USER MOD reduce.3.24.130724 H: found=0, std=0, add=587, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 590 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 51 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 52 HIS : no HD1:sc= -1.2 X(o=-1.2,f=-0.86) USER MOD Single : A 54 THR OG1 : rot 63:sc= 0.761 USER MOD Single : A 55 TYR OH : rot -67:sc= 1.62 USER MOD Single : A 63 THR OG1 : rot -119:sc= -0.863 USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 69 TYR OH : rot 30:sc= 0 USER MOD Single : A 73 ASN :FLIP amide:sc= -0.0895 F(o=-1.6,f=-0.089) USER MOD Single : A 74 SER OG : rot -97:sc= -0.676! USER MOD Single : A 77 GLN : amide:sc= 0 X(o=0,f=-0.089) USER MOD Single : A 87 SER OG : rot 83:sc= -4.36! USER MOD Single : A 89 HIS : no HD1:sc=-0.00611 X(o=-0.0061,f=-0.15) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 THR OG1 : rot -110:sc= -0.971 USER MOD Single : A 93 ASN : amide:sc= -2.19! C(o=-2.2!,f=-9.5!) USER MOD Single : A 98 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 100 ASN : amide:sc= 0 X(o=0,f=-0.014) USER MOD Single : A 104 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 106 ASN : amide:sc= -0.0907 K(o=-0.091,f=-0.97) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 112 CYS SG : rot -160:sc= -2.12! USER MOD Single : A 115 THR OG1 : rot 180:sc= 0.0139 USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 127 ASN :FLIP amide:sc= -12.5! C(o=-14!,f=-13!) USER MOD Single : A 130 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 51 -18.577 8.271 43.891 1.00 0.00 N ATOM 2 CA MET A 51 -18.073 8.218 45.294 1.00 0.00 C ATOM 3 C MET A 51 -17.093 9.362 45.524 1.00 0.00 C ATOM 4 O MET A 51 -16.522 9.495 46.607 1.00 0.00 O ATOM 5 CB MET A 51 -17.378 6.876 45.534 1.00 0.00 C ATOM 6 CG MET A 51 -16.361 6.618 44.420 1.00 0.00 C ATOM 7 SD MET A 51 -15.281 5.246 44.896 1.00 0.00 S ATOM 8 CE MET A 51 -16.236 3.921 44.117 1.00 0.00 C ATOM 0 HA MET A 51 -18.907 8.318 45.989 1.00 0.00 H new ATOM 0 HB2 MET A 51 -16.878 6.882 46.502 1.00 0.00 H new ATOM 0 HB3 MET A 51 -18.115 6.073 45.561 1.00 0.00 H new ATOM 0 HG2 MET A 51 -16.877 6.383 43.489 1.00 0.00 H new ATOM 0 HG3 MET A 51 -15.769 7.515 44.238 1.00 0.00 H new ATOM 0 HE1 MET A 51 -15.740 2.966 44.289 1.00 0.00 H new ATOM 0 HE2 MET A 51 -17.237 3.893 44.547 1.00 0.00 H new ATOM 0 HE3 MET A 51 -16.306 4.105 43.045 1.00 0.00 H new ATOM 20 N HIS A 52 -16.900 10.188 44.500 1.00 0.00 N ATOM 21 CA HIS A 52 -15.985 11.318 44.602 1.00 0.00 C ATOM 22 C HIS A 52 -16.743 12.634 44.460 1.00 0.00 C ATOM 23 O HIS A 52 -17.367 12.891 43.430 1.00 0.00 O ATOM 24 CB HIS A 52 -14.918 11.224 43.511 1.00 0.00 C ATOM 25 CG HIS A 52 -15.579 10.972 42.184 1.00 0.00 C ATOM 26 ND1 HIS A 52 -15.799 11.985 41.263 1.00 0.00 N ATOM 27 CD2 HIS A 52 -16.072 9.828 41.606 1.00 0.00 C ATOM 28 CE1 HIS A 52 -16.400 11.436 40.191 1.00 0.00 C ATOM 29 NE2 HIS A 52 -16.590 10.124 40.349 1.00 0.00 N ATOM 0 H HIS A 52 -17.362 10.096 43.595 1.00 0.00 H new ATOM 0 HA HIS A 52 -15.508 11.289 45.582 1.00 0.00 H new ATOM 0 HB2 HIS A 52 -14.340 12.147 43.472 1.00 0.00 H new ATOM 0 HB3 HIS A 52 -14.219 10.420 43.740 1.00 0.00 H new ATOM 0 HD2 HIS A 52 -16.060 8.847 42.058 1.00 0.00 H new ATOM 0 HE1 HIS A 52 -16.693 11.989 39.311 1.00 0.00 H new ATOM 0 HE2 HIS A 52 -17.022 9.477 39.689 1.00 0.00 H new ATOM 38 N LEU A 53 -16.686 13.465 45.496 1.00 0.00 N ATOM 39 CA LEU A 53 -17.373 14.751 45.464 1.00 0.00 C ATOM 40 C LEU A 53 -16.404 15.871 45.100 1.00 0.00 C ATOM 41 O LEU A 53 -15.472 16.171 45.846 1.00 0.00 O ATOM 42 CB LEU A 53 -18.004 15.044 46.830 1.00 0.00 C ATOM 43 CG LEU A 53 -18.602 16.455 46.828 1.00 0.00 C ATOM 44 CD1 LEU A 53 -19.895 16.464 47.648 1.00 0.00 C ATOM 45 CD2 LEU A 53 -17.608 17.444 47.447 1.00 0.00 C ATOM 0 H LEU A 53 -16.177 13.274 46.359 1.00 0.00 H new ATOM 0 HA LEU A 53 -18.154 14.702 44.706 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -18.779 14.310 47.049 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -17.253 14.958 47.615 1.00 0.00 H new ATOM 0 HG LEU A 53 -18.814 16.750 45.800 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -20.320 17.468 47.646 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -20.609 15.767 47.209 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -19.678 16.164 48.673 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -18.040 18.445 47.442 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -17.391 17.147 48.473 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -16.685 17.444 46.866 1.00 0.00 H new ATOM 57 N THR A 54 -16.637 16.492 43.946 1.00 0.00 N ATOM 58 CA THR A 54 -15.789 17.587 43.491 1.00 0.00 C ATOM 59 C THR A 54 -16.644 18.801 43.144 1.00 0.00 C ATOM 60 O THR A 54 -17.619 18.689 42.401 1.00 0.00 O ATOM 61 CB THR A 54 -14.985 17.157 42.261 1.00 0.00 C ATOM 62 OG1 THR A 54 -14.241 18.265 41.775 1.00 0.00 O ATOM 63 CG2 THR A 54 -15.937 16.660 41.174 1.00 0.00 C ATOM 0 H THR A 54 -17.402 16.256 43.313 1.00 0.00 H new ATOM 0 HA THR A 54 -15.100 17.850 44.293 1.00 0.00 H new ATOM 0 HB THR A 54 -14.302 16.353 42.535 1.00 0.00 H new ATOM 0 HG1 THR A 54 -13.592 18.546 42.453 1.00 0.00 H new ATOM 0 HG21 THR A 54 -15.363 16.354 40.299 1.00 0.00 H new ATOM 0 HG22 THR A 54 -16.506 15.810 41.550 1.00 0.00 H new ATOM 0 HG23 THR A 54 -16.622 17.461 40.896 1.00 0.00 H new ATOM 71 N TYR A 55 -16.278 19.961 43.679 1.00 0.00 N ATOM 72 CA TYR A 55 -17.034 21.177 43.404 1.00 0.00 C ATOM 73 C TYR A 55 -16.150 22.222 42.736 1.00 0.00 C ATOM 74 O TYR A 55 -14.947 22.286 42.985 1.00 0.00 O ATOM 75 CB TYR A 55 -17.604 21.742 44.706 1.00 0.00 C ATOM 76 CG TYR A 55 -16.474 22.149 45.623 1.00 0.00 C ATOM 77 CD1 TYR A 55 -15.679 21.169 46.235 1.00 0.00 C ATOM 78 CD2 TYR A 55 -16.221 23.504 45.864 1.00 0.00 C ATOM 79 CE1 TYR A 55 -14.635 21.548 47.087 1.00 0.00 C ATOM 80 CE2 TYR A 55 -15.178 23.883 46.715 1.00 0.00 C ATOM 81 CZ TYR A 55 -14.384 22.904 47.326 1.00 0.00 C ATOM 82 OH TYR A 55 -13.354 23.278 48.165 1.00 0.00 O ATOM 0 H TYR A 55 -15.475 20.085 44.296 1.00 0.00 H new ATOM 0 HA TYR A 55 -17.851 20.928 42.727 1.00 0.00 H new ATOM 0 HB2 TYR A 55 -18.240 22.601 44.493 1.00 0.00 H new ATOM 0 HB3 TYR A 55 -18.230 20.995 45.194 1.00 0.00 H new ATOM 0 HD1 TYR A 55 -15.872 20.123 46.049 1.00 0.00 H new ATOM 0 HD2 TYR A 55 -16.832 24.259 45.392 1.00 0.00 H new ATOM 0 HE1 TYR A 55 -14.023 20.794 47.560 1.00 0.00 H new ATOM 0 HE2 TYR A 55 -14.985 24.929 46.901 1.00 0.00 H new ATOM 0 HH TYR A 55 -13.563 23.004 49.082 1.00 0.00 H new ATOM 92 N GLU A 56 -16.760 23.040 41.885 1.00 0.00 N ATOM 93 CA GLU A 56 -16.023 24.084 41.184 1.00 0.00 C ATOM 94 C GLU A 56 -16.960 25.203 40.745 1.00 0.00 C ATOM 95 O GLU A 56 -18.009 24.950 40.152 1.00 0.00 O ATOM 96 CB GLU A 56 -15.321 23.498 39.958 1.00 0.00 C ATOM 97 CG GLU A 56 -14.829 24.634 39.060 1.00 0.00 C ATOM 98 CD GLU A 56 -13.514 24.241 38.394 1.00 0.00 C ATOM 99 OE1 GLU A 56 -13.458 23.161 37.829 1.00 0.00 O ATOM 100 OE2 GLU A 56 -12.582 25.026 38.455 1.00 0.00 O ATOM 0 H GLU A 56 -17.755 23.001 41.665 1.00 0.00 H new ATOM 0 HA GLU A 56 -15.280 24.494 41.868 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -14.481 22.876 40.269 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -16.006 22.855 39.406 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -15.578 24.858 38.300 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -14.691 25.541 39.649 1.00 0.00 H new ATOM 107 N ILE A 57 -16.569 26.441 41.021 1.00 0.00 N ATOM 108 CA ILE A 57 -17.379 27.589 40.634 1.00 0.00 C ATOM 109 C ILE A 57 -16.952 28.077 39.254 1.00 0.00 C ATOM 110 O ILE A 57 -15.916 27.660 38.735 1.00 0.00 O ATOM 111 CB ILE A 57 -17.217 28.716 41.654 1.00 0.00 C ATOM 112 CG1 ILE A 57 -17.465 28.167 43.060 1.00 0.00 C ATOM 113 CG2 ILE A 57 -18.229 29.826 41.357 1.00 0.00 C ATOM 114 CD1 ILE A 57 -18.968 28.160 43.347 1.00 0.00 C ATOM 0 H ILE A 57 -15.703 26.675 41.507 1.00 0.00 H new ATOM 0 HA ILE A 57 -18.427 27.289 40.603 1.00 0.00 H new ATOM 0 HB ILE A 57 -16.207 29.120 41.591 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -17.063 27.157 43.144 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -16.946 28.779 43.798 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -18.112 30.629 42.085 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -18.056 30.217 40.354 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -19.240 29.423 41.420 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -19.145 27.769 44.349 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -19.356 29.176 43.280 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -19.475 27.530 42.616 1.00 0.00 H new ATOM 126 N PHE A 58 -17.751 28.954 38.657 1.00 0.00 N ATOM 127 CA PHE A 58 -17.427 29.474 37.334 1.00 0.00 C ATOM 128 C PHE A 58 -17.568 30.991 37.297 1.00 0.00 C ATOM 129 O PHE A 58 -18.439 31.560 37.957 1.00 0.00 O ATOM 130 CB PHE A 58 -18.347 28.846 36.284 1.00 0.00 C ATOM 131 CG PHE A 58 -17.529 28.381 35.103 1.00 0.00 C ATOM 132 CD1 PHE A 58 -16.760 29.299 34.378 1.00 0.00 C ATOM 133 CD2 PHE A 58 -17.539 27.030 34.732 1.00 0.00 C ATOM 134 CE1 PHE A 58 -16.002 28.869 33.283 1.00 0.00 C ATOM 135 CE2 PHE A 58 -16.780 26.600 33.637 1.00 0.00 C ATOM 136 CZ PHE A 58 -16.012 27.519 32.912 1.00 0.00 C ATOM 0 H PHE A 58 -18.615 29.316 39.061 1.00 0.00 H new ATOM 0 HA PHE A 58 -16.392 29.216 37.111 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -18.888 28.005 36.717 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -19.093 29.572 35.959 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -16.752 30.340 34.664 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -18.132 26.321 35.290 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -15.409 29.578 32.724 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -16.787 25.558 33.351 1.00 0.00 H new ATOM 0 HZ PHE A 58 -15.427 27.187 32.067 1.00 0.00 H new ATOM 146 N GLY A 59 -16.706 31.637 36.521 1.00 0.00 N ATOM 147 CA GLY A 59 -16.738 33.088 36.396 1.00 0.00 C ATOM 148 C GLY A 59 -15.999 33.536 35.141 1.00 0.00 C ATOM 149 O GLY A 59 -15.140 32.821 34.627 1.00 0.00 O ATOM 0 H GLY A 59 -15.979 31.180 35.971 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -17.772 33.432 36.358 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -16.282 33.544 37.275 1.00 0.00 H new ATOM 153 N PRO A 60 -16.320 34.697 34.643 1.00 0.00 N ATOM 154 CA PRO A 60 -15.681 35.258 33.420 1.00 0.00 C ATOM 155 C PRO A 60 -14.158 35.210 33.498 1.00 0.00 C ATOM 156 O PRO A 60 -13.585 35.066 34.578 1.00 0.00 O ATOM 157 CB PRO A 60 -16.182 36.709 33.353 1.00 0.00 C ATOM 158 CG PRO A 60 -16.920 36.965 34.632 1.00 0.00 C ATOM 159 CD PRO A 60 -17.327 35.606 35.193 1.00 0.00 C ATOM 0 HA PRO A 60 -15.942 34.683 32.531 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -15.348 37.402 33.241 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -16.835 36.854 32.493 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -16.289 37.501 35.341 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -17.797 37.587 34.453 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -17.319 35.602 36.283 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -18.333 35.327 34.881 1.00 0.00 H new ATOM 167 N PRO A 61 -13.500 35.321 32.374 1.00 0.00 N ATOM 168 CA PRO A 61 -12.012 35.287 32.299 1.00 0.00 C ATOM 169 C PRO A 61 -11.380 36.603 32.744 1.00 0.00 C ATOM 170 O PRO A 61 -11.812 37.681 32.332 1.00 0.00 O ATOM 171 CB PRO A 61 -11.741 35.026 30.818 1.00 0.00 C ATOM 172 CG PRO A 61 -12.914 35.602 30.098 1.00 0.00 C ATOM 173 CD PRO A 61 -14.110 35.492 31.045 1.00 0.00 C ATOM 0 HA PRO A 61 -11.583 34.534 32.960 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -10.812 35.498 30.498 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -11.641 33.959 30.618 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -12.729 36.642 29.827 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -13.103 35.060 29.171 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -14.734 36.385 31.005 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -14.747 34.646 30.787 1.00 0.00 H new ATOM 181 N GLY A 62 -10.353 36.509 33.582 1.00 0.00 N ATOM 182 CA GLY A 62 -9.667 37.698 34.073 1.00 0.00 C ATOM 183 C GLY A 62 -10.363 38.265 35.305 1.00 0.00 C ATOM 184 O GLY A 62 -9.836 39.157 35.970 1.00 0.00 O ATOM 0 H GLY A 62 -9.979 35.627 33.933 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -8.634 37.451 34.317 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -9.637 38.454 33.288 1.00 0.00 H new ATOM 188 N THR A 63 -11.548 37.745 35.604 1.00 0.00 N ATOM 189 CA THR A 63 -12.304 38.211 36.759 1.00 0.00 C ATOM 190 C THR A 63 -11.799 37.541 38.034 1.00 0.00 C ATOM 191 O THR A 63 -11.656 36.320 38.091 1.00 0.00 O ATOM 192 CB THR A 63 -13.791 37.901 36.572 1.00 0.00 C ATOM 193 OG1 THR A 63 -14.218 38.396 35.311 1.00 0.00 O ATOM 194 CG2 THR A 63 -14.599 38.572 37.685 1.00 0.00 C ATOM 0 H THR A 63 -12.003 37.006 35.067 1.00 0.00 H new ATOM 0 HA THR A 63 -12.167 39.289 36.848 1.00 0.00 H new ATOM 0 HB THR A 63 -13.947 36.823 36.614 1.00 0.00 H new ATOM 0 HG1 THR A 63 -14.922 39.065 35.443 1.00 0.00 H new ATOM 0 HG21 THR A 63 -15.658 38.350 37.550 1.00 0.00 H new ATOM 0 HG22 THR A 63 -14.269 38.194 38.653 1.00 0.00 H new ATOM 0 HG23 THR A 63 -14.446 39.651 37.646 1.00 0.00 H new ATOM 202 N VAL A 64 -11.529 38.350 39.054 1.00 0.00 N ATOM 203 CA VAL A 64 -11.040 37.826 40.323 1.00 0.00 C ATOM 204 C VAL A 64 -12.165 37.775 41.351 1.00 0.00 C ATOM 205 O VAL A 64 -12.847 38.772 41.590 1.00 0.00 O ATOM 206 CB VAL A 64 -9.907 38.708 40.849 1.00 0.00 C ATOM 207 CG1 VAL A 64 -8.633 38.434 40.049 1.00 0.00 C ATOM 208 CG2 VAL A 64 -10.297 40.181 40.701 1.00 0.00 C ATOM 0 H VAL A 64 -11.640 39.364 39.027 1.00 0.00 H new ATOM 0 HA VAL A 64 -10.668 36.815 40.158 1.00 0.00 H new ATOM 0 HB VAL A 64 -9.730 38.483 41.901 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -7.826 39.063 40.424 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -8.355 37.385 40.155 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -8.809 38.658 38.997 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -9.490 40.810 41.076 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -10.475 40.406 39.649 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -11.205 40.376 41.272 1.00 0.00 H new ATOM 218 N ALA A 65 -12.354 36.608 41.957 1.00 0.00 N ATOM 219 CA ALA A 65 -13.401 36.439 42.957 1.00 0.00 C ATOM 220 C ALA A 65 -12.856 35.718 44.187 1.00 0.00 C ATOM 221 O ALA A 65 -11.872 34.982 44.101 1.00 0.00 O ATOM 222 CB ALA A 65 -14.562 35.637 42.368 1.00 0.00 C ATOM 0 H ALA A 65 -11.800 35.771 41.775 1.00 0.00 H new ATOM 0 HA ALA A 65 -13.755 37.426 43.254 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -15.340 35.515 43.122 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -14.970 36.167 41.507 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -14.205 34.656 42.054 1.00 0.00 H new ATOM 228 N ASP A 66 -13.501 35.933 45.329 1.00 0.00 N ATOM 229 CA ASP A 66 -13.072 35.297 46.568 1.00 0.00 C ATOM 230 C ASP A 66 -13.989 34.130 46.916 1.00 0.00 C ATOM 231 O ASP A 66 -15.212 34.275 46.937 1.00 0.00 O ATOM 232 CB ASP A 66 -13.083 36.315 47.709 1.00 0.00 C ATOM 233 CG ASP A 66 -12.709 35.632 49.020 1.00 0.00 C ATOM 234 OD1 ASP A 66 -12.739 34.413 49.060 1.00 0.00 O ATOM 235 OD2 ASP A 66 -12.399 36.338 49.966 1.00 0.00 O ATOM 0 H ASP A 66 -14.317 36.538 45.422 1.00 0.00 H new ATOM 0 HA ASP A 66 -12.059 34.919 46.429 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -12.380 37.121 47.496 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -14.071 36.768 47.794 1.00 0.00 H new ATOM 240 N ILE A 67 -13.392 32.976 47.187 1.00 0.00 N ATOM 241 CA ILE A 67 -14.168 31.791 47.534 1.00 0.00 C ATOM 242 C ILE A 67 -13.814 31.309 48.937 1.00 0.00 C ATOM 243 O ILE A 67 -12.645 31.078 49.247 1.00 0.00 O ATOM 244 CB ILE A 67 -13.894 30.674 46.525 1.00 0.00 C ATOM 245 CG1 ILE A 67 -14.670 30.951 45.234 1.00 0.00 C ATOM 246 CG2 ILE A 67 -14.344 29.336 47.113 1.00 0.00 C ATOM 247 CD1 ILE A 67 -13.722 30.856 44.037 1.00 0.00 C ATOM 0 H ILE A 67 -12.382 32.835 47.174 1.00 0.00 H new ATOM 0 HA ILE A 67 -15.226 32.053 47.509 1.00 0.00 H new ATOM 0 HB ILE A 67 -12.827 30.635 46.306 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -15.483 30.233 45.125 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -15.123 31.942 45.275 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -14.149 28.539 46.395 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -13.793 29.139 48.032 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -15.411 29.375 47.331 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -14.275 31.053 43.119 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -12.924 31.591 44.145 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -13.290 29.856 43.993 1.00 0.00 H new ATOM 259 N SER A 68 -14.824 31.152 49.771 1.00 0.00 N ATOM 260 CA SER A 68 -14.638 30.697 51.146 1.00 0.00 C ATOM 261 C SER A 68 -15.248 29.332 51.353 1.00 0.00 C ATOM 262 O SER A 68 -16.472 29.184 51.233 1.00 0.00 O ATOM 263 CB SER A 68 -15.203 31.732 52.152 1.00 0.00 C ATOM 264 OG SER A 68 -15.115 31.293 53.511 1.00 0.00 O ATOM 0 H SER A 68 -15.796 31.334 49.521 1.00 0.00 H new ATOM 0 HA SER A 68 -13.568 30.607 51.332 1.00 0.00 H new ATOM 0 HB2 SER A 68 -14.660 32.671 52.043 1.00 0.00 H new ATOM 0 HB3 SER A 68 -16.246 31.936 51.908 1.00 0.00 H new ATOM 0 HG SER A 68 -15.483 31.983 54.102 1.00 0.00 H new ATOM 270 N TYR A 69 -14.434 28.347 51.693 1.00 0.00 N ATOM 271 CA TYR A 69 -14.931 26.995 51.926 1.00 0.00 C ATOM 272 C TYR A 69 -14.225 26.364 53.122 1.00 0.00 C ATOM 273 O TYR A 69 -13.044 26.617 53.360 1.00 0.00 O ATOM 274 CB TYR A 69 -14.702 26.134 50.680 1.00 0.00 C ATOM 275 CG TYR A 69 -14.900 24.676 51.026 1.00 0.00 C ATOM 276 CD1 TYR A 69 -16.166 24.209 51.402 1.00 0.00 C ATOM 277 CD2 TYR A 69 -13.815 23.792 50.969 1.00 0.00 C ATOM 278 CE1 TYR A 69 -16.348 22.857 51.721 1.00 0.00 C ATOM 279 CE2 TYR A 69 -13.998 22.439 51.288 1.00 0.00 C ATOM 280 CZ TYR A 69 -15.263 21.973 51.664 1.00 0.00 C ATOM 281 OH TYR A 69 -15.443 20.643 51.978 1.00 0.00 O ATOM 0 H TYR A 69 -13.427 28.454 51.815 1.00 0.00 H new ATOM 0 HA TYR A 69 -15.999 27.050 52.138 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -15.394 26.428 49.891 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -13.694 26.293 50.296 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -17.002 24.891 51.446 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -12.839 24.152 50.680 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -17.324 22.497 52.011 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -13.162 21.756 51.244 1.00 0.00 H new ATOM 0 HH TYR A 69 -16.359 20.375 51.754 1.00 0.00 H new ATOM 291 N PHE A 70 -14.953 25.540 53.868 1.00 0.00 N ATOM 292 CA PHE A 70 -14.383 24.877 55.036 1.00 0.00 C ATOM 293 C PHE A 70 -13.629 23.621 54.613 1.00 0.00 C ATOM 294 O PHE A 70 -14.121 22.835 53.805 1.00 0.00 O ATOM 295 CB PHE A 70 -15.495 24.508 56.023 1.00 0.00 C ATOM 296 CG PHE A 70 -15.196 25.113 57.375 1.00 0.00 C ATOM 297 CD1 PHE A 70 -13.963 24.869 57.993 1.00 0.00 C ATOM 298 CD2 PHE A 70 -16.150 25.917 58.010 1.00 0.00 C ATOM 299 CE1 PHE A 70 -13.685 25.431 59.245 1.00 0.00 C ATOM 300 CE2 PHE A 70 -15.872 26.479 59.261 1.00 0.00 C ATOM 301 CZ PHE A 70 -14.640 26.235 59.879 1.00 0.00 C ATOM 0 H PHE A 70 -15.932 25.316 53.687 1.00 0.00 H new ATOM 0 HA PHE A 70 -13.686 25.560 55.522 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -16.455 24.870 55.656 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -15.574 23.424 56.108 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -13.227 24.248 57.504 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -17.101 26.104 57.534 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -12.734 25.244 59.722 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -16.608 27.101 59.749 1.00 0.00 H new ATOM 0 HZ PHE A 70 -14.426 26.667 60.845 1.00 0.00 H new ATOM 311 N ASP A 71 -12.430 23.441 55.159 1.00 0.00 N ATOM 312 CA ASP A 71 -11.617 22.278 54.819 1.00 0.00 C ATOM 313 C ASP A 71 -11.833 21.151 55.822 1.00 0.00 C ATOM 314 O ASP A 71 -12.181 21.391 56.978 1.00 0.00 O ATOM 315 CB ASP A 71 -10.137 22.665 54.793 1.00 0.00 C ATOM 316 CG ASP A 71 -9.371 21.732 53.860 1.00 0.00 C ATOM 317 OD1 ASP A 71 -9.868 20.649 53.599 1.00 0.00 O ATOM 318 OD2 ASP A 71 -8.299 22.116 53.422 1.00 0.00 O ATOM 0 H ASP A 71 -12.003 24.078 55.832 1.00 0.00 H new ATOM 0 HA ASP A 71 -11.920 21.928 53.832 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -10.028 23.697 54.459 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -9.720 22.610 55.799 1.00 0.00 H new ATOM 323 N VAL A 72 -11.621 19.918 55.369 1.00 0.00 N ATOM 324 CA VAL A 72 -11.792 18.755 56.233 1.00 0.00 C ATOM 325 C VAL A 72 -11.066 18.959 57.559 1.00 0.00 C ATOM 326 O VAL A 72 -11.567 18.578 58.617 1.00 0.00 O ATOM 327 CB VAL A 72 -11.246 17.507 55.539 1.00 0.00 C ATOM 328 CG1 VAL A 72 -9.746 17.676 55.289 1.00 0.00 C ATOM 329 CG2 VAL A 72 -11.481 16.286 56.430 1.00 0.00 C ATOM 0 H VAL A 72 -11.333 19.700 54.415 1.00 0.00 H new ATOM 0 HA VAL A 72 -12.856 18.627 56.431 1.00 0.00 H new ATOM 0 HB VAL A 72 -11.758 17.367 54.587 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -9.357 16.786 54.794 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -9.579 18.546 54.654 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -9.232 17.816 56.240 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -11.092 15.395 55.937 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -10.969 16.426 57.382 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -12.550 16.165 56.607 1.00 0.00 H new ATOM 339 N ASN A 73 -9.885 19.564 57.494 1.00 0.00 N ATOM 340 CA ASN A 73 -9.097 19.816 58.696 1.00 0.00 C ATOM 341 C ASN A 73 -9.491 21.150 59.320 1.00 0.00 C ATOM 342 O ASN A 73 -8.805 21.658 60.208 1.00 0.00 O ATOM 343 CB ASN A 73 -7.606 19.830 58.352 1.00 0.00 C ATOM 344 CG ASN A 73 -6.786 19.419 59.571 1.00 0.00 C ATOM 345 OD1 ASN A 73 -7.337 19.436 60.755 1.00 0.00 O flip ATOM 346 ND2 ASN A 73 -5.611 19.072 59.443 1.00 0.00 N flip ATOM 0 H ASN A 73 -9.454 19.887 56.628 1.00 0.00 H new ATOM 0 HA ASN A 73 -9.294 19.019 59.412 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -7.409 19.149 57.524 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -7.310 20.826 58.023 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -5.181 19.059 58.518 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -5.068 18.798 60.262 1.00 0.00 H new ATOM 353 N SER A 74 -10.596 21.716 58.846 1.00 0.00 N ATOM 354 CA SER A 74 -11.069 22.995 59.361 1.00 0.00 C ATOM 355 C SER A 74 -10.325 24.147 58.695 1.00 0.00 C ATOM 356 O SER A 74 -10.889 24.870 57.876 1.00 0.00 O ATOM 357 CB SER A 74 -10.866 23.055 60.876 1.00 0.00 C ATOM 358 OG SER A 74 -9.740 23.871 61.168 1.00 0.00 O ATOM 0 H SER A 74 -11.177 21.312 58.111 1.00 0.00 H new ATOM 0 HA SER A 74 -12.131 23.088 59.136 1.00 0.00 H new ATOM 0 HB2 SER A 74 -11.757 23.459 61.358 1.00 0.00 H new ATOM 0 HB3 SER A 74 -10.715 22.052 61.274 1.00 0.00 H new ATOM 0 HG SER A 74 -8.953 23.304 61.308 1.00 0.00 H new ATOM 364 N GLU A 75 -9.052 24.307 59.051 1.00 0.00 N ATOM 365 CA GLU A 75 -8.230 25.370 58.482 1.00 0.00 C ATOM 366 C GLU A 75 -8.743 25.768 57.101 1.00 0.00 C ATOM 367 O GLU A 75 -8.309 25.226 56.085 1.00 0.00 O ATOM 368 CB GLU A 75 -6.778 24.901 58.372 1.00 0.00 C ATOM 369 CG GLU A 75 -5.897 26.057 57.888 1.00 0.00 C ATOM 370 CD GLU A 75 -4.881 26.424 58.966 1.00 0.00 C ATOM 371 OE1 GLU A 75 -4.194 25.532 59.434 1.00 0.00 O ATOM 372 OE2 GLU A 75 -4.806 27.594 59.306 1.00 0.00 O ATOM 0 H GLU A 75 -8.570 23.716 59.728 1.00 0.00 H new ATOM 0 HA GLU A 75 -8.286 26.237 59.140 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -6.427 24.544 59.340 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -6.708 24.063 57.679 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -5.380 25.773 56.971 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -6.516 26.922 57.650 1.00 0.00 H new ATOM 379 N PRO A 76 -9.654 26.702 57.053 1.00 0.00 N ATOM 380 CA PRO A 76 -10.246 27.193 55.774 1.00 0.00 C ATOM 381 C PRO A 76 -9.212 27.893 54.894 1.00 0.00 C ATOM 382 O PRO A 76 -8.320 28.576 55.393 1.00 0.00 O ATOM 383 CB PRO A 76 -11.339 28.178 56.212 1.00 0.00 C ATOM 384 CG PRO A 76 -11.530 27.968 57.680 1.00 0.00 C ATOM 385 CD PRO A 76 -10.222 27.394 58.215 1.00 0.00 C ATOM 0 HA PRO A 76 -10.631 26.371 55.170 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -11.043 29.206 56.002 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -12.267 27.996 55.669 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -11.772 28.907 58.177 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -12.358 27.285 57.869 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -9.558 28.178 58.580 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -10.394 26.710 59.046 1.00 0.00 H new ATOM 393 N GLN A 77 -9.346 27.723 53.583 1.00 0.00 N ATOM 394 CA GLN A 77 -8.422 28.347 52.643 1.00 0.00 C ATOM 395 C GLN A 77 -9.109 29.495 51.909 1.00 0.00 C ATOM 396 O GLN A 77 -10.321 29.473 51.698 1.00 0.00 O ATOM 397 CB GLN A 77 -7.927 27.312 51.629 1.00 0.00 C ATOM 398 CG GLN A 77 -9.113 26.778 50.821 1.00 0.00 C ATOM 399 CD GLN A 77 -9.163 25.258 50.913 1.00 0.00 C ATOM 400 OE1 GLN A 77 -9.208 24.704 52.012 1.00 0.00 O ATOM 401 NE2 GLN A 77 -9.162 24.545 49.819 1.00 0.00 N ATOM 0 H GLN A 77 -10.080 27.163 53.150 1.00 0.00 H new ATOM 0 HA GLN A 77 -7.572 28.740 53.200 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -7.193 27.764 50.962 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -7.427 26.492 52.145 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -10.042 27.204 51.199 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -9.022 27.085 49.779 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -9.125 25.006 48.910 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -9.199 23.527 49.874 1.00 0.00 H new ATOM 410 N ARG A 78 -8.328 30.499 51.524 1.00 0.00 N ATOM 411 CA ARG A 78 -8.875 31.650 50.816 1.00 0.00 C ATOM 412 C ARG A 78 -7.954 32.072 49.676 1.00 0.00 C ATOM 413 O ARG A 78 -6.750 32.245 49.868 1.00 0.00 O ATOM 414 CB ARG A 78 -9.060 32.820 51.784 1.00 0.00 C ATOM 415 CG ARG A 78 -10.172 32.491 52.782 1.00 0.00 C ATOM 416 CD ARG A 78 -10.060 33.415 53.996 1.00 0.00 C ATOM 417 NE ARG A 78 -8.886 33.066 54.788 1.00 0.00 N ATOM 418 CZ ARG A 78 -8.269 33.974 55.538 1.00 0.00 C ATOM 419 NH1 ARG A 78 -8.714 35.199 55.576 1.00 0.00 N ATOM 420 NH2 ARG A 78 -7.218 33.639 56.236 1.00 0.00 N ATOM 0 H ARG A 78 -7.322 30.539 51.689 1.00 0.00 H new ATOM 0 HA ARG A 78 -9.841 31.366 50.398 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -8.128 33.017 52.314 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -9.310 33.726 51.232 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -11.147 32.611 52.309 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -10.097 31.450 53.096 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -9.991 34.452 53.668 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -10.958 33.334 54.608 1.00 0.00 H new ATOM 0 HE ARG A 78 -8.532 32.109 54.766 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -9.535 35.460 55.030 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -8.241 35.896 56.151 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -6.870 32.681 56.206 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -6.745 34.336 56.811 1.00 0.00 H new ATOM 434 N VAL A 79 -8.529 32.239 48.488 1.00 0.00 N ATOM 435 CA VAL A 79 -7.752 32.646 47.323 1.00 0.00 C ATOM 436 C VAL A 79 -7.966 34.127 47.030 1.00 0.00 C ATOM 437 O VAL A 79 -9.098 34.577 46.846 1.00 0.00 O ATOM 438 CB VAL A 79 -8.166 31.816 46.106 1.00 0.00 C ATOM 439 CG1 VAL A 79 -7.582 30.407 46.226 1.00 0.00 C ATOM 440 CG2 VAL A 79 -9.693 31.731 46.045 1.00 0.00 C ATOM 0 H VAL A 79 -9.523 32.100 48.308 1.00 0.00 H new ATOM 0 HA VAL A 79 -6.696 32.478 47.534 1.00 0.00 H new ATOM 0 HB VAL A 79 -7.790 32.288 45.198 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -7.877 29.816 45.359 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -6.495 30.467 46.272 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -7.958 29.933 47.133 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -9.990 31.140 45.179 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -10.068 31.258 46.953 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -10.110 32.734 45.960 1.00 0.00 H new ATOM 450 N ASP A 80 -6.872 34.884 46.993 1.00 0.00 N ATOM 451 CA ASP A 80 -6.957 36.316 46.725 1.00 0.00 C ATOM 452 C ASP A 80 -6.148 36.681 45.484 1.00 0.00 C ATOM 453 O ASP A 80 -4.917 36.663 45.506 1.00 0.00 O ATOM 454 CB ASP A 80 -6.432 37.103 47.926 1.00 0.00 C ATOM 455 CG ASP A 80 -6.756 36.362 49.219 1.00 0.00 C ATOM 456 OD1 ASP A 80 -7.754 35.660 49.241 1.00 0.00 O ATOM 457 OD2 ASP A 80 -6.002 36.508 50.166 1.00 0.00 O ATOM 0 H ASP A 80 -5.926 34.534 47.144 1.00 0.00 H new ATOM 0 HA ASP A 80 -8.002 36.571 46.550 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -5.355 37.242 47.837 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -6.881 38.096 47.944 1.00 0.00 H new ATOM 462 N GLY A 81 -6.847 37.014 44.404 1.00 0.00 N ATOM 463 CA GLY A 81 -6.182 37.382 43.159 1.00 0.00 C ATOM 464 C GLY A 81 -6.139 36.203 42.194 1.00 0.00 C ATOM 465 O GLY A 81 -5.227 36.094 41.373 1.00 0.00 O ATOM 0 H GLY A 81 -7.866 37.037 44.365 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -6.707 38.217 42.695 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -5.168 37.721 43.371 1.00 0.00 H new ATOM 469 N ALA A 82 -7.128 35.322 42.299 1.00 0.00 N ATOM 470 CA ALA A 82 -7.189 34.153 41.429 1.00 0.00 C ATOM 471 C ALA A 82 -7.944 34.480 40.143 1.00 0.00 C ATOM 472 O ALA A 82 -9.022 35.075 40.178 1.00 0.00 O ATOM 473 CB ALA A 82 -7.885 32.999 42.153 1.00 0.00 C ATOM 0 H ALA A 82 -7.892 35.393 42.971 1.00 0.00 H new ATOM 0 HA ALA A 82 -6.171 33.860 41.174 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -7.927 32.130 41.497 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -7.327 32.746 43.055 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -8.898 33.298 42.424 1.00 0.00 H new ATOM 479 N VAL A 83 -7.369 34.088 39.010 1.00 0.00 N ATOM 480 CA VAL A 83 -7.993 34.343 37.717 1.00 0.00 C ATOM 481 C VAL A 83 -9.341 33.634 37.622 1.00 0.00 C ATOM 482 O VAL A 83 -10.392 34.264 37.732 1.00 0.00 O ATOM 483 CB VAL A 83 -7.077 33.859 36.592 1.00 0.00 C ATOM 484 CG1 VAL A 83 -7.514 34.491 35.268 1.00 0.00 C ATOM 485 CG2 VAL A 83 -5.633 34.266 36.899 1.00 0.00 C ATOM 0 H VAL A 83 -6.477 33.595 38.961 1.00 0.00 H new ATOM 0 HA VAL A 83 -8.154 35.416 37.617 1.00 0.00 H new ATOM 0 HB VAL A 83 -7.141 32.774 36.514 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -6.861 34.146 34.467 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -8.542 34.202 35.048 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -7.451 35.576 35.345 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -4.980 33.921 36.098 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -5.570 35.351 36.977 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -5.320 33.815 37.841 1.00 0.00 H new ATOM 495 N LEU A 84 -9.303 32.321 37.415 1.00 0.00 N ATOM 496 CA LEU A 84 -10.530 31.540 37.307 1.00 0.00 C ATOM 497 C LEU A 84 -10.602 30.496 38.420 1.00 0.00 C ATOM 498 O LEU A 84 -9.581 30.099 38.980 1.00 0.00 O ATOM 499 CB LEU A 84 -10.599 30.845 35.943 1.00 0.00 C ATOM 500 CG LEU A 84 -9.254 30.978 35.222 1.00 0.00 C ATOM 501 CD1 LEU A 84 -8.208 30.120 35.933 1.00 0.00 C ATOM 502 CD2 LEU A 84 -9.404 30.499 33.775 1.00 0.00 C ATOM 0 H LEU A 84 -8.444 31.780 37.319 1.00 0.00 H new ATOM 0 HA LEU A 84 -11.376 32.220 37.406 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -10.849 29.792 36.074 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -11.391 31.288 35.339 1.00 0.00 H new ATOM 0 HG LEU A 84 -8.938 32.021 35.232 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -7.251 30.214 35.420 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -8.102 30.456 36.964 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -8.524 29.077 35.922 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -8.448 30.593 33.260 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -9.719 29.456 33.768 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -10.152 31.107 33.266 1.00 0.00 H new ATOM 514 N PRO A 85 -11.788 30.058 38.743 1.00 0.00 N ATOM 515 CA PRO A 85 -12.014 29.043 39.816 1.00 0.00 C ATOM 516 C PRO A 85 -11.384 27.693 39.480 1.00 0.00 C ATOM 517 O PRO A 85 -11.249 27.332 38.311 1.00 0.00 O ATOM 518 CB PRO A 85 -13.538 28.923 39.901 1.00 0.00 C ATOM 519 CG PRO A 85 -14.057 29.448 38.603 1.00 0.00 C ATOM 520 CD PRO A 85 -13.047 30.485 38.120 1.00 0.00 C ATOM 0 HA PRO A 85 -11.554 29.345 40.757 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -13.841 27.887 40.054 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -13.930 29.497 40.741 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -14.166 28.644 37.875 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -15.042 29.897 38.732 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -12.973 30.496 37.033 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -13.327 31.492 38.430 1.00 0.00 H new ATOM 528 N TRP A 86 -11.005 26.948 40.516 1.00 0.00 N ATOM 529 CA TRP A 86 -10.394 25.638 40.323 1.00 0.00 C ATOM 530 C TRP A 86 -11.305 24.540 40.869 1.00 0.00 C ATOM 531 O TRP A 86 -12.450 24.800 41.239 1.00 0.00 O ATOM 532 CB TRP A 86 -9.033 25.583 41.022 1.00 0.00 C ATOM 533 CG TRP A 86 -9.227 25.439 42.496 1.00 0.00 C ATOM 534 CD1 TRP A 86 -8.981 24.315 43.206 1.00 0.00 C ATOM 535 CD2 TRP A 86 -9.694 26.433 43.455 1.00 0.00 C ATOM 536 NE1 TRP A 86 -9.270 24.552 44.537 1.00 0.00 N ATOM 537 CE2 TRP A 86 -9.713 25.843 44.741 1.00 0.00 C ATOM 538 CE3 TRP A 86 -10.099 27.774 43.334 1.00 0.00 C ATOM 539 CZ2 TRP A 86 -10.122 26.559 45.867 1.00 0.00 C ATOM 540 CZ3 TRP A 86 -10.511 28.497 44.465 1.00 0.00 C ATOM 541 CH2 TRP A 86 -10.521 27.891 45.730 1.00 0.00 C ATOM 0 H TRP A 86 -11.110 27.228 41.491 1.00 0.00 H new ATOM 0 HA TRP A 86 -10.251 25.476 39.255 1.00 0.00 H new ATOM 0 HB2 TRP A 86 -8.451 24.745 40.639 1.00 0.00 H new ATOM 0 HB3 TRP A 86 -8.467 26.489 40.807 1.00 0.00 H new ATOM 0 HD1 TRP A 86 -8.618 23.383 42.799 1.00 0.00 H new ATOM 0 HE1 TRP A 86 -9.168 23.858 45.277 1.00 0.00 H new ATOM 0 HE3 TRP A 86 -10.093 28.251 42.365 1.00 0.00 H new ATOM 0 HZ2 TRP A 86 -10.130 26.086 46.838 1.00 0.00 H new ATOM 0 HZ3 TRP A 86 -10.822 29.526 44.360 1.00 0.00 H new ATOM 0 HH2 TRP A 86 -10.837 28.453 46.597 1.00 0.00 H new ATOM 552 N SER A 87 -10.795 23.317 40.922 1.00 0.00 N ATOM 553 CA SER A 87 -11.563 22.173 41.401 1.00 0.00 C ATOM 554 C SER A 87 -10.841 21.467 42.524 1.00 0.00 C ATOM 555 O SER A 87 -9.611 21.434 42.554 1.00 0.00 O ATOM 556 CB SER A 87 -11.893 21.203 40.237 1.00 0.00 C ATOM 557 OG SER A 87 -12.711 21.805 39.227 1.00 0.00 O ATOM 0 H SER A 87 -9.843 23.089 40.636 1.00 0.00 H new ATOM 0 HA SER A 87 -12.508 22.541 41.801 1.00 0.00 H new ATOM 0 HB2 SER A 87 -10.964 20.855 39.786 1.00 0.00 H new ATOM 0 HB3 SER A 87 -12.402 20.325 40.635 1.00 0.00 H new ATOM 0 HG SER A 87 -12.147 22.319 38.612 1.00 0.00 H new ATOM 563 N LEU A 88 -11.603 20.830 43.414 1.00 0.00 N ATOM 564 CA LEU A 88 -11.012 20.088 44.522 1.00 0.00 C ATOM 565 C LEU A 88 -11.618 18.691 44.613 1.00 0.00 C ATOM 566 O LEU A 88 -12.745 18.462 44.175 1.00 0.00 O ATOM 567 CB LEU A 88 -11.248 20.834 45.836 1.00 0.00 C ATOM 568 CG LEU A 88 -10.125 20.502 46.820 1.00 0.00 C ATOM 569 CD1 LEU A 88 -8.828 21.180 46.367 1.00 0.00 C ATOM 570 CD2 LEU A 88 -10.505 21.004 48.215 1.00 0.00 C ATOM 0 H LEU A 88 -12.623 20.814 43.388 1.00 0.00 H new ATOM 0 HA LEU A 88 -9.940 19.998 44.344 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -11.282 21.908 45.655 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -12.212 20.551 46.259 1.00 0.00 H new ATOM 0 HG LEU A 88 -9.976 19.423 46.850 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -8.029 20.942 47.069 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -8.557 20.821 45.374 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -8.974 22.260 46.335 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -9.705 20.768 48.917 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -10.655 22.083 48.185 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -11.426 20.519 48.538 1.00 0.00 H new ATOM 582 N HIS A 89 -10.861 17.759 45.185 1.00 0.00 N ATOM 583 CA HIS A 89 -11.331 16.385 45.328 1.00 0.00 C ATOM 584 C HIS A 89 -11.290 15.958 46.794 1.00 0.00 C ATOM 585 O HIS A 89 -10.233 15.965 47.424 1.00 0.00 O ATOM 586 CB HIS A 89 -10.458 15.450 44.481 1.00 0.00 C ATOM 587 CG HIS A 89 -10.347 14.101 45.141 1.00 0.00 C ATOM 588 ND1 HIS A 89 -11.417 13.223 45.219 1.00 0.00 N ATOM 589 CD2 HIS A 89 -9.296 13.464 45.753 1.00 0.00 C ATOM 590 CE1 HIS A 89 -10.990 12.118 45.857 1.00 0.00 C ATOM 591 NE2 HIS A 89 -9.705 12.213 46.205 1.00 0.00 N ATOM 0 H HIS A 89 -9.926 17.928 45.555 1.00 0.00 H new ATOM 0 HA HIS A 89 -12.362 16.326 44.980 1.00 0.00 H new ATOM 0 HB2 HIS A 89 -10.889 15.341 43.486 1.00 0.00 H new ATOM 0 HB3 HIS A 89 -9.466 15.883 44.354 1.00 0.00 H new ATOM 0 HD2 HIS A 89 -8.302 13.872 45.866 1.00 0.00 H new ATOM 0 HE1 HIS A 89 -11.611 11.259 46.062 1.00 0.00 H new ATOM 0 HE2 HIS A 89 -9.143 11.518 46.697 1.00 0.00 H new ATOM 600 N ILE A 90 -12.450 15.588 47.328 1.00 0.00 N ATOM 601 CA ILE A 90 -12.539 15.160 48.718 1.00 0.00 C ATOM 602 C ILE A 90 -13.305 13.845 48.826 1.00 0.00 C ATOM 603 O ILE A 90 -14.380 13.692 48.247 1.00 0.00 O ATOM 604 CB ILE A 90 -13.247 16.232 49.548 1.00 0.00 C ATOM 605 CG1 ILE A 90 -12.303 17.419 49.755 1.00 0.00 C ATOM 606 CG2 ILE A 90 -13.641 15.653 50.906 1.00 0.00 C ATOM 607 CD1 ILE A 90 -13.119 18.711 49.822 1.00 0.00 C ATOM 0 H ILE A 90 -13.336 15.576 46.822 1.00 0.00 H new ATOM 0 HA ILE A 90 -11.528 15.012 49.099 1.00 0.00 H new ATOM 0 HB ILE A 90 -14.143 16.564 49.023 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -11.732 17.288 50.674 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -11.583 17.472 48.938 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -14.145 16.419 51.496 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -14.312 14.807 50.760 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -12.747 15.320 51.433 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -12.448 19.558 49.969 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -13.670 18.842 48.891 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -13.821 18.655 50.654 1.00 0.00 H new ATOM 619 N THR A 91 -12.744 12.898 49.571 1.00 0.00 N ATOM 620 CA THR A 91 -13.385 11.600 49.747 1.00 0.00 C ATOM 621 C THR A 91 -14.010 11.495 51.133 1.00 0.00 C ATOM 622 O THR A 91 -13.340 11.707 52.145 1.00 0.00 O ATOM 623 CB THR A 91 -12.362 10.480 49.560 1.00 0.00 C ATOM 624 OG1 THR A 91 -12.826 9.303 50.209 1.00 0.00 O ATOM 625 CG2 THR A 91 -11.021 10.903 50.166 1.00 0.00 C ATOM 0 H THR A 91 -11.854 13.003 50.059 1.00 0.00 H new ATOM 0 HA THR A 91 -14.171 11.501 48.998 1.00 0.00 H new ATOM 0 HB THR A 91 -12.231 10.282 48.496 1.00 0.00 H new ATOM 0 HG1 THR A 91 -12.172 8.583 50.089 1.00 0.00 H new ATOM 0 HG21 THR A 91 -10.293 10.103 50.032 1.00 0.00 H new ATOM 0 HG22 THR A 91 -10.665 11.805 49.668 1.00 0.00 H new ATOM 0 HG23 THR A 91 -11.149 11.102 51.230 1.00 0.00 H new ATOM 633 N THR A 92 -15.296 11.167 51.173 1.00 0.00 N ATOM 634 CA THR A 92 -16.002 11.036 52.441 1.00 0.00 C ATOM 635 C THR A 92 -16.765 9.717 52.496 1.00 0.00 C ATOM 636 O THR A 92 -17.100 9.140 51.463 1.00 0.00 O ATOM 637 CB THR A 92 -16.977 12.203 52.619 1.00 0.00 C ATOM 638 OG1 THR A 92 -17.121 12.888 51.383 1.00 0.00 O ATOM 639 CG2 THR A 92 -16.440 13.167 53.679 1.00 0.00 C ATOM 0 H THR A 92 -15.868 10.988 50.348 1.00 0.00 H new ATOM 0 HA THR A 92 -15.269 11.051 53.247 1.00 0.00 H new ATOM 0 HB THR A 92 -17.946 11.820 52.940 1.00 0.00 H new ATOM 0 HG1 THR A 92 -16.696 13.769 51.446 1.00 0.00 H new ATOM 0 HG21 THR A 92 -17.137 13.996 53.803 1.00 0.00 H new ATOM 0 HG22 THR A 92 -16.330 12.641 54.627 1.00 0.00 H new ATOM 0 HG23 THR A 92 -15.470 13.552 53.363 1.00 0.00 H new ATOM 647 N ASN A 93 -17.036 9.247 53.709 1.00 0.00 N ATOM 648 CA ASN A 93 -17.760 7.992 53.884 1.00 0.00 C ATOM 649 C ASN A 93 -18.732 7.771 52.729 1.00 0.00 C ATOM 650 O ASN A 93 -19.628 8.582 52.496 1.00 0.00 O ATOM 651 CB ASN A 93 -18.530 8.015 55.207 1.00 0.00 C ATOM 652 CG ASN A 93 -18.906 9.446 55.567 1.00 0.00 C ATOM 653 OD1 ASN A 93 -18.737 10.356 54.755 1.00 0.00 O ATOM 654 ND2 ASN A 93 -19.409 9.703 56.744 1.00 0.00 N ATOM 0 H ASN A 93 -16.769 9.710 54.578 1.00 0.00 H new ATOM 0 HA ASN A 93 -17.039 7.175 53.898 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -19.429 7.404 55.125 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -17.921 7.580 55.999 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -19.663 10.659 56.992 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -19.548 8.948 57.415 1.00 0.00 H new ATOM 661 N ASP A 94 -18.544 6.671 52.007 1.00 0.00 N ATOM 662 CA ASP A 94 -19.411 6.357 50.876 1.00 0.00 C ATOM 663 C ASP A 94 -20.868 6.635 51.225 1.00 0.00 C ATOM 664 O ASP A 94 -21.567 5.772 51.758 1.00 0.00 O ATOM 665 CB ASP A 94 -19.248 4.886 50.486 1.00 0.00 C ATOM 666 CG ASP A 94 -19.288 4.741 48.969 1.00 0.00 C ATOM 667 OD1 ASP A 94 -20.077 5.434 48.348 1.00 0.00 O ATOM 668 OD2 ASP A 94 -18.527 3.941 48.450 1.00 0.00 O ATOM 0 H ASP A 94 -17.807 5.988 52.182 1.00 0.00 H new ATOM 0 HA ASP A 94 -19.124 6.989 50.036 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -18.304 4.502 50.871 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -20.042 4.291 50.937 1.00 0.00 H new ATOM 673 N ALA A 95 -21.322 7.845 50.920 1.00 0.00 N ATOM 674 CA ALA A 95 -22.699 8.232 51.204 1.00 0.00 C ATOM 675 C ALA A 95 -22.988 9.620 50.645 1.00 0.00 C ATOM 676 O ALA A 95 -22.168 10.191 49.925 1.00 0.00 O ATOM 677 CB ALA A 95 -22.942 8.226 52.716 1.00 0.00 C ATOM 0 H ALA A 95 -20.760 8.572 50.478 1.00 0.00 H new ATOM 0 HA ALA A 95 -23.366 7.514 50.727 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -23.973 8.516 52.920 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -22.762 7.226 53.109 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -22.265 8.932 53.196 1.00 0.00 H new ATOM 683 N ALA A 96 -24.154 10.159 50.979 1.00 0.00 N ATOM 684 CA ALA A 96 -24.534 11.482 50.500 1.00 0.00 C ATOM 685 C ALA A 96 -23.710 12.559 51.199 1.00 0.00 C ATOM 686 O ALA A 96 -23.846 12.774 52.402 1.00 0.00 O ATOM 687 CB ALA A 96 -26.023 11.722 50.755 1.00 0.00 C ATOM 0 H ALA A 96 -24.847 9.705 51.574 1.00 0.00 H new ATOM 0 HA ALA A 96 -24.340 11.532 49.429 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -26.299 12.713 50.394 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -26.608 10.968 50.229 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -26.224 11.656 51.824 1.00 0.00 H new ATOM 693 N VAL A 97 -22.861 13.234 50.432 1.00 0.00 N ATOM 694 CA VAL A 97 -22.021 14.290 50.983 1.00 0.00 C ATOM 695 C VAL A 97 -22.524 15.655 50.526 1.00 0.00 C ATOM 696 O VAL A 97 -23.133 15.777 49.463 1.00 0.00 O ATOM 697 CB VAL A 97 -20.573 14.096 50.530 1.00 0.00 C ATOM 698 CG1 VAL A 97 -19.660 15.034 51.322 1.00 0.00 C ATOM 699 CG2 VAL A 97 -20.152 12.645 50.778 1.00 0.00 C ATOM 0 H VAL A 97 -22.737 13.070 49.433 1.00 0.00 H new ATOM 0 HA VAL A 97 -22.066 14.241 52.071 1.00 0.00 H new ATOM 0 HB VAL A 97 -20.491 14.322 49.467 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -18.628 14.896 50.999 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -19.960 16.067 51.147 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -19.741 14.808 52.385 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -19.120 12.505 50.456 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -20.234 12.419 51.841 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -20.802 11.976 50.214 1.00 0.00 H new ATOM 709 N MET A 98 -22.271 16.679 51.333 1.00 0.00 N ATOM 710 CA MET A 98 -22.713 18.026 50.994 1.00 0.00 C ATOM 711 C MET A 98 -21.746 19.073 51.540 1.00 0.00 C ATOM 712 O MET A 98 -21.283 18.973 52.675 1.00 0.00 O ATOM 713 CB MET A 98 -24.110 18.275 51.563 1.00 0.00 C ATOM 714 CG MET A 98 -24.607 19.652 51.120 1.00 0.00 C ATOM 715 SD MET A 98 -26.348 19.541 50.643 1.00 0.00 S ATOM 716 CE MET A 98 -26.371 20.964 49.525 1.00 0.00 C ATOM 0 H MET A 98 -21.768 16.604 52.217 1.00 0.00 H new ATOM 0 HA MET A 98 -22.739 18.111 49.908 1.00 0.00 H new ATOM 0 HB2 MET A 98 -24.797 17.502 51.219 1.00 0.00 H new ATOM 0 HB3 MET A 98 -24.086 18.219 52.651 1.00 0.00 H new ATOM 0 HG2 MET A 98 -24.486 20.372 51.930 1.00 0.00 H new ATOM 0 HG3 MET A 98 -24.012 20.013 50.281 1.00 0.00 H new ATOM 0 HE1 MET A 98 -27.371 21.083 49.108 1.00 0.00 H new ATOM 0 HE2 MET A 98 -26.098 21.864 50.076 1.00 0.00 H new ATOM 0 HE3 MET A 98 -25.658 20.803 48.717 1.00 0.00 H new ATOM 726 N GLY A 99 -21.454 20.078 50.721 1.00 0.00 N ATOM 727 CA GLY A 99 -20.547 21.147 51.126 1.00 0.00 C ATOM 728 C GLY A 99 -21.222 22.506 50.977 1.00 0.00 C ATOM 729 O GLY A 99 -22.170 22.657 50.207 1.00 0.00 O ATOM 0 H GLY A 99 -21.830 20.175 49.778 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -20.240 20.999 52.161 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -19.643 21.115 50.518 1.00 0.00 H new ATOM 733 N ASN A 100 -20.733 23.494 51.721 1.00 0.00 N ATOM 734 CA ASN A 100 -21.305 24.834 51.661 1.00 0.00 C ATOM 735 C ASN A 100 -20.267 25.845 51.185 1.00 0.00 C ATOM 736 O ASN A 100 -19.265 26.086 51.860 1.00 0.00 O ATOM 737 CB ASN A 100 -21.824 25.242 53.041 1.00 0.00 C ATOM 738 CG ASN A 100 -23.040 26.150 52.891 1.00 0.00 C ATOM 739 OD1 ASN A 100 -24.113 25.692 52.500 1.00 0.00 O ATOM 740 ND2 ASN A 100 -22.935 27.417 53.180 1.00 0.00 N ATOM 0 H ASN A 100 -19.950 23.393 52.366 1.00 0.00 H new ATOM 0 HA ASN A 100 -22.131 24.822 50.950 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -22.090 24.355 53.616 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -21.040 25.758 53.596 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -23.744 28.031 53.082 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -22.044 27.794 53.504 1.00 0.00 H new ATOM 747 N ILE A 101 -20.513 26.434 50.021 1.00 0.00 N ATOM 748 CA ILE A 101 -19.596 27.420 49.462 1.00 0.00 C ATOM 749 C ILE A 101 -20.346 28.690 49.071 1.00 0.00 C ATOM 750 O ILE A 101 -21.460 28.627 48.549 1.00 0.00 O ATOM 751 CB ILE A 101 -18.891 26.840 48.233 1.00 0.00 C ATOM 752 CG1 ILE A 101 -18.385 27.985 47.351 1.00 0.00 C ATOM 753 CG2 ILE A 101 -19.873 25.980 47.437 1.00 0.00 C ATOM 754 CD1 ILE A 101 -17.218 27.490 46.494 1.00 0.00 C ATOM 0 H ILE A 101 -21.336 26.247 49.448 1.00 0.00 H new ATOM 0 HA ILE A 101 -18.855 27.670 50.221 1.00 0.00 H new ATOM 0 HB ILE A 101 -18.050 26.225 48.553 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -19.190 28.350 46.713 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -18.065 28.822 47.971 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -19.370 25.568 46.562 1.00 0.00 H new ATOM 0 HG22 ILE A 101 -20.235 25.166 48.065 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -20.715 26.593 47.116 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -16.857 28.304 45.866 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -16.411 27.146 47.141 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -17.553 26.666 45.864 1.00 0.00 H new ATOM 766 N VAL A 102 -19.730 29.840 49.325 1.00 0.00 N ATOM 767 CA VAL A 102 -20.352 31.119 48.995 1.00 0.00 C ATOM 768 C VAL A 102 -19.405 31.972 48.154 1.00 0.00 C ATOM 769 O VAL A 102 -18.187 31.900 48.309 1.00 0.00 O ATOM 770 CB VAL A 102 -20.716 31.867 50.277 1.00 0.00 C ATOM 771 CG1 VAL A 102 -21.317 33.228 49.921 1.00 0.00 C ATOM 772 CG2 VAL A 102 -21.740 31.050 51.068 1.00 0.00 C ATOM 0 H VAL A 102 -18.808 29.914 49.755 1.00 0.00 H new ATOM 0 HA VAL A 102 -21.257 30.926 48.419 1.00 0.00 H new ATOM 0 HB VAL A 102 -19.820 32.012 50.880 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -21.577 33.761 50.835 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -20.590 33.810 49.355 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -22.214 33.083 49.318 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -22.001 31.582 51.983 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -22.636 30.906 50.464 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -21.314 30.079 51.321 1.00 0.00 H new ATOM 782 N ALA A 103 -19.975 32.776 47.263 1.00 0.00 N ATOM 783 CA ALA A 103 -19.170 33.638 46.404 1.00 0.00 C ATOM 784 C ALA A 103 -19.817 35.011 46.258 1.00 0.00 C ATOM 785 O ALA A 103 -21.037 35.125 46.142 1.00 0.00 O ATOM 786 CB ALA A 103 -19.015 32.998 45.023 1.00 0.00 C ATOM 0 H ALA A 103 -20.982 32.849 47.117 1.00 0.00 H new ATOM 0 HA ALA A 103 -18.189 33.760 46.863 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -18.413 33.647 44.387 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -18.523 32.030 45.123 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -19.998 32.860 44.573 1.00 0.00 H new ATOM 792 N GLN A 104 -18.990 36.051 46.265 1.00 0.00 N ATOM 793 CA GLN A 104 -19.490 37.413 46.132 1.00 0.00 C ATOM 794 C GLN A 104 -18.582 38.231 45.219 1.00 0.00 C ATOM 795 O GLN A 104 -17.758 39.016 45.689 1.00 0.00 O ATOM 796 CB GLN A 104 -19.564 38.079 47.507 1.00 0.00 C ATOM 797 CG GLN A 104 -20.302 39.415 47.390 1.00 0.00 C ATOM 798 CD GLN A 104 -20.915 39.791 48.734 1.00 0.00 C ATOM 799 OE1 GLN A 104 -22.098 39.547 48.968 1.00 0.00 O ATOM 800 NE2 GLN A 104 -20.174 40.376 49.636 1.00 0.00 N ATOM 0 H GLN A 104 -17.977 35.977 46.361 1.00 0.00 H new ATOM 0 HA GLN A 104 -20.487 37.372 45.693 1.00 0.00 H new ATOM 0 HB2 GLN A 104 -20.081 37.427 48.211 1.00 0.00 H new ATOM 0 HB3 GLN A 104 -18.560 38.240 47.899 1.00 0.00 H new ATOM 0 HG2 GLN A 104 -19.612 40.194 47.065 1.00 0.00 H new ATOM 0 HG3 GLN A 104 -21.082 39.344 46.632 1.00 0.00 H new ATOM 0 HE21 GLN A 104 -19.194 40.577 49.439 1.00 0.00 H new ATOM 0 HE22 GLN A 104 -20.576 40.632 50.538 1.00 0.00 H new ATOM 809 N GLY A 105 -18.735 38.038 43.913 1.00 0.00 N ATOM 810 CA GLY A 105 -17.922 38.761 42.943 1.00 0.00 C ATOM 811 C GLY A 105 -18.790 39.365 41.847 1.00 0.00 C ATOM 812 O GLY A 105 -19.949 38.984 41.679 1.00 0.00 O ATOM 0 H GLY A 105 -19.410 37.391 43.504 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -17.364 39.550 43.447 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -17.190 38.085 42.501 1.00 0.00 H new ATOM 816 N ASN A 106 -18.224 40.309 41.105 1.00 0.00 N ATOM 817 CA ASN A 106 -18.957 40.961 40.026 1.00 0.00 C ATOM 818 C ASN A 106 -18.996 40.067 38.791 1.00 0.00 C ATOM 819 O ASN A 106 -18.645 40.495 37.692 1.00 0.00 O ATOM 820 CB ASN A 106 -18.291 42.293 39.674 1.00 0.00 C ATOM 821 CG ASN A 106 -16.790 42.092 39.496 1.00 0.00 C ATOM 822 OD1 ASN A 106 -16.022 42.264 40.442 1.00 0.00 O ATOM 823 ND2 ASN A 106 -16.324 41.736 38.330 1.00 0.00 N ATOM 0 H ASN A 106 -17.267 40.639 41.229 1.00 0.00 H new ATOM 0 HA ASN A 106 -19.978 41.143 40.362 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -18.724 42.695 38.758 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -18.478 43.022 40.462 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -15.321 41.600 38.201 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -16.962 41.594 37.547 1.00 0.00 H new ATOM 830 N SER A 107 -19.425 38.825 38.984 1.00 0.00 N ATOM 831 CA SER A 107 -19.508 37.874 37.881 1.00 0.00 C ATOM 832 C SER A 107 -20.944 37.758 37.381 1.00 0.00 C ATOM 833 O SER A 107 -21.860 38.344 37.956 1.00 0.00 O ATOM 834 CB SER A 107 -19.014 36.501 38.339 1.00 0.00 C ATOM 835 OG SER A 107 -17.647 36.595 38.715 1.00 0.00 O ATOM 0 H SER A 107 -19.719 38.454 39.888 1.00 0.00 H new ATOM 0 HA SER A 107 -18.879 38.234 37.067 1.00 0.00 H new ATOM 0 HB2 SER A 107 -19.611 36.149 39.180 1.00 0.00 H new ATOM 0 HB3 SER A 107 -19.133 35.773 37.537 1.00 0.00 H new ATOM 0 HG SER A 107 -17.328 35.717 39.011 1.00 0.00 H new ATOM 841 N ASP A 108 -21.132 36.996 36.308 1.00 0.00 N ATOM 842 CA ASP A 108 -22.464 36.809 35.743 1.00 0.00 C ATOM 843 C ASP A 108 -23.005 35.427 36.096 1.00 0.00 C ATOM 844 O ASP A 108 -22.331 34.417 35.892 1.00 0.00 O ATOM 845 CB ASP A 108 -22.418 36.969 34.223 1.00 0.00 C ATOM 846 CG ASP A 108 -23.710 36.452 33.604 1.00 0.00 C ATOM 847 OD1 ASP A 108 -24.676 37.199 33.585 1.00 0.00 O ATOM 848 OD2 ASP A 108 -23.717 35.317 33.157 1.00 0.00 O ATOM 0 H ASP A 108 -20.387 36.502 35.816 1.00 0.00 H new ATOM 0 HA ASP A 108 -23.125 37.566 36.165 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -22.276 38.018 33.964 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -21.567 36.422 33.817 1.00 0.00 H new ATOM 853 N SER A 109 -24.218 35.396 36.639 1.00 0.00 N ATOM 854 CA SER A 109 -24.820 34.115 37.001 1.00 0.00 C ATOM 855 C SER A 109 -23.817 33.223 37.695 1.00 0.00 C ATOM 856 O SER A 109 -23.081 32.491 37.016 1.00 0.00 O ATOM 857 CB SER A 109 -25.435 33.423 35.759 1.00 0.00 C ATOM 858 OG SER A 109 -26.020 32.153 36.061 1.00 0.00 O ATOM 0 H SER A 109 -24.791 36.217 36.834 1.00 0.00 H new ATOM 0 HA SER A 109 -25.630 34.306 37.705 1.00 0.00 H new ATOM 0 HB2 SER A 109 -26.195 34.074 35.326 1.00 0.00 H new ATOM 0 HB3 SER A 109 -24.661 33.290 35.003 1.00 0.00 H new ATOM 0 HG SER A 109 -26.394 31.762 35.244 1.00 0.00 H new ATOM 864 N ILE A 110 -23.784 33.255 39.011 1.00 0.00 N ATOM 865 CA ILE A 110 -22.851 32.430 39.767 1.00 0.00 C ATOM 866 C ILE A 110 -23.600 31.567 40.777 1.00 0.00 C ATOM 867 O ILE A 110 -24.393 32.071 41.570 1.00 0.00 O ATOM 868 CB ILE A 110 -21.845 33.320 40.498 1.00 0.00 C ATOM 869 CG1 ILE A 110 -20.643 32.477 40.939 1.00 0.00 C ATOM 870 CG2 ILE A 110 -22.507 33.939 41.729 1.00 0.00 C ATOM 871 CD1 ILE A 110 -19.488 33.402 41.329 1.00 0.00 C ATOM 0 H ILE A 110 -24.391 33.842 39.584 1.00 0.00 H new ATOM 0 HA ILE A 110 -22.321 31.779 39.072 1.00 0.00 H new ATOM 0 HB ILE A 110 -21.511 34.112 39.828 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -20.918 31.845 41.783 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -20.335 31.813 40.131 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -21.788 34.573 42.249 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -23.363 34.539 41.419 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -22.843 33.147 42.398 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -18.633 32.804 41.643 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -19.207 34.015 40.472 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -19.800 34.047 42.150 1.00 0.00 H new ATOM 883 N GLY A 111 -23.348 30.262 40.737 1.00 0.00 N ATOM 884 CA GLY A 111 -24.011 29.340 41.651 1.00 0.00 C ATOM 885 C GLY A 111 -23.100 28.172 42.012 1.00 0.00 C ATOM 886 O GLY A 111 -22.022 28.011 41.438 1.00 0.00 O ATOM 0 H GLY A 111 -22.696 29.823 40.088 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -24.304 29.870 42.557 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -24.925 28.963 41.192 1.00 0.00 H new ATOM 890 N CYS A 112 -23.544 27.359 42.965 1.00 0.00 N ATOM 891 CA CYS A 112 -22.767 26.205 43.398 1.00 0.00 C ATOM 892 C CYS A 112 -23.546 24.919 43.140 1.00 0.00 C ATOM 893 O CYS A 112 -24.759 24.950 42.934 1.00 0.00 O ATOM 894 CB CYS A 112 -22.448 26.321 44.891 1.00 0.00 C ATOM 895 SG CYS A 112 -22.244 24.667 45.596 1.00 0.00 S ATOM 0 H CYS A 112 -24.434 27.478 43.450 1.00 0.00 H new ATOM 0 HA CYS A 112 -21.836 26.177 42.831 1.00 0.00 H new ATOM 0 HB2 CYS A 112 -21.538 26.904 45.035 1.00 0.00 H new ATOM 0 HB3 CYS A 112 -23.250 26.850 45.405 1.00 0.00 H new ATOM 0 HG CYS A 112 -22.394 24.724 46.886 1.00 0.00 H new ATOM 901 N ARG A 113 -22.847 23.789 43.147 1.00 0.00 N ATOM 902 CA ARG A 113 -23.499 22.506 42.909 1.00 0.00 C ATOM 903 C ARG A 113 -22.661 21.359 43.464 1.00 0.00 C ATOM 904 O ARG A 113 -21.431 21.389 43.408 1.00 0.00 O ATOM 905 CB ARG A 113 -23.713 22.302 41.408 1.00 0.00 C ATOM 906 CG ARG A 113 -22.465 22.754 40.644 1.00 0.00 C ATOM 907 CD ARG A 113 -22.785 24.012 39.835 1.00 0.00 C ATOM 908 NE ARG A 113 -23.660 23.682 38.716 1.00 0.00 N ATOM 909 CZ ARG A 113 -23.180 23.127 37.608 1.00 0.00 C ATOM 910 NH1 ARG A 113 -21.904 22.872 37.506 1.00 0.00 N ATOM 911 NH2 ARG A 113 -23.984 22.835 36.622 1.00 0.00 N ATOM 0 H ARG A 113 -21.842 23.734 43.313 1.00 0.00 H new ATOM 0 HA ARG A 113 -24.462 22.513 43.420 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -23.919 21.252 41.199 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -24.581 22.870 41.074 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -21.652 22.955 41.342 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -22.125 21.959 39.980 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -23.265 24.753 40.475 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -21.863 24.460 39.465 1.00 0.00 H new ATOM 0 HE ARG A 113 -24.658 23.881 38.785 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -21.275 23.099 38.277 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -21.535 22.446 36.656 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -24.981 23.033 36.702 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -23.615 22.409 35.772 1.00 0.00 H new ATOM 925 N ILE A 114 -23.338 20.344 43.995 1.00 0.00 N ATOM 926 CA ILE A 114 -22.650 19.186 44.554 1.00 0.00 C ATOM 927 C ILE A 114 -23.042 17.921 43.797 1.00 0.00 C ATOM 928 O ILE A 114 -24.225 17.604 43.672 1.00 0.00 O ATOM 929 CB ILE A 114 -23.008 19.022 46.032 1.00 0.00 C ATOM 930 CG1 ILE A 114 -22.185 20.006 46.872 1.00 0.00 C ATOM 931 CG2 ILE A 114 -22.693 17.592 46.475 1.00 0.00 C ATOM 932 CD1 ILE A 114 -22.743 21.422 46.706 1.00 0.00 C ATOM 0 H ILE A 114 -24.356 20.300 44.049 1.00 0.00 H new ATOM 0 HA ILE A 114 -21.576 19.345 44.457 1.00 0.00 H new ATOM 0 HB ILE A 114 -24.070 19.224 46.172 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -22.214 19.715 47.922 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -21.140 19.978 46.562 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -22.947 17.473 47.528 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -23.276 16.890 45.879 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -21.631 17.393 46.334 1.00 0.00 H new ATOM 0 HD11 ILE A 114 -22.155 22.117 47.305 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -22.691 21.713 45.657 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -23.781 21.445 47.038 1.00 0.00 H new ATOM 944 N THR A 115 -22.044 17.205 43.289 1.00 0.00 N ATOM 945 CA THR A 115 -22.303 15.979 42.545 1.00 0.00 C ATOM 946 C THR A 115 -21.850 14.759 43.339 1.00 0.00 C ATOM 947 O THR A 115 -20.708 14.689 43.794 1.00 0.00 O ATOM 948 CB THR A 115 -21.568 16.020 41.203 1.00 0.00 C ATOM 949 OG1 THR A 115 -20.438 16.875 41.311 1.00 0.00 O ATOM 950 CG2 THR A 115 -22.508 16.547 40.118 1.00 0.00 C ATOM 0 H THR A 115 -21.058 17.450 43.378 1.00 0.00 H new ATOM 0 HA THR A 115 -23.376 15.903 42.371 1.00 0.00 H new ATOM 0 HB THR A 115 -21.240 15.015 40.937 1.00 0.00 H new ATOM 0 HG1 THR A 115 -19.965 16.902 40.453 1.00 0.00 H new ATOM 0 HG21 THR A 115 -21.982 16.575 39.164 1.00 0.00 H new ATOM 0 HG22 THR A 115 -23.374 15.890 40.036 1.00 0.00 H new ATOM 0 HG23 THR A 115 -22.839 17.552 40.380 1.00 0.00 H new ATOM 958 N VAL A 116 -22.752 13.795 43.498 1.00 0.00 N ATOM 959 CA VAL A 116 -22.436 12.578 44.236 1.00 0.00 C ATOM 960 C VAL A 116 -23.081 11.366 43.568 1.00 0.00 C ATOM 961 O VAL A 116 -24.240 11.415 43.155 1.00 0.00 O ATOM 962 CB VAL A 116 -22.933 12.695 45.678 1.00 0.00 C ATOM 963 CG1 VAL A 116 -24.441 12.952 45.683 1.00 0.00 C ATOM 964 CG2 VAL A 116 -22.637 11.391 46.424 1.00 0.00 C ATOM 0 H VAL A 116 -23.702 13.833 43.128 1.00 0.00 H new ATOM 0 HA VAL A 116 -21.354 12.446 44.237 1.00 0.00 H new ATOM 0 HB VAL A 116 -22.424 13.523 46.171 1.00 0.00 H new ATOM 0 HG11 VAL A 116 -24.793 13.035 46.711 1.00 0.00 H new ATOM 0 HG12 VAL A 116 -24.654 13.879 45.151 1.00 0.00 H new ATOM 0 HG13 VAL A 116 -24.953 12.125 45.190 1.00 0.00 H new ATOM 0 HG21 VAL A 116 -22.990 11.472 47.452 1.00 0.00 H new ATOM 0 HG22 VAL A 116 -23.147 10.565 45.929 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -21.563 11.207 46.423 1.00 0.00 H new ATOM 974 N ASP A 117 -22.320 10.283 43.463 1.00 0.00 N ATOM 975 CA ASP A 117 -22.827 9.063 42.842 1.00 0.00 C ATOM 976 C ASP A 117 -23.105 9.295 41.361 1.00 0.00 C ATOM 977 O ASP A 117 -23.699 8.449 40.690 1.00 0.00 O ATOM 978 CB ASP A 117 -24.112 8.614 43.540 1.00 0.00 C ATOM 979 CG ASP A 117 -24.503 7.219 43.066 1.00 0.00 C ATOM 980 OD1 ASP A 117 -23.859 6.723 42.157 1.00 0.00 O ATOM 981 OD2 ASP A 117 -25.439 6.667 43.620 1.00 0.00 O ATOM 0 H ASP A 117 -21.358 10.223 43.796 1.00 0.00 H new ATOM 0 HA ASP A 117 -22.070 8.285 42.943 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -23.967 8.613 44.620 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -24.916 9.318 43.327 1.00 0.00 H new ATOM 986 N GLY A 118 -22.673 10.446 40.855 1.00 0.00 N ATOM 987 CA GLY A 118 -22.880 10.777 39.449 1.00 0.00 C ATOM 988 C GLY A 118 -24.304 11.266 39.206 1.00 0.00 C ATOM 989 O GLY A 118 -24.640 11.698 38.103 1.00 0.00 O ATOM 0 H GLY A 118 -22.181 11.160 41.392 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -22.171 11.547 39.145 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -22.683 9.900 38.832 1.00 0.00 H new ATOM 993 N LYS A 119 -25.134 11.196 40.240 1.00 0.00 N ATOM 994 CA LYS A 119 -26.520 11.636 40.125 1.00 0.00 C ATOM 995 C LYS A 119 -26.695 13.022 40.737 1.00 0.00 C ATOM 996 O LYS A 119 -26.132 13.322 41.788 1.00 0.00 O ATOM 997 CB LYS A 119 -27.443 10.641 40.831 1.00 0.00 C ATOM 998 CG LYS A 119 -27.729 9.459 39.904 1.00 0.00 C ATOM 999 CD LYS A 119 -28.729 8.513 40.573 1.00 0.00 C ATOM 1000 CE LYS A 119 -28.025 7.719 41.673 1.00 0.00 C ATOM 1001 NZ LYS A 119 -28.907 6.606 42.124 1.00 0.00 N ATOM 0 H LYS A 119 -24.875 10.842 41.161 1.00 0.00 H new ATOM 0 HA LYS A 119 -26.781 11.685 39.068 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -26.979 10.289 41.752 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -28.376 11.130 41.111 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -28.130 9.816 38.955 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -26.804 8.928 39.680 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -29.558 9.082 40.995 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -29.153 7.833 39.834 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -27.081 7.321 41.302 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -27.788 8.372 42.513 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -28.428 6.065 42.873 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -29.797 6.997 42.494 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -29.112 5.978 41.321 1.00 0.00 H new ATOM 1015 N VAL A 120 -27.482 13.862 40.070 1.00 0.00 N ATOM 1016 CA VAL A 120 -27.725 15.214 40.557 1.00 0.00 C ATOM 1017 C VAL A 120 -28.746 15.201 41.689 1.00 0.00 C ATOM 1018 O VAL A 120 -29.705 14.429 41.664 1.00 0.00 O ATOM 1019 CB VAL A 120 -28.237 16.091 39.413 1.00 0.00 C ATOM 1020 CG1 VAL A 120 -27.063 16.524 38.532 1.00 0.00 C ATOM 1021 CG2 VAL A 120 -29.239 15.295 38.572 1.00 0.00 C ATOM 0 H VAL A 120 -27.958 13.632 39.198 1.00 0.00 H new ATOM 0 HA VAL A 120 -26.788 15.620 40.937 1.00 0.00 H new ATOM 0 HB VAL A 120 -28.725 16.975 39.824 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -27.430 17.149 37.718 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -26.349 17.090 39.130 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -26.573 15.642 38.120 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -29.605 15.918 37.756 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -28.749 14.412 38.162 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -30.077 14.988 39.198 1.00 0.00 H new ATOM 1031 N ARG A 121 -28.534 16.059 42.682 1.00 0.00 N ATOM 1032 CA ARG A 121 -29.442 16.138 43.820 1.00 0.00 C ATOM 1033 C ARG A 121 -29.146 17.379 44.657 1.00 0.00 C ATOM 1034 O ARG A 121 -29.457 17.424 45.848 1.00 0.00 O ATOM 1035 CB ARG A 121 -29.299 14.886 44.691 1.00 0.00 C ATOM 1036 CG ARG A 121 -30.672 14.242 44.900 1.00 0.00 C ATOM 1037 CD ARG A 121 -30.539 13.051 45.851 1.00 0.00 C ATOM 1038 NE ARG A 121 -31.858 12.533 46.198 1.00 0.00 N ATOM 1039 CZ ARG A 121 -32.061 11.233 46.383 1.00 0.00 C ATOM 1040 NH1 ARG A 121 -31.070 10.392 46.262 1.00 0.00 N ATOM 1041 NH2 ARG A 121 -33.252 10.795 46.688 1.00 0.00 N ATOM 0 H ARG A 121 -27.746 16.706 42.722 1.00 0.00 H new ATOM 0 HA ARG A 121 -30.462 16.203 43.443 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -28.622 14.176 44.215 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -28.860 15.149 45.653 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -31.369 14.972 45.311 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -31.081 13.914 43.944 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -29.944 12.267 45.382 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -30.011 13.355 46.755 1.00 0.00 H new ATOM 0 HE ARG A 121 -32.639 13.181 46.301 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -30.138 10.733 46.025 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -31.227 9.394 46.404 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -34.027 11.451 46.784 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -33.407 9.797 46.830 1.00 0.00 H new ATOM 1055 N ALA A 122 -28.545 18.384 44.028 1.00 0.00 N ATOM 1056 CA ALA A 122 -28.213 19.619 44.726 1.00 0.00 C ATOM 1057 C ALA A 122 -28.839 20.820 44.027 1.00 0.00 C ATOM 1058 O ALA A 122 -29.076 20.794 42.820 1.00 0.00 O ATOM 1059 CB ALA A 122 -26.693 19.795 44.779 1.00 0.00 C ATOM 0 H ALA A 122 -28.280 18.367 43.043 1.00 0.00 H new ATOM 0 HA ALA A 122 -28.610 19.557 45.739 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -26.452 20.720 45.302 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -26.247 18.952 45.308 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -26.296 19.838 43.765 1.00 0.00 H new ATOM 1065 N GLU A 123 -29.102 21.874 44.794 1.00 0.00 N ATOM 1066 CA GLU A 123 -29.698 23.083 44.238 1.00 0.00 C ATOM 1067 C GLU A 123 -28.615 24.113 43.931 1.00 0.00 C ATOM 1068 O GLU A 123 -27.599 24.182 44.624 1.00 0.00 O ATOM 1069 CB GLU A 123 -30.705 23.675 45.226 1.00 0.00 C ATOM 1070 CG GLU A 123 -30.344 23.237 46.647 1.00 0.00 C ATOM 1071 CD GLU A 123 -30.998 24.168 47.661 1.00 0.00 C ATOM 1072 OE1 GLU A 123 -30.775 25.365 47.568 1.00 0.00 O ATOM 1073 OE2 GLU A 123 -31.713 23.673 48.516 1.00 0.00 O ATOM 0 H GLU A 123 -28.913 21.915 45.796 1.00 0.00 H new ATOM 0 HA GLU A 123 -30.213 22.822 43.314 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -30.701 24.763 45.157 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -31.713 23.343 44.977 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -30.675 22.212 46.816 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -29.262 23.248 46.776 1.00 0.00 H new ATOM 1080 N ARG A 124 -28.835 24.909 42.890 1.00 0.00 N ATOM 1081 CA ARG A 124 -27.862 25.927 42.506 1.00 0.00 C ATOM 1082 C ARG A 124 -28.529 27.292 42.380 1.00 0.00 C ATOM 1083 O ARG A 124 -29.605 27.417 41.795 1.00 0.00 O ATOM 1084 CB ARG A 124 -27.215 25.550 41.171 1.00 0.00 C ATOM 1085 CG ARG A 124 -28.267 24.932 40.250 1.00 0.00 C ATOM 1086 CD ARG A 124 -27.738 24.903 38.815 1.00 0.00 C ATOM 1087 NE ARG A 124 -28.845 24.777 37.874 1.00 0.00 N ATOM 1088 CZ ARG A 124 -29.660 25.801 37.632 1.00 0.00 C ATOM 1089 NH1 ARG A 124 -29.472 26.942 38.238 1.00 0.00 N ATOM 1090 NH2 ARG A 124 -30.645 25.665 36.789 1.00 0.00 N ATOM 0 H ARG A 124 -29.668 24.871 42.303 1.00 0.00 H new ATOM 0 HA ARG A 124 -27.098 25.981 43.282 1.00 0.00 H new ATOM 0 HB2 ARG A 124 -26.781 26.433 40.703 1.00 0.00 H new ATOM 0 HB3 ARG A 124 -26.401 24.844 41.336 1.00 0.00 H new ATOM 0 HG2 ARG A 124 -28.506 23.921 40.581 1.00 0.00 H new ATOM 0 HG3 ARG A 124 -29.190 25.509 40.297 1.00 0.00 H new ATOM 0 HD2 ARG A 124 -27.177 25.814 38.608 1.00 0.00 H new ATOM 0 HD3 ARG A 124 -27.048 24.068 38.690 1.00 0.00 H new ATOM 0 HE ARG A 124 -28.997 23.890 37.394 1.00 0.00 H new ATOM 0 HH11 ARG A 124 -28.701 27.049 38.897 1.00 0.00 H new ATOM 0 HH12 ARG A 124 -30.096 27.727 38.053 1.00 0.00 H new ATOM 0 HH21 ARG A 124 -30.791 24.774 36.315 1.00 0.00 H new ATOM 0 HH22 ARG A 124 -31.270 26.450 36.604 1.00 0.00 H new ATOM 1104 N VAL A 125 -27.879 28.313 42.927 1.00 0.00 N ATOM 1105 CA VAL A 125 -28.413 29.668 42.867 1.00 0.00 C ATOM 1106 C VAL A 125 -27.672 30.479 41.808 1.00 0.00 C ATOM 1107 O VAL A 125 -26.445 30.437 41.727 1.00 0.00 O ATOM 1108 CB VAL A 125 -28.270 30.347 44.230 1.00 0.00 C ATOM 1109 CG1 VAL A 125 -29.296 31.476 44.348 1.00 0.00 C ATOM 1110 CG2 VAL A 125 -28.515 29.319 45.337 1.00 0.00 C ATOM 0 H VAL A 125 -26.987 28.229 43.414 1.00 0.00 H new ATOM 0 HA VAL A 125 -29.469 29.617 42.601 1.00 0.00 H new ATOM 0 HB VAL A 125 -27.265 30.758 44.329 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -29.194 31.960 45.319 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -29.125 32.207 43.558 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -30.301 31.066 44.251 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -28.414 29.801 46.310 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -29.520 28.910 45.238 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -27.786 28.513 45.253 1.00 0.00 H new ATOM 1120 N SER A 126 -28.424 31.211 40.991 1.00 0.00 N ATOM 1121 CA SER A 126 -27.821 32.018 39.937 1.00 0.00 C ATOM 1122 C SER A 126 -27.785 33.489 40.332 1.00 0.00 C ATOM 1123 O SER A 126 -28.826 34.122 40.512 1.00 0.00 O ATOM 1124 CB SER A 126 -28.616 31.855 38.641 1.00 0.00 C ATOM 1125 OG SER A 126 -28.649 30.481 38.280 1.00 0.00 O ATOM 0 H SER A 126 -29.442 31.262 41.038 1.00 0.00 H new ATOM 0 HA SER A 126 -26.798 31.674 39.786 1.00 0.00 H new ATOM 0 HB2 SER A 126 -29.630 32.233 38.773 1.00 0.00 H new ATOM 0 HB3 SER A 126 -28.159 32.441 37.844 1.00 0.00 H new ATOM 0 HG SER A 126 -29.159 30.373 37.450 1.00 0.00 H new ATOM 1131 N ASN A 127 -26.577 34.029 40.461 1.00 0.00 N ATOM 1132 CA ASN A 127 -26.409 35.430 40.830 1.00 0.00 C ATOM 1133 C ASN A 127 -25.479 36.133 39.845 1.00 0.00 C ATOM 1134 O ASN A 127 -24.433 35.600 39.476 1.00 0.00 O ATOM 1135 CB ASN A 127 -25.839 35.535 42.247 1.00 0.00 C ATOM 1136 CG ASN A 127 -25.580 34.142 42.812 1.00 0.00 C ATOM 1137 OD1 ASN A 127 -26.493 33.218 42.690 1.00 0.00 O flip ATOM 1138 ND2 ASN A 127 -24.516 33.889 43.380 1.00 0.00 N flip ATOM 0 H ASN A 127 -25.705 33.521 40.316 1.00 0.00 H new ATOM 0 HA ASN A 127 -27.384 35.916 40.799 1.00 0.00 H new ATOM 0 HB2 ASN A 127 -24.912 36.108 42.233 1.00 0.00 H new ATOM 0 HB3 ASN A 127 -26.537 36.073 42.889 1.00 0.00 H new ATOM 0 HD21 ASN A 127 -23.804 34.613 43.474 1.00 0.00 H new ATOM 0 HD22 ASN A 127 -24.348 32.956 43.756 1.00 0.00 H new ATOM 1145 N GLU A 128 -25.871 37.331 39.421 1.00 0.00 N ATOM 1146 CA GLU A 128 -25.065 38.098 38.475 1.00 0.00 C ATOM 1147 C GLU A 128 -24.335 39.234 39.184 1.00 0.00 C ATOM 1148 O GLU A 128 -24.538 39.470 40.375 1.00 0.00 O ATOM 1149 CB GLU A 128 -25.960 38.671 37.375 1.00 0.00 C ATOM 1150 CG GLU A 128 -27.370 38.888 37.926 1.00 0.00 C ATOM 1151 CD GLU A 128 -28.197 37.618 37.762 1.00 0.00 C ATOM 1152 OE1 GLU A 128 -27.784 36.593 38.279 1.00 0.00 O ATOM 1153 OE2 GLU A 128 -29.233 37.688 37.119 1.00 0.00 O ATOM 0 H GLU A 128 -26.734 37.789 39.714 1.00 0.00 H new ATOM 0 HA GLU A 128 -24.325 37.430 38.033 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -25.551 39.614 37.013 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -25.991 37.989 36.525 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -27.319 39.165 38.979 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -27.850 39.714 37.402 1.00 0.00 H new ATOM 1160 N VAL A 129 -23.482 39.933 38.441 1.00 0.00 N ATOM 1161 CA VAL A 129 -22.722 41.044 39.007 1.00 0.00 C ATOM 1162 C VAL A 129 -23.656 42.070 39.642 1.00 0.00 C ATOM 1163 O VAL A 129 -23.209 43.093 40.158 1.00 0.00 O ATOM 1164 CB VAL A 129 -21.892 41.717 37.912 1.00 0.00 C ATOM 1165 CG1 VAL A 129 -22.752 41.910 36.660 1.00 0.00 C ATOM 1166 CG2 VAL A 129 -21.405 43.081 38.410 1.00 0.00 C ATOM 0 H VAL A 129 -23.300 39.752 37.454 1.00 0.00 H new ATOM 0 HA VAL A 129 -22.060 40.650 39.778 1.00 0.00 H new ATOM 0 HB VAL A 129 -21.035 41.088 37.669 1.00 0.00 H new ATOM 0 HG11 VAL A 129 -22.159 42.390 35.881 1.00 0.00 H new ATOM 0 HG12 VAL A 129 -23.101 40.940 36.305 1.00 0.00 H new ATOM 0 HG13 VAL A 129 -23.610 42.538 36.901 1.00 0.00 H new ATOM 0 HG21 VAL A 129 -20.813 43.563 37.631 1.00 0.00 H new ATOM 0 HG22 VAL A 129 -22.263 43.707 38.653 1.00 0.00 H new ATOM 0 HG23 VAL A 129 -20.791 42.945 39.300 1.00 0.00 H new ATOM 1176 N ASN A 130 -24.954 41.787 39.600 1.00 0.00 N ATOM 1177 CA ASN A 130 -25.942 42.694 40.176 1.00 0.00 C ATOM 1178 C ASN A 130 -26.612 42.057 41.389 1.00 0.00 C ATOM 1179 O ASN A 130 -27.406 42.696 42.080 1.00 0.00 O ATOM 1180 CB ASN A 130 -27.003 43.046 39.132 1.00 0.00 C ATOM 1181 CG ASN A 130 -26.539 44.237 38.301 1.00 0.00 C ATOM 1182 OD1 ASN A 130 -26.562 45.372 38.777 1.00 0.00 O ATOM 1183 ND2 ASN A 130 -26.116 44.047 37.081 1.00 0.00 N ATOM 0 H ASN A 130 -25.344 40.945 39.177 1.00 0.00 H new ATOM 0 HA ASN A 130 -25.430 43.603 40.493 1.00 0.00 H new ATOM 0 HB2 ASN A 130 -27.186 42.189 38.484 1.00 0.00 H new ATOM 0 HB3 ASN A 130 -27.947 43.281 39.625 1.00 0.00 H new ATOM 0 HD21 ASN A 130 -25.804 44.840 36.520 1.00 0.00 H new ATOM 0 HD22 ASN A 130 -26.098 43.106 36.688 1.00 0.00 H new ATOM 1190 N ALA A 131 -26.287 40.793 41.641 1.00 0.00 N ATOM 1191 CA ALA A 131 -26.862 40.078 42.774 1.00 0.00 C ATOM 1192 C ALA A 131 -26.150 40.465 44.065 1.00 0.00 C ATOM 1193 O ALA A 131 -25.365 39.689 44.611 1.00 0.00 O ATOM 1194 CB ALA A 131 -26.740 38.568 42.554 1.00 0.00 C ATOM 0 H ALA A 131 -25.633 40.246 41.080 1.00 0.00 H new ATOM 0 HA ALA A 131 -27.915 40.349 42.857 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -27.172 38.040 43.405 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -27.273 38.289 41.645 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -25.688 38.298 42.456 1.00 0.00 H new