USER MOD reduce.3.24.130724 H: found=0, std=0, add=986, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 988 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 Single : A 1 MET CE :methyl -176:sc= -0.217 (180deg=-0.228) USER MOD Single : A 1 MET N :NH3+ -139:sc= 2.13 (180deg=0.714) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 14 GLN : amide:sc= 0 K(o=0,f=-0.57) USER MOD Single : A 17 THR OG1 : rot 170:sc= -1.2 USER MOD Single : A 26 SER OG : rot 116:sc= 0.0207 USER MOD Single : A 29 SER OG : rot 180:sc= -0.247 USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 HIS : no HD1:sc= -3.8! C(o=-3.8!,f=-8.6!) USER MOD Single : A 38 HIS : no HD1:sc= 1.01 K(o=1,f=-5.6!) USER MOD Single : A 40 SER OG : rot 180:sc= -0.108 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 47 THR OG1 : rot 85:sc= 0.272 USER MOD Single : A 52 HIS : no HE2:sc= -4.81! C(o=-4.8!,f=-4!) USER MOD Single : A 57 LYS NZ :NH3+ 166:sc= -0.0144 (180deg=-0.233) USER MOD Single : A 65 ASN : amide:sc= 0.0182 K(o=0.018,f=-4.9!) USER MOD Single : A 77 GLN : amide:sc= 0 X(o=0,f=-0.013) USER MOD Single : A 81 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0246) USER MOD Single : A 85 MET CE :methyl -152:sc= -0.218 (180deg=-0.856) USER MOD Single : A 91 GLN : amide:sc= -1.56! K(o=-1.6!,f=-0.069) USER MOD Single : A 94 MET CE :methyl -137:sc= -0.0324 (180deg=-2.74!) USER MOD Single : A 100 THR OG1 : rot -21:sc= 1.26 USER MOD Single : A 102 GLN : amide:sc= 0 X(o=0,f=-0.064) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 HIS : no HE2:sc= -0.623 K(o=0.42,f=-9.5!) USER MOD Single : A 131 LYS NZ :NH3+ 169:sc= -0.016 (180deg=-0.168) USER MOD Single : A 133 ASN : amide:sc= -0.486 K(o=-0.49,f=-1.8) USER MOD Single : A 143 THR OG1 : rot -77:sc= 1.17 USER MOD Single : A 149 HIS : no HD1:sc= -2.09 K(o=-2.1,f=-0.83) USER MOD Single : A 151 HIS : no HD1:sc= -0.344 X(o=-0.34,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 11.407 -18.613 8.013 1.00 0.00 N ATOM 2 CA MET A 1 11.208 -19.072 6.623 1.00 0.00 C ATOM 3 C MET A 1 10.993 -17.868 5.716 1.00 0.00 C ATOM 4 O MET A 1 10.281 -16.927 6.069 1.00 0.00 O ATOM 5 CB MET A 1 10.003 -20.019 6.521 1.00 0.00 C ATOM 6 CG MET A 1 8.668 -19.306 6.630 1.00 0.00 C ATOM 7 SD MET A 1 8.392 -18.604 8.268 1.00 0.00 S ATOM 8 CE MET A 1 7.189 -17.338 7.883 1.00 0.00 C ATOM 0 H1 MET A 1 12.163 -19.171 8.458 1.00 0.00 H new ATOM 0 H2 MET A 1 11.674 -17.608 8.012 1.00 0.00 H new ATOM 0 H3 MET A 1 10.524 -18.736 8.549 1.00 0.00 H new ATOM 0 HA MET A 1 12.098 -19.618 6.309 1.00 0.00 H new ATOM 0 HB2 MET A 1 10.047 -20.550 5.570 1.00 0.00 H new ATOM 0 HB3 MET A 1 10.072 -20.769 7.309 1.00 0.00 H new ATOM 0 HG2 MET A 1 8.622 -18.511 5.885 1.00 0.00 H new ATOM 0 HG3 MET A 1 7.866 -20.006 6.398 1.00 0.00 H new ATOM 0 HE1 MET A 1 6.966 -16.763 8.782 1.00 0.00 H new ATOM 0 HE2 MET A 1 7.591 -16.674 7.118 1.00 0.00 H new ATOM 0 HE3 MET A 1 6.275 -17.804 7.515 1.00 0.00 H new ATOM 20 N LYS A 2 11.595 -17.901 4.548 1.00 0.00 N ATOM 21 CA LYS A 2 11.547 -16.765 3.645 1.00 0.00 C ATOM 22 C LYS A 2 10.717 -17.064 2.409 1.00 0.00 C ATOM 23 O LYS A 2 10.319 -18.202 2.162 1.00 0.00 O ATOM 24 CB LYS A 2 12.955 -16.337 3.232 1.00 0.00 C ATOM 25 CG LYS A 2 13.841 -17.489 2.784 1.00 0.00 C ATOM 26 CD LYS A 2 15.174 -17.000 2.254 1.00 0.00 C ATOM 27 CE LYS A 2 15.842 -16.081 3.255 1.00 0.00 C ATOM 28 NZ LYS A 2 17.261 -15.807 2.913 1.00 0.00 N ATOM 0 H LYS A 2 12.124 -18.700 4.198 1.00 0.00 H new ATOM 0 HA LYS A 2 11.070 -15.947 4.186 1.00 0.00 H new ATOM 0 HB2 LYS A 2 12.881 -15.612 2.422 1.00 0.00 H new ATOM 0 HB3 LYS A 2 13.431 -15.830 4.071 1.00 0.00 H new ATOM 0 HG2 LYS A 2 14.009 -18.166 3.622 1.00 0.00 H new ATOM 0 HG3 LYS A 2 13.330 -18.061 2.010 1.00 0.00 H new ATOM 0 HD2 LYS A 2 15.822 -17.851 2.045 1.00 0.00 H new ATOM 0 HD3 LYS A 2 15.025 -16.473 1.311 1.00 0.00 H new ATOM 0 HE2 LYS A 2 15.294 -15.140 3.302 1.00 0.00 H new ATOM 0 HE3 LYS A 2 15.790 -16.530 4.247 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 17.674 -15.174 3.627 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 17.792 -16.701 2.894 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 17.312 -15.354 1.978 1.00 0.00 H new ATOM 42 N VAL A 3 10.477 -16.018 1.644 1.00 0.00 N ATOM 43 CA VAL A 3 9.665 -16.083 0.443 1.00 0.00 C ATOM 44 C VAL A 3 10.494 -16.525 -0.759 1.00 0.00 C ATOM 45 O VAL A 3 11.589 -16.004 -1.004 1.00 0.00 O ATOM 46 CB VAL A 3 9.042 -14.707 0.159 1.00 0.00 C ATOM 47 CG1 VAL A 3 10.083 -13.634 0.363 1.00 0.00 C ATOM 48 CG2 VAL A 3 8.473 -14.627 -1.250 1.00 0.00 C ATOM 0 H VAL A 3 10.844 -15.087 1.840 1.00 0.00 H new ATOM 0 HA VAL A 3 8.877 -16.818 0.607 1.00 0.00 H new ATOM 0 HB VAL A 3 8.215 -14.556 0.853 1.00 0.00 H new ATOM 0 HG11 VAL A 3 9.643 -12.657 0.162 1.00 0.00 H new ATOM 0 HG12 VAL A 3 10.441 -13.666 1.392 1.00 0.00 H new ATOM 0 HG13 VAL A 3 10.918 -13.803 -0.317 1.00 0.00 H new ATOM 0 HG21 VAL A 3 8.042 -13.639 -1.413 1.00 0.00 H new ATOM 0 HG22 VAL A 3 9.269 -14.799 -1.974 1.00 0.00 H new ATOM 0 HG23 VAL A 3 7.700 -15.385 -1.374 1.00 0.00 H new ATOM 58 N ALA A 4 9.969 -17.485 -1.499 1.00 0.00 N ATOM 59 CA ALA A 4 10.593 -17.942 -2.724 1.00 0.00 C ATOM 60 C ALA A 4 9.522 -18.389 -3.703 1.00 0.00 C ATOM 61 O ALA A 4 8.330 -18.215 -3.446 1.00 0.00 O ATOM 62 CB ALA A 4 11.581 -19.069 -2.449 1.00 0.00 C ATOM 0 H ALA A 4 9.101 -17.967 -1.267 1.00 0.00 H new ATOM 0 HA ALA A 4 11.154 -17.116 -3.162 1.00 0.00 H new ATOM 0 HB1 ALA A 4 12.034 -19.392 -3.386 1.00 0.00 H new ATOM 0 HB2 ALA A 4 12.359 -18.714 -1.773 1.00 0.00 H new ATOM 0 HB3 ALA A 4 11.057 -19.908 -1.991 1.00 0.00 H new ATOM 68 N LYS A 5 9.941 -18.946 -4.825 1.00 0.00 N ATOM 69 CA LYS A 5 9.016 -19.452 -5.815 1.00 0.00 C ATOM 70 C LYS A 5 8.246 -20.646 -5.244 1.00 0.00 C ATOM 71 O LYS A 5 8.730 -21.322 -4.330 1.00 0.00 O ATOM 72 CB LYS A 5 9.793 -19.845 -7.069 1.00 0.00 C ATOM 73 CG LYS A 5 8.925 -20.097 -8.277 1.00 0.00 C ATOM 74 CD LYS A 5 9.767 -20.458 -9.486 1.00 0.00 C ATOM 75 CE LYS A 5 8.949 -20.459 -10.764 1.00 0.00 C ATOM 76 NZ LYS A 5 9.783 -20.782 -11.951 1.00 0.00 N ATOM 0 H LYS A 5 10.924 -19.058 -5.072 1.00 0.00 H new ATOM 0 HA LYS A 5 8.292 -18.681 -6.080 1.00 0.00 H new ATOM 0 HB2 LYS A 5 10.505 -19.054 -7.305 1.00 0.00 H new ATOM 0 HB3 LYS A 5 10.373 -20.743 -6.858 1.00 0.00 H new ATOM 0 HG2 LYS A 5 8.224 -20.904 -8.064 1.00 0.00 H new ATOM 0 HG3 LYS A 5 8.332 -19.209 -8.495 1.00 0.00 H new ATOM 0 HD2 LYS A 5 10.589 -19.748 -9.581 1.00 0.00 H new ATOM 0 HD3 LYS A 5 10.211 -21.442 -9.338 1.00 0.00 H new ATOM 0 HE2 LYS A 5 8.141 -21.186 -10.678 1.00 0.00 H new ATOM 0 HE3 LYS A 5 8.486 -19.482 -10.900 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 9.190 -20.773 -12.805 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 10.539 -20.074 -12.047 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 10.205 -21.725 -11.832 1.00 0.00 H new ATOM 90 N ASP A 6 7.060 -20.900 -5.799 1.00 0.00 N ATOM 91 CA ASP A 6 6.144 -21.937 -5.318 1.00 0.00 C ATOM 92 C ASP A 6 5.685 -21.732 -3.862 1.00 0.00 C ATOM 93 O ASP A 6 4.858 -22.489 -3.358 1.00 0.00 O ATOM 94 CB ASP A 6 6.773 -23.326 -5.489 1.00 0.00 C ATOM 95 CG ASP A 6 6.981 -23.699 -6.946 1.00 0.00 C ATOM 96 OD1 ASP A 6 5.988 -24.021 -7.629 1.00 0.00 O ATOM 97 OD2 ASP A 6 8.138 -23.672 -7.420 1.00 0.00 O ATOM 0 H ASP A 6 6.704 -20.386 -6.605 1.00 0.00 H new ATOM 0 HA ASP A 6 5.247 -21.859 -5.933 1.00 0.00 H new ATOM 0 HB2 ASP A 6 7.732 -23.353 -4.971 1.00 0.00 H new ATOM 0 HB3 ASP A 6 6.134 -24.071 -5.015 1.00 0.00 H new ATOM 102 N LEU A 7 6.222 -20.738 -3.177 1.00 0.00 N ATOM 103 CA LEU A 7 5.812 -20.485 -1.804 1.00 0.00 C ATOM 104 C LEU A 7 4.651 -19.507 -1.742 1.00 0.00 C ATOM 105 O LEU A 7 4.796 -18.325 -2.060 1.00 0.00 O ATOM 106 CB LEU A 7 6.988 -19.980 -0.962 1.00 0.00 C ATOM 107 CG LEU A 7 8.196 -20.919 -0.906 1.00 0.00 C ATOM 108 CD1 LEU A 7 9.142 -20.502 0.204 1.00 0.00 C ATOM 109 CD2 LEU A 7 7.755 -22.359 -0.708 1.00 0.00 C ATOM 0 H LEU A 7 6.932 -20.101 -3.540 1.00 0.00 H new ATOM 0 HA LEU A 7 5.474 -21.433 -1.385 1.00 0.00 H new ATOM 0 HB2 LEU A 7 7.313 -19.018 -1.359 1.00 0.00 H new ATOM 0 HB3 LEU A 7 6.637 -19.803 0.055 1.00 0.00 H new ATOM 0 HG LEU A 7 8.722 -20.850 -1.858 1.00 0.00 H new ATOM 0 HD11 LEU A 7 9.995 -21.180 0.229 1.00 0.00 H new ATOM 0 HD12 LEU A 7 9.492 -19.486 0.021 1.00 0.00 H new ATOM 0 HD13 LEU A 7 8.620 -20.540 1.160 1.00 0.00 H new ATOM 0 HD21 LEU A 7 8.631 -23.006 -0.672 1.00 0.00 H new ATOM 0 HD22 LEU A 7 7.201 -22.445 0.227 1.00 0.00 H new ATOM 0 HD23 LEU A 7 7.115 -22.661 -1.537 1.00 0.00 H new ATOM 121 N VAL A 8 3.485 -20.027 -1.375 1.00 0.00 N ATOM 122 CA VAL A 8 2.315 -19.203 -1.126 1.00 0.00 C ATOM 123 C VAL A 8 2.611 -18.194 -0.014 1.00 0.00 C ATOM 124 O VAL A 8 3.326 -18.490 0.943 1.00 0.00 O ATOM 125 CB VAL A 8 1.091 -20.077 -0.761 1.00 0.00 C ATOM 126 CG1 VAL A 8 1.389 -20.942 0.449 1.00 0.00 C ATOM 127 CG2 VAL A 8 -0.147 -19.224 -0.523 1.00 0.00 C ATOM 0 H VAL A 8 3.328 -21.026 -1.243 1.00 0.00 H new ATOM 0 HA VAL A 8 2.075 -18.658 -2.039 1.00 0.00 H new ATOM 0 HB VAL A 8 0.886 -20.732 -1.608 1.00 0.00 H new ATOM 0 HG11 VAL A 8 0.515 -21.548 0.687 1.00 0.00 H new ATOM 0 HG12 VAL A 8 2.234 -21.595 0.230 1.00 0.00 H new ATOM 0 HG13 VAL A 8 1.633 -20.306 1.300 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -0.989 -19.868 -0.269 1.00 0.00 H new ATOM 0 HG22 VAL A 8 0.041 -18.531 0.297 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -0.380 -18.661 -1.427 1.00 0.00 H new ATOM 137 N VAL A 9 2.053 -17.010 -0.143 1.00 0.00 N ATOM 138 CA VAL A 9 2.447 -15.896 0.689 1.00 0.00 C ATOM 139 C VAL A 9 1.288 -14.924 0.880 1.00 0.00 C ATOM 140 O VAL A 9 0.546 -14.631 -0.059 1.00 0.00 O ATOM 141 CB VAL A 9 3.662 -15.184 0.036 1.00 0.00 C ATOM 142 CG1 VAL A 9 3.717 -13.724 0.402 1.00 0.00 C ATOM 143 CG2 VAL A 9 4.967 -15.866 0.419 1.00 0.00 C ATOM 0 H VAL A 9 1.321 -16.794 -0.820 1.00 0.00 H new ATOM 0 HA VAL A 9 2.730 -16.264 1.675 1.00 0.00 H new ATOM 0 HB VAL A 9 3.530 -15.258 -1.044 1.00 0.00 H new ATOM 0 HG11 VAL A 9 4.581 -13.262 -0.075 1.00 0.00 H new ATOM 0 HG12 VAL A 9 2.807 -13.229 0.062 1.00 0.00 H new ATOM 0 HG13 VAL A 9 3.802 -13.623 1.484 1.00 0.00 H new ATOM 0 HG21 VAL A 9 5.801 -15.346 -0.052 1.00 0.00 H new ATOM 0 HG22 VAL A 9 5.088 -15.838 1.502 1.00 0.00 H new ATOM 0 HG23 VAL A 9 4.948 -16.903 0.082 1.00 0.00 H new ATOM 153 N SER A 10 1.134 -14.450 2.106 1.00 0.00 N ATOM 154 CA SER A 10 0.153 -13.440 2.415 1.00 0.00 C ATOM 155 C SER A 10 0.887 -12.118 2.541 1.00 0.00 C ATOM 156 O SER A 10 1.819 -11.999 3.340 1.00 0.00 O ATOM 157 CB SER A 10 -0.565 -13.780 3.720 1.00 0.00 C ATOM 158 OG SER A 10 -1.010 -15.125 3.721 1.00 0.00 O ATOM 0 H SER A 10 1.686 -14.757 2.907 1.00 0.00 H new ATOM 0 HA SER A 10 -0.601 -13.384 1.630 1.00 0.00 H new ATOM 0 HB2 SER A 10 0.107 -13.615 4.562 1.00 0.00 H new ATOM 0 HB3 SER A 10 -1.416 -13.112 3.856 1.00 0.00 H new ATOM 0 HG SER A 10 -1.465 -15.318 4.567 1.00 0.00 H new ATOM 164 N LEU A 11 0.514 -11.150 1.732 1.00 0.00 N ATOM 165 CA LEU A 11 1.233 -9.890 1.707 1.00 0.00 C ATOM 166 C LEU A 11 0.279 -8.707 1.656 1.00 0.00 C ATOM 167 O LEU A 11 -0.838 -8.825 1.176 1.00 0.00 O ATOM 168 CB LEU A 11 2.177 -9.878 0.510 1.00 0.00 C ATOM 169 CG LEU A 11 3.094 -8.668 0.406 1.00 0.00 C ATOM 170 CD1 LEU A 11 4.528 -9.122 0.209 1.00 0.00 C ATOM 171 CD2 LEU A 11 2.652 -7.771 -0.739 1.00 0.00 C ATOM 0 H LEU A 11 -0.275 -11.207 1.088 1.00 0.00 H new ATOM 0 HA LEU A 11 1.811 -9.795 2.626 1.00 0.00 H new ATOM 0 HB2 LEU A 11 2.794 -10.776 0.548 1.00 0.00 H new ATOM 0 HB3 LEU A 11 1.581 -9.939 -0.400 1.00 0.00 H new ATOM 0 HG LEU A 11 3.035 -8.095 1.331 1.00 0.00 H new ATOM 0 HD11 LEU A 11 5.179 -8.251 0.135 1.00 0.00 H new ATOM 0 HD12 LEU A 11 4.836 -9.734 1.057 1.00 0.00 H new ATOM 0 HD13 LEU A 11 4.601 -9.708 -0.707 1.00 0.00 H new ATOM 0 HD21 LEU A 11 3.316 -6.909 -0.803 1.00 0.00 H new ATOM 0 HD22 LEU A 11 2.691 -8.329 -1.674 1.00 0.00 H new ATOM 0 HD23 LEU A 11 1.632 -7.431 -0.562 1.00 0.00 H new ATOM 183 N ALA A 12 0.735 -7.567 2.144 1.00 0.00 N ATOM 184 CA ALA A 12 -0.048 -6.352 2.127 1.00 0.00 C ATOM 185 C ALA A 12 0.776 -5.299 1.414 1.00 0.00 C ATOM 186 O ALA A 12 2.006 -5.368 1.435 1.00 0.00 O ATOM 187 CB ALA A 12 -0.396 -5.911 3.542 1.00 0.00 C ATOM 0 H ALA A 12 1.659 -7.461 2.563 1.00 0.00 H new ATOM 0 HA ALA A 12 -0.993 -6.511 1.608 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -0.985 -4.995 3.503 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -0.973 -6.693 4.035 1.00 0.00 H new ATOM 0 HB3 ALA A 12 0.521 -5.729 4.102 1.00 0.00 H new ATOM 193 N TYR A 13 0.138 -4.345 0.771 1.00 0.00 N ATOM 194 CA TYR A 13 0.878 -3.378 -0.017 1.00 0.00 C ATOM 195 C TYR A 13 0.018 -2.175 -0.350 1.00 0.00 C ATOM 196 O TYR A 13 -1.206 -2.239 -0.288 1.00 0.00 O ATOM 197 CB TYR A 13 1.400 -4.025 -1.314 1.00 0.00 C ATOM 198 CG TYR A 13 0.316 -4.416 -2.306 1.00 0.00 C ATOM 199 CD1 TYR A 13 -0.359 -5.632 -2.201 1.00 0.00 C ATOM 200 CD2 TYR A 13 -0.024 -3.566 -3.353 1.00 0.00 C ATOM 201 CE1 TYR A 13 -1.339 -5.984 -3.109 1.00 0.00 C ATOM 202 CE2 TYR A 13 -1.004 -3.912 -4.263 1.00 0.00 C ATOM 203 CZ TYR A 13 -1.658 -5.120 -4.138 1.00 0.00 C ATOM 204 OH TYR A 13 -2.630 -5.467 -5.047 1.00 0.00 O ATOM 0 H TYR A 13 -0.874 -4.217 0.776 1.00 0.00 H new ATOM 0 HA TYR A 13 1.727 -3.041 0.578 1.00 0.00 H new ATOM 0 HB2 TYR A 13 2.086 -3.331 -1.800 1.00 0.00 H new ATOM 0 HB3 TYR A 13 1.975 -4.914 -1.055 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -0.112 -6.309 -1.397 1.00 0.00 H new ATOM 0 HD2 TYR A 13 0.487 -2.620 -3.456 1.00 0.00 H new ATOM 0 HE1 TYR A 13 -1.853 -6.929 -3.015 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -1.257 -3.239 -5.069 1.00 0.00 H new ATOM 0 HH TYR A 13 -2.733 -4.749 -5.706 1.00 0.00 H new ATOM 214 N GLN A 14 0.669 -1.088 -0.717 1.00 0.00 N ATOM 215 CA GLN A 14 -0.025 0.103 -1.159 1.00 0.00 C ATOM 216 C GLN A 14 0.618 0.587 -2.443 1.00 0.00 C ATOM 217 O GLN A 14 1.803 0.901 -2.456 1.00 0.00 O ATOM 218 CB GLN A 14 0.035 1.200 -0.095 1.00 0.00 C ATOM 219 CG GLN A 14 -0.931 2.338 -0.372 1.00 0.00 C ATOM 220 CD GLN A 14 -0.809 3.482 0.612 1.00 0.00 C ATOM 221 OE1 GLN A 14 0.266 3.757 1.142 1.00 0.00 O ATOM 222 NE2 GLN A 14 -1.919 4.154 0.857 1.00 0.00 N ATOM 0 H GLN A 14 1.686 -1.007 -0.717 1.00 0.00 H new ATOM 0 HA GLN A 14 -1.075 -0.135 -1.330 1.00 0.00 H new ATOM 0 HB2 GLN A 14 -0.189 0.767 0.880 1.00 0.00 H new ATOM 0 HB3 GLN A 14 1.050 1.595 -0.043 1.00 0.00 H new ATOM 0 HG2 GLN A 14 -0.757 2.715 -1.380 1.00 0.00 H new ATOM 0 HG3 GLN A 14 -1.951 1.954 -0.347 1.00 0.00 H new ATOM 0 HE21 GLN A 14 -2.788 3.889 0.393 1.00 0.00 H new ATOM 0 HE22 GLN A 14 -1.907 4.938 1.510 1.00 0.00 H new ATOM 231 N VAL A 15 -0.149 0.629 -3.517 1.00 0.00 N ATOM 232 CA VAL A 15 0.395 1.001 -4.810 1.00 0.00 C ATOM 233 C VAL A 15 -0.121 2.362 -5.259 1.00 0.00 C ATOM 234 O VAL A 15 -1.328 2.597 -5.347 1.00 0.00 O ATOM 235 CB VAL A 15 0.103 -0.070 -5.891 1.00 0.00 C ATOM 236 CG1 VAL A 15 -1.361 -0.449 -5.927 1.00 0.00 C ATOM 237 CG2 VAL A 15 0.554 0.406 -7.257 1.00 0.00 C ATOM 0 H VAL A 15 -1.146 0.411 -3.520 1.00 0.00 H new ATOM 0 HA VAL A 15 1.476 1.066 -4.688 1.00 0.00 H new ATOM 0 HB VAL A 15 0.671 -0.960 -5.622 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -1.523 -1.202 -6.698 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -1.656 -0.852 -4.958 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -1.960 0.434 -6.150 1.00 0.00 H new ATOM 0 HG21 VAL A 15 0.339 -0.362 -7.999 1.00 0.00 H new ATOM 0 HG22 VAL A 15 0.022 1.321 -7.517 1.00 0.00 H new ATOM 0 HG23 VAL A 15 1.626 0.602 -7.238 1.00 0.00 H new ATOM 247 N ARG A 16 0.805 3.256 -5.548 1.00 0.00 N ATOM 248 CA ARG A 16 0.472 4.595 -5.990 1.00 0.00 C ATOM 249 C ARG A 16 1.522 5.041 -6.993 1.00 0.00 C ATOM 250 O ARG A 16 2.439 4.287 -7.295 1.00 0.00 O ATOM 251 CB ARG A 16 0.397 5.555 -4.793 1.00 0.00 C ATOM 252 CG ARG A 16 1.725 5.795 -4.084 1.00 0.00 C ATOM 253 CD ARG A 16 1.508 6.456 -2.730 1.00 0.00 C ATOM 254 NE ARG A 16 2.760 6.879 -2.104 1.00 0.00 N ATOM 255 CZ ARG A 16 3.122 6.555 -0.859 1.00 0.00 C ATOM 256 NH1 ARG A 16 2.343 5.787 -0.104 1.00 0.00 N ATOM 257 NH2 ARG A 16 4.271 6.997 -0.367 1.00 0.00 N ATOM 0 H ARG A 16 1.807 3.075 -5.483 1.00 0.00 H new ATOM 0 HA ARG A 16 -0.508 4.601 -6.466 1.00 0.00 H new ATOM 0 HB2 ARG A 16 0.006 6.513 -5.137 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -0.318 5.159 -4.072 1.00 0.00 H new ATOM 0 HG2 ARG A 16 2.247 4.847 -3.951 1.00 0.00 H new ATOM 0 HG3 ARG A 16 2.363 6.426 -4.703 1.00 0.00 H new ATOM 0 HD2 ARG A 16 0.857 7.321 -2.852 1.00 0.00 H new ATOM 0 HD3 ARG A 16 0.992 5.760 -2.068 1.00 0.00 H new ATOM 0 HE ARG A 16 3.397 7.458 -2.652 1.00 0.00 H new ATOM 0 HH11 ARG A 16 1.458 5.438 -0.473 1.00 0.00 H new ATOM 0 HH12 ARG A 16 2.630 5.546 0.845 1.00 0.00 H new ATOM 0 HH21 ARG A 16 4.878 7.584 -0.939 1.00 0.00 H new ATOM 0 HH22 ARG A 16 4.548 6.750 0.583 1.00 0.00 H new ATOM 271 N THR A 17 1.395 6.241 -7.511 1.00 0.00 N ATOM 272 CA THR A 17 2.377 6.742 -8.455 1.00 0.00 C ATOM 273 C THR A 17 3.353 7.670 -7.755 1.00 0.00 C ATOM 274 O THR A 17 3.177 7.985 -6.577 1.00 0.00 O ATOM 275 CB THR A 17 1.731 7.491 -9.636 1.00 0.00 C ATOM 276 OG1 THR A 17 0.870 8.521 -9.140 1.00 0.00 O ATOM 277 CG2 THR A 17 0.948 6.542 -10.531 1.00 0.00 C ATOM 0 H THR A 17 0.632 6.885 -7.300 1.00 0.00 H new ATOM 0 HA THR A 17 2.900 5.873 -8.854 1.00 0.00 H new ATOM 0 HB THR A 17 2.526 7.936 -10.235 1.00 0.00 H new ATOM 0 HG1 THR A 17 0.588 9.097 -9.881 1.00 0.00 H new ATOM 0 HG21 THR A 17 0.505 7.101 -11.355 1.00 0.00 H new ATOM 0 HG22 THR A 17 1.619 5.781 -10.929 1.00 0.00 H new ATOM 0 HG23 THR A 17 0.159 6.063 -9.951 1.00 0.00 H new ATOM 285 N GLU A 18 4.369 8.112 -8.476 1.00 0.00 N ATOM 286 CA GLU A 18 5.319 9.073 -7.939 1.00 0.00 C ATOM 287 C GLU A 18 4.630 10.410 -7.669 1.00 0.00 C ATOM 288 O GLU A 18 5.108 11.228 -6.882 1.00 0.00 O ATOM 289 CB GLU A 18 6.483 9.249 -8.907 1.00 0.00 C ATOM 290 CG GLU A 18 7.214 7.949 -9.185 1.00 0.00 C ATOM 291 CD GLU A 18 8.331 8.110 -10.195 1.00 0.00 C ATOM 292 OE1 GLU A 18 8.059 8.072 -11.410 1.00 0.00 O ATOM 293 OE2 GLU A 18 9.492 8.282 -9.772 1.00 0.00 O ATOM 0 H GLU A 18 4.558 7.821 -9.435 1.00 0.00 H new ATOM 0 HA GLU A 18 5.708 8.696 -6.993 1.00 0.00 H new ATOM 0 HB2 GLU A 18 6.111 9.660 -9.846 1.00 0.00 H new ATOM 0 HB3 GLU A 18 7.185 9.975 -8.497 1.00 0.00 H new ATOM 0 HG2 GLU A 18 7.626 7.562 -8.253 1.00 0.00 H new ATOM 0 HG3 GLU A 18 6.503 7.208 -9.551 1.00 0.00 H new ATOM 300 N ASP A 19 3.478 10.605 -8.304 1.00 0.00 N ATOM 301 CA ASP A 19 2.701 11.827 -8.138 1.00 0.00 C ATOM 302 C ASP A 19 1.929 11.798 -6.818 1.00 0.00 C ATOM 303 O ASP A 19 1.511 12.834 -6.305 1.00 0.00 O ATOM 304 CB ASP A 19 1.736 11.989 -9.317 1.00 0.00 C ATOM 305 CG ASP A 19 0.880 13.235 -9.215 1.00 0.00 C ATOM 306 OD1 ASP A 19 1.400 14.341 -9.477 1.00 0.00 O ATOM 307 OD2 ASP A 19 -0.318 13.111 -8.884 1.00 0.00 O ATOM 0 H ASP A 19 3.061 9.927 -8.942 1.00 0.00 H new ATOM 0 HA ASP A 19 3.382 12.678 -8.115 1.00 0.00 H new ATOM 0 HB2 ASP A 19 2.307 12.022 -10.245 1.00 0.00 H new ATOM 0 HB3 ASP A 19 1.089 11.114 -9.372 1.00 0.00 H new ATOM 312 N GLY A 20 1.765 10.603 -6.260 1.00 0.00 N ATOM 313 CA GLY A 20 1.131 10.473 -4.962 1.00 0.00 C ATOM 314 C GLY A 20 -0.280 9.916 -5.030 1.00 0.00 C ATOM 315 O GLY A 20 -0.849 9.547 -4.003 1.00 0.00 O ATOM 0 H GLY A 20 2.060 9.723 -6.684 1.00 0.00 H new ATOM 0 HA2 GLY A 20 1.740 9.824 -4.333 1.00 0.00 H new ATOM 0 HA3 GLY A 20 1.104 11.450 -4.480 1.00 0.00 H new ATOM 319 N VAL A 21 -0.854 9.848 -6.226 1.00 0.00 N ATOM 320 CA VAL A 21 -2.215 9.343 -6.371 1.00 0.00 C ATOM 321 C VAL A 21 -2.248 7.826 -6.186 1.00 0.00 C ATOM 322 O VAL A 21 -1.490 7.090 -6.821 1.00 0.00 O ATOM 323 CB VAL A 21 -2.856 9.742 -7.728 1.00 0.00 C ATOM 324 CG1 VAL A 21 -2.065 9.199 -8.905 1.00 0.00 C ATOM 325 CG2 VAL A 21 -4.301 9.273 -7.799 1.00 0.00 C ATOM 0 H VAL A 21 -0.407 10.131 -7.098 1.00 0.00 H new ATOM 0 HA VAL A 21 -2.813 9.810 -5.588 1.00 0.00 H new ATOM 0 HB VAL A 21 -2.837 10.830 -7.789 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -2.546 9.500 -9.836 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -1.050 9.596 -8.876 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -2.031 8.111 -8.849 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -4.731 9.563 -8.758 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -4.337 8.188 -7.698 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -4.872 9.731 -6.992 1.00 0.00 H new ATOM 335 N LEU A 22 -3.105 7.377 -5.278 1.00 0.00 N ATOM 336 CA LEU A 22 -3.254 5.959 -4.979 1.00 0.00 C ATOM 337 C LEU A 22 -4.065 5.262 -6.064 1.00 0.00 C ATOM 338 O LEU A 22 -5.164 5.706 -6.409 1.00 0.00 O ATOM 339 CB LEU A 22 -3.946 5.774 -3.623 1.00 0.00 C ATOM 340 CG LEU A 22 -4.142 4.319 -3.189 1.00 0.00 C ATOM 341 CD1 LEU A 22 -2.806 3.663 -2.909 1.00 0.00 C ATOM 342 CD2 LEU A 22 -5.039 4.232 -1.966 1.00 0.00 C ATOM 0 H LEU A 22 -3.715 7.984 -4.730 1.00 0.00 H new ATOM 0 HA LEU A 22 -2.260 5.513 -4.941 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -3.361 6.289 -2.861 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -4.921 6.261 -3.660 1.00 0.00 H new ATOM 0 HG LEU A 22 -4.628 3.787 -4.007 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -2.965 2.629 -2.602 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -2.195 3.683 -3.811 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -2.295 4.204 -2.112 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -5.162 3.188 -1.679 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -4.586 4.784 -1.143 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -6.014 4.662 -2.198 1.00 0.00 H new ATOM 354 N VAL A 23 -3.526 4.176 -6.600 1.00 0.00 N ATOM 355 CA VAL A 23 -4.240 3.406 -7.607 1.00 0.00 C ATOM 356 C VAL A 23 -4.919 2.189 -6.983 1.00 0.00 C ATOM 357 O VAL A 23 -6.012 1.805 -7.408 1.00 0.00 O ATOM 358 CB VAL A 23 -3.328 2.969 -8.779 1.00 0.00 C ATOM 359 CG1 VAL A 23 -2.739 4.185 -9.474 1.00 0.00 C ATOM 360 CG2 VAL A 23 -2.219 2.039 -8.312 1.00 0.00 C ATOM 0 H VAL A 23 -2.605 3.811 -6.357 1.00 0.00 H new ATOM 0 HA VAL A 23 -5.003 4.066 -8.020 1.00 0.00 H new ATOM 0 HB VAL A 23 -3.945 2.418 -9.489 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -2.100 3.861 -10.296 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -3.545 4.807 -9.864 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -2.149 4.761 -8.761 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -1.600 1.754 -9.163 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -1.604 2.550 -7.571 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -2.657 1.146 -7.867 1.00 0.00 H new ATOM 370 N ASP A 24 -4.275 1.587 -5.977 1.00 0.00 N ATOM 371 CA ASP A 24 -4.857 0.448 -5.263 1.00 0.00 C ATOM 372 C ASP A 24 -4.062 0.170 -3.991 1.00 0.00 C ATOM 373 O ASP A 24 -2.977 0.719 -3.808 1.00 0.00 O ATOM 374 CB ASP A 24 -4.825 -0.787 -6.166 1.00 0.00 C ATOM 375 CG ASP A 24 -5.841 -1.844 -5.775 1.00 0.00 C ATOM 376 OD1 ASP A 24 -5.526 -2.708 -4.932 1.00 0.00 O ATOM 377 OD2 ASP A 24 -6.959 -1.827 -6.328 1.00 0.00 O ATOM 0 H ASP A 24 -3.354 1.869 -5.641 1.00 0.00 H new ATOM 0 HA ASP A 24 -5.888 0.680 -4.996 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -5.008 -0.480 -7.196 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -3.827 -1.224 -6.137 1.00 0.00 H new ATOM 382 N GLU A 25 -4.600 -0.649 -3.100 1.00 0.00 N ATOM 383 CA GLU A 25 -3.820 -1.152 -1.981 1.00 0.00 C ATOM 384 C GLU A 25 -4.518 -2.326 -1.306 1.00 0.00 C ATOM 385 O GLU A 25 -5.725 -2.528 -1.452 1.00 0.00 O ATOM 386 CB GLU A 25 -3.507 -0.062 -0.942 1.00 0.00 C ATOM 387 CG GLU A 25 -4.516 0.038 0.196 1.00 0.00 C ATOM 388 CD GLU A 25 -5.731 0.875 -0.145 1.00 0.00 C ATOM 389 OE1 GLU A 25 -6.610 0.388 -0.883 1.00 0.00 O ATOM 390 OE2 GLU A 25 -5.812 2.023 0.336 1.00 0.00 O ATOM 0 H GLU A 25 -5.565 -0.977 -3.129 1.00 0.00 H new ATOM 0 HA GLU A 25 -2.872 -1.492 -2.399 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -2.521 -0.254 -0.520 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -3.455 0.901 -1.450 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -4.842 -0.965 0.471 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -4.024 0.465 1.070 1.00 0.00 H new ATOM 397 N SER A 26 -3.734 -3.100 -0.589 1.00 0.00 N ATOM 398 CA SER A 26 -4.245 -4.141 0.276 1.00 0.00 C ATOM 399 C SER A 26 -3.674 -3.922 1.664 1.00 0.00 C ATOM 400 O SER A 26 -2.462 -4.001 1.863 1.00 0.00 O ATOM 401 CB SER A 26 -3.877 -5.523 -0.261 1.00 0.00 C ATOM 402 OG SER A 26 -4.526 -5.762 -1.498 1.00 0.00 O ATOM 0 H SER A 26 -2.717 -3.025 -0.589 1.00 0.00 H new ATOM 0 HA SER A 26 -5.333 -4.095 0.314 1.00 0.00 H new ATOM 0 HB2 SER A 26 -2.797 -5.594 -0.390 1.00 0.00 H new ATOM 0 HB3 SER A 26 -4.163 -6.288 0.461 1.00 0.00 H new ATOM 0 HG SER A 26 -3.855 -5.858 -2.206 1.00 0.00 H new ATOM 408 N PRO A 27 -4.541 -3.608 2.633 1.00 0.00 N ATOM 409 CA PRO A 27 -4.118 -3.179 3.966 1.00 0.00 C ATOM 410 C PRO A 27 -3.454 -4.288 4.771 1.00 0.00 C ATOM 411 O PRO A 27 -3.541 -5.466 4.435 1.00 0.00 O ATOM 412 CB PRO A 27 -5.430 -2.779 4.634 1.00 0.00 C ATOM 413 CG PRO A 27 -6.449 -3.615 3.951 1.00 0.00 C ATOM 414 CD PRO A 27 -6.010 -3.666 2.518 1.00 0.00 C ATOM 0 HA PRO A 27 -3.373 -2.386 3.908 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -5.408 -2.973 5.706 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -5.635 -1.716 4.507 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -6.496 -4.614 4.385 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -7.444 -3.180 4.044 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -6.343 -4.579 2.024 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -6.406 -2.829 1.942 1.00 0.00 H new ATOM 422 N VAL A 28 -2.803 -3.890 5.851 1.00 0.00 N ATOM 423 CA VAL A 28 -2.191 -4.830 6.783 1.00 0.00 C ATOM 424 C VAL A 28 -3.268 -5.648 7.502 1.00 0.00 C ATOM 425 O VAL A 28 -3.016 -6.753 7.985 1.00 0.00 O ATOM 426 CB VAL A 28 -1.324 -4.080 7.820 1.00 0.00 C ATOM 427 CG1 VAL A 28 -2.163 -3.075 8.602 1.00 0.00 C ATOM 428 CG2 VAL A 28 -0.635 -5.055 8.762 1.00 0.00 C ATOM 0 H VAL A 28 -2.682 -2.910 6.108 1.00 0.00 H new ATOM 0 HA VAL A 28 -1.553 -5.506 6.214 1.00 0.00 H new ATOM 0 HB VAL A 28 -0.552 -3.532 7.279 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -1.532 -2.559 9.326 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -2.595 -2.348 7.914 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -2.963 -3.598 9.126 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -0.032 -4.501 9.481 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -1.386 -5.640 9.293 1.00 0.00 H new ATOM 0 HG23 VAL A 28 0.007 -5.723 8.188 1.00 0.00 H new ATOM 438 N SER A 29 -4.473 -5.095 7.549 1.00 0.00 N ATOM 439 CA SER A 29 -5.589 -5.736 8.215 1.00 0.00 C ATOM 440 C SER A 29 -6.071 -6.950 7.423 1.00 0.00 C ATOM 441 O SER A 29 -6.404 -7.989 8.001 1.00 0.00 O ATOM 442 CB SER A 29 -6.709 -4.719 8.407 1.00 0.00 C ATOM 443 OG SER A 29 -6.963 -4.015 7.204 1.00 0.00 O ATOM 0 H SER A 29 -4.699 -4.194 7.128 1.00 0.00 H new ATOM 0 HA SER A 29 -5.268 -6.097 9.192 1.00 0.00 H new ATOM 0 HB2 SER A 29 -7.616 -5.228 8.734 1.00 0.00 H new ATOM 0 HB3 SER A 29 -6.437 -4.016 9.194 1.00 0.00 H new ATOM 0 HG SER A 29 -7.686 -3.369 7.349 1.00 0.00 H new ATOM 449 N ALA A 30 -6.082 -6.826 6.100 1.00 0.00 N ATOM 450 CA ALA A 30 -6.419 -7.943 5.239 1.00 0.00 C ATOM 451 C ALA A 30 -5.440 -8.024 4.079 1.00 0.00 C ATOM 452 O ALA A 30 -5.414 -7.159 3.203 1.00 0.00 O ATOM 453 CB ALA A 30 -7.843 -7.795 4.727 1.00 0.00 C ATOM 0 H ALA A 30 -5.861 -5.962 5.605 1.00 0.00 H new ATOM 0 HA ALA A 30 -6.351 -8.867 5.813 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -8.087 -8.639 4.081 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -8.533 -7.773 5.571 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -7.932 -6.868 4.161 1.00 0.00 H new ATOM 459 N PRO A 31 -4.637 -9.089 4.065 1.00 0.00 N ATOM 460 CA PRO A 31 -3.595 -9.313 3.061 1.00 0.00 C ATOM 461 C PRO A 31 -4.116 -9.775 1.702 1.00 0.00 C ATOM 462 O PRO A 31 -5.273 -10.176 1.549 1.00 0.00 O ATOM 463 CB PRO A 31 -2.725 -10.413 3.687 1.00 0.00 C ATOM 464 CG PRO A 31 -3.192 -10.532 5.097 1.00 0.00 C ATOM 465 CD PRO A 31 -4.638 -10.154 5.068 1.00 0.00 C ATOM 0 HA PRO A 31 -3.072 -8.382 2.842 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -2.841 -11.357 3.154 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -1.668 -10.150 3.644 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -3.058 -11.547 5.471 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -2.626 -9.873 5.755 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -5.275 -10.990 4.779 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -4.991 -9.804 6.038 1.00 0.00 H new ATOM 473 N LEU A 32 -3.219 -9.706 0.731 1.00 0.00 N ATOM 474 CA LEU A 32 -3.407 -10.268 -0.593 1.00 0.00 C ATOM 475 C LEU A 32 -2.991 -11.737 -0.559 1.00 0.00 C ATOM 476 O LEU A 32 -1.940 -12.063 -0.003 1.00 0.00 O ATOM 477 CB LEU A 32 -2.522 -9.497 -1.576 1.00 0.00 C ATOM 478 CG LEU A 32 -2.588 -9.945 -3.031 1.00 0.00 C ATOM 479 CD1 LEU A 32 -3.821 -9.380 -3.713 1.00 0.00 C ATOM 480 CD2 LEU A 32 -1.321 -9.537 -3.762 1.00 0.00 C ATOM 0 H LEU A 32 -2.317 -9.245 0.847 1.00 0.00 H new ATOM 0 HA LEU A 32 -4.449 -10.193 -0.904 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -2.795 -8.443 -1.529 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -1.488 -9.574 -1.240 1.00 0.00 H new ATOM 0 HG LEU A 32 -2.664 -11.032 -3.059 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -3.847 -9.713 -4.751 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -4.715 -9.730 -3.197 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -3.787 -8.291 -3.682 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -1.379 -9.862 -4.801 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -1.214 -8.453 -3.727 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -0.459 -10.003 -3.284 1.00 0.00 H new ATOM 492 N ASP A 33 -3.797 -12.624 -1.135 1.00 0.00 N ATOM 493 CA ASP A 33 -3.487 -14.054 -1.077 1.00 0.00 C ATOM 494 C ASP A 33 -3.295 -14.630 -2.468 1.00 0.00 C ATOM 495 O ASP A 33 -4.236 -14.682 -3.262 1.00 0.00 O ATOM 496 CB ASP A 33 -4.611 -14.833 -0.376 1.00 0.00 C ATOM 497 CG ASP A 33 -4.623 -14.680 1.131 1.00 0.00 C ATOM 498 OD1 ASP A 33 -5.101 -13.639 1.627 1.00 0.00 O ATOM 499 OD2 ASP A 33 -4.191 -15.625 1.831 1.00 0.00 O ATOM 0 H ASP A 33 -4.653 -12.388 -1.638 1.00 0.00 H new ATOM 0 HA ASP A 33 -2.561 -14.156 -0.510 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -5.571 -14.500 -0.772 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -4.514 -15.890 -0.622 1.00 0.00 H new ATOM 504 N TYR A 34 -2.093 -15.134 -2.728 1.00 0.00 N ATOM 505 CA TYR A 34 -1.754 -15.734 -4.018 1.00 0.00 C ATOM 506 C TYR A 34 -0.526 -16.626 -3.877 1.00 0.00 C ATOM 507 O TYR A 34 0.041 -16.755 -2.790 1.00 0.00 O ATOM 508 CB TYR A 34 -1.484 -14.659 -5.083 1.00 0.00 C ATOM 509 CG TYR A 34 -2.730 -14.009 -5.644 1.00 0.00 C ATOM 510 CD1 TYR A 34 -3.510 -14.661 -6.590 1.00 0.00 C ATOM 511 CD2 TYR A 34 -3.126 -12.746 -5.224 1.00 0.00 C ATOM 512 CE1 TYR A 34 -4.652 -14.073 -7.097 1.00 0.00 C ATOM 513 CE2 TYR A 34 -4.264 -12.154 -5.726 1.00 0.00 C ATOM 514 CZ TYR A 34 -5.024 -12.819 -6.661 1.00 0.00 C ATOM 515 OH TYR A 34 -6.165 -12.232 -7.159 1.00 0.00 O ATOM 0 H TYR A 34 -1.327 -15.139 -2.054 1.00 0.00 H new ATOM 0 HA TYR A 34 -2.608 -16.331 -4.339 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -0.850 -13.886 -4.649 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -0.923 -15.109 -5.902 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -3.219 -15.642 -6.934 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -2.532 -12.219 -4.492 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -5.250 -14.592 -7.831 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -4.559 -11.172 -5.387 1.00 0.00 H new ATOM 0 HH TYR A 34 -6.285 -11.350 -6.748 1.00 0.00 H new ATOM 525 N LEU A 35 -0.122 -17.233 -4.983 1.00 0.00 N ATOM 526 CA LEU A 35 1.028 -18.122 -4.998 1.00 0.00 C ATOM 527 C LEU A 35 2.219 -17.435 -5.649 1.00 0.00 C ATOM 528 O LEU A 35 2.173 -17.088 -6.830 1.00 0.00 O ATOM 529 CB LEU A 35 0.691 -19.405 -5.757 1.00 0.00 C ATOM 530 CG LEU A 35 1.841 -20.406 -5.878 1.00 0.00 C ATOM 531 CD1 LEU A 35 2.227 -20.943 -4.510 1.00 0.00 C ATOM 532 CD2 LEU A 35 1.463 -21.540 -6.816 1.00 0.00 C ATOM 0 H LEU A 35 -0.579 -17.124 -5.889 1.00 0.00 H new ATOM 0 HA LEU A 35 1.285 -18.374 -3.969 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -0.146 -19.895 -5.259 1.00 0.00 H new ATOM 0 HB3 LEU A 35 0.354 -19.139 -6.759 1.00 0.00 H new ATOM 0 HG LEU A 35 2.705 -19.891 -6.297 1.00 0.00 H new ATOM 0 HD11 LEU A 35 3.047 -21.654 -4.616 1.00 0.00 H new ATOM 0 HD12 LEU A 35 2.542 -20.118 -3.871 1.00 0.00 H new ATOM 0 HD13 LEU A 35 1.369 -21.443 -4.060 1.00 0.00 H new ATOM 0 HD21 LEU A 35 2.293 -22.243 -6.890 1.00 0.00 H new ATOM 0 HD22 LEU A 35 0.585 -22.056 -6.428 1.00 0.00 H new ATOM 0 HD23 LEU A 35 1.240 -21.136 -7.804 1.00 0.00 H new ATOM 544 N HIS A 36 3.288 -17.253 -4.889 1.00 0.00 N ATOM 545 CA HIS A 36 4.453 -16.548 -5.395 1.00 0.00 C ATOM 546 C HIS A 36 5.187 -17.384 -6.438 1.00 0.00 C ATOM 547 O HIS A 36 5.496 -18.551 -6.201 1.00 0.00 O ATOM 548 CB HIS A 36 5.397 -16.205 -4.242 1.00 0.00 C ATOM 549 CG HIS A 36 6.568 -15.363 -4.646 1.00 0.00 C ATOM 550 ND1 HIS A 36 6.583 -13.994 -4.512 1.00 0.00 N ATOM 551 CD2 HIS A 36 7.767 -15.701 -5.178 1.00 0.00 C ATOM 552 CE1 HIS A 36 7.735 -13.527 -4.946 1.00 0.00 C ATOM 553 NE2 HIS A 36 8.471 -14.539 -5.357 1.00 0.00 N ATOM 0 H HIS A 36 3.372 -17.581 -3.927 1.00 0.00 H new ATOM 0 HA HIS A 36 4.115 -15.627 -5.871 1.00 0.00 H new ATOM 0 HB2 HIS A 36 4.835 -15.681 -3.469 1.00 0.00 H new ATOM 0 HB3 HIS A 36 5.764 -17.131 -3.798 1.00 0.00 H new ATOM 0 HD2 HIS A 36 8.105 -16.699 -5.416 1.00 0.00 H new ATOM 0 HE1 HIS A 36 8.028 -12.488 -4.962 1.00 0.00 H new ATOM 0 HE2 HIS A 36 9.412 -14.469 -5.745 1.00 0.00 H new ATOM 562 N GLY A 37 5.460 -16.790 -7.591 1.00 0.00 N ATOM 563 CA GLY A 37 6.290 -17.460 -8.569 1.00 0.00 C ATOM 564 C GLY A 37 5.508 -18.192 -9.638 1.00 0.00 C ATOM 565 O GLY A 37 6.078 -18.947 -10.419 1.00 0.00 O ATOM 0 H GLY A 37 5.125 -15.866 -7.864 1.00 0.00 H new ATOM 0 HA2 GLY A 37 6.938 -16.725 -9.046 1.00 0.00 H new ATOM 0 HA3 GLY A 37 6.938 -18.171 -8.056 1.00 0.00 H new ATOM 569 N HIS A 38 4.204 -18.000 -9.655 1.00 0.00 N ATOM 570 CA HIS A 38 3.361 -18.546 -10.716 1.00 0.00 C ATOM 571 C HIS A 38 2.421 -17.457 -11.163 1.00 0.00 C ATOM 572 O HIS A 38 1.427 -17.691 -11.852 1.00 0.00 O ATOM 573 CB HIS A 38 2.556 -19.762 -10.236 1.00 0.00 C ATOM 574 CG HIS A 38 3.369 -21.007 -10.054 1.00 0.00 C ATOM 575 ND1 HIS A 38 3.310 -22.075 -10.919 1.00 0.00 N ATOM 576 CD2 HIS A 38 4.246 -21.359 -9.085 1.00 0.00 C ATOM 577 CE1 HIS A 38 4.111 -23.030 -10.492 1.00 0.00 C ATOM 578 NE2 HIS A 38 4.691 -22.621 -9.381 1.00 0.00 N ATOM 0 H HIS A 38 3.698 -17.469 -8.946 1.00 0.00 H new ATOM 0 HA HIS A 38 3.993 -18.883 -11.537 1.00 0.00 H new ATOM 0 HB2 HIS A 38 2.076 -19.514 -9.289 1.00 0.00 H new ATOM 0 HB3 HIS A 38 1.761 -19.963 -10.954 1.00 0.00 H new ATOM 0 HD2 HIS A 38 4.540 -20.758 -8.237 1.00 0.00 H new ATOM 0 HE1 HIS A 38 4.266 -23.986 -10.971 1.00 0.00 H new ATOM 0 HE2 HIS A 38 5.362 -23.157 -8.831 1.00 0.00 H new ATOM 587 N GLY A 39 2.766 -16.256 -10.749 1.00 0.00 N ATOM 588 CA GLY A 39 1.871 -15.160 -10.855 1.00 0.00 C ATOM 589 C GLY A 39 1.200 -14.967 -9.531 1.00 0.00 C ATOM 590 O GLY A 39 0.297 -15.725 -9.165 1.00 0.00 O ATOM 0 H GLY A 39 3.670 -16.029 -10.335 1.00 0.00 H new ATOM 0 HA2 GLY A 39 2.410 -14.257 -11.142 1.00 0.00 H new ATOM 0 HA3 GLY A 39 1.130 -15.349 -11.632 1.00 0.00 H new ATOM 594 N SER A 40 1.639 -13.968 -8.800 1.00 0.00 N ATOM 595 CA SER A 40 1.053 -13.737 -7.495 1.00 0.00 C ATOM 596 C SER A 40 0.394 -12.375 -7.576 1.00 0.00 C ATOM 597 O SER A 40 -0.783 -12.189 -7.271 1.00 0.00 O ATOM 598 CB SER A 40 2.123 -13.747 -6.397 1.00 0.00 C ATOM 599 OG SER A 40 1.551 -13.603 -5.108 1.00 0.00 O ATOM 0 H SER A 40 2.377 -13.319 -9.073 1.00 0.00 H new ATOM 0 HA SER A 40 0.339 -14.521 -7.241 1.00 0.00 H new ATOM 0 HB2 SER A 40 2.684 -14.680 -6.444 1.00 0.00 H new ATOM 0 HB3 SER A 40 2.833 -12.939 -6.573 1.00 0.00 H new ATOM 0 HG SER A 40 2.260 -13.615 -4.432 1.00 0.00 H new ATOM 605 N LEU A 41 1.206 -11.426 -8.017 1.00 0.00 N ATOM 606 CA LEU A 41 0.727 -10.121 -8.410 1.00 0.00 C ATOM 607 C LEU A 41 1.459 -9.617 -9.657 1.00 0.00 C ATOM 608 O LEU A 41 0.960 -9.784 -10.771 1.00 0.00 O ATOM 609 CB LEU A 41 0.809 -9.114 -7.239 1.00 0.00 C ATOM 610 CG LEU A 41 2.091 -9.121 -6.383 1.00 0.00 C ATOM 611 CD1 LEU A 41 2.130 -7.894 -5.506 1.00 0.00 C ATOM 612 CD2 LEU A 41 2.172 -10.340 -5.479 1.00 0.00 C ATOM 0 H LEU A 41 2.215 -11.545 -8.110 1.00 0.00 H new ATOM 0 HA LEU A 41 -0.327 -10.215 -8.672 1.00 0.00 H new ATOM 0 HB2 LEU A 41 0.683 -8.112 -7.648 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -0.038 -9.297 -6.578 1.00 0.00 H new ATOM 0 HG LEU A 41 2.932 -9.139 -7.077 1.00 0.00 H new ATOM 0 HD11 LEU A 41 3.039 -7.906 -4.904 1.00 0.00 H new ATOM 0 HD12 LEU A 41 2.120 -7.000 -6.130 1.00 0.00 H new ATOM 0 HD13 LEU A 41 1.260 -7.888 -4.850 1.00 0.00 H new ATOM 0 HD21 LEU A 41 3.092 -10.300 -4.896 1.00 0.00 H new ATOM 0 HD22 LEU A 41 1.315 -10.351 -4.805 1.00 0.00 H new ATOM 0 HD23 LEU A 41 2.167 -11.245 -6.087 1.00 0.00 H new ATOM 624 N ILE A 42 2.644 -9.035 -9.497 1.00 0.00 N ATOM 625 CA ILE A 42 3.339 -8.447 -10.643 1.00 0.00 C ATOM 626 C ILE A 42 4.735 -9.039 -10.865 1.00 0.00 C ATOM 627 O ILE A 42 5.064 -10.087 -10.323 1.00 0.00 O ATOM 628 CB ILE A 42 3.426 -6.913 -10.519 1.00 0.00 C ATOM 629 CG1 ILE A 42 4.221 -6.503 -9.276 1.00 0.00 C ATOM 630 CG2 ILE A 42 2.026 -6.315 -10.487 1.00 0.00 C ATOM 631 CD1 ILE A 42 4.216 -5.013 -9.030 1.00 0.00 C ATOM 0 H ILE A 42 3.136 -8.957 -8.607 1.00 0.00 H new ATOM 0 HA ILE A 42 2.739 -8.699 -11.518 1.00 0.00 H new ATOM 0 HB ILE A 42 3.955 -6.526 -11.390 1.00 0.00 H new ATOM 0 HG12 ILE A 42 3.807 -7.010 -8.404 1.00 0.00 H new ATOM 0 HG13 ILE A 42 5.251 -6.843 -9.383 1.00 0.00 H new ATOM 0 HG21 ILE A 42 2.095 -5.231 -10.399 1.00 0.00 H new ATOM 0 HG22 ILE A 42 1.500 -6.572 -11.406 1.00 0.00 H new ATOM 0 HG23 ILE A 42 1.479 -6.714 -9.632 1.00 0.00 H new ATOM 0 HD11 ILE A 42 4.797 -4.790 -8.135 1.00 0.00 H new ATOM 0 HD12 ILE A 42 4.657 -4.502 -9.886 1.00 0.00 H new ATOM 0 HD13 ILE A 42 3.190 -4.671 -8.892 1.00 0.00 H new ATOM 643 N SER A 43 5.559 -8.347 -11.649 1.00 0.00 N ATOM 644 CA SER A 43 6.814 -8.952 -12.090 1.00 0.00 C ATOM 645 C SER A 43 7.974 -8.486 -11.205 1.00 0.00 C ATOM 646 O SER A 43 8.730 -9.289 -10.659 1.00 0.00 O ATOM 647 CB SER A 43 7.085 -8.627 -13.564 1.00 0.00 C ATOM 648 OG SER A 43 8.062 -9.497 -14.115 1.00 0.00 O ATOM 0 H SER A 43 5.390 -7.398 -11.983 1.00 0.00 H new ATOM 0 HA SER A 43 6.726 -10.034 -11.995 1.00 0.00 H new ATOM 0 HB2 SER A 43 6.159 -8.711 -14.133 1.00 0.00 H new ATOM 0 HB3 SER A 43 7.423 -7.595 -13.654 1.00 0.00 H new ATOM 0 HG SER A 43 8.212 -9.266 -15.056 1.00 0.00 H new ATOM 654 N GLY A 44 8.054 -7.168 -11.032 1.00 0.00 N ATOM 655 CA GLY A 44 9.184 -6.549 -10.359 1.00 0.00 C ATOM 656 C GLY A 44 9.114 -6.620 -8.849 1.00 0.00 C ATOM 657 O GLY A 44 10.136 -6.766 -8.181 1.00 0.00 O ATOM 0 H GLY A 44 7.344 -6.509 -11.352 1.00 0.00 H new ATOM 0 HA2 GLY A 44 10.102 -7.032 -10.693 1.00 0.00 H new ATOM 0 HA3 GLY A 44 9.246 -5.504 -10.661 1.00 0.00 H new ATOM 661 N LEU A 45 7.905 -6.531 -8.307 1.00 0.00 N ATOM 662 CA LEU A 45 7.736 -6.415 -6.863 1.00 0.00 C ATOM 663 C LEU A 45 8.006 -7.753 -6.200 1.00 0.00 C ATOM 664 O LEU A 45 8.710 -7.834 -5.200 1.00 0.00 O ATOM 665 CB LEU A 45 6.333 -5.920 -6.508 1.00 0.00 C ATOM 666 CG LEU A 45 6.047 -5.803 -5.012 1.00 0.00 C ATOM 667 CD1 LEU A 45 7.050 -4.872 -4.356 1.00 0.00 C ATOM 668 CD2 LEU A 45 4.626 -5.310 -4.774 1.00 0.00 C ATOM 0 H LEU A 45 7.035 -6.537 -8.839 1.00 0.00 H new ATOM 0 HA LEU A 45 8.453 -5.682 -6.494 1.00 0.00 H new ATOM 0 HB2 LEU A 45 6.182 -4.944 -6.969 1.00 0.00 H new ATOM 0 HB3 LEU A 45 5.603 -6.598 -6.950 1.00 0.00 H new ATOM 0 HG LEU A 45 6.145 -6.791 -4.563 1.00 0.00 H new ATOM 0 HD11 LEU A 45 6.834 -4.798 -3.290 1.00 0.00 H new ATOM 0 HD12 LEU A 45 8.057 -5.265 -4.496 1.00 0.00 H new ATOM 0 HD13 LEU A 45 6.980 -3.884 -4.810 1.00 0.00 H new ATOM 0 HD21 LEU A 45 4.442 -5.233 -3.702 1.00 0.00 H new ATOM 0 HD22 LEU A 45 4.499 -4.330 -5.235 1.00 0.00 H new ATOM 0 HD23 LEU A 45 3.919 -6.013 -5.214 1.00 0.00 H new ATOM 680 N GLU A 46 7.419 -8.785 -6.777 1.00 0.00 N ATOM 681 CA GLU A 46 7.617 -10.146 -6.296 1.00 0.00 C ATOM 682 C GLU A 46 9.107 -10.470 -6.143 1.00 0.00 C ATOM 683 O GLU A 46 9.510 -11.086 -5.158 1.00 0.00 O ATOM 684 CB GLU A 46 6.936 -11.162 -7.207 1.00 0.00 C ATOM 685 CG GLU A 46 5.417 -11.091 -7.167 1.00 0.00 C ATOM 686 CD GLU A 46 4.753 -12.237 -7.910 1.00 0.00 C ATOM 687 OE1 GLU A 46 5.208 -13.391 -7.765 1.00 0.00 O ATOM 688 OE2 GLU A 46 3.764 -11.988 -8.629 1.00 0.00 O ATOM 0 H GLU A 46 6.798 -8.709 -7.583 1.00 0.00 H new ATOM 0 HA GLU A 46 7.153 -10.213 -5.312 1.00 0.00 H new ATOM 0 HB2 GLU A 46 7.272 -11.002 -8.231 1.00 0.00 H new ATOM 0 HB3 GLU A 46 7.253 -12.165 -6.920 1.00 0.00 H new ATOM 0 HG2 GLU A 46 5.085 -11.097 -6.129 1.00 0.00 H new ATOM 0 HG3 GLU A 46 5.091 -10.146 -7.601 1.00 0.00 H new ATOM 695 N THR A 47 9.919 -10.045 -7.105 1.00 0.00 N ATOM 696 CA THR A 47 11.361 -10.240 -7.036 1.00 0.00 C ATOM 697 C THR A 47 11.988 -9.457 -5.875 1.00 0.00 C ATOM 698 O THR A 47 12.951 -9.912 -5.258 1.00 0.00 O ATOM 699 CB THR A 47 12.026 -9.810 -8.355 1.00 0.00 C ATOM 700 OG1 THR A 47 11.289 -10.340 -9.464 1.00 0.00 O ATOM 701 CG2 THR A 47 13.459 -10.303 -8.417 1.00 0.00 C ATOM 0 H THR A 47 9.600 -9.561 -7.945 1.00 0.00 H new ATOM 0 HA THR A 47 11.532 -11.303 -6.866 1.00 0.00 H new ATOM 0 HB THR A 47 12.028 -8.721 -8.403 1.00 0.00 H new ATOM 0 HG1 THR A 47 10.550 -9.735 -9.684 1.00 0.00 H new ATOM 0 HG21 THR A 47 13.912 -9.989 -9.357 1.00 0.00 H new ATOM 0 HG22 THR A 47 14.024 -9.884 -7.584 1.00 0.00 H new ATOM 0 HG23 THR A 47 13.472 -11.391 -8.354 1.00 0.00 H new ATOM 709 N ALA A 48 11.424 -8.295 -5.565 1.00 0.00 N ATOM 710 CA ALA A 48 11.925 -7.474 -4.472 1.00 0.00 C ATOM 711 C ALA A 48 11.534 -8.110 -3.146 1.00 0.00 C ATOM 712 O ALA A 48 12.259 -8.046 -2.152 1.00 0.00 O ATOM 713 CB ALA A 48 11.367 -6.056 -4.571 1.00 0.00 C ATOM 0 H ALA A 48 10.621 -7.902 -6.055 1.00 0.00 H new ATOM 0 HA ALA A 48 13.012 -7.414 -4.535 1.00 0.00 H new ATOM 0 HB1 ALA A 48 11.751 -5.455 -3.747 1.00 0.00 H new ATOM 0 HB2 ALA A 48 11.672 -5.610 -5.518 1.00 0.00 H new ATOM 0 HB3 ALA A 48 10.279 -6.089 -4.519 1.00 0.00 H new ATOM 719 N LEU A 49 10.352 -8.699 -3.156 1.00 0.00 N ATOM 720 CA LEU A 49 9.816 -9.427 -2.018 1.00 0.00 C ATOM 721 C LEU A 49 10.628 -10.665 -1.705 1.00 0.00 C ATOM 722 O LEU A 49 10.788 -11.027 -0.547 1.00 0.00 O ATOM 723 CB LEU A 49 8.372 -9.809 -2.310 1.00 0.00 C ATOM 724 CG LEU A 49 7.469 -8.610 -2.515 1.00 0.00 C ATOM 725 CD1 LEU A 49 6.060 -9.045 -2.891 1.00 0.00 C ATOM 726 CD2 LEU A 49 7.485 -7.769 -1.251 1.00 0.00 C ATOM 0 H LEU A 49 9.729 -8.686 -3.964 1.00 0.00 H new ATOM 0 HA LEU A 49 9.865 -8.779 -1.143 1.00 0.00 H new ATOM 0 HB2 LEU A 49 8.342 -10.436 -3.201 1.00 0.00 H new ATOM 0 HB3 LEU A 49 7.987 -10.409 -1.485 1.00 0.00 H new ATOM 0 HG LEU A 49 7.837 -8.007 -3.345 1.00 0.00 H new ATOM 0 HD11 LEU A 49 5.433 -8.165 -3.032 1.00 0.00 H new ATOM 0 HD12 LEU A 49 6.092 -9.620 -3.816 1.00 0.00 H new ATOM 0 HD13 LEU A 49 5.645 -9.662 -2.094 1.00 0.00 H new ATOM 0 HD21 LEU A 49 6.839 -6.901 -1.383 1.00 0.00 H new ATOM 0 HD22 LEU A 49 7.125 -8.365 -0.413 1.00 0.00 H new ATOM 0 HD23 LEU A 49 8.503 -7.436 -1.048 1.00 0.00 H new ATOM 738 N GLU A 50 11.124 -11.298 -2.745 1.00 0.00 N ATOM 739 CA GLU A 50 11.905 -12.515 -2.605 1.00 0.00 C ATOM 740 C GLU A 50 13.083 -12.355 -1.643 1.00 0.00 C ATOM 741 O GLU A 50 13.629 -11.267 -1.455 1.00 0.00 O ATOM 742 CB GLU A 50 12.369 -13.020 -3.970 1.00 0.00 C ATOM 743 CG GLU A 50 11.514 -14.169 -4.468 1.00 0.00 C ATOM 744 CD GLU A 50 11.707 -14.492 -5.931 1.00 0.00 C ATOM 745 OE1 GLU A 50 12.787 -14.989 -6.304 1.00 0.00 O ATOM 746 OE2 GLU A 50 10.754 -14.277 -6.711 1.00 0.00 O ATOM 0 H GLU A 50 11.000 -10.988 -3.709 1.00 0.00 H new ATOM 0 HA GLU A 50 11.248 -13.264 -2.163 1.00 0.00 H new ATOM 0 HB2 GLU A 50 12.334 -12.203 -4.690 1.00 0.00 H new ATOM 0 HB3 GLU A 50 13.408 -13.343 -3.904 1.00 0.00 H new ATOM 0 HG2 GLU A 50 11.739 -15.057 -3.878 1.00 0.00 H new ATOM 0 HG3 GLU A 50 10.465 -13.929 -4.295 1.00 0.00 H new ATOM 753 N GLY A 51 13.452 -13.479 -1.052 1.00 0.00 N ATOM 754 CA GLY A 51 14.559 -13.512 -0.109 1.00 0.00 C ATOM 755 C GLY A 51 14.289 -13.001 1.303 1.00 0.00 C ATOM 756 O GLY A 51 15.061 -13.318 2.205 1.00 0.00 O ATOM 0 H GLY A 51 13.002 -14.381 -1.208 1.00 0.00 H new ATOM 0 HA2 GLY A 51 14.908 -14.542 -0.034 1.00 0.00 H new ATOM 0 HA3 GLY A 51 15.378 -12.927 -0.529 1.00 0.00 H new ATOM 760 N HIS A 52 13.232 -12.224 1.549 1.00 0.00 N ATOM 761 CA HIS A 52 13.089 -11.649 2.890 1.00 0.00 C ATOM 762 C HIS A 52 11.717 -11.901 3.500 1.00 0.00 C ATOM 763 O HIS A 52 10.737 -12.115 2.799 1.00 0.00 O ATOM 764 CB HIS A 52 13.510 -10.167 2.953 1.00 0.00 C ATOM 765 CG HIS A 52 12.654 -9.138 2.259 1.00 0.00 C ATOM 766 ND1 HIS A 52 12.436 -7.906 2.825 1.00 0.00 N ATOM 767 CD2 HIS A 52 12.068 -9.080 1.032 1.00 0.00 C ATOM 768 CE1 HIS A 52 11.773 -7.146 1.990 1.00 0.00 C ATOM 769 NE2 HIS A 52 11.536 -7.828 0.891 1.00 0.00 N ATOM 0 H HIS A 52 12.499 -11.987 0.880 1.00 0.00 H new ATOM 0 HA HIS A 52 13.797 -12.187 3.521 1.00 0.00 H new ATOM 0 HB2 HIS A 52 13.575 -9.887 4.004 1.00 0.00 H new ATOM 0 HB3 HIS A 52 14.516 -10.092 2.540 1.00 0.00 H new ATOM 0 HD1 HIS A 52 12.744 -7.625 3.756 1.00 0.00 H new ATOM 0 HD2 HIS A 52 12.030 -9.876 0.303 1.00 0.00 H new ATOM 0 HE1 HIS A 52 11.470 -6.126 2.174 1.00 0.00 H new ATOM 778 N GLU A 53 11.668 -11.840 4.826 1.00 0.00 N ATOM 779 CA GLU A 53 10.617 -12.501 5.594 1.00 0.00 C ATOM 780 C GLU A 53 9.532 -11.555 6.079 1.00 0.00 C ATOM 781 O GLU A 53 9.686 -10.331 6.048 1.00 0.00 O ATOM 782 CB GLU A 53 11.216 -13.224 6.800 1.00 0.00 C ATOM 783 CG GLU A 53 11.983 -14.481 6.445 1.00 0.00 C ATOM 784 CD GLU A 53 12.571 -15.168 7.662 1.00 0.00 C ATOM 785 OE1 GLU A 53 11.806 -15.803 8.422 1.00 0.00 O ATOM 786 OE2 GLU A 53 13.803 -15.096 7.856 1.00 0.00 O ATOM 0 H GLU A 53 12.348 -11.336 5.395 1.00 0.00 H new ATOM 0 HA GLU A 53 10.150 -13.209 4.910 1.00 0.00 H new ATOM 0 HB2 GLU A 53 11.882 -12.541 7.327 1.00 0.00 H new ATOM 0 HB3 GLU A 53 10.414 -13.483 7.491 1.00 0.00 H new ATOM 0 HG2 GLU A 53 11.319 -15.173 5.927 1.00 0.00 H new ATOM 0 HG3 GLU A 53 12.785 -14.229 5.751 1.00 0.00 H new ATOM 793 N VAL A 54 8.433 -12.170 6.525 1.00 0.00 N ATOM 794 CA VAL A 54 7.259 -11.473 7.042 1.00 0.00 C ATOM 795 C VAL A 54 7.616 -10.393 8.064 1.00 0.00 C ATOM 796 O VAL A 54 8.564 -10.524 8.843 1.00 0.00 O ATOM 797 CB VAL A 54 6.219 -12.459 7.649 1.00 0.00 C ATOM 798 CG1 VAL A 54 6.533 -13.894 7.262 1.00 0.00 C ATOM 799 CG2 VAL A 54 6.112 -12.325 9.162 1.00 0.00 C ATOM 0 H VAL A 54 8.336 -13.185 6.536 1.00 0.00 H new ATOM 0 HA VAL A 54 6.808 -10.979 6.182 1.00 0.00 H new ATOM 0 HB VAL A 54 5.250 -12.190 7.229 1.00 0.00 H new ATOM 0 HG11 VAL A 54 5.790 -14.560 7.700 1.00 0.00 H new ATOM 0 HG12 VAL A 54 6.512 -13.991 6.177 1.00 0.00 H new ATOM 0 HG13 VAL A 54 7.523 -14.162 7.631 1.00 0.00 H new ATOM 0 HG21 VAL A 54 5.374 -13.033 9.539 1.00 0.00 H new ATOM 0 HG22 VAL A 54 7.081 -12.535 9.615 1.00 0.00 H new ATOM 0 HG23 VAL A 54 5.804 -11.311 9.417 1.00 0.00 H new ATOM 809 N GLY A 55 6.857 -9.310 8.024 1.00 0.00 N ATOM 810 CA GLY A 55 7.065 -8.217 8.949 1.00 0.00 C ATOM 811 C GLY A 55 7.912 -7.116 8.354 1.00 0.00 C ATOM 812 O GLY A 55 8.043 -6.041 8.939 1.00 0.00 O ATOM 0 H GLY A 55 6.094 -9.168 7.362 1.00 0.00 H new ATOM 0 HA2 GLY A 55 6.100 -7.808 9.248 1.00 0.00 H new ATOM 0 HA3 GLY A 55 7.545 -8.594 9.852 1.00 0.00 H new ATOM 816 N ASP A 56 8.505 -7.385 7.201 1.00 0.00 N ATOM 817 CA ASP A 56 9.317 -6.386 6.524 1.00 0.00 C ATOM 818 C ASP A 56 8.428 -5.347 5.867 1.00 0.00 C ATOM 819 O ASP A 56 7.414 -5.675 5.247 1.00 0.00 O ATOM 820 CB ASP A 56 10.222 -7.015 5.468 1.00 0.00 C ATOM 821 CG ASP A 56 11.542 -6.285 5.326 1.00 0.00 C ATOM 822 OD1 ASP A 56 11.542 -5.045 5.239 1.00 0.00 O ATOM 823 OD2 ASP A 56 12.594 -6.961 5.301 1.00 0.00 O ATOM 0 H ASP A 56 8.440 -8.281 6.717 1.00 0.00 H new ATOM 0 HA ASP A 56 9.947 -5.913 7.277 1.00 0.00 H new ATOM 0 HB2 ASP A 56 10.412 -8.056 5.730 1.00 0.00 H new ATOM 0 HB3 ASP A 56 9.707 -7.018 4.507 1.00 0.00 H new ATOM 828 N LYS A 57 8.825 -4.105 6.010 1.00 0.00 N ATOM 829 CA LYS A 57 8.075 -3.000 5.461 1.00 0.00 C ATOM 830 C LYS A 57 9.019 -1.997 4.834 1.00 0.00 C ATOM 831 O LYS A 57 10.021 -1.610 5.436 1.00 0.00 O ATOM 832 CB LYS A 57 7.229 -2.337 6.546 1.00 0.00 C ATOM 833 CG LYS A 57 6.061 -1.523 6.004 1.00 0.00 C ATOM 834 CD LYS A 57 6.488 -0.185 5.432 1.00 0.00 C ATOM 835 CE LYS A 57 5.294 0.582 4.889 1.00 0.00 C ATOM 836 NZ LYS A 57 4.321 0.922 5.960 1.00 0.00 N ATOM 0 H LYS A 57 9.673 -3.832 6.508 1.00 0.00 H new ATOM 0 HA LYS A 57 7.403 -3.378 4.690 1.00 0.00 H new ATOM 0 HB2 LYS A 57 6.844 -3.107 7.214 1.00 0.00 H new ATOM 0 HB3 LYS A 57 7.867 -1.686 7.144 1.00 0.00 H new ATOM 0 HG2 LYS A 57 5.553 -2.098 5.230 1.00 0.00 H new ATOM 0 HG3 LYS A 57 5.339 -1.357 6.803 1.00 0.00 H new ATOM 0 HD2 LYS A 57 6.982 0.404 6.205 1.00 0.00 H new ATOM 0 HD3 LYS A 57 7.216 -0.342 4.636 1.00 0.00 H new ATOM 0 HE2 LYS A 57 5.639 1.497 4.408 1.00 0.00 H new ATOM 0 HE3 LYS A 57 4.798 -0.014 4.123 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 3.652 1.636 5.607 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 3.799 0.067 6.239 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 4.830 1.302 6.784 1.00 0.00 H new ATOM 850 N PHE A 58 8.684 -1.585 3.624 1.00 0.00 N ATOM 851 CA PHE A 58 9.513 -0.658 2.864 1.00 0.00 C ATOM 852 C PHE A 58 8.795 -0.237 1.599 1.00 0.00 C ATOM 853 O PHE A 58 7.826 -0.878 1.181 1.00 0.00 O ATOM 854 CB PHE A 58 10.853 -1.301 2.492 1.00 0.00 C ATOM 855 CG PHE A 58 10.727 -2.502 1.590 1.00 0.00 C ATOM 856 CD1 PHE A 58 10.156 -3.682 2.044 1.00 0.00 C ATOM 857 CD2 PHE A 58 11.169 -2.443 0.277 1.00 0.00 C ATOM 858 CE1 PHE A 58 10.029 -4.773 1.209 1.00 0.00 C ATOM 859 CE2 PHE A 58 11.044 -3.534 -0.561 1.00 0.00 C ATOM 860 CZ PHE A 58 10.475 -4.699 -0.097 1.00 0.00 C ATOM 0 H PHE A 58 7.836 -1.880 3.140 1.00 0.00 H new ATOM 0 HA PHE A 58 9.702 0.215 3.489 1.00 0.00 H new ATOM 0 HB2 PHE A 58 11.479 -0.555 2.002 1.00 0.00 H new ATOM 0 HB3 PHE A 58 11.368 -1.598 3.406 1.00 0.00 H new ATOM 0 HD1 PHE A 58 9.807 -3.747 3.064 1.00 0.00 H new ATOM 0 HD2 PHE A 58 11.616 -1.533 -0.095 1.00 0.00 H new ATOM 0 HE1 PHE A 58 9.581 -5.685 1.576 1.00 0.00 H new ATOM 0 HE2 PHE A 58 11.393 -3.473 -1.581 1.00 0.00 H new ATOM 0 HZ PHE A 58 10.378 -5.552 -0.752 1.00 0.00 H new ATOM 870 N ASP A 59 9.259 0.842 1.003 1.00 0.00 N ATOM 871 CA ASP A 59 8.695 1.307 -0.254 1.00 0.00 C ATOM 872 C ASP A 59 9.536 0.856 -1.437 1.00 0.00 C ATOM 873 O ASP A 59 10.768 0.858 -1.396 1.00 0.00 O ATOM 874 CB ASP A 59 8.503 2.826 -0.273 1.00 0.00 C ATOM 875 CG ASP A 59 9.798 3.615 -0.285 1.00 0.00 C ATOM 876 OD1 ASP A 59 10.394 3.814 0.794 1.00 0.00 O ATOM 877 OD2 ASP A 59 10.197 4.078 -1.373 1.00 0.00 O ATOM 0 H ASP A 59 10.022 1.414 1.365 1.00 0.00 H new ATOM 0 HA ASP A 59 7.708 0.853 -0.343 1.00 0.00 H new ATOM 0 HB2 ASP A 59 7.918 3.096 -1.152 1.00 0.00 H new ATOM 0 HB3 ASP A 59 7.920 3.118 0.600 1.00 0.00 H new ATOM 882 N VAL A 60 8.835 0.469 -2.480 1.00 0.00 N ATOM 883 CA VAL A 60 9.431 -0.102 -3.680 1.00 0.00 C ATOM 884 C VAL A 60 8.959 0.704 -4.882 1.00 0.00 C ATOM 885 O VAL A 60 7.867 1.270 -4.846 1.00 0.00 O ATOM 886 CB VAL A 60 9.002 -1.580 -3.854 1.00 0.00 C ATOM 887 CG1 VAL A 60 9.890 -2.329 -4.824 1.00 0.00 C ATOM 888 CG2 VAL A 60 8.961 -2.305 -2.531 1.00 0.00 C ATOM 0 H VAL A 60 7.819 0.541 -2.524 1.00 0.00 H new ATOM 0 HA VAL A 60 10.517 -0.066 -3.595 1.00 0.00 H new ATOM 0 HB VAL A 60 7.996 -1.555 -4.273 1.00 0.00 H new ATOM 0 HG11 VAL A 60 9.547 -3.360 -4.910 1.00 0.00 H new ATOM 0 HG12 VAL A 60 9.847 -1.849 -5.802 1.00 0.00 H new ATOM 0 HG13 VAL A 60 10.917 -2.318 -4.460 1.00 0.00 H new ATOM 0 HG21 VAL A 60 8.656 -3.339 -2.692 1.00 0.00 H new ATOM 0 HG22 VAL A 60 9.951 -2.285 -2.075 1.00 0.00 H new ATOM 0 HG23 VAL A 60 8.247 -1.815 -1.870 1.00 0.00 H new ATOM 898 N ALA A 61 9.763 0.786 -5.931 1.00 0.00 N ATOM 899 CA ALA A 61 9.376 1.527 -7.120 1.00 0.00 C ATOM 900 C ALA A 61 9.710 0.725 -8.369 1.00 0.00 C ATOM 901 O ALA A 61 10.880 0.477 -8.667 1.00 0.00 O ATOM 902 CB ALA A 61 10.067 2.881 -7.151 1.00 0.00 C ATOM 0 H ALA A 61 10.684 0.350 -5.983 1.00 0.00 H new ATOM 0 HA ALA A 61 8.299 1.695 -7.093 1.00 0.00 H new ATOM 0 HB1 ALA A 61 9.766 3.423 -8.048 1.00 0.00 H new ATOM 0 HB2 ALA A 61 9.784 3.454 -6.268 1.00 0.00 H new ATOM 0 HB3 ALA A 61 11.148 2.738 -7.159 1.00 0.00 H new ATOM 908 N VAL A 62 8.679 0.315 -9.086 1.00 0.00 N ATOM 909 CA VAL A 62 8.846 -0.531 -10.258 1.00 0.00 C ATOM 910 C VAL A 62 8.063 0.040 -11.435 1.00 0.00 C ATOM 911 O VAL A 62 6.989 0.622 -11.257 1.00 0.00 O ATOM 912 CB VAL A 62 8.376 -1.979 -9.975 1.00 0.00 C ATOM 913 CG1 VAL A 62 8.592 -2.870 -11.185 1.00 0.00 C ATOM 914 CG2 VAL A 62 9.100 -2.552 -8.765 1.00 0.00 C ATOM 0 H VAL A 62 7.710 0.555 -8.876 1.00 0.00 H new ATOM 0 HA VAL A 62 9.908 -0.555 -10.504 1.00 0.00 H new ATOM 0 HB VAL A 62 7.308 -1.946 -9.761 1.00 0.00 H new ATOM 0 HG11 VAL A 62 8.253 -3.881 -10.958 1.00 0.00 H new ATOM 0 HG12 VAL A 62 8.026 -2.479 -12.030 1.00 0.00 H new ATOM 0 HG13 VAL A 62 9.652 -2.891 -11.437 1.00 0.00 H new ATOM 0 HG21 VAL A 62 8.755 -3.570 -8.583 1.00 0.00 H new ATOM 0 HG22 VAL A 62 10.174 -2.561 -8.954 1.00 0.00 H new ATOM 0 HG23 VAL A 62 8.890 -1.936 -7.890 1.00 0.00 H new ATOM 924 N GLY A 63 8.622 -0.112 -12.627 1.00 0.00 N ATOM 925 CA GLY A 63 7.977 0.378 -13.825 1.00 0.00 C ATOM 926 C GLY A 63 6.760 -0.442 -14.194 1.00 0.00 C ATOM 927 O GLY A 63 6.681 -1.627 -13.869 1.00 0.00 O ATOM 0 H GLY A 63 9.519 -0.571 -12.785 1.00 0.00 H new ATOM 0 HA2 GLY A 63 7.682 1.417 -13.678 1.00 0.00 H new ATOM 0 HA3 GLY A 63 8.688 0.362 -14.651 1.00 0.00 H new ATOM 931 N ALA A 64 5.816 0.194 -14.873 1.00 0.00 N ATOM 932 CA ALA A 64 4.568 -0.443 -15.287 1.00 0.00 C ATOM 933 C ALA A 64 4.809 -1.712 -16.104 1.00 0.00 C ATOM 934 O ALA A 64 3.996 -2.632 -16.088 1.00 0.00 O ATOM 935 CB ALA A 64 3.731 0.543 -16.087 1.00 0.00 C ATOM 0 H ALA A 64 5.892 1.171 -15.155 1.00 0.00 H new ATOM 0 HA ALA A 64 4.032 -0.738 -14.385 1.00 0.00 H new ATOM 0 HB1 ALA A 64 2.801 0.065 -16.394 1.00 0.00 H new ATOM 0 HB2 ALA A 64 3.505 1.413 -15.470 1.00 0.00 H new ATOM 0 HB3 ALA A 64 4.286 0.859 -16.970 1.00 0.00 H new ATOM 941 N ASN A 65 5.932 -1.765 -16.803 1.00 0.00 N ATOM 942 CA ASN A 65 6.258 -2.918 -17.633 1.00 0.00 C ATOM 943 C ASN A 65 6.616 -4.125 -16.773 1.00 0.00 C ATOM 944 O ASN A 65 6.548 -5.265 -17.227 1.00 0.00 O ATOM 945 CB ASN A 65 7.407 -2.597 -18.596 1.00 0.00 C ATOM 946 CG ASN A 65 8.689 -2.174 -17.888 1.00 0.00 C ATOM 947 OD1 ASN A 65 8.655 -1.545 -16.830 1.00 0.00 O ATOM 948 ND2 ASN A 65 9.830 -2.515 -18.473 1.00 0.00 N ATOM 0 H ASN A 65 6.634 -1.025 -16.813 1.00 0.00 H new ATOM 0 HA ASN A 65 5.373 -3.161 -18.221 1.00 0.00 H new ATOM 0 HB2 ASN A 65 7.612 -3.474 -19.210 1.00 0.00 H new ATOM 0 HB3 ASN A 65 7.094 -1.801 -19.271 1.00 0.00 H new ATOM 0 HD21 ASN A 65 10.719 -2.256 -18.046 1.00 0.00 H new ATOM 0 HD22 ASN A 65 9.818 -3.036 -19.350 1.00 0.00 H new ATOM 955 N ASP A 66 6.991 -3.869 -15.531 1.00 0.00 N ATOM 956 CA ASP A 66 7.271 -4.936 -14.584 1.00 0.00 C ATOM 957 C ASP A 66 6.218 -4.961 -13.486 1.00 0.00 C ATOM 958 O ASP A 66 6.283 -5.759 -12.549 1.00 0.00 O ATOM 959 CB ASP A 66 8.656 -4.770 -13.970 1.00 0.00 C ATOM 960 CG ASP A 66 9.769 -5.224 -14.890 1.00 0.00 C ATOM 961 OD1 ASP A 66 10.103 -6.427 -14.877 1.00 0.00 O ATOM 962 OD2 ASP A 66 10.324 -4.387 -15.627 1.00 0.00 O ATOM 0 H ASP A 66 7.109 -2.929 -15.154 1.00 0.00 H new ATOM 0 HA ASP A 66 7.243 -5.882 -15.125 1.00 0.00 H new ATOM 0 HB2 ASP A 66 8.810 -3.722 -13.712 1.00 0.00 H new ATOM 0 HB3 ASP A 66 8.706 -5.338 -13.041 1.00 0.00 H new ATOM 967 N ALA A 67 5.261 -4.068 -13.596 1.00 0.00 N ATOM 968 CA ALA A 67 4.152 -4.022 -12.667 1.00 0.00 C ATOM 969 C ALA A 67 2.826 -4.023 -13.418 1.00 0.00 C ATOM 970 O ALA A 67 2.358 -5.074 -13.861 1.00 0.00 O ATOM 971 CB ALA A 67 4.268 -2.808 -11.751 1.00 0.00 C ATOM 0 H ALA A 67 5.228 -3.357 -14.326 1.00 0.00 H new ATOM 0 HA ALA A 67 4.185 -4.915 -12.043 1.00 0.00 H new ATOM 0 HB1 ALA A 67 3.425 -2.792 -11.060 1.00 0.00 H new ATOM 0 HB2 ALA A 67 5.199 -2.866 -11.186 1.00 0.00 H new ATOM 0 HB3 ALA A 67 4.263 -1.898 -12.351 1.00 0.00 H new ATOM 1119 N GLN A 77 -2.925 7.246 -30.794 1.00 0.00 N ATOM 1120 CA GLN A 77 -2.789 7.942 -32.057 1.00 0.00 C ATOM 1121 C GLN A 77 -4.140 8.261 -32.667 1.00 0.00 C ATOM 1122 O GLN A 77 -5.188 7.877 -32.145 1.00 0.00 O ATOM 1123 CB GLN A 77 -1.986 7.080 -33.032 1.00 0.00 C ATOM 1124 CG GLN A 77 -2.634 5.733 -33.314 1.00 0.00 C ATOM 1125 CD GLN A 77 -1.773 4.836 -34.176 1.00 0.00 C ATOM 1126 OE1 GLN A 77 -1.863 4.853 -35.404 1.00 0.00 O ATOM 1127 NE2 GLN A 77 -0.928 4.042 -33.541 1.00 0.00 N ATOM 0 HA GLN A 77 -2.271 8.882 -31.868 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -1.865 7.621 -33.970 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -0.987 6.918 -32.626 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -2.842 5.230 -32.369 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -3.592 5.893 -33.808 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -0.882 4.056 -32.522 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -0.322 3.415 -34.070 1.00 0.00 H new ATOM 1136 N ARG A 78 -4.093 8.956 -33.786 1.00 0.00 N ATOM 1137 CA ARG A 78 -5.282 9.268 -34.550 1.00 0.00 C ATOM 1138 C ARG A 78 -5.177 8.562 -35.891 1.00 0.00 C ATOM 1139 O ARG A 78 -4.075 8.378 -36.412 1.00 0.00 O ATOM 1140 CB ARG A 78 -5.454 10.783 -34.746 1.00 0.00 C ATOM 1141 CG ARG A 78 -5.584 11.577 -33.448 1.00 0.00 C ATOM 1142 CD ARG A 78 -4.235 11.787 -32.780 1.00 0.00 C ATOM 1143 NE ARG A 78 -4.349 12.367 -31.442 1.00 0.00 N ATOM 1144 CZ ARG A 78 -3.321 12.491 -30.602 1.00 0.00 C ATOM 1145 NH1 ARG A 78 -2.105 12.095 -30.972 1.00 0.00 N ATOM 1146 NH2 ARG A 78 -3.510 13.003 -29.389 1.00 0.00 N ATOM 0 H ARG A 78 -3.230 9.320 -34.190 1.00 0.00 H new ATOM 0 HA ARG A 78 -6.161 8.923 -34.005 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -4.600 11.164 -35.306 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -6.340 10.960 -35.356 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -6.041 12.544 -33.657 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -6.250 11.051 -32.765 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -3.715 10.831 -32.714 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -3.624 12.440 -33.403 1.00 0.00 H new ATOM 0 HE ARG A 78 -5.265 12.694 -31.135 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -1.959 11.696 -31.899 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -1.320 12.191 -30.328 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -4.442 13.301 -29.101 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -2.723 13.097 -28.747 1.00 0.00 H new ATOM 1160 N VAL A 79 -6.306 8.178 -36.456 1.00 0.00 N ATOM 1161 CA VAL A 79 -6.316 7.330 -37.641 1.00 0.00 C ATOM 1162 C VAL A 79 -7.425 7.784 -38.582 1.00 0.00 C ATOM 1163 O VAL A 79 -8.564 7.975 -38.157 1.00 0.00 O ATOM 1164 CB VAL A 79 -6.530 5.836 -37.285 1.00 0.00 C ATOM 1165 CG1 VAL A 79 -6.329 4.961 -38.512 1.00 0.00 C ATOM 1166 CG2 VAL A 79 -5.602 5.393 -36.160 1.00 0.00 C ATOM 0 H VAL A 79 -7.232 8.438 -36.115 1.00 0.00 H new ATOM 0 HA VAL A 79 -5.343 7.425 -38.123 1.00 0.00 H new ATOM 0 HB VAL A 79 -7.556 5.722 -36.936 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -6.483 3.916 -38.243 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -7.044 5.246 -39.284 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -5.315 5.092 -38.890 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -5.778 4.341 -35.936 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -4.565 5.529 -36.468 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -5.798 5.991 -35.270 1.00 0.00 H new ATOM 1176 N PRO A 80 -7.094 7.993 -39.865 1.00 0.00 N ATOM 1177 CA PRO A 80 -8.058 8.441 -40.878 1.00 0.00 C ATOM 1178 C PRO A 80 -9.252 7.499 -41.002 1.00 0.00 C ATOM 1179 O PRO A 80 -9.098 6.279 -41.010 1.00 0.00 O ATOM 1180 CB PRO A 80 -7.257 8.431 -42.182 1.00 0.00 C ATOM 1181 CG PRO A 80 -5.821 8.433 -41.782 1.00 0.00 C ATOM 1182 CD PRO A 80 -5.744 7.809 -40.420 1.00 0.00 C ATOM 0 HA PRO A 80 -8.475 9.415 -40.623 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -7.494 7.551 -42.779 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -7.493 9.303 -42.792 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -5.221 7.872 -42.498 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -5.427 9.449 -41.763 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -5.478 6.754 -40.479 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -4.989 8.294 -39.801 1.00 0.00 H new ATOM 1190 N LYS A 81 -10.442 8.092 -41.095 1.00 0.00 N ATOM 1191 CA LYS A 81 -11.691 7.344 -41.263 1.00 0.00 C ATOM 1192 C LYS A 81 -11.625 6.408 -42.468 1.00 0.00 C ATOM 1193 O LYS A 81 -12.244 5.346 -42.473 1.00 0.00 O ATOM 1194 CB LYS A 81 -12.862 8.313 -41.448 1.00 0.00 C ATOM 1195 CG LYS A 81 -13.034 9.309 -40.310 1.00 0.00 C ATOM 1196 CD LYS A 81 -14.203 8.958 -39.405 1.00 0.00 C ATOM 1197 CE LYS A 81 -15.494 8.771 -40.193 1.00 0.00 C ATOM 1198 NZ LYS A 81 -15.879 9.993 -40.949 1.00 0.00 N ATOM 0 H LYS A 81 -10.569 9.103 -41.056 1.00 0.00 H new ATOM 0 HA LYS A 81 -11.839 6.745 -40.365 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -12.720 8.863 -42.379 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -13.782 7.738 -41.554 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -12.118 9.344 -39.719 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -13.185 10.306 -40.723 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -13.976 8.044 -38.857 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -14.340 9.747 -38.666 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -15.375 7.940 -40.888 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -16.299 8.502 -39.509 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -16.820 9.858 -41.372 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -15.904 10.808 -40.303 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -15.183 10.169 -41.702 1.00 0.00 H new ATOM 1212 N ASP A 82 -10.873 6.822 -43.484 1.00 0.00 N ATOM 1213 CA ASP A 82 -10.699 6.035 -44.704 1.00 0.00 C ATOM 1214 C ASP A 82 -10.011 4.705 -44.412 1.00 0.00 C ATOM 1215 O ASP A 82 -10.306 3.685 -45.033 1.00 0.00 O ATOM 1216 CB ASP A 82 -9.884 6.835 -45.719 1.00 0.00 C ATOM 1217 CG ASP A 82 -9.536 6.030 -46.950 1.00 0.00 C ATOM 1218 OD1 ASP A 82 -10.438 5.773 -47.772 1.00 0.00 O ATOM 1219 OD2 ASP A 82 -8.354 5.662 -47.110 1.00 0.00 O ATOM 0 H ASP A 82 -10.368 7.708 -43.487 1.00 0.00 H new ATOM 0 HA ASP A 82 -11.685 5.819 -45.116 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -10.448 7.720 -46.015 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -8.966 7.185 -45.247 1.00 0.00 H new ATOM 1224 N VAL A 83 -9.093 4.737 -43.456 1.00 0.00 N ATOM 1225 CA VAL A 83 -8.369 3.545 -43.031 1.00 0.00 C ATOM 1226 C VAL A 83 -9.330 2.451 -42.572 1.00 0.00 C ATOM 1227 O VAL A 83 -9.106 1.269 -42.821 1.00 0.00 O ATOM 1228 CB VAL A 83 -7.373 3.880 -41.900 1.00 0.00 C ATOM 1229 CG1 VAL A 83 -6.694 2.634 -41.362 1.00 0.00 C ATOM 1230 CG2 VAL A 83 -6.333 4.872 -42.389 1.00 0.00 C ATOM 0 H VAL A 83 -8.829 5.585 -42.955 1.00 0.00 H new ATOM 0 HA VAL A 83 -7.811 3.176 -43.892 1.00 0.00 H new ATOM 0 HB VAL A 83 -7.941 4.328 -41.084 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -6.001 2.911 -40.568 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -7.446 1.952 -40.965 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -6.147 2.142 -42.166 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -5.638 5.099 -41.581 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -5.786 4.442 -43.228 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -6.827 5.789 -42.710 1.00 0.00 H new ATOM 1240 N PHE A 84 -10.415 2.853 -41.927 1.00 0.00 N ATOM 1241 CA PHE A 84 -11.407 1.910 -41.439 1.00 0.00 C ATOM 1242 C PHE A 84 -12.645 1.935 -42.326 1.00 0.00 C ATOM 1243 O PHE A 84 -13.773 1.881 -41.837 1.00 0.00 O ATOM 1244 CB PHE A 84 -11.801 2.230 -40.000 1.00 0.00 C ATOM 1245 CG PHE A 84 -10.647 2.347 -39.054 1.00 0.00 C ATOM 1246 CD1 PHE A 84 -9.842 1.256 -38.782 1.00 0.00 C ATOM 1247 CD2 PHE A 84 -10.380 3.550 -38.425 1.00 0.00 C ATOM 1248 CE1 PHE A 84 -8.790 1.362 -37.897 1.00 0.00 C ATOM 1249 CE2 PHE A 84 -9.329 3.662 -37.541 1.00 0.00 C ATOM 1250 CZ PHE A 84 -8.533 2.567 -37.275 1.00 0.00 C ATOM 0 H PHE A 84 -10.630 3.830 -41.729 1.00 0.00 H new ATOM 0 HA PHE A 84 -10.965 0.914 -41.467 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -12.360 3.165 -39.989 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -12.474 1.452 -39.639 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -10.039 0.312 -39.268 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -11.001 4.410 -38.629 1.00 0.00 H new ATOM 0 HE1 PHE A 84 -8.168 0.503 -37.691 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -9.128 4.606 -37.057 1.00 0.00 H new ATOM 0 HZ PHE A 84 -7.710 2.653 -36.581 1.00 0.00 H new ATOM 1260 N MET A 85 -12.419 2.037 -43.629 1.00 0.00 N ATOM 1261 CA MET A 85 -13.499 2.083 -44.615 1.00 0.00 C ATOM 1262 C MET A 85 -14.469 0.906 -44.478 1.00 0.00 C ATOM 1263 O MET A 85 -15.637 1.013 -44.845 1.00 0.00 O ATOM 1264 CB MET A 85 -12.914 2.091 -46.023 1.00 0.00 C ATOM 1265 CG MET A 85 -11.980 0.926 -46.280 1.00 0.00 C ATOM 1266 SD MET A 85 -11.776 0.562 -48.032 1.00 0.00 S ATOM 1267 CE MET A 85 -13.423 -0.018 -48.436 1.00 0.00 C ATOM 0 H MET A 85 -11.485 2.090 -44.035 1.00 0.00 H new ATOM 0 HA MET A 85 -14.061 2.998 -44.431 1.00 0.00 H new ATOM 0 HB2 MET A 85 -13.727 2.065 -46.749 1.00 0.00 H new ATOM 0 HB3 MET A 85 -12.374 3.025 -46.181 1.00 0.00 H new ATOM 0 HG2 MET A 85 -11.005 1.146 -45.844 1.00 0.00 H new ATOM 0 HG3 MET A 85 -12.364 0.041 -45.773 1.00 0.00 H new ATOM 0 HE1 MET A 85 -13.368 -0.719 -49.269 1.00 0.00 H new ATOM 0 HE2 MET A 85 -13.856 -0.517 -47.569 1.00 0.00 H new ATOM 0 HE3 MET A 85 -14.049 0.829 -48.716 1.00 0.00 H new ATOM 1277 N GLY A 86 -13.980 -0.215 -43.961 1.00 0.00 N ATOM 1278 CA GLY A 86 -14.815 -1.391 -43.810 1.00 0.00 C ATOM 1279 C GLY A 86 -15.660 -1.373 -42.546 1.00 0.00 C ATOM 1280 O GLY A 86 -16.371 -2.335 -42.257 1.00 0.00 O ATOM 0 H GLY A 86 -13.018 -0.330 -43.643 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -15.472 -1.475 -44.676 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -14.182 -2.278 -43.803 1.00 0.00 H new ATOM 1284 N VAL A 87 -15.586 -0.290 -41.786 1.00 0.00 N ATOM 1285 CA VAL A 87 -16.360 -0.173 -40.556 1.00 0.00 C ATOM 1286 C VAL A 87 -17.694 0.518 -40.811 1.00 0.00 C ATOM 1287 O VAL A 87 -17.778 1.419 -41.649 1.00 0.00 O ATOM 1288 CB VAL A 87 -15.590 0.595 -39.467 1.00 0.00 C ATOM 1289 CG1 VAL A 87 -16.446 0.800 -38.220 1.00 0.00 C ATOM 1290 CG2 VAL A 87 -14.296 -0.128 -39.119 1.00 0.00 C ATOM 0 H VAL A 87 -15.001 0.518 -41.997 1.00 0.00 H new ATOM 0 HA VAL A 87 -16.541 -1.188 -40.203 1.00 0.00 H new ATOM 0 HB VAL A 87 -15.342 1.580 -39.863 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -15.872 1.345 -37.471 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -17.338 1.370 -38.480 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -16.740 -0.169 -37.817 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -13.764 0.429 -38.347 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -14.526 -1.128 -38.752 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -13.671 -0.203 -40.009 1.00 0.00 H new ATOM 1300 N ASP A 88 -18.732 0.082 -40.103 1.00 0.00 N ATOM 1301 CA ASP A 88 -20.050 0.696 -40.208 1.00 0.00 C ATOM 1302 C ASP A 88 -19.988 2.182 -39.890 1.00 0.00 C ATOM 1303 O ASP A 88 -19.986 3.025 -40.793 1.00 0.00 O ATOM 1304 CB ASP A 88 -21.048 -0.010 -39.287 1.00 0.00 C ATOM 1305 CG ASP A 88 -22.387 0.700 -39.208 1.00 0.00 C ATOM 1306 OD1 ASP A 88 -22.958 1.041 -40.265 1.00 0.00 O ATOM 1307 OD2 ASP A 88 -22.874 0.922 -38.080 1.00 0.00 O ATOM 0 H ASP A 88 -18.684 -0.698 -39.448 1.00 0.00 H new ATOM 0 HA ASP A 88 -20.391 0.586 -41.237 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -21.204 -1.029 -39.642 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -20.622 -0.083 -38.286 1.00 0.00 H new ATOM 1312 N GLU A 89 -19.918 2.498 -38.616 1.00 0.00 N ATOM 1313 CA GLU A 89 -19.855 3.873 -38.177 1.00 0.00 C ATOM 1314 C GLU A 89 -18.784 4.050 -37.124 1.00 0.00 C ATOM 1315 O GLU A 89 -18.943 3.612 -35.984 1.00 0.00 O ATOM 1316 CB GLU A 89 -21.192 4.312 -37.630 1.00 0.00 C ATOM 1317 CG GLU A 89 -22.167 4.765 -38.701 1.00 0.00 C ATOM 1318 CD GLU A 89 -23.476 5.253 -38.122 1.00 0.00 C ATOM 1319 OE1 GLU A 89 -24.342 4.410 -37.805 1.00 0.00 O ATOM 1320 OE2 GLU A 89 -23.643 6.484 -37.965 1.00 0.00 O ATOM 0 H GLU A 89 -19.903 1.814 -37.860 1.00 0.00 H new ATOM 0 HA GLU A 89 -19.603 4.493 -39.037 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -21.635 3.487 -37.072 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -21.036 5.127 -36.924 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -21.713 5.563 -39.288 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -22.361 3.938 -39.384 1.00 0.00 H new ATOM 1327 N LEU A 90 -17.689 4.673 -37.516 1.00 0.00 N ATOM 1328 CA LEU A 90 -16.623 4.989 -36.590 1.00 0.00 C ATOM 1329 C LEU A 90 -17.156 5.885 -35.485 1.00 0.00 C ATOM 1330 O LEU A 90 -17.427 7.067 -35.692 1.00 0.00 O ATOM 1331 CB LEU A 90 -15.464 5.653 -37.327 1.00 0.00 C ATOM 1332 CG LEU A 90 -14.749 4.740 -38.325 1.00 0.00 C ATOM 1333 CD1 LEU A 90 -13.714 5.518 -39.118 1.00 0.00 C ATOM 1334 CD2 LEU A 90 -14.095 3.573 -37.599 1.00 0.00 C ATOM 0 H LEU A 90 -17.516 4.971 -38.476 1.00 0.00 H new ATOM 0 HA LEU A 90 -16.249 4.070 -36.139 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -15.839 6.528 -37.857 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -14.740 6.010 -36.595 1.00 0.00 H new ATOM 0 HG LEU A 90 -15.489 4.347 -39.022 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -13.217 4.850 -39.822 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -14.205 6.322 -39.666 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -12.976 5.941 -38.436 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -13.590 2.932 -38.322 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -13.368 3.953 -36.881 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -14.858 2.998 -37.074 1.00 0.00 H new ATOM 1346 N GLN A 91 -17.328 5.290 -34.322 1.00 0.00 N ATOM 1347 CA GLN A 91 -17.938 5.960 -33.194 1.00 0.00 C ATOM 1348 C GLN A 91 -17.042 5.802 -31.979 1.00 0.00 C ATOM 1349 O GLN A 91 -16.120 4.984 -31.985 1.00 0.00 O ATOM 1350 CB GLN A 91 -19.309 5.340 -32.923 1.00 0.00 C ATOM 1351 CG GLN A 91 -20.281 6.255 -32.200 1.00 0.00 C ATOM 1352 CD GLN A 91 -21.672 5.652 -32.101 1.00 0.00 C ATOM 1353 OE1 GLN A 91 -22.410 5.917 -31.152 1.00 0.00 O ATOM 1354 NE2 GLN A 91 -22.039 4.841 -33.085 1.00 0.00 N ATOM 0 H GLN A 91 -17.048 4.327 -34.133 1.00 0.00 H new ATOM 0 HA GLN A 91 -18.064 7.021 -33.410 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -19.751 5.038 -33.872 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -19.174 4.434 -32.332 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -19.905 6.463 -31.198 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -20.337 7.209 -32.724 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -21.396 4.648 -33.853 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -22.964 4.411 -33.073 1.00 0.00 H new ATOM 1363 N VAL A 92 -17.324 6.557 -30.935 1.00 0.00 N ATOM 1364 CA VAL A 92 -16.514 6.516 -29.733 1.00 0.00 C ATOM 1365 C VAL A 92 -16.900 5.305 -28.899 1.00 0.00 C ATOM 1366 O VAL A 92 -18.084 5.016 -28.728 1.00 0.00 O ATOM 1367 CB VAL A 92 -16.681 7.791 -28.884 1.00 0.00 C ATOM 1368 CG1 VAL A 92 -15.748 7.761 -27.685 1.00 0.00 C ATOM 1369 CG2 VAL A 92 -16.433 9.031 -29.727 1.00 0.00 C ATOM 0 H VAL A 92 -18.109 7.207 -30.895 1.00 0.00 H new ATOM 0 HA VAL A 92 -15.470 6.449 -30.040 1.00 0.00 H new ATOM 0 HB VAL A 92 -17.707 7.827 -28.517 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -15.881 8.670 -27.098 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -15.978 6.893 -27.067 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -14.716 7.699 -28.029 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -16.556 9.921 -29.110 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -15.419 9.003 -30.126 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -17.146 9.060 -30.551 1.00 0.00 H new ATOM 1379 N GLY A 93 -15.904 4.591 -28.400 1.00 0.00 N ATOM 1380 CA GLY A 93 -16.173 3.416 -27.609 1.00 0.00 C ATOM 1381 C GLY A 93 -16.201 2.157 -28.449 1.00 0.00 C ATOM 1382 O GLY A 93 -16.435 1.062 -27.936 1.00 0.00 O ATOM 0 H GLY A 93 -14.915 4.806 -28.530 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -15.411 3.318 -26.836 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -17.130 3.533 -27.101 1.00 0.00 H new ATOM 1386 N MET A 94 -15.957 2.308 -29.746 1.00 0.00 N ATOM 1387 CA MET A 94 -15.973 1.169 -30.644 1.00 0.00 C ATOM 1388 C MET A 94 -14.631 0.473 -30.608 1.00 0.00 C ATOM 1389 O MET A 94 -13.574 1.111 -30.642 1.00 0.00 O ATOM 1390 CB MET A 94 -16.317 1.598 -32.075 1.00 0.00 C ATOM 1391 CG MET A 94 -17.772 1.995 -32.266 1.00 0.00 C ATOM 1392 SD MET A 94 -18.720 0.768 -33.193 1.00 0.00 S ATOM 1393 CE MET A 94 -17.977 0.916 -34.820 1.00 0.00 C ATOM 0 H MET A 94 -15.748 3.201 -30.192 1.00 0.00 H new ATOM 0 HA MET A 94 -16.746 0.476 -30.311 1.00 0.00 H new ATOM 0 HB2 MET A 94 -15.682 2.438 -32.355 1.00 0.00 H new ATOM 0 HB3 MET A 94 -16.081 0.780 -32.756 1.00 0.00 H new ATOM 0 HG2 MET A 94 -18.234 2.142 -31.290 1.00 0.00 H new ATOM 0 HG3 MET A 94 -17.817 2.951 -32.787 1.00 0.00 H new ATOM 0 HE1 MET A 94 -18.759 0.905 -35.579 1.00 0.00 H new ATOM 0 HE2 MET A 94 -17.423 1.852 -34.883 1.00 0.00 H new ATOM 0 HE3 MET A 94 -17.297 0.080 -34.987 1.00 0.00 H new ATOM 1403 N ARG A 95 -14.696 -0.835 -30.519 1.00 0.00 N ATOM 1404 CA ARG A 95 -13.532 -1.677 -30.466 1.00 0.00 C ATOM 1405 C ARG A 95 -13.524 -2.628 -31.644 1.00 0.00 C ATOM 1406 O ARG A 95 -14.547 -3.222 -31.983 1.00 0.00 O ATOM 1407 CB ARG A 95 -13.555 -2.466 -29.178 1.00 0.00 C ATOM 1408 CG ARG A 95 -13.355 -1.616 -27.948 1.00 0.00 C ATOM 1409 CD ARG A 95 -13.542 -2.439 -26.697 1.00 0.00 C ATOM 1410 NE ARG A 95 -13.787 -1.607 -25.525 1.00 0.00 N ATOM 1411 CZ ARG A 95 -14.646 -1.910 -24.553 1.00 0.00 C ATOM 1412 NH1 ARG A 95 -15.382 -3.018 -24.622 1.00 0.00 N ATOM 1413 NH2 ARG A 95 -14.776 -1.091 -23.518 1.00 0.00 N ATOM 0 H ARG A 95 -15.576 -1.349 -30.481 1.00 0.00 H new ATOM 0 HA ARG A 95 -12.635 -1.059 -30.507 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -14.508 -2.988 -29.098 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -12.776 -3.228 -29.214 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -12.355 -1.182 -27.958 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -14.063 -0.787 -27.953 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -14.378 -3.124 -26.836 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -12.655 -3.049 -26.529 1.00 0.00 H new ATOM 0 HE ARG A 95 -13.266 -0.734 -25.444 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -15.290 -3.642 -25.424 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -16.037 -3.242 -23.873 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -14.221 -0.237 -23.471 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -15.431 -1.315 -22.769 1.00 0.00 H new ATOM 1427 N PHE A 96 -12.369 -2.770 -32.252 1.00 0.00 N ATOM 1428 CA PHE A 96 -12.224 -3.603 -33.437 1.00 0.00 C ATOM 1429 C PHE A 96 -10.758 -3.912 -33.692 1.00 0.00 C ATOM 1430 O PHE A 96 -9.871 -3.279 -33.109 1.00 0.00 O ATOM 1431 CB PHE A 96 -12.841 -2.905 -34.660 1.00 0.00 C ATOM 1432 CG PHE A 96 -12.401 -1.477 -34.842 1.00 0.00 C ATOM 1433 CD1 PHE A 96 -11.145 -1.180 -35.344 1.00 0.00 C ATOM 1434 CD2 PHE A 96 -13.251 -0.430 -34.515 1.00 0.00 C ATOM 1435 CE1 PHE A 96 -10.744 0.130 -35.515 1.00 0.00 C ATOM 1436 CE2 PHE A 96 -12.854 0.879 -34.683 1.00 0.00 C ATOM 1437 CZ PHE A 96 -11.599 1.162 -35.183 1.00 0.00 C ATOM 0 H PHE A 96 -11.507 -2.318 -31.947 1.00 0.00 H new ATOM 0 HA PHE A 96 -12.753 -4.541 -33.267 1.00 0.00 H new ATOM 0 HB2 PHE A 96 -12.583 -3.470 -35.556 1.00 0.00 H new ATOM 0 HB3 PHE A 96 -13.927 -2.930 -34.569 1.00 0.00 H new ATOM 0 HD1 PHE A 96 -10.471 -1.983 -35.605 1.00 0.00 H new ATOM 0 HD2 PHE A 96 -14.235 -0.643 -34.124 1.00 0.00 H new ATOM 0 HE1 PHE A 96 -9.762 0.347 -35.908 1.00 0.00 H new ATOM 0 HE2 PHE A 96 -13.525 1.684 -34.423 1.00 0.00 H new ATOM 0 HZ PHE A 96 -11.287 2.188 -35.314 1.00 0.00 H new ATOM 1447 N LEU A 97 -10.505 -4.892 -34.544 1.00 0.00 N ATOM 1448 CA LEU A 97 -9.153 -5.172 -34.977 1.00 0.00 C ATOM 1449 C LEU A 97 -8.806 -4.349 -36.192 1.00 0.00 C ATOM 1450 O LEU A 97 -9.573 -4.263 -37.153 1.00 0.00 O ATOM 1451 CB LEU A 97 -8.947 -6.654 -35.280 1.00 0.00 C ATOM 1452 CG LEU A 97 -8.228 -7.426 -34.188 1.00 0.00 C ATOM 1453 CD1 LEU A 97 -8.148 -8.905 -34.524 1.00 0.00 C ATOM 1454 CD2 LEU A 97 -6.846 -6.861 -33.944 1.00 0.00 C ATOM 0 H LEU A 97 -11.217 -5.502 -34.946 1.00 0.00 H new ATOM 0 HA LEU A 97 -8.489 -4.902 -34.155 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -9.919 -7.115 -35.453 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -8.380 -6.747 -36.207 1.00 0.00 H new ATOM 0 HG LEU A 97 -8.808 -7.318 -33.271 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -7.628 -9.432 -33.724 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -9.155 -9.309 -34.630 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -7.604 -9.037 -35.459 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -6.353 -7.432 -33.157 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -6.260 -6.925 -34.861 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -6.928 -5.818 -33.638 1.00 0.00 H new ATOM 1466 N ALA A 98 -7.647 -3.747 -36.126 1.00 0.00 N ATOM 1467 CA ALA A 98 -7.134 -2.941 -37.220 1.00 0.00 C ATOM 1468 C ALA A 98 -5.921 -3.627 -37.814 1.00 0.00 C ATOM 1469 O ALA A 98 -4.897 -3.760 -37.148 1.00 0.00 O ATOM 1470 CB ALA A 98 -6.780 -1.543 -36.736 1.00 0.00 C ATOM 0 H ALA A 98 -7.028 -3.797 -35.317 1.00 0.00 H new ATOM 0 HA ALA A 98 -7.902 -2.841 -37.987 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -6.398 -0.955 -37.570 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -7.670 -1.062 -36.331 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -6.018 -1.609 -35.959 1.00 0.00 H new ATOM 1476 N GLU A 99 -6.023 -4.072 -39.053 1.00 0.00 N ATOM 1477 CA GLU A 99 -4.970 -4.886 -39.624 1.00 0.00 C ATOM 1478 C GLU A 99 -3.905 -4.022 -40.248 1.00 0.00 C ATOM 1479 O GLU A 99 -4.009 -3.571 -41.390 1.00 0.00 O ATOM 1480 CB GLU A 99 -5.502 -5.860 -40.640 1.00 0.00 C ATOM 1481 CG GLU A 99 -6.721 -6.630 -40.168 1.00 0.00 C ATOM 1482 CD GLU A 99 -7.266 -7.563 -41.225 1.00 0.00 C ATOM 1483 OE1 GLU A 99 -7.977 -7.085 -42.135 1.00 0.00 O ATOM 1484 OE2 GLU A 99 -6.977 -8.778 -41.157 1.00 0.00 O ATOM 0 H GLU A 99 -6.811 -3.887 -39.673 1.00 0.00 H new ATOM 0 HA GLU A 99 -4.531 -5.459 -38.808 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -5.756 -5.318 -41.551 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -4.714 -6.568 -40.899 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -6.461 -7.206 -39.280 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -7.499 -5.926 -39.874 1.00 0.00 H new ATOM 1491 N THR A 100 -2.889 -3.811 -39.466 1.00 0.00 N ATOM 1492 CA THR A 100 -1.792 -2.933 -39.820 1.00 0.00 C ATOM 1493 C THR A 100 -0.637 -3.704 -40.446 1.00 0.00 C ATOM 1494 O THR A 100 -0.742 -4.911 -40.697 1.00 0.00 O ATOM 1495 CB THR A 100 -1.278 -2.161 -38.586 1.00 0.00 C ATOM 1496 OG1 THR A 100 -0.615 -3.053 -37.678 1.00 0.00 O ATOM 1497 CG2 THR A 100 -2.431 -1.477 -37.869 1.00 0.00 C ATOM 0 H THR A 100 -2.789 -4.246 -38.549 1.00 0.00 H new ATOM 0 HA THR A 100 -2.179 -2.225 -40.552 1.00 0.00 H new ATOM 0 HB THR A 100 -0.571 -1.406 -38.929 1.00 0.00 H new ATOM 0 HG1 THR A 100 -0.915 -3.971 -37.844 1.00 0.00 H new ATOM 0 HG21 THR A 100 -2.051 -0.937 -37.002 1.00 0.00 H new ATOM 0 HG22 THR A 100 -2.917 -0.776 -38.548 1.00 0.00 H new ATOM 0 HG23 THR A 100 -3.152 -2.226 -37.543 1.00 0.00 H new ATOM 1505 N ASP A 101 0.451 -2.989 -40.694 1.00 0.00 N ATOM 1506 CA ASP A 101 1.664 -3.551 -41.277 1.00 0.00 C ATOM 1507 C ASP A 101 2.120 -4.791 -40.518 1.00 0.00 C ATOM 1508 O ASP A 101 2.465 -5.815 -41.108 1.00 0.00 O ATOM 1509 CB ASP A 101 2.766 -2.493 -41.222 1.00 0.00 C ATOM 1510 CG ASP A 101 2.338 -1.178 -41.846 1.00 0.00 C ATOM 1511 OD1 ASP A 101 2.450 -1.028 -43.079 1.00 0.00 O ATOM 1512 OD2 ASP A 101 1.867 -0.290 -41.103 1.00 0.00 O ATOM 0 H ASP A 101 0.519 -1.991 -40.494 1.00 0.00 H new ATOM 0 HA ASP A 101 1.456 -3.842 -42.307 1.00 0.00 H new ATOM 0 HB2 ASP A 101 3.051 -2.323 -40.184 1.00 0.00 H new ATOM 0 HB3 ASP A 101 3.650 -2.866 -41.739 1.00 0.00 H new ATOM 1517 N GLN A 102 2.071 -4.688 -39.203 1.00 0.00 N ATOM 1518 CA GLN A 102 2.556 -5.736 -38.315 1.00 0.00 C ATOM 1519 C GLN A 102 1.411 -6.603 -37.818 1.00 0.00 C ATOM 1520 O GLN A 102 1.431 -7.109 -36.695 1.00 0.00 O ATOM 1521 CB GLN A 102 3.289 -5.098 -37.141 1.00 0.00 C ATOM 1522 CG GLN A 102 2.527 -3.935 -36.531 1.00 0.00 C ATOM 1523 CD GLN A 102 3.433 -2.962 -35.816 1.00 0.00 C ATOM 1524 OE1 GLN A 102 4.421 -3.346 -35.193 1.00 0.00 O ATOM 1525 NE2 GLN A 102 3.137 -1.685 -35.969 1.00 0.00 N ATOM 0 H GLN A 102 1.694 -3.875 -38.716 1.00 0.00 H new ATOM 0 HA GLN A 102 3.242 -6.379 -38.867 1.00 0.00 H new ATOM 0 HB2 GLN A 102 3.464 -5.853 -36.375 1.00 0.00 H new ATOM 0 HB3 GLN A 102 4.267 -4.750 -37.475 1.00 0.00 H new ATOM 0 HG2 GLN A 102 1.982 -3.410 -37.316 1.00 0.00 H new ATOM 0 HG3 GLN A 102 1.785 -4.318 -35.830 1.00 0.00 H new ATOM 0 HE21 GLN A 102 2.306 -1.414 -36.495 1.00 0.00 H new ATOM 0 HE22 GLN A 102 3.739 -0.970 -35.562 1.00 0.00 H new ATOM 1534 N GLY A 103 0.405 -6.757 -38.656 1.00 0.00 N ATOM 1535 CA GLY A 103 -0.736 -7.562 -38.282 1.00 0.00 C ATOM 1536 C GLY A 103 -1.834 -6.726 -37.668 1.00 0.00 C ATOM 1537 O GLY A 103 -1.699 -5.506 -37.546 1.00 0.00 O ATOM 0 H GLY A 103 0.355 -6.342 -39.586 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -1.121 -8.078 -39.161 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -0.423 -8.329 -37.573 1.00 0.00 H new ATOM 1541 N PRO A 104 -2.943 -7.354 -37.284 1.00 0.00 N ATOM 1542 CA PRO A 104 -4.049 -6.664 -36.643 1.00 0.00 C ATOM 1543 C PRO A 104 -3.672 -6.139 -35.260 1.00 0.00 C ATOM 1544 O PRO A 104 -2.860 -6.731 -34.546 1.00 0.00 O ATOM 1545 CB PRO A 104 -5.163 -7.714 -36.547 1.00 0.00 C ATOM 1546 CG PRO A 104 -4.688 -8.903 -37.314 1.00 0.00 C ATOM 1547 CD PRO A 104 -3.198 -8.785 -37.458 1.00 0.00 C ATOM 0 HA PRO A 104 -4.353 -5.785 -37.211 1.00 0.00 H new ATOM 0 HB2 PRO A 104 -5.361 -7.976 -35.508 1.00 0.00 H new ATOM 0 HB3 PRO A 104 -6.095 -7.331 -36.962 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -4.951 -9.824 -36.794 1.00 0.00 H new ATOM 0 HG3 PRO A 104 -5.165 -8.943 -38.293 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -2.675 -9.379 -36.708 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -2.861 -9.136 -38.434 1.00 0.00 H new ATOM 1555 N VAL A 105 -4.274 -5.020 -34.904 1.00 0.00 N ATOM 1556 CA VAL A 105 -4.030 -4.355 -33.637 1.00 0.00 C ATOM 1557 C VAL A 105 -5.368 -3.960 -33.024 1.00 0.00 C ATOM 1558 O VAL A 105 -6.124 -3.196 -33.624 1.00 0.00 O ATOM 1559 CB VAL A 105 -3.149 -3.096 -33.808 1.00 0.00 C ATOM 1560 CG1 VAL A 105 -2.909 -2.411 -32.471 1.00 0.00 C ATOM 1561 CG2 VAL A 105 -1.826 -3.443 -34.475 1.00 0.00 C ATOM 0 H VAL A 105 -4.955 -4.541 -35.494 1.00 0.00 H new ATOM 0 HA VAL A 105 -3.495 -5.046 -32.985 1.00 0.00 H new ATOM 0 HB VAL A 105 -3.685 -2.401 -34.454 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -2.287 -1.529 -32.621 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -3.864 -2.112 -32.039 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -2.404 -3.101 -31.794 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -1.225 -2.540 -34.583 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -1.288 -4.165 -33.861 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -2.016 -3.873 -35.459 1.00 0.00 H new ATOM 1571 N PRO A 106 -5.703 -4.516 -31.852 1.00 0.00 N ATOM 1572 CA PRO A 106 -6.969 -4.234 -31.178 1.00 0.00 C ATOM 1573 C PRO A 106 -6.976 -2.849 -30.550 1.00 0.00 C ATOM 1574 O PRO A 106 -6.387 -2.638 -29.489 1.00 0.00 O ATOM 1575 CB PRO A 106 -7.060 -5.314 -30.086 1.00 0.00 C ATOM 1576 CG PRO A 106 -5.915 -6.245 -30.328 1.00 0.00 C ATOM 1577 CD PRO A 106 -4.884 -5.461 -31.088 1.00 0.00 C ATOM 0 HA PRO A 106 -7.810 -4.251 -31.871 1.00 0.00 H new ATOM 0 HB2 PRO A 106 -6.998 -4.870 -29.092 1.00 0.00 H new ATOM 0 HB3 PRO A 106 -8.011 -5.844 -30.140 1.00 0.00 H new ATOM 0 HG2 PRO A 106 -5.507 -6.612 -29.386 1.00 0.00 H new ATOM 0 HG3 PRO A 106 -6.237 -7.117 -30.897 1.00 0.00 H new ATOM 0 HD2 PRO A 106 -4.190 -4.949 -30.421 1.00 0.00 H new ATOM 0 HD3 PRO A 106 -4.287 -6.100 -31.739 1.00 0.00 H new ATOM 1585 N VAL A 107 -7.637 -1.904 -31.200 1.00 0.00 N ATOM 1586 CA VAL A 107 -7.675 -0.533 -30.718 1.00 0.00 C ATOM 1587 C VAL A 107 -9.103 -0.110 -30.411 1.00 0.00 C ATOM 1588 O VAL A 107 -10.057 -0.630 -30.996 1.00 0.00 O ATOM 1589 CB VAL A 107 -7.077 0.446 -31.755 1.00 0.00 C ATOM 1590 CG1 VAL A 107 -5.561 0.325 -31.793 1.00 0.00 C ATOM 1591 CG2 VAL A 107 -7.665 0.189 -33.136 1.00 0.00 C ATOM 0 H VAL A 107 -8.155 -2.062 -32.064 1.00 0.00 H new ATOM 0 HA VAL A 107 -7.076 -0.497 -29.808 1.00 0.00 H new ATOM 0 HB VAL A 107 -7.335 1.461 -31.454 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -5.159 1.022 -32.529 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -5.153 0.559 -30.810 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -5.284 -0.693 -32.068 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -7.232 0.888 -33.852 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -7.439 -0.832 -33.443 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -8.746 0.327 -33.103 1.00 0.00 H new ATOM 1601 N GLU A 108 -9.248 0.815 -29.475 1.00 0.00 N ATOM 1602 CA GLU A 108 -10.555 1.347 -29.145 1.00 0.00 C ATOM 1603 C GLU A 108 -10.616 2.832 -29.463 1.00 0.00 C ATOM 1604 O GLU A 108 -9.682 3.585 -29.180 1.00 0.00 O ATOM 1605 CB GLU A 108 -10.887 1.107 -27.671 1.00 0.00 C ATOM 1606 CG GLU A 108 -12.251 1.640 -27.247 1.00 0.00 C ATOM 1607 CD GLU A 108 -12.378 1.735 -25.743 1.00 0.00 C ATOM 1608 OE1 GLU A 108 -12.657 0.708 -25.094 1.00 0.00 O ATOM 1609 OE2 GLU A 108 -12.182 2.838 -25.197 1.00 0.00 O ATOM 0 H GLU A 108 -8.479 1.210 -28.934 1.00 0.00 H new ATOM 0 HA GLU A 108 -11.297 0.826 -29.751 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -10.849 0.036 -27.470 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -10.118 1.574 -27.055 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -12.409 2.625 -27.687 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -13.033 0.988 -27.637 1.00 0.00 H new ATOM 1616 N ILE A 109 -11.734 3.233 -30.037 1.00 0.00 N ATOM 1617 CA ILE A 109 -11.938 4.614 -30.429 1.00 0.00 C ATOM 1618 C ILE A 109 -12.374 5.441 -29.225 1.00 0.00 C ATOM 1619 O ILE A 109 -13.304 5.073 -28.514 1.00 0.00 O ATOM 1620 CB ILE A 109 -12.971 4.752 -31.569 1.00 0.00 C ATOM 1621 CG1 ILE A 109 -12.466 4.045 -32.831 1.00 0.00 C ATOM 1622 CG2 ILE A 109 -13.246 6.220 -31.855 1.00 0.00 C ATOM 1623 CD1 ILE A 109 -13.330 4.266 -34.060 1.00 0.00 C ATOM 0 H ILE A 109 -12.520 2.617 -30.243 1.00 0.00 H new ATOM 0 HA ILE A 109 -10.986 4.989 -30.806 1.00 0.00 H new ATOM 0 HB ILE A 109 -13.903 4.280 -31.257 1.00 0.00 H new ATOM 0 HG12 ILE A 109 -11.454 4.389 -33.046 1.00 0.00 H new ATOM 0 HG13 ILE A 109 -12.403 2.975 -32.633 1.00 0.00 H new ATOM 0 HG21 ILE A 109 -13.976 6.303 -32.660 1.00 0.00 H new ATOM 0 HG22 ILE A 109 -13.640 6.698 -30.958 1.00 0.00 H new ATOM 0 HG23 ILE A 109 -12.320 6.713 -32.152 1.00 0.00 H new ATOM 0 HD11 ILE A 109 -12.901 3.731 -34.907 1.00 0.00 H new ATOM 0 HD12 ILE A 109 -14.337 3.895 -33.869 1.00 0.00 H new ATOM 0 HD13 ILE A 109 -13.373 5.331 -34.288 1.00 0.00 H new ATOM 1635 N THR A 110 -11.698 6.554 -29.003 1.00 0.00 N ATOM 1636 CA THR A 110 -11.989 7.429 -27.876 1.00 0.00 C ATOM 1637 C THR A 110 -12.485 8.783 -28.375 1.00 0.00 C ATOM 1638 O THR A 110 -12.717 9.707 -27.594 1.00 0.00 O ATOM 1639 CB THR A 110 -10.742 7.624 -26.990 1.00 0.00 C ATOM 1640 OG1 THR A 110 -9.626 8.010 -27.799 1.00 0.00 O ATOM 1641 CG2 THR A 110 -10.407 6.344 -26.241 1.00 0.00 C ATOM 0 H THR A 110 -10.934 6.878 -29.596 1.00 0.00 H new ATOM 0 HA THR A 110 -12.768 6.958 -27.276 1.00 0.00 H new ATOM 0 HB THR A 110 -10.957 8.408 -26.264 1.00 0.00 H new ATOM 0 HG1 THR A 110 -8.837 8.134 -27.231 1.00 0.00 H new ATOM 0 HG21 THR A 110 -9.524 6.505 -25.622 1.00 0.00 H new ATOM 0 HG22 THR A 110 -11.248 6.063 -25.607 1.00 0.00 H new ATOM 0 HG23 THR A 110 -10.209 5.545 -26.956 1.00 0.00 H new ATOM 1649 N ALA A 111 -12.659 8.864 -29.694 1.00 0.00 N ATOM 1650 CA ALA A 111 -13.087 10.086 -30.372 1.00 0.00 C ATOM 1651 C ALA A 111 -13.117 9.885 -31.865 1.00 0.00 C ATOM 1652 O ALA A 111 -12.354 9.086 -32.411 1.00 0.00 O ATOM 1653 CB ALA A 111 -12.174 11.255 -30.047 1.00 0.00 C ATOM 0 H ALA A 111 -12.506 8.078 -30.326 1.00 0.00 H new ATOM 0 HA ALA A 111 -14.090 10.315 -30.013 1.00 0.00 H new ATOM 0 HB1 ALA A 111 -12.524 12.146 -30.569 1.00 0.00 H new ATOM 0 HB2 ALA A 111 -12.184 11.437 -28.972 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -11.158 11.023 -30.366 1.00 0.00 H new ATOM 1659 N VAL A 112 -13.989 10.626 -32.518 1.00 0.00 N ATOM 1660 CA VAL A 112 -14.132 10.584 -33.953 1.00 0.00 C ATOM 1661 C VAL A 112 -14.366 11.995 -34.433 1.00 0.00 C ATOM 1662 O VAL A 112 -15.416 12.584 -34.173 1.00 0.00 O ATOM 1663 CB VAL A 112 -15.318 9.710 -34.404 1.00 0.00 C ATOM 1664 CG1 VAL A 112 -15.386 9.650 -35.927 1.00 0.00 C ATOM 1665 CG2 VAL A 112 -15.215 8.318 -33.807 1.00 0.00 C ATOM 0 H VAL A 112 -14.623 11.280 -32.059 1.00 0.00 H new ATOM 0 HA VAL A 112 -13.226 10.148 -34.374 1.00 0.00 H new ATOM 0 HB VAL A 112 -16.241 10.163 -34.041 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -16.229 9.029 -36.229 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -15.515 10.656 -36.325 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -14.462 9.222 -36.316 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -16.062 7.717 -34.138 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -14.287 7.849 -34.135 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -15.222 8.387 -32.719 1.00 0.00 H new ATOM 1675 N GLU A 113 -13.387 12.556 -35.104 1.00 0.00 N ATOM 1676 CA GLU A 113 -13.498 13.915 -35.586 1.00 0.00 C ATOM 1677 C GLU A 113 -14.074 13.922 -36.996 1.00 0.00 C ATOM 1678 O GLU A 113 -14.776 12.990 -37.391 1.00 0.00 O ATOM 1679 CB GLU A 113 -12.129 14.593 -35.562 1.00 0.00 C ATOM 1680 CG GLU A 113 -11.484 14.575 -34.191 1.00 0.00 C ATOM 1681 CD GLU A 113 -10.240 15.430 -34.118 1.00 0.00 C ATOM 1682 OE1 GLU A 113 -10.330 16.640 -34.388 1.00 0.00 O ATOM 1683 OE2 GLU A 113 -9.157 14.889 -33.812 1.00 0.00 O ATOM 0 H GLU A 113 -12.506 12.094 -35.329 1.00 0.00 H new ATOM 0 HA GLU A 113 -14.171 14.471 -34.933 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -11.471 14.095 -36.274 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -12.235 15.626 -35.894 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -12.204 14.925 -33.451 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -11.230 13.548 -33.928 1.00 0.00 H new ATOM 1690 N ASP A 114 -13.762 14.954 -37.757 1.00 0.00 N ATOM 1691 CA ASP A 114 -14.334 15.118 -39.085 1.00 0.00 C ATOM 1692 C ASP A 114 -13.784 14.104 -40.078 1.00 0.00 C ATOM 1693 O ASP A 114 -14.514 13.622 -40.946 1.00 0.00 O ATOM 1694 CB ASP A 114 -14.082 16.531 -39.603 1.00 0.00 C ATOM 1695 CG ASP A 114 -14.892 17.569 -38.855 1.00 0.00 C ATOM 1696 OD1 ASP A 114 -16.034 17.855 -39.270 1.00 0.00 O ATOM 1697 OD2 ASP A 114 -14.395 18.098 -37.837 1.00 0.00 O ATOM 0 H ASP A 114 -13.116 15.693 -37.480 1.00 0.00 H new ATOM 0 HA ASP A 114 -15.406 14.946 -38.993 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -13.021 16.766 -39.512 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -14.328 16.576 -40.664 1.00 0.00 H new ATOM 1702 N ASP A 115 -12.505 13.764 -39.957 1.00 0.00 N ATOM 1703 CA ASP A 115 -11.860 12.928 -40.973 1.00 0.00 C ATOM 1704 C ASP A 115 -11.047 11.789 -40.353 1.00 0.00 C ATOM 1705 O ASP A 115 -10.640 10.858 -41.046 1.00 0.00 O ATOM 1706 CB ASP A 115 -10.973 13.759 -41.897 1.00 0.00 C ATOM 1707 CG ASP A 115 -9.876 14.492 -41.156 1.00 0.00 C ATOM 1708 OD1 ASP A 115 -8.809 13.893 -40.910 1.00 0.00 O ATOM 1709 OD2 ASP A 115 -10.079 15.672 -40.804 1.00 0.00 O ATOM 0 H ASP A 115 -11.902 14.045 -39.184 1.00 0.00 H new ATOM 0 HA ASP A 115 -12.663 12.485 -41.562 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -10.525 13.106 -42.646 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -11.590 14.482 -42.431 1.00 0.00 H new ATOM 1714 N HIS A 116 -10.780 11.879 -39.057 1.00 0.00 N ATOM 1715 CA HIS A 116 -9.971 10.874 -38.380 1.00 0.00 C ATOM 1716 C HIS A 116 -10.543 10.556 -37.017 1.00 0.00 C ATOM 1717 O HIS A 116 -11.273 11.362 -36.442 1.00 0.00 O ATOM 1718 CB HIS A 116 -8.520 11.358 -38.243 1.00 0.00 C ATOM 1719 CG HIS A 116 -8.390 12.708 -37.601 1.00 0.00 C ATOM 1720 ND1 HIS A 116 -8.526 13.884 -38.299 1.00 0.00 N ATOM 1721 CD2 HIS A 116 -8.174 13.062 -36.315 1.00 0.00 C ATOM 1722 CE1 HIS A 116 -8.407 14.903 -37.474 1.00 0.00 C ATOM 1723 NE2 HIS A 116 -8.192 14.434 -36.259 1.00 0.00 N ATOM 0 H HIS A 116 -11.110 12.634 -38.456 1.00 0.00 H new ATOM 0 HA HIS A 116 -9.984 9.965 -38.982 1.00 0.00 H new ATOM 0 HB2 HIS A 116 -7.958 10.631 -37.656 1.00 0.00 H new ATOM 0 HB3 HIS A 116 -8.063 11.391 -39.232 1.00 0.00 H new ATOM 0 HD1 HIS A 116 -8.693 13.956 -39.303 1.00 0.00 H new ATOM 0 HD2 HIS A 116 -8.016 12.390 -35.484 1.00 0.00 H new ATOM 0 HE1 HIS A 116 -8.474 15.946 -37.745 1.00 0.00 H new ATOM 1732 N VAL A 117 -10.208 9.386 -36.506 1.00 0.00 N ATOM 1733 CA VAL A 117 -10.647 8.968 -35.193 1.00 0.00 C ATOM 1734 C VAL A 117 -9.441 8.888 -34.270 1.00 0.00 C ATOM 1735 O VAL A 117 -8.301 8.943 -34.727 1.00 0.00 O ATOM 1736 CB VAL A 117 -11.345 7.593 -35.243 1.00 0.00 C ATOM 1737 CG1 VAL A 117 -12.548 7.639 -36.164 1.00 0.00 C ATOM 1738 CG2 VAL A 117 -10.381 6.505 -35.690 1.00 0.00 C ATOM 0 H VAL A 117 -9.626 8.702 -36.990 1.00 0.00 H new ATOM 0 HA VAL A 117 -11.366 9.698 -34.821 1.00 0.00 H new ATOM 0 HB VAL A 117 -11.684 7.354 -34.235 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -13.027 6.660 -36.186 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -13.257 8.382 -35.799 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -12.226 7.908 -37.170 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -10.900 5.547 -35.716 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -10.003 6.740 -36.685 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -9.548 6.447 -34.990 1.00 0.00 H new ATOM 1748 N VAL A 118 -9.694 8.773 -32.985 1.00 0.00 N ATOM 1749 CA VAL A 118 -8.624 8.661 -32.006 1.00 0.00 C ATOM 1750 C VAL A 118 -8.712 7.317 -31.297 1.00 0.00 C ATOM 1751 O VAL A 118 -9.709 7.027 -30.644 1.00 0.00 O ATOM 1752 CB VAL A 118 -8.688 9.795 -30.961 1.00 0.00 C ATOM 1753 CG1 VAL A 118 -7.500 9.728 -30.011 1.00 0.00 C ATOM 1754 CG2 VAL A 118 -8.757 11.152 -31.640 1.00 0.00 C ATOM 0 H VAL A 118 -10.633 8.754 -32.588 1.00 0.00 H new ATOM 0 HA VAL A 118 -7.677 8.742 -32.539 1.00 0.00 H new ATOM 0 HB VAL A 118 -9.597 9.661 -30.375 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -7.569 10.538 -29.285 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -7.505 8.771 -29.489 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -6.575 9.827 -30.578 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -8.801 11.936 -30.884 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -7.871 11.295 -32.259 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -9.648 11.201 -32.266 1.00 0.00 H new ATOM 1764 N VAL A 119 -7.684 6.493 -31.439 1.00 0.00 N ATOM 1765 CA VAL A 119 -7.684 5.183 -30.794 1.00 0.00 C ATOM 1766 C VAL A 119 -6.523 5.014 -29.836 1.00 0.00 C ATOM 1767 O VAL A 119 -5.397 5.447 -30.100 1.00 0.00 O ATOM 1768 CB VAL A 119 -7.680 4.009 -31.789 1.00 0.00 C ATOM 1769 CG1 VAL A 119 -9.008 3.915 -32.503 1.00 0.00 C ATOM 1770 CG2 VAL A 119 -6.542 4.131 -32.786 1.00 0.00 C ATOM 0 H VAL A 119 -6.849 6.701 -31.986 1.00 0.00 H new ATOM 0 HA VAL A 119 -8.621 5.155 -30.238 1.00 0.00 H new ATOM 0 HB VAL A 119 -7.525 3.091 -31.222 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -8.987 3.079 -33.202 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -9.803 3.758 -31.774 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -9.194 4.840 -33.049 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -6.569 3.286 -33.474 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -6.648 5.059 -33.347 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -5.591 4.136 -32.254 1.00 0.00 H new ATOM 1780 N ASP A 120 -6.827 4.385 -28.717 1.00 0.00 N ATOM 1781 CA ASP A 120 -5.848 4.124 -27.676 1.00 0.00 C ATOM 1782 C ASP A 120 -5.728 2.622 -27.417 1.00 0.00 C ATOM 1783 O ASP A 120 -6.713 1.885 -27.520 1.00 0.00 O ATOM 1784 CB ASP A 120 -6.258 4.853 -26.390 1.00 0.00 C ATOM 1785 CG ASP A 120 -5.279 4.638 -25.255 1.00 0.00 C ATOM 1786 OD1 ASP A 120 -5.353 3.575 -24.598 1.00 0.00 O ATOM 1787 OD2 ASP A 120 -4.439 5.532 -25.014 1.00 0.00 O ATOM 0 H ASP A 120 -7.762 4.039 -28.502 1.00 0.00 H new ATOM 0 HA ASP A 120 -4.876 4.493 -28.004 1.00 0.00 H new ATOM 0 HB2 ASP A 120 -6.342 5.920 -26.594 1.00 0.00 H new ATOM 0 HB3 ASP A 120 -7.245 4.509 -26.082 1.00 0.00 H new ATOM 1915 N LEU A 130 5.390 2.924 -10.638 1.00 0.00 N ATOM 1916 CA LEU A 130 4.493 2.788 -9.512 1.00 0.00 C ATOM 1917 C LEU A 130 5.298 2.604 -8.242 1.00 0.00 C ATOM 1918 O LEU A 130 6.419 2.093 -8.271 1.00 0.00 O ATOM 1919 CB LEU A 130 3.537 1.608 -9.700 1.00 0.00 C ATOM 1920 CG LEU A 130 2.497 1.774 -10.807 1.00 0.00 C ATOM 1921 CD1 LEU A 130 1.617 0.539 -10.882 1.00 0.00 C ATOM 1922 CD2 LEU A 130 1.646 3.016 -10.566 1.00 0.00 C ATOM 0 HA LEU A 130 3.894 3.696 -9.440 1.00 0.00 H new ATOM 0 HB2 LEU A 130 4.126 0.715 -9.910 1.00 0.00 H new ATOM 0 HB3 LEU A 130 3.016 1.432 -8.759 1.00 0.00 H new ATOM 0 HG LEU A 130 3.018 1.897 -11.757 1.00 0.00 H new ATOM 0 HD11 LEU A 130 0.879 0.666 -11.674 1.00 0.00 H new ATOM 0 HD12 LEU A 130 2.233 -0.334 -11.097 1.00 0.00 H new ATOM 0 HD13 LEU A 130 1.107 0.397 -9.929 1.00 0.00 H new ATOM 0 HD21 LEU A 130 0.912 3.115 -11.366 1.00 0.00 H new ATOM 0 HD22 LEU A 130 1.131 2.924 -9.610 1.00 0.00 H new ATOM 0 HD23 LEU A 130 2.286 3.898 -10.550 1.00 0.00 H new ATOM 1934 N LYS A 131 4.722 3.011 -7.137 1.00 0.00 N ATOM 1935 CA LYS A 131 5.382 2.944 -5.858 1.00 0.00 C ATOM 1936 C LYS A 131 4.553 2.116 -4.917 1.00 0.00 C ATOM 1937 O LYS A 131 3.366 2.376 -4.728 1.00 0.00 O ATOM 1938 CB LYS A 131 5.590 4.342 -5.293 1.00 0.00 C ATOM 1939 CG LYS A 131 6.753 5.067 -5.934 1.00 0.00 C ATOM 1940 CD LYS A 131 6.659 6.568 -5.731 1.00 0.00 C ATOM 1941 CE LYS A 131 6.660 6.928 -4.257 1.00 0.00 C ATOM 1942 NZ LYS A 131 7.937 6.541 -3.603 1.00 0.00 N ATOM 0 H LYS A 131 3.779 3.399 -7.100 1.00 0.00 H new ATOM 0 HA LYS A 131 6.361 2.480 -5.981 1.00 0.00 H new ATOM 0 HB2 LYS A 131 4.681 4.926 -5.436 1.00 0.00 H new ATOM 0 HB3 LYS A 131 5.759 4.273 -4.218 1.00 0.00 H new ATOM 0 HG2 LYS A 131 7.688 4.700 -5.511 1.00 0.00 H new ATOM 0 HG3 LYS A 131 6.777 4.845 -7.001 1.00 0.00 H new ATOM 0 HD2 LYS A 131 7.497 7.057 -6.227 1.00 0.00 H new ATOM 0 HD3 LYS A 131 5.749 6.944 -6.198 1.00 0.00 H new ATOM 0 HE2 LYS A 131 6.502 8.000 -4.143 1.00 0.00 H new ATOM 0 HE3 LYS A 131 5.829 6.429 -3.759 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 7.982 6.962 -2.653 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 7.987 5.505 -3.525 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 8.737 6.884 -4.172 1.00 0.00 H new ATOM 1956 N PHE A 132 5.177 1.115 -4.351 1.00 0.00 N ATOM 1957 CA PHE A 132 4.490 0.199 -3.466 1.00 0.00 C ATOM 1958 C PHE A 132 5.075 0.310 -2.079 1.00 0.00 C ATOM 1959 O PHE A 132 6.290 0.338 -1.928 1.00 0.00 O ATOM 1960 CB PHE A 132 4.648 -1.247 -3.951 1.00 0.00 C ATOM 1961 CG PHE A 132 4.649 -1.394 -5.445 1.00 0.00 C ATOM 1962 CD1 PHE A 132 3.463 -1.451 -6.155 1.00 0.00 C ATOM 1963 CD2 PHE A 132 5.846 -1.470 -6.140 1.00 0.00 C ATOM 1964 CE1 PHE A 132 3.469 -1.579 -7.530 1.00 0.00 C ATOM 1965 CE2 PHE A 132 5.857 -1.599 -7.513 1.00 0.00 C ATOM 1966 CZ PHE A 132 4.668 -1.653 -8.210 1.00 0.00 C ATOM 0 H PHE A 132 6.167 0.910 -4.486 1.00 0.00 H new ATOM 0 HA PHE A 132 3.431 0.458 -3.456 1.00 0.00 H new ATOM 0 HB2 PHE A 132 5.580 -1.652 -3.556 1.00 0.00 H new ATOM 0 HB3 PHE A 132 3.838 -1.848 -3.538 1.00 0.00 H new ATOM 0 HD1 PHE A 132 2.522 -1.395 -5.628 1.00 0.00 H new ATOM 0 HD2 PHE A 132 6.780 -1.428 -5.600 1.00 0.00 H new ATOM 0 HE1 PHE A 132 2.536 -1.621 -8.073 1.00 0.00 H new ATOM 0 HE2 PHE A 132 6.797 -1.658 -8.042 1.00 0.00 H new ATOM 0 HZ PHE A 132 4.675 -1.753 -9.285 1.00 0.00 H new ATOM 1976 N ASN A 133 4.241 0.378 -1.068 1.00 0.00 N ATOM 1977 CA ASN A 133 4.724 0.260 0.290 1.00 0.00 C ATOM 1978 C ASN A 133 4.326 -1.114 0.764 1.00 0.00 C ATOM 1979 O ASN A 133 3.148 -1.374 1.003 1.00 0.00 O ATOM 1980 CB ASN A 133 4.105 1.331 1.192 1.00 0.00 C ATOM 1981 CG ASN A 133 4.404 2.737 0.716 1.00 0.00 C ATOM 1982 OD1 ASN A 133 3.674 3.293 -0.101 1.00 0.00 O ATOM 1983 ND2 ASN A 133 5.474 3.326 1.224 1.00 0.00 N ATOM 0 H ASN A 133 3.234 0.513 -1.157 1.00 0.00 H new ATOM 0 HA ASN A 133 5.804 0.401 0.328 1.00 0.00 H new ATOM 0 HB2 ASN A 133 3.025 1.187 1.232 1.00 0.00 H new ATOM 0 HB3 ASN A 133 4.481 1.207 2.207 1.00 0.00 H new ATOM 0 HD21 ASN A 133 5.717 4.275 0.939 1.00 0.00 H new ATOM 0 HD22 ASN A 133 6.056 2.831 1.900 1.00 0.00 H new ATOM 1990 N VAL A 134 5.286 -2.008 0.866 1.00 0.00 N ATOM 1991 CA VAL A 134 4.954 -3.401 1.062 1.00 0.00 C ATOM 1992 C VAL A 134 5.065 -3.818 2.509 1.00 0.00 C ATOM 1993 O VAL A 134 5.978 -3.415 3.231 1.00 0.00 O ATOM 1994 CB VAL A 134 5.864 -4.316 0.232 1.00 0.00 C ATOM 1995 CG1 VAL A 134 5.270 -5.704 0.144 1.00 0.00 C ATOM 1996 CG2 VAL A 134 6.112 -3.743 -1.152 1.00 0.00 C ATOM 0 H VAL A 134 6.284 -1.801 0.818 1.00 0.00 H new ATOM 0 HA VAL A 134 3.919 -3.506 0.737 1.00 0.00 H new ATOM 0 HB VAL A 134 6.829 -4.382 0.735 1.00 0.00 H new ATOM 0 HG11 VAL A 134 5.925 -6.343 -0.448 1.00 0.00 H new ATOM 0 HG12 VAL A 134 5.166 -6.119 1.146 1.00 0.00 H new ATOM 0 HG13 VAL A 134 4.290 -5.651 -0.330 1.00 0.00 H new ATOM 0 HG21 VAL A 134 6.760 -4.416 -1.714 1.00 0.00 H new ATOM 0 HG22 VAL A 134 5.162 -3.633 -1.676 1.00 0.00 H new ATOM 0 HG23 VAL A 134 6.592 -2.768 -1.062 1.00 0.00 H new ATOM 2006 N GLU A 135 4.103 -4.622 2.905 1.00 0.00 N ATOM 2007 CA GLU A 135 4.042 -5.189 4.231 1.00 0.00 C ATOM 2008 C GLU A 135 3.785 -6.689 4.131 1.00 0.00 C ATOM 2009 O GLU A 135 2.639 -7.125 4.060 1.00 0.00 O ATOM 2010 CB GLU A 135 2.923 -4.521 5.035 1.00 0.00 C ATOM 2011 CG GLU A 135 3.078 -3.013 5.160 1.00 0.00 C ATOM 2012 CD GLU A 135 2.081 -2.391 6.119 1.00 0.00 C ATOM 2013 OE1 GLU A 135 2.357 -2.374 7.339 1.00 0.00 O ATOM 2014 OE2 GLU A 135 1.035 -1.894 5.656 1.00 0.00 O ATOM 0 H GLU A 135 3.329 -4.904 2.303 1.00 0.00 H new ATOM 0 HA GLU A 135 4.991 -5.018 4.739 1.00 0.00 H new ATOM 0 HB2 GLU A 135 1.966 -4.741 4.562 1.00 0.00 H new ATOM 0 HB3 GLU A 135 2.893 -4.959 6.033 1.00 0.00 H new ATOM 0 HG2 GLU A 135 4.089 -2.784 5.497 1.00 0.00 H new ATOM 0 HG3 GLU A 135 2.959 -2.559 4.176 1.00 0.00 H new ATOM 2021 N VAL A 136 4.850 -7.472 4.092 1.00 0.00 N ATOM 2022 CA VAL A 136 4.719 -8.926 4.070 1.00 0.00 C ATOM 2023 C VAL A 136 4.062 -9.381 5.379 1.00 0.00 C ATOM 2024 O VAL A 136 4.203 -8.712 6.410 1.00 0.00 O ATOM 2025 CB VAL A 136 6.090 -9.597 3.828 1.00 0.00 C ATOM 2026 CG1 VAL A 136 7.122 -9.085 4.808 1.00 0.00 C ATOM 2027 CG2 VAL A 136 5.988 -11.114 3.876 1.00 0.00 C ATOM 0 H VAL A 136 5.811 -7.132 4.075 1.00 0.00 H new ATOM 0 HA VAL A 136 4.081 -9.234 3.242 1.00 0.00 H new ATOM 0 HB VAL A 136 6.417 -9.327 2.824 1.00 0.00 H new ATOM 0 HG11 VAL A 136 8.078 -9.572 4.617 1.00 0.00 H new ATOM 0 HG12 VAL A 136 7.234 -8.007 4.689 1.00 0.00 H new ATOM 0 HG13 VAL A 136 6.799 -9.306 5.825 1.00 0.00 H new ATOM 0 HG21 VAL A 136 6.971 -11.550 3.702 1.00 0.00 H new ATOM 0 HG22 VAL A 136 5.622 -11.423 4.855 1.00 0.00 H new ATOM 0 HG23 VAL A 136 5.297 -11.457 3.106 1.00 0.00 H new ATOM 2037 N VAL A 137 3.383 -10.536 5.374 1.00 0.00 N ATOM 2038 CA VAL A 137 2.305 -10.687 6.353 1.00 0.00 C ATOM 2039 C VAL A 137 2.606 -12.012 7.003 1.00 0.00 C ATOM 2040 O VAL A 137 2.773 -12.157 8.209 1.00 0.00 O ATOM 2041 CB VAL A 137 0.883 -10.732 5.763 1.00 0.00 C ATOM 2042 CG1 VAL A 137 -0.143 -10.909 6.872 1.00 0.00 C ATOM 2043 CG2 VAL A 137 0.593 -9.478 4.972 1.00 0.00 C ATOM 0 H VAL A 137 3.545 -11.327 4.750 1.00 0.00 H new ATOM 0 HA VAL A 137 2.291 -9.823 7.018 1.00 0.00 H new ATOM 0 HB VAL A 137 0.818 -11.585 5.087 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -1.144 -10.939 6.441 1.00 0.00 H new ATOM 0 HG12 VAL A 137 0.052 -11.841 7.402 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -0.073 -10.074 7.569 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -0.416 -9.530 4.564 1.00 0.00 H new ATOM 0 HG22 VAL A 137 0.676 -8.609 5.625 1.00 0.00 H new ATOM 0 HG23 VAL A 137 1.310 -9.389 4.156 1.00 0.00 H new ATOM 2053 N ALA A 138 2.697 -12.972 6.082 1.00 0.00 N ATOM 2054 CA ALA A 138 2.996 -14.361 6.364 1.00 0.00 C ATOM 2055 C ALA A 138 3.619 -15.017 5.136 1.00 0.00 C ATOM 2056 O ALA A 138 3.427 -14.538 4.020 1.00 0.00 O ATOM 2057 CB ALA A 138 1.714 -15.077 6.725 1.00 0.00 C ATOM 0 H ALA A 138 2.559 -12.789 5.088 1.00 0.00 H new ATOM 0 HA ALA A 138 3.700 -14.421 7.194 1.00 0.00 H new ATOM 0 HB1 ALA A 138 1.930 -16.124 6.939 1.00 0.00 H new ATOM 0 HB2 ALA A 138 1.272 -14.610 7.605 1.00 0.00 H new ATOM 0 HB3 ALA A 138 1.015 -15.014 5.891 1.00 0.00 H new ATOM 2063 N ILE A 139 4.350 -16.108 5.334 1.00 0.00 N ATOM 2064 CA ILE A 139 4.940 -16.861 4.229 1.00 0.00 C ATOM 2065 C ILE A 139 4.786 -18.349 4.515 1.00 0.00 C ATOM 2066 O ILE A 139 5.052 -18.790 5.634 1.00 0.00 O ATOM 2067 CB ILE A 139 6.444 -16.537 4.047 1.00 0.00 C ATOM 2068 CG1 ILE A 139 6.648 -15.047 3.768 1.00 0.00 C ATOM 2069 CG2 ILE A 139 7.040 -17.370 2.918 1.00 0.00 C ATOM 2070 CD1 ILE A 139 8.086 -14.603 3.906 1.00 0.00 C ATOM 0 H ILE A 139 4.550 -16.495 6.256 1.00 0.00 H new ATOM 0 HA ILE A 139 4.423 -16.580 3.312 1.00 0.00 H new ATOM 0 HB ILE A 139 6.958 -16.789 4.975 1.00 0.00 H new ATOM 0 HG12 ILE A 139 6.301 -14.823 2.759 1.00 0.00 H new ATOM 0 HG13 ILE A 139 6.029 -14.468 4.454 1.00 0.00 H new ATOM 0 HG21 ILE A 139 8.097 -17.128 2.806 1.00 0.00 H new ATOM 0 HG22 ILE A 139 6.933 -18.429 3.152 1.00 0.00 H new ATOM 0 HG23 ILE A 139 6.517 -17.149 1.988 1.00 0.00 H new ATOM 0 HD11 ILE A 139 8.159 -13.536 3.695 1.00 0.00 H new ATOM 0 HD12 ILE A 139 8.431 -14.796 4.922 1.00 0.00 H new ATOM 0 HD13 ILE A 139 8.707 -15.156 3.201 1.00 0.00 H new ATOM 2082 N ARG A 140 4.345 -19.115 3.529 1.00 0.00 N ATOM 2083 CA ARG A 140 4.123 -20.538 3.723 1.00 0.00 C ATOM 2084 C ARG A 140 4.595 -21.315 2.500 1.00 0.00 C ATOM 2085 O ARG A 140 4.655 -20.779 1.398 1.00 0.00 O ATOM 2086 CB ARG A 140 2.633 -20.804 3.969 1.00 0.00 C ATOM 2087 CG ARG A 140 2.361 -21.937 4.947 1.00 0.00 C ATOM 2088 CD ARG A 140 0.878 -22.271 5.022 1.00 0.00 C ATOM 2089 NE ARG A 140 0.439 -23.062 3.874 1.00 0.00 N ATOM 2090 CZ ARG A 140 -0.336 -22.604 2.889 1.00 0.00 C ATOM 2091 NH1 ARG A 140 -0.820 -21.366 2.929 1.00 0.00 N ATOM 2092 NH2 ARG A 140 -0.632 -23.394 1.865 1.00 0.00 N ATOM 0 H ARG A 140 4.135 -18.776 2.590 1.00 0.00 H new ATOM 0 HA ARG A 140 4.693 -20.869 4.591 1.00 0.00 H new ATOM 0 HB2 ARG A 140 2.169 -19.893 4.346 1.00 0.00 H new ATOM 0 HB3 ARG A 140 2.154 -21.036 3.018 1.00 0.00 H new ATOM 0 HG2 ARG A 140 2.919 -22.823 4.642 1.00 0.00 H new ATOM 0 HG3 ARG A 140 2.722 -21.658 5.937 1.00 0.00 H new ATOM 0 HD2 ARG A 140 0.676 -22.821 5.941 1.00 0.00 H new ATOM 0 HD3 ARG A 140 0.300 -21.348 5.069 1.00 0.00 H new ATOM 0 HE ARG A 140 0.747 -24.033 3.822 1.00 0.00 H new ATOM 0 HH11 ARG A 140 -0.600 -20.757 3.717 1.00 0.00 H new ATOM 0 HH12 ARG A 140 -1.412 -21.025 2.171 1.00 0.00 H new ATOM 0 HH21 ARG A 140 -0.268 -24.346 1.833 1.00 0.00 H new ATOM 0 HH22 ARG A 140 -1.224 -23.049 1.109 1.00 0.00 H new ATOM 2106 N GLU A 141 4.953 -22.571 2.694 1.00 0.00 N ATOM 2107 CA GLU A 141 5.291 -23.430 1.575 1.00 0.00 C ATOM 2108 C GLU A 141 4.041 -24.165 1.109 1.00 0.00 C ATOM 2109 O GLU A 141 3.286 -24.705 1.920 1.00 0.00 O ATOM 2110 CB GLU A 141 6.415 -24.399 1.956 1.00 0.00 C ATOM 2111 CG GLU A 141 6.119 -25.254 3.179 1.00 0.00 C ATOM 2112 CD GLU A 141 7.340 -25.994 3.677 1.00 0.00 C ATOM 2113 OE1 GLU A 141 7.662 -27.067 3.128 1.00 0.00 O ATOM 2114 OE2 GLU A 141 7.989 -25.503 4.624 1.00 0.00 O ATOM 0 H GLU A 141 5.017 -23.016 3.609 1.00 0.00 H new ATOM 0 HA GLU A 141 5.662 -22.824 0.748 1.00 0.00 H new ATOM 0 HB2 GLU A 141 6.616 -25.055 1.109 1.00 0.00 H new ATOM 0 HB3 GLU A 141 7.325 -23.827 2.139 1.00 0.00 H new ATOM 0 HG2 GLU A 141 5.732 -24.620 3.977 1.00 0.00 H new ATOM 0 HG3 GLU A 141 5.337 -25.973 2.935 1.00 0.00 H new ATOM 2121 N ALA A 142 3.814 -24.157 -0.200 1.00 0.00 N ATOM 2122 CA ALA A 142 2.575 -24.675 -0.761 1.00 0.00 C ATOM 2123 C ALA A 142 2.512 -26.194 -0.713 1.00 0.00 C ATOM 2124 O ALA A 142 3.523 -26.878 -0.558 1.00 0.00 O ATOM 2125 CB ALA A 142 2.389 -24.187 -2.186 1.00 0.00 C ATOM 0 H ALA A 142 4.473 -23.797 -0.891 1.00 0.00 H new ATOM 0 HA ALA A 142 1.761 -24.295 -0.143 1.00 0.00 H new ATOM 0 HB1 ALA A 142 1.457 -24.585 -2.588 1.00 0.00 H new ATOM 0 HB2 ALA A 142 2.353 -23.098 -2.196 1.00 0.00 H new ATOM 0 HB3 ALA A 142 3.223 -24.528 -2.799 1.00 0.00 H new ATOM 2131 N THR A 143 1.308 -26.702 -0.888 1.00 0.00 N ATOM 2132 CA THR A 143 1.009 -28.115 -0.708 1.00 0.00 C ATOM 2133 C THR A 143 1.079 -28.883 -2.019 1.00 0.00 C ATOM 2134 O THR A 143 0.435 -29.920 -2.170 1.00 0.00 O ATOM 2135 CB THR A 143 -0.400 -28.270 -0.121 1.00 0.00 C ATOM 2136 OG1 THR A 143 -1.352 -27.622 -0.978 1.00 0.00 O ATOM 2137 CG2 THR A 143 -0.474 -27.646 1.255 1.00 0.00 C ATOM 0 H THR A 143 0.500 -26.143 -1.162 1.00 0.00 H new ATOM 0 HA THR A 143 1.758 -28.525 -0.031 1.00 0.00 H new ATOM 0 HB THR A 143 -0.627 -29.333 -0.044 1.00 0.00 H new ATOM 0 HG1 THR A 143 -1.311 -26.653 -0.838 1.00 0.00 H new ATOM 0 HG21 THR A 143 -1.481 -27.766 1.655 1.00 0.00 H new ATOM 0 HG22 THR A 143 0.240 -28.137 1.916 1.00 0.00 H new ATOM 0 HG23 THR A 143 -0.235 -26.585 1.187 1.00 0.00 H new ATOM 2145 N GLU A 144 1.848 -28.350 -2.963 1.00 0.00 N ATOM 2146 CA GLU A 144 1.973 -28.914 -4.309 1.00 0.00 C ATOM 2147 C GLU A 144 0.700 -28.729 -5.128 1.00 0.00 C ATOM 2148 O GLU A 144 0.775 -28.444 -6.317 1.00 0.00 O ATOM 2149 CB GLU A 144 2.360 -30.391 -4.282 1.00 0.00 C ATOM 2150 CG GLU A 144 3.731 -30.649 -3.685 1.00 0.00 C ATOM 2151 CD GLU A 144 4.169 -32.088 -3.849 1.00 0.00 C ATOM 2152 OE1 GLU A 144 4.235 -32.567 -4.997 1.00 0.00 O ATOM 2153 OE2 GLU A 144 4.460 -32.747 -2.828 1.00 0.00 O ATOM 0 H GLU A 144 2.407 -27.509 -2.818 1.00 0.00 H new ATOM 0 HA GLU A 144 2.777 -28.358 -4.791 1.00 0.00 H new ATOM 0 HB2 GLU A 144 1.614 -30.943 -3.710 1.00 0.00 H new ATOM 0 HB3 GLU A 144 2.336 -30.783 -5.299 1.00 0.00 H new ATOM 0 HG2 GLU A 144 4.461 -29.993 -4.160 1.00 0.00 H new ATOM 0 HG3 GLU A 144 3.717 -30.395 -2.625 1.00 0.00 H new ATOM 2160 N GLU A 145 -0.465 -28.872 -4.506 1.00 0.00 N ATOM 2161 CA GLU A 145 -1.716 -28.700 -5.228 1.00 0.00 C ATOM 2162 C GLU A 145 -1.857 -27.239 -5.615 1.00 0.00 C ATOM 2163 O GLU A 145 -2.275 -26.907 -6.722 1.00 0.00 O ATOM 2164 CB GLU A 145 -2.908 -29.164 -4.383 1.00 0.00 C ATOM 2165 CG GLU A 145 -3.769 -28.040 -3.844 1.00 0.00 C ATOM 2166 CD GLU A 145 -5.060 -28.532 -3.218 1.00 0.00 C ATOM 2167 OE1 GLU A 145 -5.977 -28.923 -3.969 1.00 0.00 O ATOM 2168 OE2 GLU A 145 -5.174 -28.522 -1.977 1.00 0.00 O ATOM 0 H GLU A 145 -0.568 -29.103 -3.518 1.00 0.00 H new ATOM 0 HA GLU A 145 -1.704 -29.315 -6.128 1.00 0.00 H new ATOM 0 HB2 GLU A 145 -3.530 -29.824 -4.987 1.00 0.00 H new ATOM 0 HB3 GLU A 145 -2.536 -29.754 -3.545 1.00 0.00 H new ATOM 0 HG2 GLU A 145 -3.202 -27.479 -3.101 1.00 0.00 H new ATOM 0 HG3 GLU A 145 -4.004 -27.349 -4.654 1.00 0.00 H new ATOM 2175 N GLU A 146 -1.471 -26.378 -4.686 1.00 0.00 N ATOM 2176 CA GLU A 146 -1.450 -24.945 -4.918 1.00 0.00 C ATOM 2177 C GLU A 146 -0.533 -24.620 -6.094 1.00 0.00 C ATOM 2178 O GLU A 146 -0.832 -23.755 -6.913 1.00 0.00 O ATOM 2179 CB GLU A 146 -0.994 -24.230 -3.643 1.00 0.00 C ATOM 2180 CG GLU A 146 -1.993 -24.359 -2.503 1.00 0.00 C ATOM 2181 CD GLU A 146 -1.376 -24.088 -1.149 1.00 0.00 C ATOM 2182 OE1 GLU A 146 -0.718 -25.002 -0.616 1.00 0.00 O ATOM 2183 OE2 GLU A 146 -1.553 -22.978 -0.606 1.00 0.00 O ATOM 0 H GLU A 146 -1.165 -26.654 -3.753 1.00 0.00 H new ATOM 0 HA GLU A 146 -2.452 -24.597 -5.169 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -0.034 -24.639 -3.327 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -0.834 -23.174 -3.862 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -2.817 -23.664 -2.667 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -2.417 -25.363 -2.509 1.00 0.00 H new ATOM 2190 N LEU A 147 0.567 -25.358 -6.194 1.00 0.00 N ATOM 2191 CA LEU A 147 1.503 -25.206 -7.301 1.00 0.00 C ATOM 2192 C LEU A 147 0.887 -25.743 -8.583 1.00 0.00 C ATOM 2193 O LEU A 147 0.943 -25.100 -9.632 1.00 0.00 O ATOM 2194 CB LEU A 147 2.791 -25.966 -6.995 1.00 0.00 C ATOM 2195 CG LEU A 147 3.336 -25.734 -5.592 1.00 0.00 C ATOM 2196 CD1 LEU A 147 4.621 -26.509 -5.383 1.00 0.00 C ATOM 2197 CD2 LEU A 147 3.546 -24.252 -5.354 1.00 0.00 C ATOM 0 H LEU A 147 0.833 -26.072 -5.516 1.00 0.00 H new ATOM 0 HA LEU A 147 1.729 -24.147 -7.430 1.00 0.00 H new ATOM 0 HB2 LEU A 147 2.611 -27.032 -7.131 1.00 0.00 H new ATOM 0 HB3 LEU A 147 3.551 -25.676 -7.720 1.00 0.00 H new ATOM 0 HG LEU A 147 2.608 -26.098 -4.867 1.00 0.00 H new ATOM 0 HD11 LEU A 147 4.994 -26.330 -4.375 1.00 0.00 H new ATOM 0 HD12 LEU A 147 4.429 -27.574 -5.515 1.00 0.00 H new ATOM 0 HD13 LEU A 147 5.365 -26.182 -6.109 1.00 0.00 H new ATOM 0 HD21 LEU A 147 3.936 -24.097 -4.348 1.00 0.00 H new ATOM 0 HD22 LEU A 147 4.257 -23.864 -6.083 1.00 0.00 H new ATOM 0 HD23 LEU A 147 2.596 -23.728 -5.460 1.00 0.00 H new ATOM 2209 N ALA A 148 0.293 -26.924 -8.469 1.00 0.00 N ATOM 2210 CA ALA A 148 -0.368 -27.598 -9.579 1.00 0.00 C ATOM 2211 C ALA A 148 -1.432 -26.710 -10.216 1.00 0.00 C ATOM 2212 O ALA A 148 -1.632 -26.729 -11.431 1.00 0.00 O ATOM 2213 CB ALA A 148 -0.993 -28.893 -9.078 1.00 0.00 C ATOM 0 H ALA A 148 0.256 -27.446 -7.594 1.00 0.00 H new ATOM 0 HA ALA A 148 0.376 -27.819 -10.344 1.00 0.00 H new ATOM 0 HB1 ALA A 148 -1.489 -29.401 -9.905 1.00 0.00 H new ATOM 0 HB2 ALA A 148 -0.215 -29.538 -8.670 1.00 0.00 H new ATOM 0 HB3 ALA A 148 -1.723 -28.668 -8.300 1.00 0.00 H new ATOM 2219 N HIS A 149 -2.111 -25.927 -9.387 1.00 0.00 N ATOM 2220 CA HIS A 149 -3.196 -25.073 -9.860 1.00 0.00 C ATOM 2221 C HIS A 149 -2.679 -23.698 -10.278 1.00 0.00 C ATOM 2222 O HIS A 149 -3.387 -22.940 -10.937 1.00 0.00 O ATOM 2223 CB HIS A 149 -4.265 -24.904 -8.775 1.00 0.00 C ATOM 2224 CG HIS A 149 -4.805 -26.195 -8.242 1.00 0.00 C ATOM 2225 ND1 HIS A 149 -5.083 -26.401 -6.907 1.00 0.00 N ATOM 2226 CD2 HIS A 149 -5.099 -27.360 -8.868 1.00 0.00 C ATOM 2227 CE1 HIS A 149 -5.516 -27.636 -6.736 1.00 0.00 C ATOM 2228 NE2 HIS A 149 -5.538 -28.237 -7.910 1.00 0.00 N ATOM 0 H HIS A 149 -1.931 -25.865 -8.385 1.00 0.00 H new ATOM 0 HA HIS A 149 -3.637 -25.561 -10.729 1.00 0.00 H new ATOM 0 HB2 HIS A 149 -3.842 -24.331 -7.950 1.00 0.00 H new ATOM 0 HB3 HIS A 149 -5.089 -24.318 -9.181 1.00 0.00 H new ATOM 0 HD2 HIS A 149 -5.005 -27.561 -9.925 1.00 0.00 H new ATOM 0 HE1 HIS A 149 -5.804 -28.079 -5.794 1.00 0.00 H new ATOM 0 HE2 HIS A 149 -5.834 -29.199 -8.078 1.00 0.00 H new ATOM 2237 N GLY A 150 -1.453 -23.377 -9.881 1.00 0.00 N ATOM 2238 CA GLY A 150 -0.894 -22.066 -10.170 1.00 0.00 C ATOM 2239 C GLY A 150 -1.338 -21.032 -9.157 1.00 0.00 C ATOM 2240 O GLY A 150 -0.971 -19.860 -9.240 1.00 0.00 O ATOM 0 H GLY A 150 -0.834 -24.001 -9.363 1.00 0.00 H new ATOM 0 HA2 GLY A 150 0.194 -22.127 -10.174 1.00 0.00 H new ATOM 0 HA3 GLY A 150 -1.199 -21.752 -11.168 1.00 0.00 H new ATOM 2244 N HIS A 151 -2.127 -21.488 -8.198 1.00 0.00 N ATOM 2245 CA HIS A 151 -2.665 -20.645 -7.139 1.00 0.00 C ATOM 2246 C HIS A 151 -3.298 -21.528 -6.070 1.00 0.00 C ATOM 2247 O HIS A 151 -3.481 -22.724 -6.293 1.00 0.00 O ATOM 2248 CB HIS A 151 -3.677 -19.614 -7.683 1.00 0.00 C ATOM 2249 CG HIS A 151 -4.836 -20.178 -8.459 1.00 0.00 C ATOM 2250 ND1 HIS A 151 -5.793 -19.382 -9.051 1.00 0.00 N ATOM 2251 CD2 HIS A 151 -5.184 -21.450 -8.749 1.00 0.00 C ATOM 2252 CE1 HIS A 151 -6.677 -20.143 -9.667 1.00 0.00 C ATOM 2253 NE2 HIS A 151 -6.331 -21.404 -9.501 1.00 0.00 N ATOM 0 H HIS A 151 -2.416 -22.464 -8.131 1.00 0.00 H new ATOM 0 HA HIS A 151 -1.848 -20.074 -6.699 1.00 0.00 H new ATOM 0 HB2 HIS A 151 -4.071 -19.042 -6.843 1.00 0.00 H new ATOM 0 HB3 HIS A 151 -3.143 -18.912 -8.324 1.00 0.00 H new ATOM 0 HD2 HIS A 151 -4.656 -22.341 -8.445 1.00 0.00 H new ATOM 0 HE1 HIS A 151 -7.539 -19.792 -10.215 1.00 0.00 H new ATOM 0 HE2 HIS A 151 -6.833 -22.212 -9.870 1.00 0.00 H new