229 1.00 0.00 C ATOM 1810 CE1 TYR A 117 10.673 -2.172 11.139 1.00 0.00 C ATOM 1811 CE2 TYR A 117 9.189 -0.984 12.586 1.00 0.00 C ATOM 1812 CZ TYR A 117 10.440 -1.156 12.040 1.00 0.00 C ATOM 1813 OH TYR A 117 11.462 -0.309 12.399 1.00 0.00 O ATOM 0 H TYR A 117 8.317 -5.756 9.779 1.00 0.00 H new ATOM 0 HA TYR A 117 7.750 -5.106 12.549 1.00 0.00 H new ATOM 0 HB2 TYR A 117 7.215 -3.873 9.852 1.00 0.00 H new ATOM 0 HB3 TYR A 117 6.301 -3.337 11.248 1.00 0.00 H new ATOM 0 HD1 TYR A 117 9.826 -3.814 10.077 1.00 0.00 H new ATOM 0 HD2 TYR A 117 7.185 -1.695 12.659 1.00 0.00 H new ATOM 0 HE1 TYR A 117 11.656 -2.304 10.712 1.00 0.00 H new ATOM 0 HE2 TYR A 117 9.010 -0.186 13.291 1.00 0.00 H new ATOM 0 HH TYR A 117 11.129 0.351 13.042 1.00 0.00 H new ATOM 1823 N PRO A 118 5.123 -5.432 12.567 1.00 0.00 N ATOM 1824 CA PRO A 118 3.744 -5.907 12.638 1.00 0.00 C ATOM 1825 C PRO A 118 2.897 -5.306 11.522 1.00 0.00 C ATOM 1826 O PRO A 118 2.124 -4.376 11.741 1.00 0.00 O ATOM 1827 CB PRO A 118 3.266 -5.434 14.013 1.00 0.00 C ATOM 1828 CG PRO A 118 4.122 -4.257 14.332 1.00 0.00 C ATOM 1829 CD PRO A 118 5.452 -4.508 13.670 1.00 0.00 C ATOM 0 HA PRO A 118 3.664 -6.987 12.514 1.00 0.00 H new ATOM 0 HB2 PRO A 118 2.211 -5.161 13.992 1.00 0.00 H new ATOM 0 HB3 PRO A 118 3.378 -6.218 14.762 1.00 0.00 H new ATOM 0 HG2 PRO A 118 3.671 -3.337 13.961 1.00 0.00 H new ATOM 0 HG3 PRO A 118 4.240 -4.143 15.410 1.00 0.00 H new ATOM 0 HD2 PRO A 118 5.896 -3.584 13.300 1.00 0.00 H new ATOM 0 HD3 PRO A 118 6.168 -4.950 14.363 1.00 0.00 H new ATOM 1837 N LEU A 119 3.088 -5.817 10.317 1.00 0.00 N ATOM 1838 CA LEU A 119 2.363 -5.342 9.149 1.00 0.00 C ATOM 1839 C LEU A 119 0.977 -5.966 9.086 1.00 0.00 C ATOM 1840 O LEU A 119 0.746 -7.053 9.626 1.00 0.00 O ATOM 1841 CB LEU A 119 3.133 -5.666 7.863 1.00 0.00 C ATOM 1842 CG LEU A 119 4.455 -4.915 7.664 1.00 0.00 C ATOM 1843 CD1 LEU A 119 5.095 -5.324 6.346 1.00 0.00 C ATOM 1844 CD2 LEU A 119 4.230 -3.412 7.697 1.00 0.00 C ATOM 0 H LEU A 119 3.747 -6.570 10.121 1.00 0.00 H new ATOM 0 HA LEU A 119 2.261 -4.260 9.237 1.00 0.00 H new ATOM 0 HB2 LEU A 119 3.340 -6.736 7.847 1.00 0.00 H new ATOM 0 HB3 LEU A 119 2.486 -5.454 7.012 1.00 0.00 H new ATOM 0 HG LEU A 119 5.128 -5.178 8.480 1.00 0.00 H new ATOM 0 HD11 LEU A 119 6.033 -4.785 6.214 1.00 0.00 H new ATOM 0 HD12 LEU A 119 5.291 -6.396 6.354 1.00 0.00 H new ATOM 0 HD13 LEU A 119 4.420 -5.084 5.524 1.00 0.00 H new ATOM 0 HD21 LEU A 119 5.181 -2.899 7.554 1.00 0.00 H new ATOM 0 HD22 LEU A 119 3.542 -3.130 6.900 1.00 0.00 H new ATOM 0 HD23 LEU A 119 3.806 -3.129 8.660 1.00 0.00 H new ATOM 1856 N ALA A 120 0.052 -5.261 8.449 1.00 0.00 N ATOM 1857 CA ALA A 120 -1.293 -5.775 8.234 1.00 0.00 C ATOM 1858 C ALA A 120 -1.244 -7.070 7.421 1.00 0.00 C ATOM 1859 O ALA A 120 -0.363 -7.245 6.582 1.00 0.00 O ATOM 1860 CB ALA A 120 -2.145 -4.729 7.529 1.00 0.00 C ATOM 0 H ALA A 120 0.210 -4.327 8.071 1.00 0.00 H new ATOM 0 HA ALA A 120 -1.745 -5.996 9.201 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -3.149 -5.123 7.373 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -2.199 -3.830 8.143 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -1.697 -4.484 6.566 1.00 0.00 H new ATOM 1866 N PRO A 121 -2.192 -7.994 7.656 1.00 0.00 N ATOM 1867 CA PRO A 121 -2.214 -9.302 6.985 1.00 0.00 C ATOM 1868 C PRO A 121 -2.207 -9.197 5.459 1.00 0.00 C ATOM 1869 O PRO A 121 -1.725 -10.094 4.771 1.00 0.00 O ATOM 1870 CB PRO A 121 -3.521 -9.946 7.469 1.00 0.00 C ATOM 1871 CG PRO A 121 -4.310 -8.839 8.083 1.00 0.00 C ATOM 1872 CD PRO A 121 -3.307 -7.854 8.605 1.00 0.00 C ATOM 0 HA PRO A 121 -1.322 -9.880 7.227 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -4.064 -10.402 6.641 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -3.324 -10.736 8.194 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -4.967 -8.374 7.348 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -4.945 -9.212 8.887 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -3.704 -6.839 8.616 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -3.002 -8.088 9.625 1.00 0.00 H new ATOM 1880 N ALA A 122 -2.730 -8.094 4.936 1.00 0.00 N ATOM 1881 CA ALA A 122 -2.787 -7.883 3.495 1.00 0.00 C ATOM 1882 C ALA A 122 -1.559 -7.126 2.998 1.00 0.00 C ATOM 1883 O ALA A 122 -1.254 -7.141 1.808 1.00 0.00 O ATOM 1884 CB ALA A 122 -4.057 -7.134 3.123 1.00 0.00 C ATOM 0 H ALA A 122 -3.121 -7.331 5.489 1.00 0.00 H new ATOM 0 HA ALA A 122 -2.797 -8.860 3.011 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -4.087 -6.983 2.044 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -4.926 -7.715 3.433 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -4.069 -6.167 3.625 1.00 0.00 H new ATOM 1890 N ASP A 123 -0.853 -6.489 3.922 1.00 0.00 N ATOM 1891 CA ASP A 123 0.323 -5.685 3.586 1.00 0.00 C ATOM 1892 C ASP A 123 1.532 -6.589 3.376 1.00 0.00 C ATOM 1893 O ASP A 123 2.418 -6.298 2.569 1.00 0.00 O ATOM 1894 CB ASP A 123 0.610 -4.691 4.716 1.00 0.00 C ATOM 1895 CG ASP A 123 1.636 -3.636 4.344 1.00 0.00 C ATOM 1896 OD1 ASP A 123 2.842 -3.889 4.523 1.00 0.00 O ATOM 1897 OD2 ASP A 123 1.228 -2.543 3.899 1.00 0.00 O ATOM 0 H ASP A 123 -1.073 -6.512 4.918 1.00 0.00 H new ATOM 0 HA ASP A 123 0.126 -5.137 2.665 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -0.320 -4.199 5.002 1.00 0.00 H new ATOM 0 HB3 ASP A 123 0.963 -5.238 5.590 1.00 0.00 H new ATOM 1902 N ILE A 124 1.517 -7.725 4.064 1.00 0.00 N ATOM 1903 CA ILE A 124 2.650 -8.645 4.076 1.00 0.00 C ATOM 1904 C ILE A 124 2.931 -9.221 2.680 1.00 0.00 C ATOM 1905 O ILE A 124 4.034 -9.049 2.162 1.00 0.00 O ATOM 1906 CB ILE A 124 2.429 -9.795 5.089 1.00 0.00 C ATOM 1907 CG1 ILE A 124 2.247 -9.225 6.500 1.00 0.00 C ATOM 1908 CG2 ILE A 124 3.594 -10.776 5.054 1.00 0.00 C ATOM 1909 CD1 ILE A 124 1.929 -10.275 7.543 1.00 0.00 C ATOM 0 H ILE A 124 0.724 -8.034 4.627 1.00 0.00 H new ATOM 0 HA ILE A 124 3.521 -8.068 4.387 1.00 0.00 H new ATOM 0 HB ILE A 124 1.524 -10.335 4.810 1.00 0.00 H new ATOM 0 HG12 ILE A 124 3.157 -8.700 6.791 1.00 0.00 H new ATOM 0 HG13 ILE A 124 1.445 -8.487 6.484 1.00 0.00 H new ATOM 0 HG21 ILE A 124 3.418 -11.576 5.773 1.00 0.00 H new ATOM 0 HG22 ILE A 124 3.682 -11.200 4.054 1.00 0.00 H new ATOM 0 HG23 ILE A 124 4.516 -10.255 5.310 1.00 0.00 H new ATOM 0 HD11 ILE A 124 1.814 -9.798 8.516 1.00 0.00 H new ATOM 0 HD12 ILE A 124 1.003 -10.784 7.276 1.00 0.00 H new ATOM 0 HD13 ILE A 124 2.741 -11.000 7.588 1.00 0.00 H new ATOM 1921 N PRO A 125 1.945 -9.895 2.035 1.00 0.00 N ATOM 1922 CA PRO A 125 2.136 -10.493 0.701 1.00 0.00 C ATOM 1923 C PRO A 125 2.554 -9.470 -0.352 1.00 0.00 C ATOM 1924 O PRO A 125 3.216 -9.805 -1.334 1.00 0.00 O ATOM 1925 CB PRO A 125 0.757 -11.069 0.357 1.00 0.00 C ATOM 1926 CG PRO A 125 -0.192 -10.387 1.279 1.00 0.00 C ATOM 1927 CD PRO A 125 0.580 -10.140 2.537 1.00 0.00 C ATOM 0 HA PRO A 125 2.935 -11.234 0.711 1.00 0.00 H new ATOM 0 HB2 PRO A 125 0.499 -10.878 -0.685 1.00 0.00 H new ATOM 0 HB3 PRO A 125 0.735 -12.150 0.498 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -0.552 -9.452 0.850 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -1.067 -11.008 1.471 1.00 0.00 H new ATOM 0 HD2 PRO A 125 0.192 -9.284 3.089 1.00 0.00 H new ATOM 0 HD3 PRO A 125 0.543 -10.997 3.210 1.00 0.00 H new ATOM 1935 N LEU A 126 2.165 -8.222 -0.139 1.00 0.00 N ATOM 1936 CA LEU A 126 2.510 -7.149 -1.056 1.00 0.00 C ATOM 1937 C LEU A 126 3.980 -6.785 -0.912 1.00 0.00 C ATOM 1938 O LEU A 126 4.669 -6.537 -1.902 1.00 0.00 O ATOM 1939 CB LEU A 126 1.631 -5.923 -0.798 1.00 0.00 C ATOM 1940 CG LEU A 126 0.135 -6.136 -1.028 1.00 0.00 C ATOM 1941 CD1 LEU A 126 -0.646 -4.881 -0.667 1.00 0.00 C ATOM 1942 CD2 LEU A 126 -0.131 -6.530 -2.471 1.00 0.00 C ATOM 0 H LEU A 126 1.609 -7.928 0.664 1.00 0.00 H new ATOM 0 HA LEU A 126 2.334 -7.493 -2.075 1.00 0.00 H new ATOM 0 HB2 LEU A 126 1.782 -5.598 0.231 1.00 0.00 H new ATOM 0 HB3 LEU A 126 1.969 -5.111 -1.442 1.00 0.00 H new ATOM 0 HG LEU A 126 -0.199 -6.947 -0.381 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -1.709 -5.052 -0.837 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -0.481 -4.639 0.383 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -0.308 -4.051 -1.288 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -1.201 -6.678 -2.617 1.00 0.00 H new ATOM 0 HD22 LEU A 126 0.220 -5.740 -3.135 1.00 0.00 H new ATOM 0 HD23 LEU A 126 0.397 -7.456 -2.699 1.00 0.00 H new ATOM 1954 N LEU A 127 4.464 -6.788 0.321 1.00 0.00 N ATOM 1955 CA LEU A 127 5.851 -6.448 0.587 1.00 0.00 C ATOM 1956 C LEU A 127 6.750 -7.617 0.206 1.00 0.00 C ATOM 1957 O LEU A 127 7.844 -7.416 -0.325 1.00 0.00 O ATOM 1958 CB LEU A 127 6.042 -6.062 2.062 1.00 0.00 C ATOM 1959 CG LEU A 127 7.392 -5.418 2.430 1.00 0.00 C ATOM 1960 CD1 LEU A 127 8.504 -6.452 2.512 1.00 0.00 C ATOM 1961 CD2 LEU A 127 7.753 -4.336 1.425 1.00 0.00 C ATOM 0 H LEU A 127 3.918 -7.022 1.150 1.00 0.00 H new ATOM 0 HA LEU A 127 6.127 -5.585 -0.019 1.00 0.00 H new ATOM 0 HB2 LEU A 127 5.246 -5.371 2.341 1.00 0.00 H new ATOM 0 HB3 LEU A 127 5.913 -6.958 2.669 1.00 0.00 H new ATOM 0 HG LEU A 127 7.284 -4.967 3.417 1.00 0.00 H new ATOM 0 HD11 LEU A 127 9.440 -5.959 2.774 1.00 0.00 H new ATOM 0 HD12 LEU A 127 8.258 -7.192 3.274 1.00 0.00 H new ATOM 0 HD13 LEU A 127 8.612 -6.947 1.547 1.00 0.00 H new ATOM 0 HD21 LEU A 127 8.709 -3.890 1.698 1.00 0.00 H new ATOM 0 HD22 LEU A 127 7.828 -4.774 0.430 1.00 0.00 H new ATOM 0 HD23 LEU A 127 6.981 -3.567 1.425 1.00 0.00 H new ATOM 1973 N GLU A 128 6.284 -8.839 0.455 1.00 0.00 N ATOM 1974 CA GLU A 128 7.053 -10.029 0.117 1.00 0.00 C ATOM 1975 C GLU A 128 7.404 -10.052 -1.366 1.00 0.00 C ATOM 1976 O GLU A 128 8.523 -10.397 -1.737 1.00 0.00 O ATOM 1977 CB GLU A 128 6.290 -11.299 0.490 1.00 0.00 C ATOM 1978 CG GLU A 128 5.981 -11.407 1.971 1.00 0.00 C ATOM 1979 CD GLU A 128 5.545 -12.799 2.372 1.00 0.00 C ATOM 1980 OE1 GLU A 128 6.420 -13.680 2.505 1.00 0.00 O ATOM 1981 OE2 GLU A 128 4.335 -13.022 2.566 1.00 0.00 O ATOM 0 H GLU A 128 5.380 -9.028 0.888 1.00 0.00 H new ATOM 0 HA GLU A 128 7.978 -9.995 0.693 1.00 0.00 H new ATOM 0 HB2 GLU A 128 5.356 -11.330 -0.071 1.00 0.00 H new ATOM 0 HB3 GLU A 128 6.874 -12.167 0.185 1.00 0.00 H new ATOM 0 HG2 GLU A 128 6.865 -11.127 2.545 1.00 0.00 H new ATOM 0 HG3 GLU A 128 5.196 -10.696 2.228 1.00 0.00 H new ATOM 1988 N ALA A 129 6.462 -9.664 -2.218 1.00 0.00 N ATOM 1989 CA ALA A 129 6.734 -9.620 -3.648 1.00 0.00 C ATOM 1990 C ALA A 129 7.555 -8.397 -4.015 1.00 0.00 C ATOM 1991 O ALA A 129 8.271 -8.405 -5.014 1.00 0.00 O ATOM 1992 CB ALA A 129 5.462 -9.645 -4.464 1.00 0.00 C ATOM 0 H ALA A 129 5.520 -9.380 -1.950 1.00 0.00 H new ATOM 0 HA ALA A 129 7.309 -10.515 -3.884 1.00 0.00 H new ATOM 0 HB1 ALA A 129 5.710 -9.611 -5.525 1.00 0.00 H new ATOM 0 HB2 ALA A 129 4.910 -10.560 -4.250 1.00 0.00 H new ATOM 0 HB3 ALA A 129 4.848 -8.782 -4.207 1.00 0.00 H new ATOM 1998 N PHE A 130 7.461 -7.347 -3.210 1.00 0.00 N ATOM 1999 CA PHE A 130 8.252 -6.151 -3.443 1.00 0.00 C ATOM 2000 C PHE A 130 9.719 -6.460 -3.202 1.00 0.00 C ATOM 2001 O PHE A 130 10.585 -6.100 -3.999 1.00 0.00 O ATOM 2002 CB PHE A 130 7.790 -5.017 -2.525 1.00 0.00 C ATOM 2003 CG PHE A 130 8.550 -3.735 -2.708 1.00 0.00 C ATOM 2004 CD1 PHE A 130 8.278 -2.903 -3.780 1.00 0.00 C ATOM 2005 CD2 PHE A 130 9.529 -3.357 -1.805 1.00 0.00 C ATOM 2006 CE1 PHE A 130 8.963 -1.718 -3.948 1.00 0.00 C ATOM 2007 CE2 PHE A 130 10.220 -2.173 -1.968 1.00 0.00 C ATOM 2008 CZ PHE A 130 9.935 -1.353 -3.041 1.00 0.00 C ATOM 0 H PHE A 130 6.849 -7.301 -2.396 1.00 0.00 H new ATOM 0 HA PHE A 130 8.117 -5.830 -4.476 1.00 0.00 H new ATOM 0 HB2 PHE A 130 6.731 -4.828 -2.702 1.00 0.00 H new ATOM 0 HB3 PHE A 130 7.887 -5.340 -1.488 1.00 0.00 H new ATOM 0 HD1 PHE A 130 7.519 -3.186 -4.495 1.00 0.00 H new ATOM 0 HD2 PHE A 130 9.755 -3.995 -0.964 1.00 0.00 H new ATOM 0 HE1 PHE A 130 8.739 -1.077 -4.788 1.00 0.00 H new ATOM 0 HE2 PHE A 130 10.982 -1.889 -1.257 1.00 0.00 H new ATOM 0 HZ PHE A 130 10.473 -0.426 -3.170 1.00 0.00 H new ATOM 2018 N MET A 131 9.988 -7.147 -2.100 1.00 0.00 N ATOM 2019 CA MET A 131 11.342 -7.565 -1.793 1.00 0.00 C ATOM 2020 C MET A 131 11.779 -8.667 -2.754 1.00 0.00 C ATOM 2021 O MET A 131 12.944 -8.717 -3.143 1.00 0.00 O ATOM 2022 CB MET A 131 11.476 -8.017 -0.328 1.00 0.00 C ATOM 2023 CG MET A 131 10.713 -9.287 0.016 1.00 0.00 C ATOM 2024 SD MET A 131 10.811 -9.703 1.770 1.00 0.00 S ATOM 2025 CE MET A 131 12.577 -9.938 1.968 1.00 0.00 C ATOM 0 H MET A 131 9.289 -7.423 -1.410 1.00 0.00 H new ATOM 0 HA MET A 131 12.002 -6.708 -1.923 1.00 0.00 H new ATOM 0 HB2 MET A 131 12.532 -8.171 -0.104 1.00 0.00 H new ATOM 0 HB3 MET A 131 11.127 -7.213 0.320 1.00 0.00 H new ATOM 0 HG2 MET A 131 9.667 -9.166 -0.267 1.00 0.00 H new ATOM 0 HG3 MET A 131 11.109 -10.115 -0.573 1.00 0.00 H new ATOM 0 HE1 MET A 131 12.769 -10.498 2.883 1.00 0.00 H new ATOM 0 HE2 MET A 131 12.968 -10.492 1.115 1.00 0.00 H new ATOM 0 HE3 MET A 131 13.069 -8.967 2.027 1.00 0.00 H new ATOM 2035 N ALA A 132 10.848 -9.542 -3.153 1.00 0.00 N ATOM 2036 CA ALA A 132 11.122 -10.565 -4.157 1.00 0.00 C ATOM 2037 C ALA A 132 11.577 -9.950 -5.472 1.00 0.00 C ATOM 2038 O ALA A 132 12.621 -10.314 -6.014 1.00 0.00 O ATOM 2039 CB ALA A 132 9.866 -11.406 -4.391 1.00 0.00 C ATOM 0 H ALA A 132 9.895 -9.558 -2.791 1.00 0.00 H new ATOM 0 HA ALA A 132 11.928 -11.196 -3.783 1.00 0.00 H new ATOM 0 HB1 ALA A 132 10.074 -12.169 -5.141 1.00 0.00 H new ATOM 0 HB2 ALA A 132 9.570 -11.885 -3.458 1.00 0.00 H new ATOM 0 HB3 ALA A 132 9.058 -10.764 -4.741 1.00 0.00 H new ATOM 2045 N LEU A 133 10.807 -8.988 -5.955 1.00 0.00 N ATOM 2046 CA LEU A 133 11.034 -8.399 -7.266 1.00 0.00 C ATOM 2047 C LEU A 133 12.356 -7.649 -7.325 1.00 0.00 C ATOM 2048 O LEU A 133 12.953 -7.515 -8.388 1.00 0.00 O ATOM 2049 CB LEU A 133 9.893 -7.447 -7.618 1.00 0.00 C ATOM 2050 CG LEU A 133 9.083 -7.831 -8.857 1.00 0.00 C ATOM 2051 CD1 LEU A 133 8.426 -9.192 -8.669 1.00 0.00 C ATOM 2052 CD2 LEU A 133 8.038 -6.769 -9.157 1.00 0.00 C ATOM 0 H LEU A 133 10.011 -8.595 -5.453 1.00 0.00 H new ATOM 0 HA LEU A 133 11.073 -9.214 -7.989 1.00 0.00 H new ATOM 0 HB2 LEU A 133 9.216 -7.386 -6.766 1.00 0.00 H new ATOM 0 HB3 LEU A 133 10.307 -6.450 -7.769 1.00 0.00 H new ATOM 0 HG LEU A 133 9.763 -7.896 -9.706 1.00 0.00 H new ATOM 0 HD11 LEU A 133 7.855 -9.447 -9.562 1.00 0.00 H new ATOM 0 HD12 LEU A 133 9.194 -9.947 -8.502 1.00 0.00 H new ATOM 0 HD13 LEU A 133 7.758 -9.158 -7.808 1.00 0.00 H new ATOM 0 HD21 LEU A 133 7.470 -7.057 -10.042 1.00 0.00 H new ATOM 0 HD22 LEU A 133 7.362 -6.673 -8.307 1.00 0.00 H new ATOM 0 HD23 LEU A 133 8.531 -5.814 -9.338 1.00 0.00 H new ATOM 2064 N ARG A 134 12.813 -7.167 -6.187 1.00 0.00 N ATOM 2065 CA ARG A 134 14.041 -6.390 -6.141 1.00 0.00 C ATOM 2066 C ARG A 134 15.254 -7.269 -5.847 1.00 0.00 C ATOM 2067 O ARG A 134 16.386 -6.904 -6.171 1.00 0.00 O ATOM 2068 CB ARG A 134 13.918 -5.281 -5.103 1.00 0.00 C ATOM 2069 CG ARG A 134 12.782 -4.321 -5.403 1.00 0.00 C ATOM 2070 CD ARG A 134 12.676 -3.233 -4.353 1.00 0.00 C ATOM 2071 NE ARG A 134 13.832 -2.339 -4.357 1.00 0.00 N ATOM 2072 CZ ARG A 134 13.735 -1.016 -4.272 1.00 0.00 C ATOM 2073 NH1 ARG A 134 12.550 -0.435 -4.385 1.00 0.00 N ATOM 2074 NH2 ARG A 134 14.820 -0.266 -4.141 1.00 0.00 N ATOM 0 H ARG A 134 12.357 -7.297 -5.284 1.00 0.00 H new ATOM 0 HA ARG A 134 14.194 -5.944 -7.124 1.00 0.00 H new ATOM 0 HB2 ARG A 134 13.763 -5.725 -4.120 1.00 0.00 H new ATOM 0 HB3 ARG A 134 14.855 -4.726 -5.058 1.00 0.00 H new ATOM 0 HG2 ARG A 134 12.937 -3.868 -6.382 1.00 0.00 H new ATOM 0 HG3 ARG A 134 11.843 -4.872 -5.452 1.00 0.00 H new ATOM 0 HD2 ARG A 134 11.770 -2.652 -4.526 1.00 0.00 H new ATOM 0 HD3 ARG A 134 12.578 -3.691 -3.369 1.00 0.00 H new ATOM 0 HE ARG A 134 14.762 -2.752 -4.429 1.00 0.00 H new ATOM 0 HH11 ARG A 134 11.716 -1.003 -4.537 1.00 0.00 H new ATOM 0 HH12 ARG A 134 12.471 0.580 -4.320 1.00 0.00 H new ATOM 0 HH21 ARG A 134 15.741 -0.703 -4.105 1.00 0.00 H new ATOM 0 HH22 ARG A 134 14.734 0.748 -4.077 1.00 0.00 H new ATOM 2088 N ALA A 135 15.020 -8.430 -5.248 1.00 0.00 N ATOM 2089 CA ALA A 135 16.107 -9.349 -4.919 1.00 0.00 C ATOM 2090 C ALA A 135 16.349 -10.332 -6.058 1.00 0.00 C ATOM 2091 O ALA A 135 17.491 -10.669 -6.373 1.00 0.00 O ATOM 2092 CB ALA A 135 15.799 -10.095 -3.629 1.00 0.00 C ATOM 0 H ALA A 135 14.092 -8.758 -4.980 1.00 0.00 H new ATOM 0 HA ALA A 135 17.016 -8.765 -4.775 1.00 0.00 H new ATOM 0 HB1 ALA A 135 16.618 -10.776 -3.398 1.00 0.00 H new ATOM 0 HB2 ALA A 135 15.680 -9.380 -2.815 1.00 0.00 H new ATOM 0 HB3 ALA A 135 14.877 -10.664 -3.749 1.00 0.00 H new ATOM 2098 N ALA A 136 15.269 -10.770 -6.684 1.00 0.00 N ATOM 2099 CA ALA A 136 15.357 -11.712 -7.792 1.00 0.00 C ATOM 2100 C ALA A 136 15.390 -10.965 -9.119 1.00 0.00 C ATOM 2101 O ALA A 136 15.874 -11.489 -10.121 1.00 0.00 O ATOM 2102 CB ALA A 136 14.189 -12.687 -7.756 1.00 0.00 C ATOM 0 H ALA A 136 14.318 -10.489 -6.444 1.00 0.00 H new ATOM 0 HA ALA A 136 16.281 -12.281 -7.692 1.00 0.00 H new ATOM 0 HB1 ALA A 136 14.270 -13.383 -8.591 1.00 0.00 H new ATOM 0 HB2 ALA A 136 14.207 -13.241 -6.818 1.00 0.00 H new ATOM 0 HB3 ALA A 136 13.252 -12.135 -7.834 1.00 0.00 H new ATOM 2108 N ARG A 137 14.893 -9.726 -9.085 1.00 0.00 N ATOM 2109 CA ARG A 137 14.765 -8.852 -10.260 1.00 0.00 C ATOM 2110 C ARG A 137 14.281 -9.606 -11.508 1.00 0.00 C ATOM 2111 O ARG A 137 15.017 -9.771 -12.486 1.00 0.00 O ATOM 2112 CB ARG A 137 16.067 -8.070 -10.529 1.00 0.00 C ATOM 2113 CG ARG A 137 17.293 -8.921 -10.822 1.00 0.00 C ATOM 2114 CD ARG A 137 18.531 -8.060 -10.993 1.00 0.00 C ATOM 2115 NE ARG A 137 19.661 -8.812 -11.534 1.00 0.00 N ATOM 2116 CZ ARG A 137 20.930 -8.422 -11.428 1.00 0.00 C ATOM 2117 NH1 ARG A 137 21.237 -7.362 -10.688 1.00 0.00 N ATOM 2118 NH2 ARG A 137 21.890 -9.109 -12.037 1.00 0.00 N ATOM 0 H ARG A 137 14.561 -9.291 -8.224 1.00 0.00 H new ATOM 0 HA ARG A 137 13.989 -8.124 -10.024 1.00 0.00 H new ATOM 0 HB2 ARG A 137 15.901 -7.401 -11.373 1.00 0.00 H new ATOM 0 HB3 ARG A 137 16.280 -7.444 -9.663 1.00 0.00 H new ATOM 0 HG2 ARG A 137 17.449 -9.630 -10.009 1.00 0.00 H new ATOM 0 HG3 ARG A 137 17.125 -9.505 -11.727 1.00 0.00 H new ATOM 0 HD2 ARG A 137 18.302 -7.226 -11.657 1.00 0.00 H new ATOM 0 HD3 ARG A 137 18.810 -7.633 -10.029 1.00 0.00 H new ATOM 0 HE ARG A 137 19.467 -9.687 -12.021 1.00 0.00 H new ATOM 0 HH11 ARG A 137 20.501 -6.849 -10.202 1.00 0.00 H new ATOM 0 HH12 ARG A 137 22.208 -7.062 -10.605 1.00 0.00 H new ATOM 0 HH21 ARG A 137 21.655 -9.936 -12.586 1.00 0.00 H new ATOM 0 HH22 ARG A 137 22.862 -8.810 -11.955 1.00 0.00 H new ATOM 2132 N PRO A 138 13.022 -10.082 -11.482 1.00 0.00 N ATOM 2133 CA PRO A 138 12.435 -10.811 -12.595 1.00 0.00 C ATOM 2134 C PRO A 138 11.767 -9.889 -13.611 1.00 0.00 C ATOM 2135 O PRO A 138 11.056 -8.950 -13.245 1.00 0.00 O ATOM 2136 CB PRO A 138 11.398 -11.690 -11.906 1.00 0.00 C ATOM 2137 CG PRO A 138 10.945 -10.895 -10.725 1.00 0.00 C ATOM 2138 CD PRO A 138 12.072 -9.954 -10.363 1.00 0.00 C ATOM 0 HA PRO A 138 13.179 -11.362 -13.170 1.00 0.00 H new ATOM 0 HB2 PRO A 138 10.566 -11.916 -12.573 1.00 0.00 H new ATOM 0 HB3 PRO A 138 11.829 -12.643 -11.599 1.00 0.00 H new ATOM 0 HG2 PRO A 138 10.039 -10.337 -10.961 1.00 0.00 H new ATOM 0 HG3 PRO A 138 10.707 -11.551 -9.888 1.00 0.00 H new ATOM 0 HD2 PRO A 138 11.717 -8.929 -10.257 1.00 0.00 H new ATOM 0 HD3 PRO A 138 12.533 -10.231 -9.415 1.00 0.00 H new ATOM 2146 N ALA A 139 12.002 -10.160 -14.885 1.00 0.00 N ATOM 2147 CA ALA A 139 11.381 -9.406 -15.958 1.00 0.00 C ATOM 2148 C ALA A 139 9.931 -9.836 -16.116 1.00 0.00 C ATOM 2149 O ALA A 139 9.650 -10.998 -16.413 1.00 0.00 O ATOM 2150 CB ALA A 139 12.140 -9.604 -17.261 1.00 0.00 C ATOM 0 H ALA A 139 12.624 -10.904 -15.201 1.00 0.00 H new ATOM 0 HA ALA A 139 11.411 -8.346 -15.707 1.00 0.00 H new ATOM 0 HB1 ALA A 139 11.659 -9.031 -18.053 1.00 0.00 H new ATOM 0 HB2 ALA A 139 13.168 -9.262 -17.139 1.00 0.00 H new ATOM 0 HB3 ALA A 139 12.138 -10.661 -17.526 1.00 0.00 H new ATOM 2156 N ASP A 140 9.024 -8.901 -15.891 1.00 0.00 N ATOM 2157 CA ASP A 140 7.592 -9.172 -15.963 1.00 0.00 C ATOM 2158 C ASP A 140 7.183 -9.613 -17.362 1.00 0.00 C ATOM 2159 O ASP A 140 6.672 -10.747 -17.502 1.00 0.00 O ATOM 2160 CB ASP A 140 6.788 -7.941 -15.551 1.00 0.00 C ATOM 2161 CG ASP A 140 5.300 -8.220 -15.529 1.00 0.00 C ATOM 2162 OD1 ASP A 140 4.849 -8.960 -14.627 1.00 0.00 O ATOM 2163 OD2 ASP A 140 4.571 -7.698 -16.399 1.00 0.00 O ATOM 2164 OXT ASP A 140 7.402 -8.841 -18.317 1.00 0.00 O ATOM 0 H ASP A 140 9.254 -7.936 -15.654 1.00 0.00 H new ATOM 0 HA ASP A 140 7.377 -9.985 -15.269 1.00 0.00 H new ATOM 0 HB2 ASP A 140 7.110 -7.611 -14.563 1.00 0.00 H new ATOM 0 HB3 ASP A 140 6.994 -7.124 -16.243 1.00 0.00 H new TER 2169 ASP A 140