USER MOD reduce.3.24.130724 H: found=0, std=0, add=768, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 766 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 61 ASN : amide:sc= -1.06 K(o=-1,f=-0.051) USER MOD Set 1.2: A 67 THR OG1 : rot 180:sc= 0.0312 USER MOD Set 2.1: A 22 SER OG : rot -19:sc= 0.695 USER MOD Set 2.2: A 23 HIS : no HD1:sc= -0.376 X(o=0.32,f=0.68) USER MOD Single : A 1 GLY N :NH3+ 137:sc= 0.0135 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= -0.0444 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 10 ASN : amide:sc= -0.0216 X(o=-0.022,f=0) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 13 HIS : no HD1:sc= -0.0241 X(o=-0.024,f=-0.00079) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 17 TYR OH : rot 165:sc= -0.0732 USER MOD Single : A 25 MET CE :methyl 173:sc= 0 (180deg=-0.0388) USER MOD Single : A 27 ASN : amide:sc= -1.48! K(o=-1.5!,f=-0.1) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ -125:sc= 0 (180deg=-0.197) USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 52 SER OG : rot 39:sc= 0.662 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 CYS SG : rot 180:sc= 0.00982 USER MOD Single : A 59 LYS NZ :NH3+ -165:sc= 0 (180deg=-0.127) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 CYS SG : rot 10:sc= 1.29 USER MOD Single : A 69 SER OG : rot 180:sc= -0.141 USER MOD Single : A 70 TYR OH : rot -166:sc= -4.62! USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 TYR OH : rot -49:sc= 1.36 USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 HIS : no HE2:sc= -3.07! X(o=-3.1!,f=-3) USER MOD Single : A 92 SER OG : rot -110:sc= -0.437 USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 THR OG1 : rot 180:sc= -0.176 USER MOD Single : A 103 SER OG : rot 38:sc= 0.226 USER MOD Single : A 104 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot 41:sc= 0.577 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 8.653 -35.619 14.406 1.00 0.00 N ATOM 2 CA GLY A 1 8.547 -34.430 13.580 1.00 0.00 C ATOM 3 C GLY A 1 7.795 -34.687 12.289 1.00 0.00 C ATOM 4 O GLY A 1 7.914 -35.759 11.696 1.00 0.00 O ATOM 0 H1 GLY A 1 9.616 -35.688 14.793 1.00 0.00 H new ATOM 0 H2 GLY A 1 7.969 -35.561 15.188 1.00 0.00 H new ATOM 0 H3 GLY A 1 8.450 -36.461 13.830 1.00 0.00 H new ATOM 0 HA2 GLY A 1 8.041 -33.645 14.142 1.00 0.00 H new ATOM 0 HA3 GLY A 1 9.546 -34.062 13.348 1.00 0.00 H new ATOM 8 N SER A 2 7.018 -33.700 11.854 1.00 0.00 N ATOM 9 CA SER A 2 6.238 -33.826 10.627 1.00 0.00 C ATOM 10 C SER A 2 5.992 -32.459 9.997 1.00 0.00 C ATOM 11 O SER A 2 5.956 -31.441 10.690 1.00 0.00 O ATOM 12 CB SER A 2 4.903 -34.515 10.915 1.00 0.00 C ATOM 13 OG SER A 2 4.103 -33.734 11.785 1.00 0.00 O ATOM 0 H SER A 2 6.912 -32.805 12.332 1.00 0.00 H new ATOM 0 HA SER A 2 6.808 -34.433 9.924 1.00 0.00 H new ATOM 0 HB2 SER A 2 4.369 -34.686 9.980 1.00 0.00 H new ATOM 0 HB3 SER A 2 5.084 -35.493 11.362 1.00 0.00 H new ATOM 0 HG SER A 2 3.255 -34.195 11.952 1.00 0.00 H new ATOM 19 N SER A 3 5.824 -32.443 8.679 1.00 0.00 N ATOM 20 CA SER A 3 5.585 -31.201 7.953 1.00 0.00 C ATOM 21 C SER A 3 4.161 -31.155 7.409 1.00 0.00 C ATOM 22 O SER A 3 3.466 -30.148 7.542 1.00 0.00 O ATOM 23 CB SER A 3 6.587 -31.055 6.806 1.00 0.00 C ATOM 24 OG SER A 3 6.463 -32.122 5.882 1.00 0.00 O ATOM 0 H SER A 3 5.849 -33.276 8.092 1.00 0.00 H new ATOM 0 HA SER A 3 5.716 -30.372 8.648 1.00 0.00 H new ATOM 0 HB2 SER A 3 6.424 -30.106 6.295 1.00 0.00 H new ATOM 0 HB3 SER A 3 7.601 -31.032 7.205 1.00 0.00 H new ATOM 0 HG SER A 3 7.113 -32.005 5.158 1.00 0.00 H new ATOM 30 N GLY A 4 3.733 -32.254 6.795 1.00 0.00 N ATOM 31 CA GLY A 4 2.394 -32.319 6.240 1.00 0.00 C ATOM 32 C GLY A 4 1.320 -32.288 7.309 1.00 0.00 C ATOM 33 O GLY A 4 0.999 -33.316 7.905 1.00 0.00 O ATOM 0 H GLY A 4 4.290 -33.100 6.672 1.00 0.00 H new ATOM 0 HA2 GLY A 4 2.246 -31.482 5.557 1.00 0.00 H new ATOM 0 HA3 GLY A 4 2.291 -33.232 5.653 1.00 0.00 H new ATOM 37 N SER A 5 0.765 -31.106 7.554 1.00 0.00 N ATOM 38 CA SER A 5 -0.275 -30.944 8.563 1.00 0.00 C ATOM 39 C SER A 5 -1.471 -31.842 8.260 1.00 0.00 C ATOM 40 O SER A 5 -2.190 -31.627 7.284 1.00 0.00 O ATOM 41 CB SER A 5 -0.725 -29.483 8.634 1.00 0.00 C ATOM 42 OG SER A 5 0.362 -28.630 8.949 1.00 0.00 O ATOM 0 H SER A 5 1.018 -30.246 7.068 1.00 0.00 H new ATOM 0 HA SER A 5 0.141 -31.235 9.527 1.00 0.00 H new ATOM 0 HB2 SER A 5 -1.160 -29.186 7.680 1.00 0.00 H new ATOM 0 HB3 SER A 5 -1.506 -29.376 9.387 1.00 0.00 H new ATOM 0 HG SER A 5 0.049 -27.702 8.987 1.00 0.00 H new ATOM 48 N SER A 6 -1.677 -32.848 9.103 1.00 0.00 N ATOM 49 CA SER A 6 -2.783 -33.781 8.924 1.00 0.00 C ATOM 50 C SER A 6 -4.115 -33.040 8.865 1.00 0.00 C ATOM 51 O SER A 6 -4.906 -33.235 7.943 1.00 0.00 O ATOM 52 CB SER A 6 -2.805 -34.803 10.062 1.00 0.00 C ATOM 53 OG SER A 6 -1.831 -35.813 9.860 1.00 0.00 O ATOM 0 H SER A 6 -1.092 -33.038 9.917 1.00 0.00 H new ATOM 0 HA SER A 6 -2.636 -34.303 7.979 1.00 0.00 H new ATOM 0 HB2 SER A 6 -2.620 -34.299 11.011 1.00 0.00 H new ATOM 0 HB3 SER A 6 -3.794 -35.256 10.129 1.00 0.00 H new ATOM 0 HG SER A 6 -1.864 -36.453 10.602 1.00 0.00 H new ATOM 59 N GLY A 7 -4.356 -32.188 9.857 1.00 0.00 N ATOM 60 CA GLY A 7 -5.593 -31.430 9.900 1.00 0.00 C ATOM 61 C GLY A 7 -5.383 -30.004 10.368 1.00 0.00 C ATOM 62 O GLY A 7 -4.333 -29.672 10.917 1.00 0.00 O ATOM 0 H GLY A 7 -3.717 -32.009 10.631 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -6.045 -31.421 8.908 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -6.298 -31.928 10.566 1.00 0.00 H new ATOM 66 N ALA A 8 -6.383 -29.157 10.147 1.00 0.00 N ATOM 67 CA ALA A 8 -6.303 -27.758 10.550 1.00 0.00 C ATOM 68 C ALA A 8 -7.667 -27.083 10.462 1.00 0.00 C ATOM 69 O ALA A 8 -8.449 -27.357 9.551 1.00 0.00 O ATOM 70 CB ALA A 8 -5.289 -27.019 9.690 1.00 0.00 C ATOM 0 H ALA A 8 -7.258 -29.415 9.691 1.00 0.00 H new ATOM 0 HA ALA A 8 -5.976 -27.722 11.589 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -5.239 -25.976 10.002 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -4.308 -27.480 9.807 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -5.592 -27.071 8.644 1.00 0.00 H new ATOM 76 N ILE A 9 -7.947 -26.200 11.415 1.00 0.00 N ATOM 77 CA ILE A 9 -9.217 -25.485 11.444 1.00 0.00 C ATOM 78 C ILE A 9 -8.999 -23.977 11.479 1.00 0.00 C ATOM 79 O ILE A 9 -9.917 -23.200 11.219 1.00 0.00 O ATOM 80 CB ILE A 9 -10.068 -25.898 12.659 1.00 0.00 C ATOM 81 CG1 ILE A 9 -9.259 -25.749 13.950 1.00 0.00 C ATOM 82 CG2 ILE A 9 -10.561 -27.328 12.500 1.00 0.00 C ATOM 83 CD1 ILE A 9 -8.421 -26.963 14.281 1.00 0.00 C ATOM 0 H ILE A 9 -7.312 -25.963 12.177 1.00 0.00 H new ATOM 0 HA ILE A 9 -9.749 -25.751 10.531 1.00 0.00 H new ATOM 0 HB ILE A 9 -10.935 -25.240 12.717 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -8.607 -24.880 13.862 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -9.942 -25.553 14.777 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -11.161 -27.605 13.367 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -11.169 -27.405 11.599 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -9.707 -28.001 12.420 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -7.875 -26.787 15.208 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -9.069 -27.831 14.401 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -7.713 -27.148 13.473 1.00 0.00 H new ATOM 95 N ASN A 10 -7.776 -23.569 11.801 1.00 0.00 N ATOM 96 CA ASN A 10 -7.435 -22.152 11.869 1.00 0.00 C ATOM 97 C ASN A 10 -7.733 -21.457 10.544 1.00 0.00 C ATOM 98 O ASN A 10 -7.300 -21.908 9.484 1.00 0.00 O ATOM 99 CB ASN A 10 -5.958 -21.978 12.229 1.00 0.00 C ATOM 100 CG ASN A 10 -5.720 -22.011 13.727 1.00 0.00 C ATOM 101 OD1 ASN A 10 -5.354 -21.003 14.330 1.00 0.00 O ATOM 102 ND2 ASN A 10 -5.928 -23.174 14.333 1.00 0.00 N ATOM 0 H ASN A 10 -7.004 -24.199 12.019 1.00 0.00 H new ATOM 0 HA ASN A 10 -8.047 -21.693 12.645 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -5.376 -22.767 11.754 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -5.598 -21.031 11.827 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -5.784 -23.258 15.339 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -6.231 -23.984 13.792 1.00 0.00 H new ATOM 109 N SER A 11 -8.474 -20.356 10.614 1.00 0.00 N ATOM 110 CA SER A 11 -8.832 -19.599 9.420 1.00 0.00 C ATOM 111 C SER A 11 -7.726 -18.616 9.047 1.00 0.00 C ATOM 112 O SER A 11 -6.846 -18.320 9.855 1.00 0.00 O ATOM 113 CB SER A 11 -10.145 -18.847 9.642 1.00 0.00 C ATOM 114 OG SER A 11 -11.255 -19.726 9.578 1.00 0.00 O ATOM 0 H SER A 11 -8.838 -19.968 11.484 1.00 0.00 H new ATOM 0 HA SER A 11 -8.960 -20.304 8.598 1.00 0.00 H new ATOM 0 HB2 SER A 11 -10.125 -18.353 10.613 1.00 0.00 H new ATOM 0 HB3 SER A 11 -10.252 -18.066 8.889 1.00 0.00 H new ATOM 0 HG SER A 11 -12.082 -19.220 9.725 1.00 0.00 H new ATOM 120 N ARG A 12 -7.779 -18.115 7.817 1.00 0.00 N ATOM 121 CA ARG A 12 -6.782 -17.166 7.336 1.00 0.00 C ATOM 122 C ARG A 12 -7.450 -15.931 6.739 1.00 0.00 C ATOM 123 O ARG A 12 -8.579 -15.998 6.251 1.00 0.00 O ATOM 124 CB ARG A 12 -5.881 -17.827 6.291 1.00 0.00 C ATOM 125 CG ARG A 12 -4.815 -18.730 6.889 1.00 0.00 C ATOM 126 CD ARG A 12 -5.355 -20.124 7.165 1.00 0.00 C ATOM 127 NE ARG A 12 -5.619 -20.862 5.932 1.00 0.00 N ATOM 128 CZ ARG A 12 -4.665 -21.282 5.109 1.00 0.00 C ATOM 129 NH1 ARG A 12 -3.392 -21.038 5.385 1.00 0.00 N ATOM 130 NH2 ARG A 12 -4.985 -21.948 4.006 1.00 0.00 N ATOM 0 H ARG A 12 -8.501 -18.350 7.136 1.00 0.00 H new ATOM 0 HA ARG A 12 -6.174 -16.854 8.185 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -6.499 -18.411 5.608 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -5.397 -17.051 5.698 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -3.968 -18.796 6.206 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -4.444 -18.292 7.816 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -4.638 -20.677 7.772 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -6.274 -20.048 7.746 1.00 0.00 H new ATOM 0 HE ARG A 12 -6.589 -21.066 5.690 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -3.143 -20.526 6.231 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -2.662 -21.362 4.751 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -5.964 -22.137 3.790 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -4.252 -22.270 3.374 1.00 0.00 H new ATOM 144 N HIS A 13 -6.746 -14.805 6.782 1.00 0.00 N ATOM 145 CA HIS A 13 -7.271 -13.554 6.246 1.00 0.00 C ATOM 146 C HIS A 13 -6.157 -12.524 6.079 1.00 0.00 C ATOM 147 O HIS A 13 -5.033 -12.732 6.534 1.00 0.00 O ATOM 148 CB HIS A 13 -8.362 -12.999 7.162 1.00 0.00 C ATOM 149 CG HIS A 13 -8.091 -13.222 8.618 1.00 0.00 C ATOM 150 ND1 HIS A 13 -9.027 -13.743 9.487 1.00 0.00 N ATOM 151 CD2 HIS A 13 -6.980 -12.993 9.357 1.00 0.00 C ATOM 152 CE1 HIS A 13 -8.504 -13.823 10.697 1.00 0.00 C ATOM 153 NE2 HIS A 13 -7.263 -13.374 10.646 1.00 0.00 N ATOM 0 H HIS A 13 -5.811 -14.733 7.182 1.00 0.00 H new ATOM 0 HA HIS A 13 -7.701 -13.760 5.266 1.00 0.00 H new ATOM 0 HB2 HIS A 13 -8.469 -11.930 6.980 1.00 0.00 H new ATOM 0 HB3 HIS A 13 -9.314 -13.463 6.903 1.00 0.00 H new ATOM 0 HD2 HIS A 13 -6.045 -12.587 9.000 1.00 0.00 H new ATOM 0 HE1 HIS A 13 -9.006 -14.193 11.579 1.00 0.00 H new ATOM 0 HE2 HIS A 13 -6.619 -13.319 11.435 1.00 0.00 H new ATOM 162 N VAL A 14 -6.478 -11.414 5.423 1.00 0.00 N ATOM 163 CA VAL A 14 -5.505 -10.351 5.197 1.00 0.00 C ATOM 164 C VAL A 14 -6.163 -8.978 5.273 1.00 0.00 C ATOM 165 O VAL A 14 -7.310 -8.804 4.861 1.00 0.00 O ATOM 166 CB VAL A 14 -4.817 -10.504 3.827 1.00 0.00 C ATOM 167 CG1 VAL A 14 -3.923 -9.306 3.543 1.00 0.00 C ATOM 168 CG2 VAL A 14 -4.020 -11.799 3.773 1.00 0.00 C ATOM 0 H VAL A 14 -7.404 -11.227 5.039 1.00 0.00 H new ATOM 0 HA VAL A 14 -4.755 -10.434 5.984 1.00 0.00 H new ATOM 0 HB VAL A 14 -5.586 -10.545 3.055 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -3.445 -9.431 2.571 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -4.524 -8.397 3.538 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -3.159 -9.231 4.316 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -3.541 -11.891 2.798 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -3.258 -11.790 4.553 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -4.689 -12.645 3.929 1.00 0.00 H new ATOM 178 N SER A 15 -5.429 -8.005 5.802 1.00 0.00 N ATOM 179 CA SER A 15 -5.942 -6.646 5.935 1.00 0.00 C ATOM 180 C SER A 15 -4.799 -5.638 6.001 1.00 0.00 C ATOM 181 O SER A 15 -3.751 -5.909 6.585 1.00 0.00 O ATOM 182 CB SER A 15 -6.814 -6.529 7.187 1.00 0.00 C ATOM 183 OG SER A 15 -7.455 -5.266 7.244 1.00 0.00 O ATOM 0 H SER A 15 -4.477 -8.132 6.146 1.00 0.00 H new ATOM 0 HA SER A 15 -6.548 -6.424 5.056 1.00 0.00 H new ATOM 0 HB2 SER A 15 -7.563 -7.321 7.188 1.00 0.00 H new ATOM 0 HB3 SER A 15 -6.200 -6.670 8.077 1.00 0.00 H new ATOM 0 HG SER A 15 -8.008 -5.216 8.052 1.00 0.00 H new ATOM 189 N ALA A 16 -5.011 -4.473 5.397 1.00 0.00 N ATOM 190 CA ALA A 16 -4.001 -3.422 5.388 1.00 0.00 C ATOM 191 C ALA A 16 -4.442 -2.229 6.229 1.00 0.00 C ATOM 192 O ALA A 16 -5.621 -1.876 6.252 1.00 0.00 O ATOM 193 CB ALA A 16 -3.707 -2.985 3.961 1.00 0.00 C ATOM 0 H ALA A 16 -5.873 -4.233 4.908 1.00 0.00 H new ATOM 0 HA ALA A 16 -3.089 -3.825 5.828 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -2.951 -2.200 3.969 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -3.339 -3.836 3.388 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -4.620 -2.605 3.501 1.00 0.00 H new ATOM 199 N TYR A 17 -3.489 -1.613 6.919 1.00 0.00 N ATOM 200 CA TYR A 17 -3.780 -0.461 7.764 1.00 0.00 C ATOM 201 C TYR A 17 -2.548 0.426 7.920 1.00 0.00 C ATOM 202 O TYR A 17 -1.432 -0.065 8.081 1.00 0.00 O ATOM 203 CB TYR A 17 -4.268 -0.921 9.139 1.00 0.00 C ATOM 204 CG TYR A 17 -3.151 -1.337 10.070 1.00 0.00 C ATOM 205 CD1 TYR A 17 -2.464 -0.395 10.826 1.00 0.00 C ATOM 206 CD2 TYR A 17 -2.783 -2.671 10.192 1.00 0.00 C ATOM 207 CE1 TYR A 17 -1.443 -0.771 11.678 1.00 0.00 C ATOM 208 CE2 TYR A 17 -1.764 -3.055 11.042 1.00 0.00 C ATOM 209 CZ TYR A 17 -1.097 -2.102 11.783 1.00 0.00 C ATOM 210 OH TYR A 17 -0.081 -2.480 12.629 1.00 0.00 O ATOM 0 H TYR A 17 -2.508 -1.892 6.910 1.00 0.00 H new ATOM 0 HA TYR A 17 -4.566 0.121 7.283 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -4.835 -0.114 9.603 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -4.954 -1.759 9.010 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -2.732 0.648 10.746 1.00 0.00 H new ATOM 0 HD2 TYR A 17 -3.302 -3.420 9.613 1.00 0.00 H new ATOM 0 HE1 TYR A 17 -0.919 -0.026 12.259 1.00 0.00 H new ATOM 0 HE2 TYR A 17 -1.491 -4.097 11.126 1.00 0.00 H new ATOM 0 HH TYR A 17 -0.117 -3.449 12.771 1.00 0.00 H new ATOM 220 N GLY A 18 -2.761 1.737 7.871 1.00 0.00 N ATOM 221 CA GLY A 18 -1.661 2.673 8.008 1.00 0.00 C ATOM 222 C GLY A 18 -2.020 4.066 7.529 1.00 0.00 C ATOM 223 O GLY A 18 -3.086 4.292 6.956 1.00 0.00 O ATOM 0 H GLY A 18 -3.676 2.168 7.739 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -1.356 2.719 9.053 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -0.804 2.307 7.442 1.00 0.00 H new ATOM 227 N PRO A 19 -1.118 5.029 7.766 1.00 0.00 N ATOM 228 CA PRO A 19 -1.324 6.423 7.364 1.00 0.00 C ATOM 229 C PRO A 19 -1.265 6.605 5.851 1.00 0.00 C ATOM 230 O PRO A 19 -2.093 7.303 5.268 1.00 0.00 O ATOM 231 CB PRO A 19 -0.164 7.162 8.037 1.00 0.00 C ATOM 232 CG PRO A 19 0.896 6.128 8.206 1.00 0.00 C ATOM 233 CD PRO A 19 0.174 4.831 8.445 1.00 0.00 C ATOM 0 HA PRO A 19 -2.308 6.790 7.656 1.00 0.00 H new ATOM 0 HB2 PRO A 19 0.186 7.992 7.423 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -0.465 7.581 8.997 1.00 0.00 H new ATOM 0 HG2 PRO A 19 1.526 6.066 7.319 1.00 0.00 H new ATOM 0 HG3 PRO A 19 1.549 6.372 9.044 1.00 0.00 H new ATOM 0 HD2 PRO A 19 0.721 3.984 8.030 1.00 0.00 H new ATOM 0 HD3 PRO A 19 0.043 4.634 9.509 1.00 0.00 H new ATOM 241 N GLY A 20 -0.281 5.972 5.221 1.00 0.00 N ATOM 242 CA GLY A 20 -0.133 6.076 3.781 1.00 0.00 C ATOM 243 C GLY A 20 -1.341 5.545 3.035 1.00 0.00 C ATOM 244 O GLY A 20 -1.631 5.979 1.919 1.00 0.00 O ATOM 0 H GLY A 20 0.417 5.388 5.682 1.00 0.00 H new ATOM 0 HA2 GLY A 20 0.028 7.119 3.510 1.00 0.00 H new ATOM 0 HA3 GLY A 20 0.754 5.525 3.469 1.00 0.00 H new ATOM 248 N LEU A 21 -2.047 4.602 3.649 1.00 0.00 N ATOM 249 CA LEU A 21 -3.229 4.009 3.035 1.00 0.00 C ATOM 250 C LEU A 21 -4.431 4.942 3.155 1.00 0.00 C ATOM 251 O LEU A 21 -5.263 5.017 2.251 1.00 0.00 O ATOM 252 CB LEU A 21 -3.547 2.663 3.688 1.00 0.00 C ATOM 253 CG LEU A 21 -2.527 1.548 3.457 1.00 0.00 C ATOM 254 CD1 LEU A 21 -2.953 0.277 4.176 1.00 0.00 C ATOM 255 CD2 LEU A 21 -2.351 1.286 1.968 1.00 0.00 C ATOM 0 H LEU A 21 -1.821 4.232 4.572 1.00 0.00 H new ATOM 0 HA LEU A 21 -3.018 3.852 1.977 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -3.649 2.818 4.762 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -4.516 2.324 3.321 1.00 0.00 H new ATOM 0 HG LEU A 21 -1.569 1.869 3.865 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -2.215 -0.505 4.000 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -3.027 0.472 5.246 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -3.923 -0.047 3.798 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -1.621 0.489 1.822 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -3.306 0.987 1.536 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -1.999 2.194 1.478 1.00 0.00 H new ATOM 267 N SER A 22 -4.513 5.652 4.276 1.00 0.00 N ATOM 268 CA SER A 22 -5.613 6.578 4.515 1.00 0.00 C ATOM 269 C SER A 22 -5.388 7.891 3.771 1.00 0.00 C ATOM 270 O SER A 22 -6.328 8.490 3.246 1.00 0.00 O ATOM 271 CB SER A 22 -5.764 6.847 6.013 1.00 0.00 C ATOM 272 OG SER A 22 -4.575 7.392 6.556 1.00 0.00 O ATOM 0 H SER A 22 -3.831 5.603 5.033 1.00 0.00 H new ATOM 0 HA SER A 22 -6.529 6.121 4.141 1.00 0.00 H new ATOM 0 HB2 SER A 22 -6.593 7.535 6.180 1.00 0.00 H new ATOM 0 HB3 SER A 22 -6.011 5.919 6.529 1.00 0.00 H new ATOM 0 HG SER A 22 -3.824 7.201 5.956 1.00 0.00 H new ATOM 278 N HIS A 23 -4.136 8.334 3.730 1.00 0.00 N ATOM 279 CA HIS A 23 -3.786 9.577 3.050 1.00 0.00 C ATOM 280 C HIS A 23 -2.277 9.684 2.856 1.00 0.00 C ATOM 281 O HIS A 23 -1.530 8.769 3.202 1.00 0.00 O ATOM 282 CB HIS A 23 -4.297 10.779 3.845 1.00 0.00 C ATOM 283 CG HIS A 23 -3.465 11.097 5.049 1.00 0.00 C ATOM 284 ND1 HIS A 23 -3.737 10.598 6.305 1.00 0.00 N ATOM 285 CD2 HIS A 23 -2.360 11.868 5.184 1.00 0.00 C ATOM 286 CE1 HIS A 23 -2.838 11.050 7.161 1.00 0.00 C ATOM 287 NE2 HIS A 23 -1.990 11.823 6.505 1.00 0.00 N ATOM 0 H HIS A 23 -3.347 7.851 4.159 1.00 0.00 H new ATOM 0 HA HIS A 23 -4.261 9.572 2.069 1.00 0.00 H new ATOM 0 HB2 HIS A 23 -4.325 11.651 3.192 1.00 0.00 H new ATOM 0 HB3 HIS A 23 -5.322 10.586 4.162 1.00 0.00 H new ATOM 0 HD2 HIS A 23 -1.862 12.417 4.398 1.00 0.00 H new ATOM 0 HE1 HIS A 23 -2.802 10.826 8.217 1.00 0.00 H new ATOM 0 HE2 HIS A 23 -1.191 12.307 6.914 1.00 0.00 H new ATOM 296 N GLY A 24 -1.834 10.808 2.301 1.00 0.00 N ATOM 297 CA GLY A 24 -0.416 11.013 2.070 1.00 0.00 C ATOM 298 C GLY A 24 -0.124 12.340 1.399 1.00 0.00 C ATOM 299 O GLY A 24 -1.008 13.186 1.271 1.00 0.00 O ATOM 0 H GLY A 24 -2.432 11.580 2.007 1.00 0.00 H new ATOM 0 HA2 GLY A 24 0.114 10.966 3.021 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -0.031 10.203 1.450 1.00 0.00 H new ATOM 303 N MET A 25 1.121 12.524 0.972 1.00 0.00 N ATOM 304 CA MET A 25 1.527 13.759 0.311 1.00 0.00 C ATOM 305 C MET A 25 2.536 13.477 -0.797 1.00 0.00 C ATOM 306 O MET A 25 3.200 12.440 -0.796 1.00 0.00 O ATOM 307 CB MET A 25 2.128 14.733 1.327 1.00 0.00 C ATOM 308 CG MET A 25 1.163 15.128 2.434 1.00 0.00 C ATOM 309 SD MET A 25 2.003 15.505 3.985 1.00 0.00 S ATOM 310 CE MET A 25 3.015 16.898 3.492 1.00 0.00 C ATOM 0 H MET A 25 1.866 11.834 1.072 1.00 0.00 H new ATOM 0 HA MET A 25 0.641 14.210 -0.135 1.00 0.00 H new ATOM 0 HB2 MET A 25 3.014 14.280 1.773 1.00 0.00 H new ATOM 0 HB3 MET A 25 2.458 15.632 0.806 1.00 0.00 H new ATOM 0 HG2 MET A 25 0.588 15.997 2.116 1.00 0.00 H new ATOM 0 HG3 MET A 25 0.452 14.318 2.598 1.00 0.00 H new ATOM 0 HE1 MET A 25 3.501 17.324 4.370 1.00 0.00 H new ATOM 0 HE2 MET A 25 3.773 16.564 2.784 1.00 0.00 H new ATOM 0 HE3 MET A 25 2.388 17.655 3.022 1.00 0.00 H new ATOM 320 N VAL A 26 2.646 14.405 -1.742 1.00 0.00 N ATOM 321 CA VAL A 26 3.574 14.255 -2.857 1.00 0.00 C ATOM 322 C VAL A 26 5.019 14.236 -2.369 1.00 0.00 C ATOM 323 O VAL A 26 5.370 14.921 -1.410 1.00 0.00 O ATOM 324 CB VAL A 26 3.406 15.390 -3.884 1.00 0.00 C ATOM 325 CG1 VAL A 26 4.397 15.229 -5.026 1.00 0.00 C ATOM 326 CG2 VAL A 26 1.978 15.427 -4.407 1.00 0.00 C ATOM 0 H VAL A 26 2.104 15.269 -1.758 1.00 0.00 H new ATOM 0 HA VAL A 26 3.342 13.304 -3.337 1.00 0.00 H new ATOM 0 HB VAL A 26 3.612 16.339 -3.388 1.00 0.00 H new ATOM 0 HG11 VAL A 26 4.263 16.040 -5.741 1.00 0.00 H new ATOM 0 HG12 VAL A 26 5.413 15.257 -4.633 1.00 0.00 H new ATOM 0 HG13 VAL A 26 4.226 14.274 -5.524 1.00 0.00 H new ATOM 0 HG21 VAL A 26 1.877 16.235 -5.132 1.00 0.00 H new ATOM 0 HG22 VAL A 26 1.742 14.477 -4.887 1.00 0.00 H new ATOM 0 HG23 VAL A 26 1.291 15.595 -3.578 1.00 0.00 H new ATOM 336 N ASN A 27 5.852 13.446 -3.038 1.00 0.00 N ATOM 337 CA ASN A 27 7.260 13.337 -2.673 1.00 0.00 C ATOM 338 C ASN A 27 7.415 12.781 -1.261 1.00 0.00 C ATOM 339 O ASN A 27 8.365 13.111 -0.552 1.00 0.00 O ATOM 340 CB ASN A 27 7.942 14.704 -2.772 1.00 0.00 C ATOM 341 CG ASN A 27 8.521 14.963 -4.150 1.00 0.00 C ATOM 342 OD1 ASN A 27 9.594 14.463 -4.488 1.00 0.00 O ATOM 343 ND2 ASN A 27 7.811 15.748 -4.952 1.00 0.00 N ATOM 0 H ASN A 27 5.577 12.872 -3.835 1.00 0.00 H new ATOM 0 HA ASN A 27 7.737 12.648 -3.370 1.00 0.00 H new ATOM 0 HB2 ASN A 27 7.221 15.485 -2.531 1.00 0.00 H new ATOM 0 HB3 ASN A 27 8.738 14.765 -2.029 1.00 0.00 H new ATOM 0 HD21 ASN A 27 8.150 15.958 -5.891 1.00 0.00 H new ATOM 0 HD22 ASN A 27 6.927 16.141 -4.629 1.00 0.00 H new ATOM 350 N LYS A 28 6.474 11.933 -0.859 1.00 0.00 N ATOM 351 CA LYS A 28 6.505 11.327 0.467 1.00 0.00 C ATOM 352 C LYS A 28 6.122 9.852 0.400 1.00 0.00 C ATOM 353 O LYS A 28 5.035 9.488 -0.047 1.00 0.00 O ATOM 354 CB LYS A 28 5.556 12.069 1.411 1.00 0.00 C ATOM 355 CG LYS A 28 5.908 13.535 1.599 1.00 0.00 C ATOM 356 CD LYS A 28 7.109 13.707 2.514 1.00 0.00 C ATOM 357 CE LYS A 28 7.744 15.079 2.348 1.00 0.00 C ATOM 358 NZ LYS A 28 8.647 15.413 3.484 1.00 0.00 N ATOM 0 H LYS A 28 5.680 11.650 -1.433 1.00 0.00 H new ATOM 0 HA LYS A 28 7.522 11.403 0.851 1.00 0.00 H new ATOM 0 HB2 LYS A 28 4.540 11.995 1.023 1.00 0.00 H new ATOM 0 HB3 LYS A 28 5.563 11.575 2.382 1.00 0.00 H new ATOM 0 HG2 LYS A 28 6.120 13.986 0.630 1.00 0.00 H new ATOM 0 HG3 LYS A 28 5.052 14.065 2.017 1.00 0.00 H new ATOM 0 HD2 LYS A 28 6.801 13.571 3.551 1.00 0.00 H new ATOM 0 HD3 LYS A 28 7.847 12.935 2.297 1.00 0.00 H new ATOM 0 HE2 LYS A 28 8.308 15.108 1.415 1.00 0.00 H new ATOM 0 HE3 LYS A 28 6.962 15.834 2.271 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 9.060 16.356 3.334 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 8.104 15.410 4.371 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 9.408 14.707 3.542 1.00 0.00 H new ATOM 372 N PRO A 29 7.035 8.982 0.857 1.00 0.00 N ATOM 373 CA PRO A 29 6.815 7.533 0.862 1.00 0.00 C ATOM 374 C PRO A 29 5.760 7.110 1.879 1.00 0.00 C ATOM 375 O PRO A 29 6.029 7.053 3.078 1.00 0.00 O ATOM 376 CB PRO A 29 8.184 6.967 1.245 1.00 0.00 C ATOM 377 CG PRO A 29 8.846 8.061 2.009 1.00 0.00 C ATOM 378 CD PRO A 29 8.353 9.346 1.404 1.00 0.00 C ATOM 0 HA PRO A 29 6.444 7.174 -0.098 1.00 0.00 H new ATOM 0 HB2 PRO A 29 8.085 6.066 1.850 1.00 0.00 H new ATOM 0 HB3 PRO A 29 8.762 6.696 0.361 1.00 0.00 H new ATOM 0 HG2 PRO A 29 8.593 8.006 3.068 1.00 0.00 H new ATOM 0 HG3 PRO A 29 9.931 7.987 1.936 1.00 0.00 H new ATOM 0 HD2 PRO A 29 8.274 10.137 2.150 1.00 0.00 H new ATOM 0 HD3 PRO A 29 9.025 9.708 0.626 1.00 0.00 H new ATOM 386 N ALA A 30 4.560 6.815 1.392 1.00 0.00 N ATOM 387 CA ALA A 30 3.466 6.395 2.258 1.00 0.00 C ATOM 388 C ALA A 30 3.730 5.013 2.845 1.00 0.00 C ATOM 389 O ALA A 30 3.641 4.002 2.146 1.00 0.00 O ATOM 390 CB ALA A 30 2.152 6.403 1.491 1.00 0.00 C ATOM 0 H ALA A 30 4.321 6.859 0.401 1.00 0.00 H new ATOM 0 HA ALA A 30 3.396 7.104 3.083 1.00 0.00 H new ATOM 0 HB1 ALA A 30 1.344 6.087 2.151 1.00 0.00 H new ATOM 0 HB2 ALA A 30 1.950 7.410 1.126 1.00 0.00 H new ATOM 0 HB3 ALA A 30 2.220 5.718 0.646 1.00 0.00 H new ATOM 396 N THR A 31 4.056 4.974 4.133 1.00 0.00 N ATOM 397 CA THR A 31 4.335 3.716 4.813 1.00 0.00 C ATOM 398 C THR A 31 3.084 3.167 5.490 1.00 0.00 C ATOM 399 O THR A 31 2.363 3.897 6.170 1.00 0.00 O ATOM 400 CB THR A 31 5.445 3.882 5.869 1.00 0.00 C ATOM 401 OG1 THR A 31 4.936 4.584 7.008 1.00 0.00 O ATOM 402 CG2 THR A 31 6.633 4.636 5.291 1.00 0.00 C ATOM 0 H THR A 31 4.133 5.800 4.726 1.00 0.00 H new ATOM 0 HA THR A 31 4.671 3.013 4.051 1.00 0.00 H new ATOM 0 HB THR A 31 5.778 2.890 6.173 1.00 0.00 H new ATOM 0 HG1 THR A 31 5.647 4.684 7.675 1.00 0.00 H new ATOM 0 HG21 THR A 31 7.404 4.741 6.055 1.00 0.00 H new ATOM 0 HG22 THR A 31 7.036 4.084 4.442 1.00 0.00 H new ATOM 0 HG23 THR A 31 6.312 5.624 4.962 1.00 0.00 H new ATOM 410 N PHE A 32 2.832 1.876 5.300 1.00 0.00 N ATOM 411 CA PHE A 32 1.667 1.229 5.892 1.00 0.00 C ATOM 412 C PHE A 32 1.996 -0.197 6.322 1.00 0.00 C ATOM 413 O PHE A 32 3.030 -0.749 5.944 1.00 0.00 O ATOM 414 CB PHE A 32 0.503 1.219 4.899 1.00 0.00 C ATOM 415 CG PHE A 32 0.812 0.491 3.622 1.00 0.00 C ATOM 416 CD1 PHE A 32 1.548 1.103 2.620 1.00 0.00 C ATOM 417 CD2 PHE A 32 0.366 -0.806 3.423 1.00 0.00 C ATOM 418 CE1 PHE A 32 1.832 0.435 1.444 1.00 0.00 C ATOM 419 CE2 PHE A 32 0.648 -1.479 2.249 1.00 0.00 C ATOM 420 CZ PHE A 32 1.383 -0.858 1.259 1.00 0.00 C ATOM 0 H PHE A 32 3.419 1.257 4.741 1.00 0.00 H new ATOM 0 HA PHE A 32 1.377 1.798 6.775 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -0.363 0.756 5.371 1.00 0.00 H new ATOM 0 HB3 PHE A 32 0.227 2.247 4.664 1.00 0.00 H new ATOM 0 HD1 PHE A 32 1.904 2.113 2.760 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -0.209 -1.297 4.194 1.00 0.00 H new ATOM 0 HE1 PHE A 32 2.405 0.924 0.670 1.00 0.00 H new ATOM 0 HE2 PHE A 32 0.294 -2.489 2.106 1.00 0.00 H new ATOM 0 HZ PHE A 32 1.606 -1.382 0.342 1.00 0.00 H new ATOM 430 N THR A 33 1.110 -0.789 7.116 1.00 0.00 N ATOM 431 CA THR A 33 1.306 -2.150 7.600 1.00 0.00 C ATOM 432 C THR A 33 0.332 -3.116 6.935 1.00 0.00 C ATOM 433 O THR A 33 -0.838 -2.790 6.732 1.00 0.00 O ATOM 434 CB THR A 33 1.131 -2.234 9.128 1.00 0.00 C ATOM 435 OG1 THR A 33 2.315 -1.766 9.783 1.00 0.00 O ATOM 436 CG2 THR A 33 0.837 -3.662 9.562 1.00 0.00 C ATOM 0 H THR A 33 0.249 -0.347 7.438 1.00 0.00 H new ATOM 0 HA THR A 33 2.327 -2.432 7.342 1.00 0.00 H new ATOM 0 HB THR A 33 0.287 -1.604 9.410 1.00 0.00 H new ATOM 0 HG1 THR A 33 2.195 -1.821 10.754 1.00 0.00 H new ATOM 0 HG21 THR A 33 0.717 -3.696 10.645 1.00 0.00 H new ATOM 0 HG22 THR A 33 -0.081 -4.006 9.085 1.00 0.00 H new ATOM 0 HG23 THR A 33 1.663 -4.309 9.268 1.00 0.00 H new ATOM 444 N ILE A 34 0.821 -4.304 6.598 1.00 0.00 N ATOM 445 CA ILE A 34 -0.008 -5.317 5.957 1.00 0.00 C ATOM 446 C ILE A 34 -0.063 -6.591 6.793 1.00 0.00 C ATOM 447 O ILE A 34 0.935 -7.298 6.934 1.00 0.00 O ATOM 448 CB ILE A 34 0.513 -5.663 4.549 1.00 0.00 C ATOM 449 CG1 ILE A 34 0.865 -4.385 3.785 1.00 0.00 C ATOM 450 CG2 ILE A 34 -0.523 -6.475 3.786 1.00 0.00 C ATOM 451 CD1 ILE A 34 1.498 -4.644 2.436 1.00 0.00 C ATOM 0 H ILE A 34 1.787 -4.589 6.758 1.00 0.00 H new ATOM 0 HA ILE A 34 -1.010 -4.897 5.872 1.00 0.00 H new ATOM 0 HB ILE A 34 1.416 -6.265 4.649 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -0.040 -3.794 3.645 1.00 0.00 H new ATOM 0 HG13 ILE A 34 1.547 -3.786 4.389 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -0.141 -6.712 2.793 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -0.730 -7.399 4.325 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -1.442 -5.896 3.692 1.00 0.00 H new ATOM 0 HD11 ILE A 34 1.721 -3.694 1.950 1.00 0.00 H new ATOM 0 HD12 ILE A 34 2.421 -5.209 2.569 1.00 0.00 H new ATOM 0 HD13 ILE A 34 0.809 -5.216 1.815 1.00 0.00 H new ATOM 463 N VAL A 35 -1.238 -6.880 7.345 1.00 0.00 N ATOM 464 CA VAL A 35 -1.425 -8.071 8.165 1.00 0.00 C ATOM 465 C VAL A 35 -1.339 -9.338 7.321 1.00 0.00 C ATOM 466 O VAL A 35 -2.292 -9.706 6.634 1.00 0.00 O ATOM 467 CB VAL A 35 -2.782 -8.043 8.893 1.00 0.00 C ATOM 468 CG1 VAL A 35 -2.926 -9.256 9.800 1.00 0.00 C ATOM 469 CG2 VAL A 35 -2.934 -6.754 9.686 1.00 0.00 C ATOM 0 H VAL A 35 -2.074 -6.305 7.239 1.00 0.00 H new ATOM 0 HA VAL A 35 -0.624 -8.076 8.905 1.00 0.00 H new ATOM 0 HB VAL A 35 -3.576 -8.080 8.147 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -3.891 -9.219 10.306 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -2.864 -10.166 9.203 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -2.127 -9.253 10.541 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -3.898 -6.751 10.194 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -2.135 -6.684 10.424 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -2.878 -5.902 9.009 1.00 0.00 H new ATOM 479 N THR A 36 -0.189 -10.004 7.378 1.00 0.00 N ATOM 480 CA THR A 36 0.022 -11.230 6.619 1.00 0.00 C ATOM 481 C THR A 36 0.530 -12.352 7.518 1.00 0.00 C ATOM 482 O THR A 36 1.116 -13.325 7.043 1.00 0.00 O ATOM 483 CB THR A 36 1.025 -11.014 5.471 1.00 0.00 C ATOM 484 OG1 THR A 36 2.191 -10.340 5.959 1.00 0.00 O ATOM 485 CG2 THR A 36 0.397 -10.201 4.349 1.00 0.00 C ATOM 0 H THR A 36 0.610 -9.714 7.942 1.00 0.00 H new ATOM 0 HA THR A 36 -0.944 -11.513 6.200 1.00 0.00 H new ATOM 0 HB THR A 36 1.308 -11.990 5.077 1.00 0.00 H new ATOM 0 HG1 THR A 36 2.825 -10.208 5.223 1.00 0.00 H new ATOM 0 HG21 THR A 36 1.125 -10.061 3.550 1.00 0.00 H new ATOM 0 HG22 THR A 36 -0.473 -10.730 3.960 1.00 0.00 H new ATOM 0 HG23 THR A 36 0.089 -9.228 4.733 1.00 0.00 H new ATOM 493 N LYS A 37 0.300 -12.212 8.819 1.00 0.00 N ATOM 494 CA LYS A 37 0.732 -13.214 9.785 1.00 0.00 C ATOM 495 C LYS A 37 0.137 -14.580 9.456 1.00 0.00 C ATOM 496 O LYS A 37 0.855 -15.575 9.364 1.00 0.00 O ATOM 497 CB LYS A 37 0.325 -12.797 11.200 1.00 0.00 C ATOM 498 CG LYS A 37 -1.170 -12.587 11.367 1.00 0.00 C ATOM 499 CD LYS A 37 -1.472 -11.583 12.467 1.00 0.00 C ATOM 500 CE LYS A 37 -1.474 -12.242 13.837 1.00 0.00 C ATOM 501 NZ LYS A 37 -0.108 -12.298 14.427 1.00 0.00 N ATOM 0 H LYS A 37 -0.184 -11.413 9.229 1.00 0.00 H new ATOM 0 HA LYS A 37 1.818 -13.288 9.732 1.00 0.00 H new ATOM 0 HB2 LYS A 37 0.657 -13.560 11.904 1.00 0.00 H new ATOM 0 HB3 LYS A 37 0.844 -11.875 11.461 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -1.597 -12.237 10.427 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -1.648 -13.538 11.600 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -0.730 -10.785 12.447 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -2.442 -11.121 12.283 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -2.136 -11.690 14.505 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -1.875 -13.252 13.754 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 0.122 -13.281 14.677 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 0.584 -11.946 13.735 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -0.075 -11.707 15.282 1.00 0.00 H new ATOM 515 N ASP A 38 -1.179 -14.619 9.278 1.00 0.00 N ATOM 516 CA ASP A 38 -1.871 -15.862 8.956 1.00 0.00 C ATOM 517 C ASP A 38 -1.656 -16.239 7.493 1.00 0.00 C ATOM 518 O ASP A 38 -1.223 -17.349 7.186 1.00 0.00 O ATOM 519 CB ASP A 38 -3.366 -15.728 9.247 1.00 0.00 C ATOM 520 CG ASP A 38 -3.643 -15.331 10.683 1.00 0.00 C ATOM 521 OD1 ASP A 38 -3.410 -16.163 11.584 1.00 0.00 O ATOM 522 OD2 ASP A 38 -4.093 -14.187 10.907 1.00 0.00 O ATOM 0 H ASP A 38 -1.788 -13.804 9.351 1.00 0.00 H new ATOM 0 HA ASP A 38 -1.457 -16.653 9.581 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -3.798 -14.984 8.578 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -3.861 -16.675 9.033 1.00 0.00 H new ATOM 527 N ALA A 39 -1.963 -15.308 6.596 1.00 0.00 N ATOM 528 CA ALA A 39 -1.803 -15.543 5.166 1.00 0.00 C ATOM 529 C ALA A 39 -0.561 -16.381 4.883 1.00 0.00 C ATOM 530 O ALA A 39 -0.593 -17.301 4.067 1.00 0.00 O ATOM 531 CB ALA A 39 -1.732 -14.220 4.419 1.00 0.00 C ATOM 0 H ALA A 39 -2.324 -14.384 6.834 1.00 0.00 H new ATOM 0 HA ALA A 39 -2.672 -16.100 4.814 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -1.613 -14.410 3.352 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -2.651 -13.658 4.587 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -0.882 -13.642 4.782 1.00 0.00 H new ATOM 537 N GLY A 40 0.535 -16.055 5.563 1.00 0.00 N ATOM 538 CA GLY A 40 1.773 -16.786 5.369 1.00 0.00 C ATOM 539 C GLY A 40 2.371 -16.561 3.994 1.00 0.00 C ATOM 540 O GLY A 40 1.654 -16.549 2.994 1.00 0.00 O ATOM 0 H GLY A 40 0.587 -15.298 6.244 1.00 0.00 H new ATOM 0 HA2 GLY A 40 2.493 -16.483 6.129 1.00 0.00 H new ATOM 0 HA3 GLY A 40 1.589 -17.851 5.512 1.00 0.00 H new ATOM 544 N GLU A 41 3.687 -16.381 3.945 1.00 0.00 N ATOM 545 CA GLU A 41 4.379 -16.152 2.682 1.00 0.00 C ATOM 546 C GLU A 41 3.808 -17.040 1.580 1.00 0.00 C ATOM 547 O GLU A 41 4.048 -18.246 1.553 1.00 0.00 O ATOM 548 CB GLU A 41 5.878 -16.418 2.841 1.00 0.00 C ATOM 549 CG GLU A 41 6.648 -15.238 3.411 1.00 0.00 C ATOM 550 CD GLU A 41 8.054 -15.612 3.839 1.00 0.00 C ATOM 551 OE1 GLU A 41 8.228 -16.037 5.000 1.00 0.00 O ATOM 552 OE2 GLU A 41 8.980 -15.478 3.012 1.00 0.00 O ATOM 0 H GLU A 41 4.295 -16.389 4.764 1.00 0.00 H new ATOM 0 HA GLU A 41 4.230 -15.110 2.399 1.00 0.00 H new ATOM 0 HB2 GLU A 41 6.018 -17.281 3.492 1.00 0.00 H new ATOM 0 HB3 GLU A 41 6.297 -16.680 1.869 1.00 0.00 H new ATOM 0 HG2 GLU A 41 6.698 -14.446 2.664 1.00 0.00 H new ATOM 0 HG3 GLU A 41 6.107 -14.835 4.267 1.00 0.00 H new ATOM 559 N GLY A 42 3.050 -16.433 0.672 1.00 0.00 N ATOM 560 CA GLY A 42 2.456 -17.183 -0.419 1.00 0.00 C ATOM 561 C GLY A 42 2.634 -16.496 -1.759 1.00 0.00 C ATOM 562 O GLY A 42 3.707 -16.556 -2.357 1.00 0.00 O ATOM 0 H GLY A 42 2.837 -15.436 0.673 1.00 0.00 H new ATOM 0 HA2 GLY A 42 2.905 -18.175 -0.460 1.00 0.00 H new ATOM 0 HA3 GLY A 42 1.393 -17.322 -0.224 1.00 0.00 H new ATOM 566 N GLY A 43 1.577 -15.842 -2.232 1.00 0.00 N ATOM 567 CA GLY A 43 1.641 -15.153 -3.507 1.00 0.00 C ATOM 568 C GLY A 43 0.959 -13.799 -3.470 1.00 0.00 C ATOM 569 O GLY A 43 -0.036 -13.578 -4.162 1.00 0.00 O ATOM 0 H GLY A 43 0.678 -15.777 -1.755 1.00 0.00 H new ATOM 0 HA2 GLY A 43 2.684 -15.023 -3.794 1.00 0.00 H new ATOM 0 HA3 GLY A 43 1.174 -15.771 -4.274 1.00 0.00 H new ATOM 573 N LEU A 44 1.492 -12.892 -2.659 1.00 0.00 N ATOM 574 CA LEU A 44 0.927 -11.553 -2.532 1.00 0.00 C ATOM 575 C LEU A 44 1.467 -10.629 -3.620 1.00 0.00 C ATOM 576 O LEU A 44 2.628 -10.730 -4.014 1.00 0.00 O ATOM 577 CB LEU A 44 1.243 -10.974 -1.152 1.00 0.00 C ATOM 578 CG LEU A 44 0.442 -9.736 -0.745 1.00 0.00 C ATOM 579 CD1 LEU A 44 -1.012 -10.102 -0.491 1.00 0.00 C ATOM 580 CD2 LEU A 44 1.054 -9.088 0.489 1.00 0.00 C ATOM 0 H LEU A 44 2.315 -13.059 -2.079 1.00 0.00 H new ATOM 0 HA LEU A 44 -0.154 -11.628 -2.649 1.00 0.00 H new ATOM 0 HB2 LEU A 44 1.076 -11.752 -0.407 1.00 0.00 H new ATOM 0 HB3 LEU A 44 2.303 -10.723 -1.119 1.00 0.00 H new ATOM 0 HG LEU A 44 0.477 -9.018 -1.564 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -1.567 -9.209 -0.203 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -1.446 -10.521 -1.399 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -1.067 -10.838 0.311 1.00 0.00 H new ATOM 0 HD21 LEU A 44 0.472 -8.209 0.765 1.00 0.00 H new ATOM 0 HD22 LEU A 44 1.049 -9.800 1.314 1.00 0.00 H new ATOM 0 HD23 LEU A 44 2.080 -8.791 0.273 1.00 0.00 H new ATOM 592 N SER A 45 0.615 -9.728 -4.099 1.00 0.00 N ATOM 593 CA SER A 45 1.006 -8.787 -5.142 1.00 0.00 C ATOM 594 C SER A 45 0.821 -7.347 -4.672 1.00 0.00 C ATOM 595 O SER A 45 -0.038 -7.060 -3.837 1.00 0.00 O ATOM 596 CB SER A 45 0.186 -9.030 -6.411 1.00 0.00 C ATOM 597 OG SER A 45 0.924 -8.683 -7.569 1.00 0.00 O ATOM 0 H SER A 45 -0.349 -9.630 -3.782 1.00 0.00 H new ATOM 0 HA SER A 45 2.061 -8.946 -5.363 1.00 0.00 H new ATOM 0 HB2 SER A 45 -0.107 -10.079 -6.463 1.00 0.00 H new ATOM 0 HB3 SER A 45 -0.732 -8.444 -6.372 1.00 0.00 H new ATOM 0 HG SER A 45 0.379 -8.849 -8.366 1.00 0.00 H new ATOM 603 N LEU A 46 1.634 -6.446 -5.213 1.00 0.00 N ATOM 604 CA LEU A 46 1.562 -5.035 -4.849 1.00 0.00 C ATOM 605 C LEU A 46 1.686 -4.148 -6.084 1.00 0.00 C ATOM 606 O LEU A 46 2.662 -4.237 -6.829 1.00 0.00 O ATOM 607 CB LEU A 46 2.664 -4.690 -3.846 1.00 0.00 C ATOM 608 CG LEU A 46 2.499 -5.270 -2.441 1.00 0.00 C ATOM 609 CD1 LEU A 46 3.853 -5.426 -1.766 1.00 0.00 C ATOM 610 CD2 LEU A 46 1.582 -4.390 -1.605 1.00 0.00 C ATOM 0 H LEU A 46 2.350 -6.667 -5.905 1.00 0.00 H new ATOM 0 HA LEU A 46 0.591 -4.852 -4.389 1.00 0.00 H new ATOM 0 HB2 LEU A 46 3.616 -5.034 -4.250 1.00 0.00 H new ATOM 0 HB3 LEU A 46 2.726 -3.605 -3.764 1.00 0.00 H new ATOM 0 HG LEU A 46 2.043 -6.256 -2.527 1.00 0.00 H new ATOM 0 HD11 LEU A 46 3.716 -5.840 -0.767 1.00 0.00 H new ATOM 0 HD12 LEU A 46 4.478 -6.098 -2.355 1.00 0.00 H new ATOM 0 HD13 LEU A 46 4.337 -4.452 -1.692 1.00 0.00 H new ATOM 0 HD21 LEU A 46 1.476 -4.818 -0.608 1.00 0.00 H new ATOM 0 HD22 LEU A 46 2.009 -3.390 -1.527 1.00 0.00 H new ATOM 0 HD23 LEU A 46 0.603 -4.330 -2.080 1.00 0.00 H new ATOM 622 N ALA A 47 0.691 -3.292 -6.293 1.00 0.00 N ATOM 623 CA ALA A 47 0.691 -2.386 -7.434 1.00 0.00 C ATOM 624 C ALA A 47 -0.252 -1.210 -7.202 1.00 0.00 C ATOM 625 O ALA A 47 -1.357 -1.380 -6.686 1.00 0.00 O ATOM 626 CB ALA A 47 0.303 -3.133 -8.702 1.00 0.00 C ATOM 0 H ALA A 47 -0.125 -3.207 -5.687 1.00 0.00 H new ATOM 0 HA ALA A 47 1.700 -1.991 -7.552 1.00 0.00 H new ATOM 0 HB1 ALA A 47 0.307 -2.444 -9.546 1.00 0.00 H new ATOM 0 HB2 ALA A 47 1.018 -3.935 -8.885 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -0.695 -3.556 -8.584 1.00 0.00 H new ATOM 632 N VAL A 48 0.191 -0.017 -7.585 1.00 0.00 N ATOM 633 CA VAL A 48 -0.614 1.187 -7.418 1.00 0.00 C ATOM 634 C VAL A 48 -1.033 1.760 -8.768 1.00 0.00 C ATOM 635 O VAL A 48 -0.241 1.798 -9.709 1.00 0.00 O ATOM 636 CB VAL A 48 0.149 2.268 -6.629 1.00 0.00 C ATOM 637 CG1 VAL A 48 -0.709 3.513 -6.462 1.00 0.00 C ATOM 638 CG2 VAL A 48 0.589 1.728 -5.277 1.00 0.00 C ATOM 0 H VAL A 48 1.103 0.142 -8.013 1.00 0.00 H new ATOM 0 HA VAL A 48 -1.503 0.898 -6.857 1.00 0.00 H new ATOM 0 HB VAL A 48 1.040 2.544 -7.192 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -0.153 4.265 -5.902 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -0.970 3.910 -7.443 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -1.620 3.257 -5.921 1.00 0.00 H new ATOM 0 HG21 VAL A 48 1.127 2.504 -4.733 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -0.287 1.423 -4.704 1.00 0.00 H new ATOM 0 HG23 VAL A 48 1.243 0.869 -5.424 1.00 0.00 H new ATOM 648 N GLU A 49 -2.283 2.204 -8.854 1.00 0.00 N ATOM 649 CA GLU A 49 -2.806 2.775 -10.090 1.00 0.00 C ATOM 650 C GLU A 49 -3.482 4.117 -9.826 1.00 0.00 C ATOM 651 O GLU A 49 -4.592 4.172 -9.299 1.00 0.00 O ATOM 652 CB GLU A 49 -3.799 1.811 -10.742 1.00 0.00 C ATOM 653 CG GLU A 49 -3.136 0.688 -11.521 1.00 0.00 C ATOM 654 CD GLU A 49 -4.031 0.122 -12.606 1.00 0.00 C ATOM 655 OE1 GLU A 49 -4.768 0.909 -13.237 1.00 0.00 O ATOM 656 OE2 GLU A 49 -3.995 -1.107 -12.825 1.00 0.00 O ATOM 0 H GLU A 49 -2.951 2.179 -8.084 1.00 0.00 H new ATOM 0 HA GLU A 49 -1.968 2.937 -10.768 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -4.434 1.379 -9.969 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -4.450 2.372 -11.413 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -2.215 1.058 -11.972 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -2.856 -0.110 -10.833 1.00 0.00 H new ATOM 663 N GLY A 50 -2.802 5.198 -10.196 1.00 0.00 N ATOM 664 CA GLY A 50 -3.351 6.526 -9.991 1.00 0.00 C ATOM 665 C GLY A 50 -2.928 7.502 -11.070 1.00 0.00 C ATOM 666 O GLY A 50 -2.632 7.118 -12.202 1.00 0.00 O ATOM 0 H GLY A 50 -1.881 5.178 -10.634 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -4.439 6.466 -9.966 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -3.030 6.902 -9.019 1.00 0.00 H new ATOM 670 N PRO A 51 -2.896 8.797 -10.724 1.00 0.00 N ATOM 671 CA PRO A 51 -2.508 9.858 -11.658 1.00 0.00 C ATOM 672 C PRO A 51 -1.024 9.813 -12.003 1.00 0.00 C ATOM 673 O PRO A 51 -0.543 10.593 -12.825 1.00 0.00 O ATOM 674 CB PRO A 51 -2.842 11.142 -10.896 1.00 0.00 C ATOM 675 CG PRO A 51 -2.778 10.757 -9.458 1.00 0.00 C ATOM 676 CD PRO A 51 -3.236 9.326 -9.392 1.00 0.00 C ATOM 0 HA PRO A 51 -3.024 9.768 -12.614 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -2.130 11.935 -11.126 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -3.831 11.515 -11.162 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -1.764 10.861 -9.071 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -3.417 11.400 -8.853 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -2.727 8.777 -8.600 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -4.305 9.255 -9.192 1.00 0.00 H new ATOM 684 N SER A 52 -0.301 8.894 -11.369 1.00 0.00 N ATOM 685 CA SER A 52 1.130 8.750 -11.606 1.00 0.00 C ATOM 686 C SER A 52 1.628 7.394 -11.115 1.00 0.00 C ATOM 687 O SER A 52 0.989 6.748 -10.284 1.00 0.00 O ATOM 688 CB SER A 52 1.900 9.872 -10.907 1.00 0.00 C ATOM 689 OG SER A 52 2.075 10.984 -11.768 1.00 0.00 O ATOM 0 H SER A 52 -0.684 8.239 -10.688 1.00 0.00 H new ATOM 0 HA SER A 52 1.303 8.815 -12.680 1.00 0.00 H new ATOM 0 HB2 SER A 52 1.362 10.183 -10.011 1.00 0.00 H new ATOM 0 HB3 SER A 52 2.873 9.502 -10.583 1.00 0.00 H new ATOM 0 HG SER A 52 1.261 11.120 -12.297 1.00 0.00 H new ATOM 695 N LYS A 53 2.774 6.968 -11.635 1.00 0.00 N ATOM 696 CA LYS A 53 3.361 5.690 -11.251 1.00 0.00 C ATOM 697 C LYS A 53 4.288 5.856 -10.051 1.00 0.00 C ATOM 698 O LYS A 53 5.375 6.422 -10.168 1.00 0.00 O ATOM 699 CB LYS A 53 4.133 5.086 -12.426 1.00 0.00 C ATOM 700 CG LYS A 53 4.464 3.615 -12.245 1.00 0.00 C ATOM 701 CD LYS A 53 5.730 3.232 -12.993 1.00 0.00 C ATOM 702 CE LYS A 53 5.679 1.790 -13.474 1.00 0.00 C ATOM 703 NZ LYS A 53 6.206 0.845 -12.452 1.00 0.00 N ATOM 0 H LYS A 53 3.315 7.490 -12.324 1.00 0.00 H new ATOM 0 HA LYS A 53 2.551 5.016 -10.972 1.00 0.00 H new ATOM 0 HB2 LYS A 53 3.546 5.208 -13.336 1.00 0.00 H new ATOM 0 HB3 LYS A 53 5.059 5.643 -12.566 1.00 0.00 H new ATOM 0 HG2 LYS A 53 4.587 3.397 -11.184 1.00 0.00 H new ATOM 0 HG3 LYS A 53 3.632 3.007 -12.601 1.00 0.00 H new ATOM 0 HD2 LYS A 53 5.865 3.897 -13.846 1.00 0.00 H new ATOM 0 HD3 LYS A 53 6.594 3.369 -12.342 1.00 0.00 H new ATOM 0 HE2 LYS A 53 4.650 1.525 -13.717 1.00 0.00 H new ATOM 0 HE3 LYS A 53 6.259 1.693 -14.392 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 6.154 -0.127 -12.818 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 7.196 1.082 -12.238 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 5.637 0.919 -11.585 1.00 0.00 H new ATOM 717 N ALA A 54 3.853 5.357 -8.899 1.00 0.00 N ATOM 718 CA ALA A 54 4.645 5.447 -7.679 1.00 0.00 C ATOM 719 C ALA A 54 5.361 4.132 -7.391 1.00 0.00 C ATOM 720 O ALA A 54 4.749 3.064 -7.415 1.00 0.00 O ATOM 721 CB ALA A 54 3.762 5.838 -6.504 1.00 0.00 C ATOM 0 H ALA A 54 2.956 4.886 -8.785 1.00 0.00 H new ATOM 0 HA ALA A 54 5.402 6.218 -7.823 1.00 0.00 H new ATOM 0 HB1 ALA A 54 4.367 5.901 -5.600 1.00 0.00 H new ATOM 0 HB2 ALA A 54 3.302 6.806 -6.701 1.00 0.00 H new ATOM 0 HB3 ALA A 54 2.984 5.087 -6.368 1.00 0.00 H new ATOM 727 N GLU A 55 6.660 4.217 -7.120 1.00 0.00 N ATOM 728 CA GLU A 55 7.458 3.032 -6.830 1.00 0.00 C ATOM 729 C GLU A 55 7.097 2.454 -5.464 1.00 0.00 C ATOM 730 O GLU A 55 6.979 3.185 -4.481 1.00 0.00 O ATOM 731 CB GLU A 55 8.949 3.371 -6.874 1.00 0.00 C ATOM 732 CG GLU A 55 9.443 4.106 -5.639 1.00 0.00 C ATOM 733 CD GLU A 55 10.726 4.874 -5.892 1.00 0.00 C ATOM 734 OE1 GLU A 55 10.684 5.871 -6.642 1.00 0.00 O ATOM 735 OE2 GLU A 55 11.773 4.476 -5.339 1.00 0.00 O ATOM 0 H GLU A 55 7.181 5.093 -7.095 1.00 0.00 H new ATOM 0 HA GLU A 55 7.240 2.283 -7.592 1.00 0.00 H new ATOM 0 HB2 GLU A 55 9.519 2.449 -6.990 1.00 0.00 H new ATOM 0 HB3 GLU A 55 9.148 3.982 -7.754 1.00 0.00 H new ATOM 0 HG2 GLU A 55 8.671 4.797 -5.299 1.00 0.00 H new ATOM 0 HG3 GLU A 55 9.606 3.389 -4.835 1.00 0.00 H new ATOM 742 N ILE A 56 6.922 1.138 -5.413 1.00 0.00 N ATOM 743 CA ILE A 56 6.574 0.462 -4.169 1.00 0.00 C ATOM 744 C ILE A 56 7.711 -0.438 -3.696 1.00 0.00 C ATOM 745 O ILE A 56 8.257 -1.227 -4.469 1.00 0.00 O ATOM 746 CB ILE A 56 5.297 -0.384 -4.326 1.00 0.00 C ATOM 747 CG1 ILE A 56 4.212 0.420 -5.045 1.00 0.00 C ATOM 748 CG2 ILE A 56 4.802 -0.853 -2.966 1.00 0.00 C ATOM 749 CD1 ILE A 56 3.208 -0.441 -5.778 1.00 0.00 C ATOM 0 H ILE A 56 7.015 0.519 -6.218 1.00 0.00 H new ATOM 0 HA ILE A 56 6.396 1.240 -3.426 1.00 0.00 H new ATOM 0 HB ILE A 56 5.532 -1.262 -4.928 1.00 0.00 H new ATOM 0 HG12 ILE A 56 3.686 1.037 -4.317 1.00 0.00 H new ATOM 0 HG13 ILE A 56 4.684 1.098 -5.756 1.00 0.00 H new ATOM 0 HG21 ILE A 56 3.899 -1.450 -3.093 1.00 0.00 H new ATOM 0 HG22 ILE A 56 5.572 -1.458 -2.487 1.00 0.00 H new ATOM 0 HG23 ILE A 56 4.580 0.012 -2.341 1.00 0.00 H new ATOM 0 HD11 ILE A 56 2.469 0.196 -6.264 1.00 0.00 H new ATOM 0 HD12 ILE A 56 3.722 -1.039 -6.530 1.00 0.00 H new ATOM 0 HD13 ILE A 56 2.708 -1.101 -5.069 1.00 0.00 H new ATOM 761 N THR A 57 8.064 -0.316 -2.420 1.00 0.00 N ATOM 762 CA THR A 57 9.135 -1.118 -1.843 1.00 0.00 C ATOM 763 C THR A 57 8.672 -1.821 -0.572 1.00 0.00 C ATOM 764 O THR A 57 8.241 -1.175 0.384 1.00 0.00 O ATOM 765 CB THR A 57 10.370 -0.257 -1.520 1.00 0.00 C ATOM 766 OG1 THR A 57 10.770 0.482 -2.679 1.00 0.00 O ATOM 767 CG2 THR A 57 11.525 -1.124 -1.041 1.00 0.00 C ATOM 0 H THR A 57 7.623 0.331 -1.766 1.00 0.00 H new ATOM 0 HA THR A 57 9.408 -1.865 -2.589 1.00 0.00 H new ATOM 0 HB THR A 57 10.102 0.436 -0.723 1.00 0.00 H new ATOM 0 HG1 THR A 57 11.555 1.028 -2.464 1.00 0.00 H new ATOM 0 HG21 THR A 57 12.386 -0.493 -0.819 1.00 0.00 H new ATOM 0 HG22 THR A 57 11.227 -1.662 -0.141 1.00 0.00 H new ATOM 0 HG23 THR A 57 11.790 -1.839 -1.820 1.00 0.00 H new ATOM 775 N CYS A 58 8.765 -3.146 -0.567 1.00 0.00 N ATOM 776 CA CYS A 58 8.355 -3.937 0.588 1.00 0.00 C ATOM 777 C CYS A 58 9.556 -4.289 1.460 1.00 0.00 C ATOM 778 O CYS A 58 10.700 -4.252 1.005 1.00 0.00 O ATOM 779 CB CYS A 58 7.649 -5.215 0.133 1.00 0.00 C ATOM 780 SG CYS A 58 8.703 -6.349 -0.800 1.00 0.00 S ATOM 0 H CYS A 58 9.121 -3.695 -1.350 1.00 0.00 H new ATOM 0 HA CYS A 58 7.662 -3.338 1.179 1.00 0.00 H new ATOM 0 HB2 CYS A 58 7.261 -5.735 1.009 1.00 0.00 H new ATOM 0 HB3 CYS A 58 6.791 -4.944 -0.483 1.00 0.00 H new ATOM 0 HG CYS A 58 8.017 -7.400 -1.138 1.00 0.00 H new ATOM 786 N LYS A 59 9.289 -4.629 2.716 1.00 0.00 N ATOM 787 CA LYS A 59 10.347 -4.987 3.653 1.00 0.00 C ATOM 788 C LYS A 59 9.966 -6.226 4.456 1.00 0.00 C ATOM 789 O LYS A 59 8.794 -6.438 4.770 1.00 0.00 O ATOM 790 CB LYS A 59 10.633 -3.820 4.602 1.00 0.00 C ATOM 791 CG LYS A 59 12.068 -3.778 5.098 1.00 0.00 C ATOM 792 CD LYS A 59 12.240 -4.585 6.375 1.00 0.00 C ATOM 793 CE LYS A 59 11.742 -3.818 7.590 1.00 0.00 C ATOM 794 NZ LYS A 59 12.206 -4.434 8.864 1.00 0.00 N ATOM 0 H LYS A 59 8.348 -4.664 3.109 1.00 0.00 H new ATOM 0 HA LYS A 59 11.246 -5.210 3.079 1.00 0.00 H new ATOM 0 HB2 LYS A 59 10.406 -2.884 4.092 1.00 0.00 H new ATOM 0 HB3 LYS A 59 9.963 -3.887 5.459 1.00 0.00 H new ATOM 0 HG2 LYS A 59 12.732 -4.169 4.327 1.00 0.00 H new ATOM 0 HG3 LYS A 59 12.362 -2.744 5.278 1.00 0.00 H new ATOM 0 HD2 LYS A 59 11.695 -5.525 6.289 1.00 0.00 H new ATOM 0 HD3 LYS A 59 13.292 -4.837 6.509 1.00 0.00 H new ATOM 0 HE2 LYS A 59 12.092 -2.787 7.537 1.00 0.00 H new ATOM 0 HE3 LYS A 59 10.653 -3.786 7.578 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 11.653 -4.050 9.657 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 12.077 -5.465 8.819 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 13.213 -4.218 9.008 1.00 0.00 H new ATOM 808 N ASP A 60 10.962 -7.041 4.787 1.00 0.00 N ATOM 809 CA ASP A 60 10.731 -8.258 5.556 1.00 0.00 C ATOM 810 C ASP A 60 10.975 -8.016 7.043 1.00 0.00 C ATOM 811 O ASP A 60 12.112 -7.830 7.473 1.00 0.00 O ATOM 812 CB ASP A 60 11.637 -9.383 5.055 1.00 0.00 C ATOM 813 CG ASP A 60 13.108 -9.027 5.145 1.00 0.00 C ATOM 814 OD1 ASP A 60 13.442 -7.837 4.967 1.00 0.00 O ATOM 815 OD2 ASP A 60 13.924 -9.937 5.395 1.00 0.00 O ATOM 0 H ASP A 60 11.937 -6.881 4.535 1.00 0.00 H new ATOM 0 HA ASP A 60 9.690 -8.552 5.420 1.00 0.00 H new ATOM 0 HB2 ASP A 60 11.448 -10.284 5.638 1.00 0.00 H new ATOM 0 HB3 ASP A 60 11.385 -9.614 4.020 1.00 0.00 H new ATOM 820 N ASN A 61 9.898 -8.020 7.822 1.00 0.00 N ATOM 821 CA ASN A 61 9.995 -7.799 9.260 1.00 0.00 C ATOM 822 C ASN A 61 10.321 -9.099 9.989 1.00 0.00 C ATOM 823 O ASN A 61 10.912 -9.087 11.070 1.00 0.00 O ATOM 824 CB ASN A 61 8.687 -7.214 9.797 1.00 0.00 C ATOM 825 CG ASN A 61 8.379 -5.851 9.208 1.00 0.00 C ATOM 826 OD1 ASN A 61 8.917 -4.836 9.649 1.00 0.00 O ATOM 827 ND2 ASN A 61 7.508 -5.824 8.206 1.00 0.00 N ATOM 0 H ASN A 61 8.949 -8.174 7.482 1.00 0.00 H new ATOM 0 HA ASN A 61 10.803 -7.090 9.440 1.00 0.00 H new ATOM 0 HB2 ASN A 61 7.868 -7.897 9.573 1.00 0.00 H new ATOM 0 HB3 ASN A 61 8.747 -7.133 10.882 1.00 0.00 H new ATOM 0 HD21 ASN A 61 7.260 -4.936 7.769 1.00 0.00 H new ATOM 0 HD22 ASN A 61 7.087 -6.691 7.873 1.00 0.00 H new ATOM 834 N LYS A 62 9.932 -10.220 9.391 1.00 0.00 N ATOM 835 CA LYS A 62 10.183 -11.530 9.981 1.00 0.00 C ATOM 836 C LYS A 62 9.551 -11.633 11.365 1.00 0.00 C ATOM 837 O LYS A 62 10.050 -12.350 12.233 1.00 0.00 O ATOM 838 CB LYS A 62 11.689 -11.789 10.075 1.00 0.00 C ATOM 839 CG LYS A 62 12.271 -12.447 8.837 1.00 0.00 C ATOM 840 CD LYS A 62 13.636 -13.054 9.117 1.00 0.00 C ATOM 841 CE LYS A 62 14.347 -13.446 7.831 1.00 0.00 C ATOM 842 NZ LYS A 62 15.549 -14.285 8.095 1.00 0.00 N ATOM 0 H LYS A 62 9.441 -10.248 8.497 1.00 0.00 H new ATOM 0 HA LYS A 62 9.730 -12.284 9.337 1.00 0.00 H new ATOM 0 HB2 LYS A 62 12.202 -10.843 10.248 1.00 0.00 H new ATOM 0 HB3 LYS A 62 11.887 -12.422 10.940 1.00 0.00 H new ATOM 0 HG2 LYS A 62 11.592 -13.223 8.483 1.00 0.00 H new ATOM 0 HG3 LYS A 62 12.356 -11.710 8.038 1.00 0.00 H new ATOM 0 HD2 LYS A 62 14.247 -12.339 9.668 1.00 0.00 H new ATOM 0 HD3 LYS A 62 13.521 -13.932 9.753 1.00 0.00 H new ATOM 0 HE2 LYS A 62 13.658 -13.992 7.187 1.00 0.00 H new ATOM 0 HE3 LYS A 62 14.643 -12.547 7.291 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 16.005 -14.531 7.193 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 16.219 -13.755 8.689 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 15.263 -15.155 8.587 1.00 0.00 H new ATOM 856 N ASP A 63 8.451 -10.916 11.563 1.00 0.00 N ATOM 857 CA ASP A 63 7.749 -10.929 12.841 1.00 0.00 C ATOM 858 C ASP A 63 6.283 -11.306 12.652 1.00 0.00 C ATOM 859 O ASP A 63 5.593 -11.656 13.609 1.00 0.00 O ATOM 860 CB ASP A 63 7.854 -9.563 13.520 1.00 0.00 C ATOM 861 CG ASP A 63 7.423 -9.603 14.973 1.00 0.00 C ATOM 862 OD1 ASP A 63 7.642 -10.643 15.629 1.00 0.00 O ATOM 863 OD2 ASP A 63 6.867 -8.594 15.454 1.00 0.00 O ATOM 0 H ASP A 63 8.026 -10.318 10.855 1.00 0.00 H new ATOM 0 HA ASP A 63 8.219 -11.679 13.477 1.00 0.00 H new ATOM 0 HB2 ASP A 63 8.883 -9.209 13.459 1.00 0.00 H new ATOM 0 HB3 ASP A 63 7.237 -8.844 12.981 1.00 0.00 H new ATOM 868 N GLY A 64 5.813 -11.230 11.411 1.00 0.00 N ATOM 869 CA GLY A 64 4.431 -11.564 11.119 1.00 0.00 C ATOM 870 C GLY A 64 3.717 -10.464 10.359 1.00 0.00 C ATOM 871 O GLY A 64 2.488 -10.384 10.377 1.00 0.00 O ATOM 0 H GLY A 64 6.364 -10.943 10.602 1.00 0.00 H new ATOM 0 HA2 GLY A 64 4.398 -12.484 10.536 1.00 0.00 H new ATOM 0 HA3 GLY A 64 3.902 -11.759 12.052 1.00 0.00 H new ATOM 875 N THR A 65 4.487 -9.612 9.690 1.00 0.00 N ATOM 876 CA THR A 65 3.921 -8.510 8.923 1.00 0.00 C ATOM 877 C THR A 65 4.897 -8.023 7.858 1.00 0.00 C ATOM 878 O THR A 65 6.027 -8.505 7.771 1.00 0.00 O ATOM 879 CB THR A 65 3.541 -7.328 9.834 1.00 0.00 C ATOM 880 OG1 THR A 65 4.710 -6.813 10.482 1.00 0.00 O ATOM 881 CG2 THR A 65 2.523 -7.757 10.881 1.00 0.00 C ATOM 0 H THR A 65 5.505 -9.664 9.664 1.00 0.00 H new ATOM 0 HA THR A 65 3.021 -8.891 8.440 1.00 0.00 H new ATOM 0 HB THR A 65 3.096 -6.549 9.215 1.00 0.00 H new ATOM 0 HG1 THR A 65 4.460 -6.061 11.058 1.00 0.00 H new ATOM 0 HG21 THR A 65 2.270 -6.906 11.513 1.00 0.00 H new ATOM 0 HG22 THR A 65 1.623 -8.122 10.386 1.00 0.00 H new ATOM 0 HG23 THR A 65 2.946 -8.552 11.496 1.00 0.00 H new ATOM 889 N CYS A 66 4.455 -7.064 7.052 1.00 0.00 N ATOM 890 CA CYS A 66 5.291 -6.511 5.992 1.00 0.00 C ATOM 891 C CYS A 66 5.216 -4.988 5.980 1.00 0.00 C ATOM 892 O CYS A 66 4.156 -4.405 6.213 1.00 0.00 O ATOM 893 CB CYS A 66 4.861 -7.066 4.633 1.00 0.00 C ATOM 894 SG CYS A 66 6.186 -7.115 3.404 1.00 0.00 S ATOM 0 H CYS A 66 3.523 -6.653 7.112 1.00 0.00 H new ATOM 0 HA CYS A 66 6.323 -6.804 6.186 1.00 0.00 H new ATOM 0 HB2 CYS A 66 4.471 -8.074 4.771 1.00 0.00 H new ATOM 0 HB3 CYS A 66 4.043 -6.458 4.246 1.00 0.00 H new ATOM 0 HG CYS A 66 7.323 -6.865 3.982 1.00 0.00 H new ATOM 900 N THR A 67 6.348 -4.346 5.707 1.00 0.00 N ATOM 901 CA THR A 67 6.412 -2.891 5.667 1.00 0.00 C ATOM 902 C THR A 67 6.637 -2.389 4.245 1.00 0.00 C ATOM 903 O THR A 67 7.740 -2.492 3.708 1.00 0.00 O ATOM 904 CB THR A 67 7.535 -2.353 6.573 1.00 0.00 C ATOM 905 OG1 THR A 67 7.237 -2.637 7.944 1.00 0.00 O ATOM 906 CG2 THR A 67 7.708 -0.853 6.388 1.00 0.00 C ATOM 0 H THR A 67 7.234 -4.812 5.510 1.00 0.00 H new ATOM 0 HA THR A 67 5.453 -2.523 6.032 1.00 0.00 H new ATOM 0 HB THR A 67 8.465 -2.848 6.293 1.00 0.00 H new ATOM 0 HG1 THR A 67 7.957 -2.293 8.513 1.00 0.00 H new ATOM 0 HG21 THR A 67 8.507 -0.496 7.038 1.00 0.00 H new ATOM 0 HG22 THR A 67 7.964 -0.642 5.350 1.00 0.00 H new ATOM 0 HG23 THR A 67 6.778 -0.345 6.643 1.00 0.00 H new ATOM 914 N VAL A 68 5.586 -1.846 3.640 1.00 0.00 N ATOM 915 CA VAL A 68 5.670 -1.326 2.281 1.00 0.00 C ATOM 916 C VAL A 68 5.564 0.195 2.266 1.00 0.00 C ATOM 917 O VAL A 68 4.920 0.791 3.129 1.00 0.00 O ATOM 918 CB VAL A 68 4.564 -1.915 1.385 1.00 0.00 C ATOM 919 CG1 VAL A 68 4.801 -1.544 -0.071 1.00 0.00 C ATOM 920 CG2 VAL A 68 4.491 -3.426 1.553 1.00 0.00 C ATOM 0 H VAL A 68 4.666 -1.755 4.070 1.00 0.00 H new ATOM 0 HA VAL A 68 6.643 -1.623 1.889 1.00 0.00 H new ATOM 0 HB VAL A 68 3.608 -1.491 1.692 1.00 0.00 H new ATOM 0 HG11 VAL A 68 4.010 -1.969 -0.688 1.00 0.00 H new ATOM 0 HG12 VAL A 68 4.799 -0.459 -0.175 1.00 0.00 H new ATOM 0 HG13 VAL A 68 5.765 -1.938 -0.395 1.00 0.00 H new ATOM 0 HG21 VAL A 68 3.704 -3.826 0.913 1.00 0.00 H new ATOM 0 HG22 VAL A 68 5.447 -3.870 1.274 1.00 0.00 H new ATOM 0 HG23 VAL A 68 4.270 -3.666 2.593 1.00 0.00 H new ATOM 930 N SER A 69 6.200 0.817 1.279 1.00 0.00 N ATOM 931 CA SER A 69 6.181 2.270 1.153 1.00 0.00 C ATOM 932 C SER A 69 6.157 2.688 -0.314 1.00 0.00 C ATOM 933 O SER A 69 6.955 2.210 -1.120 1.00 0.00 O ATOM 934 CB SER A 69 7.399 2.880 1.849 1.00 0.00 C ATOM 935 OG SER A 69 7.707 2.181 3.043 1.00 0.00 O ATOM 0 H SER A 69 6.735 0.338 0.555 1.00 0.00 H new ATOM 0 HA SER A 69 5.275 2.639 1.633 1.00 0.00 H new ATOM 0 HB2 SER A 69 8.257 2.854 1.177 1.00 0.00 H new ATOM 0 HB3 SER A 69 7.205 3.928 2.077 1.00 0.00 H new ATOM 0 HG SER A 69 8.490 2.589 3.468 1.00 0.00 H new ATOM 941 N TYR A 70 5.235 3.583 -0.652 1.00 0.00 N ATOM 942 CA TYR A 70 5.104 4.064 -2.022 1.00 0.00 C ATOM 943 C TYR A 70 5.315 5.574 -2.092 1.00 0.00 C ATOM 944 O TYR A 70 4.733 6.331 -1.313 1.00 0.00 O ATOM 945 CB TYR A 70 3.727 3.704 -2.582 1.00 0.00 C ATOM 946 CG TYR A 70 2.624 4.628 -2.117 1.00 0.00 C ATOM 947 CD1 TYR A 70 2.494 5.907 -2.645 1.00 0.00 C ATOM 948 CD2 TYR A 70 1.713 4.222 -1.150 1.00 0.00 C ATOM 949 CE1 TYR A 70 1.488 6.754 -2.223 1.00 0.00 C ATOM 950 CE2 TYR A 70 0.703 5.062 -0.723 1.00 0.00 C ATOM 951 CZ TYR A 70 0.595 6.327 -1.262 1.00 0.00 C ATOM 952 OH TYR A 70 -0.409 7.168 -0.839 1.00 0.00 O ATOM 0 H TYR A 70 4.568 3.990 0.004 1.00 0.00 H new ATOM 0 HA TYR A 70 5.872 3.580 -2.625 1.00 0.00 H new ATOM 0 HB2 TYR A 70 3.771 3.723 -3.671 1.00 0.00 H new ATOM 0 HB3 TYR A 70 3.481 2.683 -2.291 1.00 0.00 H new ATOM 0 HD1 TYR A 70 3.191 6.244 -3.398 1.00 0.00 H new ATOM 0 HD2 TYR A 70 1.796 3.233 -0.725 1.00 0.00 H new ATOM 0 HE1 TYR A 70 1.401 7.745 -2.643 1.00 0.00 H new ATOM 0 HE2 TYR A 70 0.002 4.730 0.029 1.00 0.00 H new ATOM 0 HH TYR A 70 -0.804 6.817 -0.014 1.00 0.00 H new ATOM 962 N LEU A 71 6.151 6.005 -3.029 1.00 0.00 N ATOM 963 CA LEU A 71 6.440 7.425 -3.203 1.00 0.00 C ATOM 964 C LEU A 71 5.739 7.975 -4.441 1.00 0.00 C ATOM 965 O LEU A 71 6.197 7.805 -5.571 1.00 0.00 O ATOM 966 CB LEU A 71 7.949 7.648 -3.315 1.00 0.00 C ATOM 967 CG LEU A 71 8.395 9.083 -3.599 1.00 0.00 C ATOM 968 CD1 LEU A 71 8.377 9.910 -2.323 1.00 0.00 C ATOM 969 CD2 LEU A 71 9.782 9.096 -4.225 1.00 0.00 C ATOM 0 H LEU A 71 6.641 5.392 -3.681 1.00 0.00 H new ATOM 0 HA LEU A 71 6.065 7.957 -2.329 1.00 0.00 H new ATOM 0 HB2 LEU A 71 8.415 7.321 -2.385 1.00 0.00 H new ATOM 0 HB3 LEU A 71 8.333 7.006 -4.107 1.00 0.00 H new ATOM 0 HG LEU A 71 7.694 9.528 -4.306 1.00 0.00 H new ATOM 0 HD11 LEU A 71 8.697 10.928 -2.545 1.00 0.00 H new ATOM 0 HD12 LEU A 71 7.366 9.928 -1.915 1.00 0.00 H new ATOM 0 HD13 LEU A 71 9.055 9.467 -1.593 1.00 0.00 H new ATOM 0 HD21 LEU A 71 10.083 10.125 -4.420 1.00 0.00 H new ATOM 0 HD22 LEU A 71 10.494 8.633 -3.542 1.00 0.00 H new ATOM 0 HD23 LEU A 71 9.764 8.539 -5.162 1.00 0.00 H new ATOM 981 N PRO A 72 4.603 8.654 -4.225 1.00 0.00 N ATOM 982 CA PRO A 72 3.816 9.246 -5.311 1.00 0.00 C ATOM 983 C PRO A 72 4.520 10.436 -5.955 1.00 0.00 C ATOM 984 O PRO A 72 5.358 11.088 -5.330 1.00 0.00 O ATOM 985 CB PRO A 72 2.531 9.699 -4.613 1.00 0.00 C ATOM 986 CG PRO A 72 2.927 9.911 -3.193 1.00 0.00 C ATOM 987 CD PRO A 72 3.998 8.896 -2.905 1.00 0.00 C ATOM 0 HA PRO A 72 3.649 8.540 -6.124 1.00 0.00 H new ATOM 0 HB2 PRO A 72 2.141 10.615 -5.056 1.00 0.00 H new ATOM 0 HB3 PRO A 72 1.748 8.946 -4.698 1.00 0.00 H new ATOM 0 HG2 PRO A 72 3.298 10.924 -3.039 1.00 0.00 H new ATOM 0 HG3 PRO A 72 2.075 9.779 -2.526 1.00 0.00 H new ATOM 0 HD2 PRO A 72 4.729 9.275 -2.191 1.00 0.00 H new ATOM 0 HD3 PRO A 72 3.582 7.982 -2.480 1.00 0.00 H new ATOM 995 N THR A 73 4.175 10.716 -7.208 1.00 0.00 N ATOM 996 CA THR A 73 4.774 11.827 -7.936 1.00 0.00 C ATOM 997 C THR A 73 3.754 12.931 -8.190 1.00 0.00 C ATOM 998 O THR A 73 4.100 14.009 -8.674 1.00 0.00 O ATOM 999 CB THR A 73 5.360 11.365 -9.283 1.00 0.00 C ATOM 1000 OG1 THR A 73 6.122 10.166 -9.101 1.00 0.00 O ATOM 1001 CG2 THR A 73 6.243 12.446 -9.889 1.00 0.00 C ATOM 0 H THR A 73 3.483 10.188 -7.740 1.00 0.00 H new ATOM 0 HA THR A 73 5.579 12.216 -7.313 1.00 0.00 H new ATOM 0 HB THR A 73 4.533 11.169 -9.965 1.00 0.00 H new ATOM 0 HG1 THR A 73 6.490 9.878 -9.963 1.00 0.00 H new ATOM 0 HG21 THR A 73 6.645 12.096 -10.840 1.00 0.00 H new ATOM 0 HG22 THR A 73 5.653 13.348 -10.054 1.00 0.00 H new ATOM 0 HG23 THR A 73 7.064 12.669 -9.208 1.00 0.00 H new ATOM 1009 N ALA A 74 2.496 12.656 -7.861 1.00 0.00 N ATOM 1010 CA ALA A 74 1.427 13.628 -8.052 1.00 0.00 C ATOM 1011 C ALA A 74 0.268 13.363 -7.097 1.00 0.00 C ATOM 1012 O ALA A 74 -0.047 12.219 -6.767 1.00 0.00 O ATOM 1013 CB ALA A 74 0.942 13.603 -9.494 1.00 0.00 C ATOM 0 H ALA A 74 2.192 11.768 -7.461 1.00 0.00 H new ATOM 0 HA ALA A 74 1.826 14.618 -7.832 1.00 0.00 H new ATOM 0 HB1 ALA A 74 0.144 14.334 -9.622 1.00 0.00 H new ATOM 0 HB2 ALA A 74 1.769 13.848 -10.160 1.00 0.00 H new ATOM 0 HB3 ALA A 74 0.565 12.609 -9.734 1.00 0.00 H new ATOM 1019 N PRO A 75 -0.383 14.443 -6.641 1.00 0.00 N ATOM 1020 CA PRO A 75 -1.518 14.352 -5.718 1.00 0.00 C ATOM 1021 C PRO A 75 -2.759 13.763 -6.380 1.00 0.00 C ATOM 1022 O PRO A 75 -3.042 14.037 -7.545 1.00 0.00 O ATOM 1023 CB PRO A 75 -1.767 15.808 -5.317 1.00 0.00 C ATOM 1024 CG PRO A 75 -1.233 16.610 -6.453 1.00 0.00 C ATOM 1025 CD PRO A 75 -0.062 15.836 -6.993 1.00 0.00 C ATOM 0 HA PRO A 75 -1.306 13.693 -4.876 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -2.829 16.000 -5.161 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -1.259 16.054 -4.385 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -1.993 16.753 -7.221 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -0.925 17.601 -6.120 1.00 0.00 H new ATOM 0 HD2 PRO A 75 0.042 15.964 -8.070 1.00 0.00 H new ATOM 0 HD3 PRO A 75 0.876 16.159 -6.541 1.00 0.00 H new ATOM 1033 N GLY A 76 -3.496 12.950 -5.628 1.00 0.00 N ATOM 1034 CA GLY A 76 -4.698 12.335 -6.160 1.00 0.00 C ATOM 1035 C GLY A 76 -5.077 11.067 -5.420 1.00 0.00 C ATOM 1036 O GLY A 76 -4.480 10.737 -4.395 1.00 0.00 O ATOM 0 H GLY A 76 -3.282 12.707 -4.661 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -5.522 13.046 -6.102 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -4.549 12.105 -7.215 1.00 0.00 H new ATOM 1040 N ASP A 77 -6.072 10.356 -5.939 1.00 0.00 N ATOM 1041 CA ASP A 77 -6.530 9.118 -5.320 1.00 0.00 C ATOM 1042 C ASP A 77 -5.788 7.916 -5.897 1.00 0.00 C ATOM 1043 O ASP A 77 -6.075 7.472 -7.010 1.00 0.00 O ATOM 1044 CB ASP A 77 -8.036 8.948 -5.522 1.00 0.00 C ATOM 1045 CG ASP A 77 -8.505 9.488 -6.859 1.00 0.00 C ATOM 1046 OD1 ASP A 77 -7.774 9.317 -7.857 1.00 0.00 O ATOM 1047 OD2 ASP A 77 -9.603 10.082 -6.908 1.00 0.00 O ATOM 0 H ASP A 77 -6.577 10.616 -6.787 1.00 0.00 H new ATOM 0 HA ASP A 77 -6.319 9.175 -4.252 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -8.292 7.891 -5.450 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -8.567 9.460 -4.720 1.00 0.00 H new ATOM 1052 N TYR A 78 -4.834 7.394 -5.135 1.00 0.00 N ATOM 1053 CA TYR A 78 -4.049 6.246 -5.572 1.00 0.00 C ATOM 1054 C TYR A 78 -4.769 4.940 -5.253 1.00 0.00 C ATOM 1055 O TYR A 78 -5.298 4.761 -4.155 1.00 0.00 O ATOM 1056 CB TYR A 78 -2.673 6.258 -4.904 1.00 0.00 C ATOM 1057 CG TYR A 78 -1.710 7.249 -5.518 1.00 0.00 C ATOM 1058 CD1 TYR A 78 -1.632 8.555 -5.050 1.00 0.00 C ATOM 1059 CD2 TYR A 78 -0.877 6.879 -6.567 1.00 0.00 C ATOM 1060 CE1 TYR A 78 -0.755 9.463 -5.609 1.00 0.00 C ATOM 1061 CE2 TYR A 78 0.004 7.781 -7.132 1.00 0.00 C ATOM 1062 CZ TYR A 78 0.062 9.072 -6.650 1.00 0.00 C ATOM 1063 OH TYR A 78 0.938 9.973 -7.208 1.00 0.00 O ATOM 0 H TYR A 78 -4.585 7.748 -4.211 1.00 0.00 H new ATOM 0 HA TYR A 78 -3.922 6.316 -6.652 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -2.794 6.490 -3.846 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -2.241 5.259 -4.964 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -2.269 8.865 -4.235 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -0.919 5.869 -6.947 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -0.709 10.474 -5.233 1.00 0.00 H new ATOM 0 HE2 TYR A 78 0.644 7.477 -7.947 1.00 0.00 H new ATOM 0 HH TYR A 78 0.463 10.805 -7.417 1.00 0.00 H new ATOM 1073 N SER A 79 -4.786 4.029 -6.220 1.00 0.00 N ATOM 1074 CA SER A 79 -5.444 2.739 -6.045 1.00 0.00 C ATOM 1075 C SER A 79 -4.423 1.643 -5.754 1.00 0.00 C ATOM 1076 O SER A 79 -3.814 1.089 -6.669 1.00 0.00 O ATOM 1077 CB SER A 79 -6.251 2.381 -7.295 1.00 0.00 C ATOM 1078 OG SER A 79 -7.303 3.307 -7.505 1.00 0.00 O ATOM 0 H SER A 79 -4.352 4.160 -7.133 1.00 0.00 H new ATOM 0 HA SER A 79 -6.120 2.816 -5.194 1.00 0.00 H new ATOM 0 HB2 SER A 79 -5.594 2.369 -8.165 1.00 0.00 H new ATOM 0 HB3 SER A 79 -6.662 1.377 -7.191 1.00 0.00 H new ATOM 0 HG SER A 79 -7.803 3.057 -8.310 1.00 0.00 H new ATOM 1084 N ILE A 80 -4.243 1.337 -4.474 1.00 0.00 N ATOM 1085 CA ILE A 80 -3.297 0.307 -4.061 1.00 0.00 C ATOM 1086 C ILE A 80 -3.917 -1.082 -4.165 1.00 0.00 C ATOM 1087 O ILE A 80 -4.660 -1.509 -3.280 1.00 0.00 O ATOM 1088 CB ILE A 80 -2.812 0.534 -2.617 1.00 0.00 C ATOM 1089 CG1 ILE A 80 -2.120 1.893 -2.496 1.00 0.00 C ATOM 1090 CG2 ILE A 80 -1.873 -0.584 -2.192 1.00 0.00 C ATOM 1091 CD1 ILE A 80 -2.249 2.517 -1.124 1.00 0.00 C ATOM 0 H ILE A 80 -4.739 1.787 -3.705 1.00 0.00 H new ATOM 0 HA ILE A 80 -2.444 0.373 -4.736 1.00 0.00 H new ATOM 0 HB ILE A 80 -3.677 0.527 -1.954 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -1.063 1.776 -2.735 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -2.541 2.573 -3.237 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -1.539 -0.409 -1.169 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -2.397 -1.539 -2.245 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -1.010 -0.607 -2.857 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -1.735 3.478 -1.112 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -3.303 2.666 -0.890 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -1.802 1.857 -0.381 1.00 0.00 H new ATOM 1103 N ILE A 81 -3.607 -1.783 -5.250 1.00 0.00 N ATOM 1104 CA ILE A 81 -4.131 -3.125 -5.468 1.00 0.00 C ATOM 1105 C ILE A 81 -3.295 -4.168 -4.735 1.00 0.00 C ATOM 1106 O ILE A 81 -2.095 -4.300 -4.978 1.00 0.00 O ATOM 1107 CB ILE A 81 -4.172 -3.477 -6.967 1.00 0.00 C ATOM 1108 CG1 ILE A 81 -5.047 -2.477 -7.725 1.00 0.00 C ATOM 1109 CG2 ILE A 81 -4.687 -4.895 -7.164 1.00 0.00 C ATOM 1110 CD1 ILE A 81 -4.639 -2.290 -9.170 1.00 0.00 C ATOM 0 H ILE A 81 -2.995 -1.443 -5.992 1.00 0.00 H new ATOM 0 HA ILE A 81 -5.147 -3.135 -5.073 1.00 0.00 H new ATOM 0 HB ILE A 81 -3.159 -3.420 -7.366 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -6.083 -2.813 -7.689 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -5.007 -1.513 -7.217 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -4.710 -5.129 -8.228 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -4.027 -5.596 -6.653 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -5.693 -4.977 -6.752 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -5.303 -1.568 -9.645 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -3.613 -1.924 -9.214 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -4.706 -3.244 -9.693 1.00 0.00 H new ATOM 1122 N VAL A 82 -3.936 -4.909 -3.837 1.00 0.00 N ATOM 1123 CA VAL A 82 -3.252 -5.943 -3.070 1.00 0.00 C ATOM 1124 C VAL A 82 -3.982 -7.278 -3.175 1.00 0.00 C ATOM 1125 O VAL A 82 -5.003 -7.492 -2.522 1.00 0.00 O ATOM 1126 CB VAL A 82 -3.131 -5.552 -1.585 1.00 0.00 C ATOM 1127 CG1 VAL A 82 -2.425 -6.648 -0.800 1.00 0.00 C ATOM 1128 CG2 VAL A 82 -2.398 -4.227 -1.442 1.00 0.00 C ATOM 0 H VAL A 82 -4.929 -4.812 -3.623 1.00 0.00 H new ATOM 0 HA VAL A 82 -2.253 -6.044 -3.494 1.00 0.00 H new ATOM 0 HB VAL A 82 -4.134 -5.433 -1.175 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -2.349 -6.354 0.247 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -2.994 -7.574 -0.876 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -1.426 -6.801 -1.208 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -2.321 -3.966 -0.387 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -1.398 -4.316 -1.867 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -2.948 -3.448 -1.970 1.00 0.00 H new ATOM 1138 N ARG A 83 -3.450 -8.173 -4.000 1.00 0.00 N ATOM 1139 CA ARG A 83 -4.050 -9.488 -4.191 1.00 0.00 C ATOM 1140 C ARG A 83 -3.249 -10.563 -3.463 1.00 0.00 C ATOM 1141 O ARG A 83 -2.042 -10.423 -3.262 1.00 0.00 O ATOM 1142 CB ARG A 83 -4.134 -9.822 -5.682 1.00 0.00 C ATOM 1143 CG ARG A 83 -4.937 -8.814 -6.488 1.00 0.00 C ATOM 1144 CD ARG A 83 -5.101 -9.260 -7.932 1.00 0.00 C ATOM 1145 NE ARG A 83 -5.333 -8.131 -8.830 1.00 0.00 N ATOM 1146 CZ ARG A 83 -5.367 -8.240 -10.154 1.00 0.00 C ATOM 1147 NH1 ARG A 83 -5.186 -9.421 -10.730 1.00 0.00 N ATOM 1148 NH2 ARG A 83 -5.583 -7.167 -10.904 1.00 0.00 N ATOM 0 H ARG A 83 -2.604 -8.012 -4.547 1.00 0.00 H new ATOM 0 HA ARG A 83 -5.056 -9.464 -3.773 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -3.125 -9.880 -6.090 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -4.582 -10.809 -5.800 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -5.919 -8.682 -6.033 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -4.439 -7.845 -6.460 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -4.208 -9.798 -8.249 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -5.935 -9.958 -8.004 1.00 0.00 H new ATOM 0 HE ARG A 83 -5.477 -7.209 -8.418 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -5.020 -10.248 -10.157 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -5.213 -9.502 -11.746 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -5.723 -6.257 -10.464 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -5.609 -7.252 -11.920 1.00 0.00 H new ATOM 1162 N PHE A 84 -3.929 -11.634 -3.068 1.00 0.00 N ATOM 1163 CA PHE A 84 -3.281 -12.732 -2.360 1.00 0.00 C ATOM 1164 C PHE A 84 -3.694 -14.078 -2.949 1.00 0.00 C ATOM 1165 O PHE A 84 -4.755 -14.611 -2.623 1.00 0.00 O ATOM 1166 CB PHE A 84 -3.632 -12.685 -0.871 1.00 0.00 C ATOM 1167 CG PHE A 84 -2.960 -13.758 -0.063 1.00 0.00 C ATOM 1168 CD1 PHE A 84 -1.647 -13.610 0.354 1.00 0.00 C ATOM 1169 CD2 PHE A 84 -3.642 -14.914 0.280 1.00 0.00 C ATOM 1170 CE1 PHE A 84 -1.026 -14.596 1.098 1.00 0.00 C ATOM 1171 CE2 PHE A 84 -3.027 -15.903 1.025 1.00 0.00 C ATOM 1172 CZ PHE A 84 -1.717 -15.744 1.433 1.00 0.00 C ATOM 0 H PHE A 84 -4.928 -11.765 -3.226 1.00 0.00 H new ATOM 0 HA PHE A 84 -2.203 -12.620 -2.476 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -3.352 -11.711 -0.470 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -4.712 -12.778 -0.757 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -1.102 -12.714 0.095 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -4.666 -15.044 -0.038 1.00 0.00 H new ATOM 0 HE1 PHE A 84 -0.002 -14.469 1.417 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -3.570 -16.799 1.288 1.00 0.00 H new ATOM 0 HZ PHE A 84 -1.234 -16.516 2.013 1.00 0.00 H new ATOM 1182 N ASP A 85 -2.849 -14.621 -3.818 1.00 0.00 N ATOM 1183 CA ASP A 85 -3.124 -15.905 -4.452 1.00 0.00 C ATOM 1184 C ASP A 85 -4.320 -15.800 -5.394 1.00 0.00 C ATOM 1185 O ASP A 85 -5.204 -16.656 -5.388 1.00 0.00 O ATOM 1186 CB ASP A 85 -3.386 -16.976 -3.393 1.00 0.00 C ATOM 1187 CG ASP A 85 -3.119 -18.377 -3.907 1.00 0.00 C ATOM 1188 OD1 ASP A 85 -3.574 -18.695 -5.026 1.00 0.00 O ATOM 1189 OD2 ASP A 85 -2.455 -19.156 -3.191 1.00 0.00 O ATOM 0 H ASP A 85 -1.968 -14.192 -4.100 1.00 0.00 H new ATOM 0 HA ASP A 85 -2.248 -16.189 -5.035 1.00 0.00 H new ATOM 0 HB2 ASP A 85 -2.756 -16.785 -2.524 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -4.421 -16.906 -3.058 1.00 0.00 H new ATOM 1194 N ASP A 86 -4.340 -14.744 -6.200 1.00 0.00 N ATOM 1195 CA ASP A 86 -5.427 -14.527 -7.148 1.00 0.00 C ATOM 1196 C ASP A 86 -6.730 -14.213 -6.418 1.00 0.00 C ATOM 1197 O ASP A 86 -7.803 -14.662 -6.820 1.00 0.00 O ATOM 1198 CB ASP A 86 -5.611 -15.757 -8.038 1.00 0.00 C ATOM 1199 CG ASP A 86 -6.179 -15.408 -9.399 1.00 0.00 C ATOM 1200 OD1 ASP A 86 -7.345 -14.963 -9.459 1.00 0.00 O ATOM 1201 OD2 ASP A 86 -5.458 -15.577 -10.404 1.00 0.00 O ATOM 0 H ASP A 86 -3.616 -14.025 -6.216 1.00 0.00 H new ATOM 0 HA ASP A 86 -5.165 -13.673 -7.772 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -4.650 -16.256 -8.166 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -6.275 -16.465 -7.541 1.00 0.00 H new ATOM 1206 N LYS A 87 -6.628 -13.441 -5.342 1.00 0.00 N ATOM 1207 CA LYS A 87 -7.796 -13.066 -4.555 1.00 0.00 C ATOM 1208 C LYS A 87 -7.610 -11.689 -3.926 1.00 0.00 C ATOM 1209 O LYS A 87 -6.692 -11.476 -3.134 1.00 0.00 O ATOM 1210 CB LYS A 87 -8.056 -14.106 -3.462 1.00 0.00 C ATOM 1211 CG LYS A 87 -8.296 -15.506 -4.000 1.00 0.00 C ATOM 1212 CD LYS A 87 -9.058 -16.363 -3.003 1.00 0.00 C ATOM 1213 CE LYS A 87 -9.369 -17.738 -3.573 1.00 0.00 C ATOM 1214 NZ LYS A 87 -10.268 -18.519 -2.679 1.00 0.00 N ATOM 0 H LYS A 87 -5.747 -13.062 -4.995 1.00 0.00 H new ATOM 0 HA LYS A 87 -8.656 -13.027 -5.224 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -7.204 -14.128 -2.783 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -8.922 -13.797 -2.877 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -8.856 -15.447 -4.933 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -7.340 -15.977 -4.231 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -8.471 -16.470 -2.091 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -9.987 -15.864 -2.728 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -9.836 -17.628 -4.552 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -8.440 -18.287 -3.723 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -10.456 -19.450 -3.103 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -9.812 -18.646 -1.753 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -11.165 -18.007 -2.556 1.00 0.00 H new ATOM 1228 N HIS A 88 -8.488 -10.757 -4.283 1.00 0.00 N ATOM 1229 CA HIS A 88 -8.421 -9.400 -3.752 1.00 0.00 C ATOM 1230 C HIS A 88 -8.759 -9.381 -2.265 1.00 0.00 C ATOM 1231 O HIS A 88 -9.753 -9.969 -1.837 1.00 0.00 O ATOM 1232 CB HIS A 88 -9.377 -8.483 -4.516 1.00 0.00 C ATOM 1233 CG HIS A 88 -8.725 -7.741 -5.642 1.00 0.00 C ATOM 1234 ND1 HIS A 88 -8.507 -6.380 -5.620 1.00 0.00 N ATOM 1235 CD2 HIS A 88 -8.241 -8.179 -6.827 1.00 0.00 C ATOM 1236 CE1 HIS A 88 -7.919 -6.012 -6.744 1.00 0.00 C ATOM 1237 NE2 HIS A 88 -7.745 -7.086 -7.494 1.00 0.00 N ATOM 0 H HIS A 88 -9.254 -10.916 -4.937 1.00 0.00 H new ATOM 0 HA HIS A 88 -7.401 -9.037 -3.879 1.00 0.00 H new ATOM 0 HB2 HIS A 88 -10.199 -9.079 -4.912 1.00 0.00 H new ATOM 0 HB3 HIS A 88 -9.810 -7.764 -3.821 1.00 0.00 H new ATOM 0 HD1 HIS A 88 -8.760 -5.755 -4.855 1.00 0.00 H new ATOM 0 HD2 HIS A 88 -8.244 -9.199 -7.182 1.00 0.00 H new ATOM 0 HE1 HIS A 88 -7.630 -5.005 -7.006 1.00 0.00 H new ATOM 1246 N ILE A 89 -7.926 -8.704 -1.482 1.00 0.00 N ATOM 1247 CA ILE A 89 -8.137 -8.609 -0.043 1.00 0.00 C ATOM 1248 C ILE A 89 -9.324 -7.709 0.280 1.00 0.00 C ATOM 1249 O ILE A 89 -9.674 -6.804 -0.478 1.00 0.00 O ATOM 1250 CB ILE A 89 -6.887 -8.069 0.675 1.00 0.00 C ATOM 1251 CG1 ILE A 89 -6.565 -6.654 0.191 1.00 0.00 C ATOM 1252 CG2 ILE A 89 -5.702 -8.996 0.446 1.00 0.00 C ATOM 1253 CD1 ILE A 89 -5.502 -5.960 1.014 1.00 0.00 C ATOM 0 H ILE A 89 -7.098 -8.213 -1.820 1.00 0.00 H new ATOM 0 HA ILE A 89 -8.342 -9.619 0.313 1.00 0.00 H new ATOM 0 HB ILE A 89 -7.090 -8.029 1.745 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -6.236 -6.700 -0.847 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -7.476 -6.056 0.211 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -4.826 -8.600 0.960 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -5.935 -9.987 0.836 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -5.495 -9.065 -0.622 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -5.326 -4.962 0.613 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -5.836 -5.882 2.049 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -4.577 -6.536 0.974 1.00 0.00 H new ATOM 1265 N PRO A 90 -9.959 -7.958 1.435 1.00 0.00 N ATOM 1266 CA PRO A 90 -11.116 -7.179 1.887 1.00 0.00 C ATOM 1267 C PRO A 90 -10.736 -5.758 2.290 1.00 0.00 C ATOM 1268 O PRO A 90 -10.544 -5.468 3.470 1.00 0.00 O ATOM 1269 CB PRO A 90 -11.619 -7.963 3.102 1.00 0.00 C ATOM 1270 CG PRO A 90 -10.422 -8.694 3.603 1.00 0.00 C ATOM 1271 CD PRO A 90 -9.597 -9.020 2.389 1.00 0.00 C ATOM 0 HA PRO A 90 -11.861 -7.062 1.100 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -12.023 -7.296 3.864 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -12.417 -8.652 2.826 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -9.857 -8.082 4.306 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -10.712 -9.601 4.133 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -8.530 -9.012 2.614 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -9.832 -10.010 1.997 1.00 0.00 H new ATOM 1279 N GLY A 91 -10.629 -4.876 1.301 1.00 0.00 N ATOM 1280 CA GLY A 91 -10.273 -3.496 1.574 1.00 0.00 C ATOM 1281 C GLY A 91 -9.501 -2.860 0.434 1.00 0.00 C ATOM 1282 O GLY A 91 -9.284 -1.649 0.422 1.00 0.00 O ATOM 0 H GLY A 91 -10.782 -5.092 0.316 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -11.179 -2.920 1.761 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -9.674 -3.452 2.484 1.00 0.00 H new ATOM 1286 N SER A 92 -9.084 -3.680 -0.526 1.00 0.00 N ATOM 1287 CA SER A 92 -8.327 -3.192 -1.672 1.00 0.00 C ATOM 1288 C SER A 92 -9.167 -3.256 -2.945 1.00 0.00 C ATOM 1289 O SER A 92 -10.097 -4.053 -3.065 1.00 0.00 O ATOM 1290 CB SER A 92 -7.047 -4.010 -1.851 1.00 0.00 C ATOM 1291 OG SER A 92 -6.708 -4.134 -3.221 1.00 0.00 O ATOM 0 H SER A 92 -9.258 -4.685 -0.532 1.00 0.00 H new ATOM 0 HA SER A 92 -8.061 -2.152 -1.484 1.00 0.00 H new ATOM 0 HB2 SER A 92 -6.228 -3.533 -1.312 1.00 0.00 H new ATOM 0 HB3 SER A 92 -7.181 -5.000 -1.415 1.00 0.00 H new ATOM 0 HG SER A 92 -6.846 -5.060 -3.510 1.00 0.00 H new ATOM 1297 N PRO A 93 -8.831 -2.396 -3.918 1.00 0.00 N ATOM 1298 CA PRO A 93 -7.726 -1.442 -3.785 1.00 0.00 C ATOM 1299 C PRO A 93 -8.031 -0.337 -2.780 1.00 0.00 C ATOM 1300 O PRO A 93 -9.128 0.221 -2.770 1.00 0.00 O ATOM 1301 CB PRO A 93 -7.589 -0.860 -5.194 1.00 0.00 C ATOM 1302 CG PRO A 93 -8.938 -1.023 -5.804 1.00 0.00 C ATOM 1303 CD PRO A 93 -9.505 -2.288 -5.222 1.00 0.00 C ATOM 0 HA PRO A 93 -6.818 -1.919 -3.415 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -7.293 0.189 -5.162 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -6.828 -1.389 -5.768 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -9.575 -0.169 -5.576 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -8.870 -1.089 -6.890 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -10.588 -2.229 -5.111 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -9.296 -3.150 -5.855 1.00 0.00 H new ATOM 1311 N PHE A 94 -7.054 -0.026 -1.935 1.00 0.00 N ATOM 1312 CA PHE A 94 -7.218 1.012 -0.924 1.00 0.00 C ATOM 1313 C PHE A 94 -7.037 2.399 -1.535 1.00 0.00 C ATOM 1314 O PHE A 94 -5.941 2.765 -1.961 1.00 0.00 O ATOM 1315 CB PHE A 94 -6.216 0.809 0.214 1.00 0.00 C ATOM 1316 CG PHE A 94 -6.601 -0.290 1.162 1.00 0.00 C ATOM 1317 CD1 PHE A 94 -6.360 -1.616 0.841 1.00 0.00 C ATOM 1318 CD2 PHE A 94 -7.205 0.002 2.375 1.00 0.00 C ATOM 1319 CE1 PHE A 94 -6.712 -2.631 1.711 1.00 0.00 C ATOM 1320 CE2 PHE A 94 -7.559 -1.008 3.249 1.00 0.00 C ATOM 1321 CZ PHE A 94 -7.314 -2.326 2.916 1.00 0.00 C ATOM 0 H PHE A 94 -6.140 -0.478 -1.930 1.00 0.00 H new ATOM 0 HA PHE A 94 -8.230 0.939 -0.525 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -5.237 0.586 -0.210 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -6.117 1.741 0.771 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -5.891 -1.860 -0.101 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -7.401 1.030 2.640 1.00 0.00 H new ATOM 0 HE1 PHE A 94 -6.517 -3.660 1.449 1.00 0.00 H new ATOM 0 HE2 PHE A 94 -8.027 -0.767 4.192 1.00 0.00 H new ATOM 0 HZ PHE A 94 -7.593 -3.117 3.597 1.00 0.00 H new ATOM 1331 N THR A 95 -8.121 3.168 -1.575 1.00 0.00 N ATOM 1332 CA THR A 95 -8.083 4.513 -2.134 1.00 0.00 C ATOM 1333 C THR A 95 -7.452 5.498 -1.157 1.00 0.00 C ATOM 1334 O THR A 95 -8.073 5.891 -0.169 1.00 0.00 O ATOM 1335 CB THR A 95 -9.495 5.008 -2.503 1.00 0.00 C ATOM 1336 OG1 THR A 95 -10.131 4.066 -3.375 1.00 0.00 O ATOM 1337 CG2 THR A 95 -9.432 6.369 -3.178 1.00 0.00 C ATOM 0 H THR A 95 -9.036 2.882 -1.227 1.00 0.00 H new ATOM 0 HA THR A 95 -7.475 4.462 -3.037 1.00 0.00 H new ATOM 0 HB THR A 95 -10.075 5.102 -1.585 1.00 0.00 H new ATOM 0 HG1 THR A 95 -11.028 4.386 -3.604 1.00 0.00 H new ATOM 0 HG21 THR A 95 -10.440 6.698 -3.429 1.00 0.00 H new ATOM 0 HG22 THR A 95 -8.973 7.090 -2.501 1.00 0.00 H new ATOM 0 HG23 THR A 95 -8.837 6.296 -4.088 1.00 0.00 H new ATOM 1345 N ALA A 96 -6.215 5.894 -1.439 1.00 0.00 N ATOM 1346 CA ALA A 96 -5.501 6.835 -0.585 1.00 0.00 C ATOM 1347 C ALA A 96 -5.464 8.225 -1.212 1.00 0.00 C ATOM 1348 O ALA A 96 -5.244 8.370 -2.415 1.00 0.00 O ATOM 1349 CB ALA A 96 -4.089 6.337 -0.316 1.00 0.00 C ATOM 0 H ALA A 96 -5.687 5.578 -2.252 1.00 0.00 H new ATOM 0 HA ALA A 96 -6.035 6.906 0.362 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -3.567 7.050 0.323 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -4.133 5.368 0.182 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -3.553 6.236 -1.260 1.00 0.00 H new ATOM 1355 N LYS A 97 -5.681 9.246 -0.390 1.00 0.00 N ATOM 1356 CA LYS A 97 -5.672 10.625 -0.862 1.00 0.00 C ATOM 1357 C LYS A 97 -4.301 11.261 -0.659 1.00 0.00 C ATOM 1358 O LYS A 97 -3.752 11.236 0.443 1.00 0.00 O ATOM 1359 CB LYS A 97 -6.739 11.443 -0.131 1.00 0.00 C ATOM 1360 CG LYS A 97 -6.439 11.653 1.343 1.00 0.00 C ATOM 1361 CD LYS A 97 -7.591 12.345 2.053 1.00 0.00 C ATOM 1362 CE LYS A 97 -7.420 12.304 3.564 1.00 0.00 C ATOM 1363 NZ LYS A 97 -8.625 12.817 4.273 1.00 0.00 N ATOM 0 H LYS A 97 -5.866 9.144 0.608 1.00 0.00 H new ATOM 0 HA LYS A 97 -5.895 10.619 -1.929 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -6.836 12.415 -0.616 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -7.701 10.940 -0.230 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -6.244 10.691 1.816 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -5.533 12.250 1.450 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -7.655 13.381 1.721 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -8.530 11.864 1.779 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -7.222 11.280 3.879 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -6.551 12.898 3.847 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -8.469 12.772 5.300 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -8.800 13.803 3.992 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -9.449 12.234 4.023 1.00 0.00 H new ATOM 1377 N ILE A 98 -3.753 11.830 -1.728 1.00 0.00 N ATOM 1378 CA ILE A 98 -2.447 12.474 -1.665 1.00 0.00 C ATOM 1379 C ILE A 98 -2.551 13.960 -1.994 1.00 0.00 C ATOM 1380 O ILE A 98 -3.064 14.340 -3.047 1.00 0.00 O ATOM 1381 CB ILE A 98 -1.447 11.814 -2.632 1.00 0.00 C ATOM 1382 CG1 ILE A 98 -1.361 10.311 -2.364 1.00 0.00 C ATOM 1383 CG2 ILE A 98 -0.077 12.461 -2.499 1.00 0.00 C ATOM 1384 CD1 ILE A 98 -0.881 9.972 -0.969 1.00 0.00 C ATOM 0 H ILE A 98 -4.193 11.858 -2.648 1.00 0.00 H new ATOM 0 HA ILE A 98 -2.085 12.355 -0.644 1.00 0.00 H new ATOM 0 HB ILE A 98 -1.799 11.962 -3.653 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -2.344 9.866 -2.520 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -0.687 9.858 -3.091 1.00 0.00 H new ATOM 0 HG21 ILE A 98 0.619 11.984 -3.189 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -0.151 13.523 -2.735 1.00 0.00 H new ATOM 0 HG23 ILE A 98 0.284 12.341 -1.478 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -0.845 8.889 -0.850 1.00 0.00 H new ATOM 0 HD12 ILE A 98 0.115 10.388 -0.816 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -1.567 10.395 -0.235 1.00 0.00 H new ATOM 1396 N THR A 99 -2.058 14.797 -1.086 1.00 0.00 N ATOM 1397 CA THR A 99 -2.094 16.241 -1.279 1.00 0.00 C ATOM 1398 C THR A 99 -0.764 16.757 -1.816 1.00 0.00 C ATOM 1399 O THR A 99 0.257 16.076 -1.732 1.00 0.00 O ATOM 1400 CB THR A 99 -2.425 16.976 0.034 1.00 0.00 C ATOM 1401 OG1 THR A 99 -1.547 16.534 1.076 1.00 0.00 O ATOM 1402 CG2 THR A 99 -3.869 16.730 0.443 1.00 0.00 C ATOM 0 H THR A 99 -1.629 14.499 -0.210 1.00 0.00 H new ATOM 0 HA THR A 99 -2.880 16.443 -2.007 1.00 0.00 H new ATOM 0 HB THR A 99 -2.288 18.045 -0.129 1.00 0.00 H new ATOM 0 HG1 THR A 99 -1.762 17.006 1.907 1.00 0.00 H new ATOM 0 HG21 THR A 99 -4.079 17.259 1.373 1.00 0.00 H new ATOM 0 HG22 THR A 99 -4.536 17.093 -0.339 1.00 0.00 H new ATOM 0 HG23 THR A 99 -4.029 15.662 0.589 1.00 0.00 H new ATOM 1410 N GLY A 100 -0.783 17.967 -2.368 1.00 0.00 N ATOM 1411 CA GLY A 100 0.428 18.554 -2.910 1.00 0.00 C ATOM 1412 C GLY A 100 0.247 20.011 -3.288 1.00 0.00 C ATOM 1413 O GLY A 100 -0.857 20.440 -3.621 1.00 0.00 O ATOM 0 H GLY A 100 -1.616 18.551 -2.449 1.00 0.00 H new ATOM 0 HA2 GLY A 100 1.229 18.469 -2.176 1.00 0.00 H new ATOM 0 HA3 GLY A 100 0.740 17.990 -3.789 1.00 0.00 H new ATOM 1417 N ASP A 101 1.334 20.773 -3.234 1.00 0.00 N ATOM 1418 CA ASP A 101 1.291 22.191 -3.573 1.00 0.00 C ATOM 1419 C ASP A 101 2.691 22.724 -3.861 1.00 0.00 C ATOM 1420 O ASP A 101 3.679 22.001 -3.735 1.00 0.00 O ATOM 1421 CB ASP A 101 0.651 22.989 -2.436 1.00 0.00 C ATOM 1422 CG ASP A 101 1.213 22.616 -1.079 1.00 0.00 C ATOM 1423 OD1 ASP A 101 2.370 22.989 -0.793 1.00 0.00 O ATOM 1424 OD2 ASP A 101 0.497 21.950 -0.302 1.00 0.00 O ATOM 0 H ASP A 101 2.255 20.433 -2.959 1.00 0.00 H new ATOM 0 HA ASP A 101 0.687 22.306 -4.473 1.00 0.00 H new ATOM 0 HB2 ASP A 101 0.807 24.054 -2.610 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -0.426 22.820 -2.439 1.00 0.00 H new ATOM 1429 N ASP A 102 2.768 23.992 -4.248 1.00 0.00 N ATOM 1430 CA ASP A 102 4.047 24.623 -4.554 1.00 0.00 C ATOM 1431 C ASP A 102 4.511 25.499 -3.394 1.00 0.00 C ATOM 1432 O ASP A 102 3.700 25.981 -2.604 1.00 0.00 O ATOM 1433 CB ASP A 102 3.935 25.459 -5.829 1.00 0.00 C ATOM 1434 CG ASP A 102 3.078 24.792 -6.886 1.00 0.00 C ATOM 1435 OD1 ASP A 102 3.491 23.733 -7.404 1.00 0.00 O ATOM 1436 OD2 ASP A 102 1.993 25.328 -7.195 1.00 0.00 O ATOM 0 H ASP A 102 1.959 24.604 -4.357 1.00 0.00 H new ATOM 0 HA ASP A 102 4.785 23.836 -4.709 1.00 0.00 H new ATOM 0 HB2 ASP A 102 3.512 26.434 -5.585 1.00 0.00 H new ATOM 0 HB3 ASP A 102 4.932 25.636 -6.232 1.00 0.00 H new ATOM 1441 N SER A 103 5.822 25.699 -3.299 1.00 0.00 N ATOM 1442 CA SER A 103 6.395 26.513 -2.234 1.00 0.00 C ATOM 1443 C SER A 103 7.891 26.718 -2.452 1.00 0.00 C ATOM 1444 O SER A 103 8.645 25.757 -2.603 1.00 0.00 O ATOM 1445 CB SER A 103 6.152 25.855 -0.874 1.00 0.00 C ATOM 1446 OG SER A 103 6.712 24.554 -0.829 1.00 0.00 O ATOM 0 H SER A 103 6.507 25.309 -3.947 1.00 0.00 H new ATOM 0 HA SER A 103 5.906 27.487 -2.251 1.00 0.00 H new ATOM 0 HB2 SER A 103 6.588 26.469 -0.086 1.00 0.00 H new ATOM 0 HB3 SER A 103 5.081 25.800 -0.679 1.00 0.00 H new ATOM 0 HG SER A 103 7.566 24.549 -1.310 1.00 0.00 H new ATOM 1452 N MET A 104 8.313 27.979 -2.468 1.00 0.00 N ATOM 1453 CA MET A 104 9.719 28.311 -2.667 1.00 0.00 C ATOM 1454 C MET A 104 10.429 28.494 -1.329 1.00 0.00 C ATOM 1455 O MET A 104 9.811 28.877 -0.335 1.00 0.00 O ATOM 1456 CB MET A 104 9.850 29.584 -3.505 1.00 0.00 C ATOM 1457 CG MET A 104 11.235 29.779 -4.101 1.00 0.00 C ATOM 1458 SD MET A 104 11.606 31.510 -4.445 1.00 0.00 S ATOM 1459 CE MET A 104 13.113 31.350 -5.398 1.00 0.00 C ATOM 0 H MET A 104 7.702 28.786 -2.346 1.00 0.00 H new ATOM 0 HA MET A 104 10.190 27.484 -3.198 1.00 0.00 H new ATOM 0 HB2 MET A 104 9.117 29.556 -4.311 1.00 0.00 H new ATOM 0 HB3 MET A 104 9.606 30.445 -2.883 1.00 0.00 H new ATOM 0 HG2 MET A 104 11.981 29.381 -3.413 1.00 0.00 H new ATOM 0 HG3 MET A 104 11.313 29.204 -5.024 1.00 0.00 H new ATOM 0 HE1 MET A 104 13.468 32.339 -5.686 1.00 0.00 H new ATOM 0 HE2 MET A 104 13.873 30.853 -4.796 1.00 0.00 H new ATOM 0 HE3 MET A 104 12.916 30.760 -6.293 1.00 0.00 H new ATOM 1469 N ARG A 105 11.728 28.218 -1.311 1.00 0.00 N ATOM 1470 CA ARG A 105 12.521 28.351 -0.095 1.00 0.00 C ATOM 1471 C ARG A 105 12.621 29.812 0.332 1.00 0.00 C ATOM 1472 O ARG A 105 12.149 30.708 -0.369 1.00 0.00 O ATOM 1473 CB ARG A 105 13.922 27.773 -0.308 1.00 0.00 C ATOM 1474 CG ARG A 105 13.949 26.256 -0.389 1.00 0.00 C ATOM 1475 CD ARG A 105 13.692 25.769 -1.807 1.00 0.00 C ATOM 1476 NE ARG A 105 14.287 24.458 -2.051 1.00 0.00 N ATOM 1477 CZ ARG A 105 15.591 24.259 -2.205 1.00 0.00 C ATOM 1478 NH1 ARG A 105 16.433 25.281 -2.139 1.00 0.00 N ATOM 1479 NH2 ARG A 105 16.056 23.036 -2.424 1.00 0.00 N ATOM 0 H ARG A 105 12.254 27.901 -2.125 1.00 0.00 H new ATOM 0 HA ARG A 105 12.022 27.793 0.697 1.00 0.00 H new ATOM 0 HB2 ARG A 105 14.340 28.185 -1.227 1.00 0.00 H new ATOM 0 HB3 ARG A 105 14.567 28.096 0.509 1.00 0.00 H new ATOM 0 HG2 ARG A 105 14.917 25.889 -0.047 1.00 0.00 H new ATOM 0 HG3 ARG A 105 13.196 25.841 0.281 1.00 0.00 H new ATOM 0 HD2 ARG A 105 12.618 25.718 -1.984 1.00 0.00 H new ATOM 0 HD3 ARG A 105 14.098 26.489 -2.517 1.00 0.00 H new ATOM 0 HE ARG A 105 13.667 23.650 -2.106 1.00 0.00 H new ATOM 0 HH11 ARG A 105 16.080 26.223 -1.970 1.00 0.00 H new ATOM 0 HH12 ARG A 105 17.434 25.126 -2.258 1.00 0.00 H new ATOM 0 HH21 ARG A 105 15.412 22.247 -2.474 1.00 0.00 H new ATOM 0 HH22 ARG A 105 17.058 22.885 -2.542 1.00 0.00 H new ATOM 1493 N SER A 106 13.239 30.046 1.485 1.00 0.00 N ATOM 1494 CA SER A 106 13.398 31.398 2.007 1.00 0.00 C ATOM 1495 C SER A 106 14.594 31.479 2.951 1.00 0.00 C ATOM 1496 O SER A 106 15.187 30.462 3.309 1.00 0.00 O ATOM 1497 CB SER A 106 12.127 31.838 2.738 1.00 0.00 C ATOM 1498 OG SER A 106 12.007 33.249 2.746 1.00 0.00 O ATOM 0 H SER A 106 13.638 29.316 2.076 1.00 0.00 H new ATOM 0 HA SER A 106 13.575 32.067 1.165 1.00 0.00 H new ATOM 0 HB2 SER A 106 11.255 31.398 2.254 1.00 0.00 H new ATOM 0 HB3 SER A 106 12.145 31.465 3.762 1.00 0.00 H new ATOM 0 HG SER A 106 11.187 33.505 3.217 1.00 0.00 H new ATOM 1504 N GLY A 107 14.943 32.698 3.350 1.00 0.00 N ATOM 1505 CA GLY A 107 16.067 32.891 4.248 1.00 0.00 C ATOM 1506 C GLY A 107 16.134 34.302 4.798 1.00 0.00 C ATOM 1507 O GLY A 107 16.156 35.282 4.053 1.00 0.00 O ATOM 0 H GLY A 107 14.468 33.555 3.068 1.00 0.00 H new ATOM 0 HA2 GLY A 107 15.993 32.185 5.075 1.00 0.00 H new ATOM 0 HA3 GLY A 107 16.993 32.666 3.719 1.00 0.00 H new ATOM 1511 N PRO A 108 16.165 34.420 6.134 1.00 0.00 N ATOM 1512 CA PRO A 108 16.229 35.718 6.813 1.00 0.00 C ATOM 1513 C PRO A 108 17.576 36.406 6.623 1.00 0.00 C ATOM 1514 O PRO A 108 18.482 36.256 7.443 1.00 0.00 O ATOM 1515 CB PRO A 108 16.015 35.358 8.285 1.00 0.00 C ATOM 1516 CG PRO A 108 16.470 33.944 8.400 1.00 0.00 C ATOM 1517 CD PRO A 108 16.141 33.295 7.084 1.00 0.00 C ATOM 0 HA PRO A 108 15.494 36.421 6.420 1.00 0.00 H new ATOM 0 HB2 PRO A 108 16.589 36.013 8.940 1.00 0.00 H new ATOM 0 HB3 PRO A 108 14.968 35.461 8.569 1.00 0.00 H new ATOM 0 HG2 PRO A 108 17.540 33.894 8.603 1.00 0.00 H new ATOM 0 HG3 PRO A 108 15.965 33.437 9.222 1.00 0.00 H new ATOM 0 HD2 PRO A 108 16.871 32.530 6.820 1.00 0.00 H new ATOM 0 HD3 PRO A 108 15.165 32.810 7.108 1.00 0.00 H new ATOM 1525 N SER A 109 17.702 37.160 5.536 1.00 0.00 N ATOM 1526 CA SER A 109 18.941 37.869 5.236 1.00 0.00 C ATOM 1527 C SER A 109 18.759 38.799 4.040 1.00 0.00 C ATOM 1528 O SER A 109 17.854 38.612 3.227 1.00 0.00 O ATOM 1529 CB SER A 109 20.068 36.873 4.956 1.00 0.00 C ATOM 1530 OG SER A 109 21.328 37.418 5.307 1.00 0.00 O ATOM 0 H SER A 109 16.961 37.296 4.848 1.00 0.00 H new ATOM 0 HA SER A 109 19.206 38.471 6.105 1.00 0.00 H new ATOM 0 HB2 SER A 109 19.895 35.956 5.519 1.00 0.00 H new ATOM 0 HB3 SER A 109 20.066 36.604 3.900 1.00 0.00 H new ATOM 0 HG SER A 109 22.032 36.762 5.120 1.00 0.00 H new ATOM 1536 N SER A 110 19.627 39.801 3.941 1.00 0.00 N ATOM 1537 CA SER A 110 19.561 40.763 2.847 1.00 0.00 C ATOM 1538 C SER A 110 19.789 40.075 1.504 1.00 0.00 C ATOM 1539 O SER A 110 20.914 39.712 1.163 1.00 0.00 O ATOM 1540 CB SER A 110 20.599 41.869 3.049 1.00 0.00 C ATOM 1541 OG SER A 110 21.902 41.327 3.182 1.00 0.00 O ATOM 0 H SER A 110 20.384 39.968 4.605 1.00 0.00 H new ATOM 0 HA SER A 110 18.565 41.205 2.845 1.00 0.00 H new ATOM 0 HB2 SER A 110 20.572 42.556 2.203 1.00 0.00 H new ATOM 0 HB3 SER A 110 20.350 42.448 3.938 1.00 0.00 H new ATOM 0 HG SER A 110 22.017 40.591 2.545 1.00 0.00 H new ATOM 1547 N GLY A 111 18.711 39.899 0.746 1.00 0.00 N ATOM 1548 CA GLY A 111 18.813 39.256 -0.551 1.00 0.00 C ATOM 1549 C GLY A 111 17.662 39.615 -1.469 1.00 0.00 C ATOM 1550 O GLY A 111 16.990 40.626 -1.266 1.00 0.00 O ATOM 0 H GLY A 111 17.769 40.190 1.007 1.00 0.00 H new ATOM 0 HA2 GLY A 111 19.753 39.543 -1.022 1.00 0.00 H new ATOM 0 HA3 GLY A 111 18.842 38.175 -0.416 1.00 0.00 H new TER 1554 GLY A 111