USER MOD reduce.3.24.130724 H: found=0, std=0, add=673, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 673 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 57 GLN : amide:sc= 0.449 K(o=0.84,f=0.32) USER MOD Set 1.2: A 88 GLN : amide:sc= 0.392 K(o=0.84,f=0.32) USER MOD Set 2.1: A 28 SER OG : rot -73:sc= 1.2 USER MOD Set 2.2: A 47 TYR OH : rot 180:sc= 0 USER MOD Set 2.3: A 51 GLN : amide:sc= -0.0266 X(o=1.2,f=0.98) USER MOD Set 3.1: A 19 ASN : amide:sc= 0.59 K(o=0.89,f=-2.2) USER MOD Set 3.2: A 31 GLN : amide:sc= 0.298 K(o=0.89,f=-1.9!) USER MOD Single : A 17 HIS : no HD1:sc= -0.52 X(o=-0.52,f=-0.89) USER MOD Single : A 21 LYS NZ :NH3+ 177:sc= 1.21 (180deg=1.16) USER MOD Single : A 25 GLN : amide:sc= 2.02 K(o=2,f=-1) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0109) USER MOD Single : A 37 HIS : no HD1:sc= -0.25 X(o=-0.25,f=-0.012) USER MOD Single : A 38 THR OG1 : rot -175:sc= -3.7! USER MOD Single : A 41 SER OG : rot -141:sc= 1.31 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 MET CE :methyl 177:sc= -0.517 (180deg=-0.64) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 CYS SG : rot -71:sc= -0.96 USER MOD Single : A 54 SER OG : rot 41:sc= 0.246 USER MOD Single : A 55 MET CE :methyl 154:sc= -0.233 (180deg=-0.836) USER MOD Single : A 65 GLN : amide:sc= -0.112 X(o=-0.11,f=-0.26) USER MOD Single : A 68 ASN : amide:sc= 1.14 K(o=1.1,f=-0.048) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 THR OG1 : rot 180:sc= -2.17! USER MOD Single : A 75 GLN : amide:sc= -0.0356 K(o=-0.036,f=-0.98) USER MOD Single : A 78 MET CE :methyl -109:sc= -0.281 (180deg=-1.4) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 GLN : amide:sc= -0.0454 K(o=-0.045,f=-0.59) USER MOD Single : A 90 GLN : amide:sc= -0.238 K(o=-0.24,f=-2.9!) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0.0844 USER MOD Single : B 357 ASN : amide:sc= -0.714 K(o=-0.71,f=-4.5!) USER MOD Single : B 358 ASN : amide:sc= -0.0183 K(o=-0.018,f=-1) USER MOD ----------------------------------------------------------------- ATOM 13 N HIS A 17 -6.419 20.119 5.913 1.00 10.00 N ATOM 14 CA HIS A 17 -6.172 18.717 5.617 1.00 10.00 C ATOM 15 C HIS A 17 -7.123 18.261 4.521 1.00 10.00 C ATOM 16 O HIS A 17 -8.254 18.748 4.436 1.00 10.00 O ATOM 17 CB HIS A 17 -6.363 17.851 6.865 1.00 10.00 C ATOM 18 CG HIS A 17 -5.236 17.946 7.848 1.00 10.00 C ATOM 19 ND1 HIS A 17 -5.423 18.475 9.104 1.00 10.00 N ATOM 20 CD2 HIS A 17 -3.943 17.562 7.719 1.00 10.00 C ATOM 21 CE1 HIS A 17 -4.250 18.397 9.709 1.00 10.00 C ATOM 22 NE2 HIS A 17 -3.324 17.854 8.908 1.00 10.00 N ATOM 0 HA HIS A 17 -5.140 18.606 5.283 1.00 10.00 H new ATOM 0 HB2 HIS A 17 -7.289 18.143 7.360 1.00 10.00 H new ATOM 0 HB3 HIS A 17 -6.479 16.811 6.559 1.00 10.00 H new ATOM 0 HD2 HIS A 17 -3.488 17.113 6.849 1.00 10.00 H new ATOM 0 HE1 HIS A 17 -4.063 18.729 10.720 1.00 10.00 H new ATOM 0 HE2 HIS A 17 -2.344 17.689 9.138 1.00 10.00 H new ATOM 30 N ILE A 18 -6.671 17.351 3.680 1.00 10.00 N ATOM 31 CA ILE A 18 -7.501 16.846 2.603 1.00 10.00 C ATOM 32 C ILE A 18 -7.966 15.431 2.925 1.00 10.00 C ATOM 33 O ILE A 18 -7.178 14.586 3.362 1.00 10.00 O ATOM 34 CB ILE A 18 -6.765 16.889 1.240 1.00 10.00 C ATOM 35 CG1 ILE A 18 -7.661 16.358 0.122 1.00 10.00 C ATOM 36 CG2 ILE A 18 -5.459 16.111 1.297 1.00 10.00 C ATOM 37 CD1 ILE A 18 -7.041 16.464 -1.255 1.00 10.00 C ATOM 0 H ILE A 18 -5.735 16.947 3.721 1.00 10.00 H new ATOM 0 HA ILE A 18 -8.372 17.495 2.516 1.00 10.00 H new ATOM 0 HB ILE A 18 -6.527 17.930 1.022 1.00 10.00 H new ATOM 0 HG12 ILE A 18 -7.900 15.314 0.324 1.00 10.00 H new ATOM 0 HG13 ILE A 18 -8.602 16.907 0.131 1.00 10.00 H new ATOM 0 HG21 ILE A 18 -4.964 16.159 0.327 1.00 10.00 H new ATOM 0 HG22 ILE A 18 -4.810 16.545 2.057 1.00 10.00 H new ATOM 0 HG23 ILE A 18 -5.666 15.071 1.548 1.00 10.00 H new ATOM 0 HD11 ILE A 18 -7.734 16.068 -1.997 1.00 10.00 H new ATOM 0 HD12 ILE A 18 -6.828 17.509 -1.479 1.00 10.00 H new ATOM 0 HD13 ILE A 18 -6.114 15.891 -1.282 1.00 10.00 H new ATOM 49 N ASN A 19 -9.252 15.183 2.738 1.00 10.00 N ATOM 50 CA ASN A 19 -9.822 13.877 3.026 1.00 10.00 C ATOM 51 C ASN A 19 -9.739 12.964 1.816 1.00 10.00 C ATOM 52 O ASN A 19 -10.563 13.044 0.904 1.00 10.00 O ATOM 53 CB ASN A 19 -11.275 14.004 3.485 1.00 10.00 C ATOM 54 CG ASN A 19 -11.396 14.226 4.978 1.00 10.00 C ATOM 55 OD1 ASN A 19 -11.444 13.274 5.758 1.00 10.00 O ATOM 56 ND2 ASN A 19 -11.449 15.481 5.389 1.00 10.00 N ATOM 0 H ASN A 19 -9.921 15.869 2.388 1.00 10.00 H new ATOM 0 HA ASN A 19 -9.237 13.436 3.833 1.00 10.00 H new ATOM 0 HB2 ASN A 19 -11.747 14.833 2.959 1.00 10.00 H new ATOM 0 HB3 ASN A 19 -11.819 13.101 3.210 1.00 10.00 H new ATOM 0 HD21 ASN A 19 -11.533 15.689 6.384 1.00 10.00 H new ATOM 0 HD22 ASN A 19 -11.406 16.242 4.711 1.00 10.00 H new ATOM 63 N LEU A 20 -8.728 12.112 1.805 1.00 10.00 N ATOM 64 CA LEU A 20 -8.544 11.165 0.718 1.00 10.00 C ATOM 65 C LEU A 20 -8.973 9.783 1.179 1.00 10.00 C ATOM 66 O LEU A 20 -8.772 9.422 2.340 1.00 10.00 O ATOM 67 CB LEU A 20 -7.084 11.142 0.257 1.00 10.00 C ATOM 68 CG LEU A 20 -6.584 12.433 -0.391 1.00 10.00 C ATOM 69 CD1 LEU A 20 -5.104 12.326 -0.718 1.00 10.00 C ATOM 70 CD2 LEU A 20 -7.384 12.748 -1.644 1.00 10.00 C ATOM 0 H LEU A 20 -8.021 12.056 2.538 1.00 10.00 H new ATOM 0 HA LEU A 20 -9.158 11.473 -0.128 1.00 10.00 H new ATOM 0 HB2 LEU A 20 -6.452 10.918 1.116 1.00 10.00 H new ATOM 0 HB3 LEU A 20 -6.957 10.325 -0.454 1.00 10.00 H new ATOM 0 HG LEU A 20 -6.723 13.249 0.319 1.00 10.00 H new ATOM 0 HD11 LEU A 20 -4.765 13.254 -1.179 1.00 10.00 H new ATOM 0 HD12 LEU A 20 -4.541 12.149 0.198 1.00 10.00 H new ATOM 0 HD13 LEU A 20 -4.943 11.498 -1.409 1.00 10.00 H new ATOM 0 HD21 LEU A 20 -7.013 13.670 -2.090 1.00 10.00 H new ATOM 0 HD22 LEU A 20 -7.278 11.931 -2.358 1.00 10.00 H new ATOM 0 HD23 LEU A 20 -8.436 12.869 -1.384 1.00 10.00 H new ATOM 82 N LYS A 21 -9.578 9.020 0.289 1.00 10.00 N ATOM 83 CA LYS A 21 -10.034 7.687 0.636 1.00 10.00 C ATOM 84 C LYS A 21 -9.348 6.638 -0.222 1.00 10.00 C ATOM 85 O LYS A 21 -9.340 6.728 -1.448 1.00 10.00 O ATOM 86 CB LYS A 21 -11.553 7.591 0.485 1.00 10.00 C ATOM 87 CG LYS A 21 -12.305 8.494 1.450 1.00 10.00 C ATOM 88 CD LYS A 21 -13.783 8.578 1.112 1.00 10.00 C ATOM 89 CE LYS A 21 -14.542 9.346 2.180 1.00 10.00 C ATOM 90 NZ LYS A 21 -15.977 9.506 1.835 1.00 10.00 N ATOM 0 H LYS A 21 -9.765 9.298 -0.675 1.00 10.00 H new ATOM 0 HA LYS A 21 -9.772 7.496 1.677 1.00 10.00 H new ATOM 0 HB2 LYS A 21 -11.828 7.852 -0.537 1.00 10.00 H new ATOM 0 HB3 LYS A 21 -11.864 6.559 0.645 1.00 10.00 H new ATOM 0 HG2 LYS A 21 -12.186 8.118 2.466 1.00 10.00 H new ATOM 0 HG3 LYS A 21 -11.870 9.493 1.426 1.00 10.00 H new ATOM 0 HD2 LYS A 21 -13.912 9.067 0.146 1.00 10.00 H new ATOM 0 HD3 LYS A 21 -14.196 7.574 1.018 1.00 10.00 H new ATOM 0 HE2 LYS A 21 -14.454 8.825 3.133 1.00 10.00 H new ATOM 0 HE3 LYS A 21 -14.089 10.329 2.311 1.00 10.00 H new ATOM 0 HZ1 LYS A 21 -16.469 9.991 2.613 1.00 10.00 H new ATOM 0 HZ2 LYS A 21 -16.064 10.070 0.965 1.00 10.00 H new ATOM 0 HZ3 LYS A 21 -16.404 8.570 1.685 1.00 10.00 H new ATOM 104 N VAL A 22 -8.763 5.654 0.431 1.00 10.00 N ATOM 105 CA VAL A 22 -8.074 4.578 -0.257 1.00 10.00 C ATOM 106 C VAL A 22 -8.910 3.310 -0.177 1.00 10.00 C ATOM 107 O VAL A 22 -9.291 2.885 0.915 1.00 10.00 O ATOM 108 CB VAL A 22 -6.676 4.323 0.347 1.00 10.00 C ATOM 109 CG1 VAL A 22 -5.978 3.175 -0.362 1.00 10.00 C ATOM 110 CG2 VAL A 22 -5.831 5.583 0.281 1.00 10.00 C ATOM 0 H VAL A 22 -8.751 5.577 1.448 1.00 10.00 H new ATOM 0 HA VAL A 22 -7.939 4.870 -1.298 1.00 10.00 H new ATOM 0 HB VAL A 22 -6.804 4.045 1.393 1.00 10.00 H new ATOM 0 HG11 VAL A 22 -4.996 3.016 0.083 1.00 10.00 H new ATOM 0 HG12 VAL A 22 -6.574 2.268 -0.259 1.00 10.00 H new ATOM 0 HG13 VAL A 22 -5.863 3.416 -1.419 1.00 10.00 H new ATOM 0 HG21 VAL A 22 -4.849 5.385 0.711 1.00 10.00 H new ATOM 0 HG22 VAL A 22 -5.717 5.891 -0.758 1.00 10.00 H new ATOM 0 HG23 VAL A 22 -6.320 6.379 0.843 1.00 10.00 H new ATOM 120 N ALA A 23 -9.210 2.721 -1.322 1.00 10.00 N ATOM 121 CA ALA A 23 -10.016 1.513 -1.358 1.00 10.00 C ATOM 122 C ALA A 23 -9.251 0.356 -1.980 1.00 10.00 C ATOM 123 O ALA A 23 -8.850 0.414 -3.144 1.00 10.00 O ATOM 124 CB ALA A 23 -11.309 1.763 -2.122 1.00 10.00 C ATOM 0 H ALA A 23 -8.909 3.058 -2.236 1.00 10.00 H new ATOM 0 HA ALA A 23 -10.258 1.241 -0.331 1.00 10.00 H new ATOM 0 HB1 ALA A 23 -11.903 0.849 -2.141 1.00 10.00 H new ATOM 0 HB2 ALA A 23 -11.875 2.554 -1.630 1.00 10.00 H new ATOM 0 HB3 ALA A 23 -11.076 2.065 -3.143 1.00 10.00 H new ATOM 130 N GLY A 24 -9.041 -0.692 -1.193 1.00 10.00 N ATOM 131 CA GLY A 24 -8.342 -1.858 -1.687 1.00 10.00 C ATOM 132 C GLY A 24 -9.277 -2.778 -2.442 1.00 10.00 C ATOM 133 O GLY A 24 -10.498 -2.656 -2.320 1.00 10.00 O ATOM 0 H GLY A 24 -9.343 -0.753 -0.221 1.00 10.00 H new ATOM 0 HA2 GLY A 24 -7.527 -1.547 -2.341 1.00 10.00 H new ATOM 0 HA3 GLY A 24 -7.893 -2.397 -0.853 1.00 10.00 H new ATOM 137 N GLN A 25 -8.717 -3.709 -3.208 1.00 10.00 N ATOM 138 CA GLN A 25 -9.521 -4.645 -3.996 1.00 10.00 C ATOM 139 C GLN A 25 -10.318 -5.587 -3.099 1.00 10.00 C ATOM 140 O GLN A 25 -11.221 -6.280 -3.563 1.00 10.00 O ATOM 141 CB GLN A 25 -8.637 -5.479 -4.930 1.00 10.00 C ATOM 142 CG GLN A 25 -7.633 -4.669 -5.737 1.00 10.00 C ATOM 143 CD GLN A 25 -8.265 -3.516 -6.493 1.00 10.00 C ATOM 144 OE1 GLN A 25 -9.419 -3.582 -6.921 1.00 10.00 O ATOM 145 NE2 GLN A 25 -7.508 -2.450 -6.654 1.00 10.00 N ATOM 0 H GLN A 25 -7.710 -3.838 -3.302 1.00 10.00 H new ATOM 0 HA GLN A 25 -10.213 -4.046 -4.589 1.00 10.00 H new ATOM 0 HB2 GLN A 25 -8.097 -6.216 -4.336 1.00 10.00 H new ATOM 0 HB3 GLN A 25 -9.277 -6.031 -5.618 1.00 10.00 H new ATOM 0 HG2 GLN A 25 -6.868 -4.279 -5.066 1.00 10.00 H new ATOM 0 HG3 GLN A 25 -7.130 -5.327 -6.445 1.00 10.00 H new ATOM 0 HE21 GLN A 25 -6.558 -2.438 -6.283 1.00 10.00 H new ATOM 0 HE22 GLN A 25 -7.872 -1.636 -7.150 1.00 10.00 H new ATOM 154 N ASP A 26 -9.977 -5.608 -1.818 1.00 10.00 N ATOM 155 CA ASP A 26 -10.651 -6.470 -0.858 1.00 10.00 C ATOM 156 C ASP A 26 -11.865 -5.773 -0.245 1.00 10.00 C ATOM 157 O ASP A 26 -12.632 -6.389 0.494 1.00 10.00 O ATOM 158 CB ASP A 26 -9.673 -6.898 0.240 1.00 10.00 C ATOM 159 CG ASP A 26 -9.520 -5.853 1.330 1.00 10.00 C ATOM 160 OD1 ASP A 26 -9.186 -4.698 1.005 1.00 10.00 O ATOM 161 OD2 ASP A 26 -9.719 -6.191 2.514 1.00 10.00 O ATOM 0 H ASP A 26 -9.234 -5.035 -1.418 1.00 10.00 H new ATOM 0 HA ASP A 26 -11.005 -7.355 -1.386 1.00 10.00 H new ATOM 0 HB2 ASP A 26 -10.018 -7.832 0.684 1.00 10.00 H new ATOM 0 HB3 ASP A 26 -8.698 -7.098 -0.205 1.00 10.00 H new ATOM 166 N GLY A 27 -12.035 -4.496 -0.558 1.00 10.00 N ATOM 167 CA GLY A 27 -13.161 -3.747 -0.032 1.00 10.00 C ATOM 168 C GLY A 27 -12.842 -3.064 1.283 1.00 10.00 C ATOM 169 O GLY A 27 -13.621 -3.138 2.236 1.00 10.00 O ATOM 0 H GLY A 27 -11.413 -3.964 -1.167 1.00 10.00 H new ATOM 0 HA2 GLY A 27 -13.467 -2.997 -0.762 1.00 10.00 H new ATOM 0 HA3 GLY A 27 -14.007 -4.420 0.108 1.00 10.00 H new ATOM 173 N SER A 28 -11.694 -2.406 1.336 1.00 10.00 N ATOM 174 CA SER A 28 -11.270 -1.699 2.536 1.00 10.00 C ATOM 175 C SER A 28 -11.507 -0.199 2.391 1.00 10.00 C ATOM 176 O SER A 28 -11.013 0.429 1.455 1.00 10.00 O ATOM 177 CB SER A 28 -9.786 -1.968 2.797 1.00 10.00 C ATOM 178 OG SER A 28 -9.091 -2.196 1.579 1.00 10.00 O ATOM 0 H SER A 28 -11.036 -2.347 0.559 1.00 10.00 H new ATOM 0 HA SER A 28 -11.859 -2.061 3.379 1.00 10.00 H new ATOM 0 HB2 SER A 28 -9.345 -1.119 3.319 1.00 10.00 H new ATOM 0 HB3 SER A 28 -9.678 -2.834 3.450 1.00 10.00 H new ATOM 0 HG SER A 28 -9.332 -3.077 1.225 1.00 10.00 H new ATOM 184 N VAL A 29 -12.281 0.367 3.307 1.00 10.00 N ATOM 185 CA VAL A 29 -12.565 1.793 3.291 1.00 10.00 C ATOM 186 C VAL A 29 -11.576 2.516 4.196 1.00 10.00 C ATOM 187 O VAL A 29 -11.770 2.592 5.406 1.00 10.00 O ATOM 188 CB VAL A 29 -14.010 2.083 3.757 1.00 10.00 C ATOM 189 CG1 VAL A 29 -14.296 3.578 3.767 1.00 10.00 C ATOM 190 CG2 VAL A 29 -15.013 1.354 2.876 1.00 10.00 C ATOM 0 H VAL A 29 -12.724 -0.142 4.072 1.00 10.00 H new ATOM 0 HA VAL A 29 -12.463 2.153 2.267 1.00 10.00 H new ATOM 0 HB VAL A 29 -14.112 1.715 4.778 1.00 10.00 H new ATOM 0 HG11 VAL A 29 -15.320 3.750 4.099 1.00 10.00 H new ATOM 0 HG12 VAL A 29 -13.605 4.076 4.447 1.00 10.00 H new ATOM 0 HG13 VAL A 29 -14.168 3.980 2.762 1.00 10.00 H new ATOM 0 HG21 VAL A 29 -16.024 1.571 3.220 1.00 10.00 H new ATOM 0 HG22 VAL A 29 -14.901 1.688 1.844 1.00 10.00 H new ATOM 0 HG23 VAL A 29 -14.833 0.280 2.931 1.00 10.00 H new ATOM 200 N VAL A 30 -10.503 3.023 3.614 1.00 10.00 N ATOM 201 CA VAL A 30 -9.484 3.709 4.392 1.00 10.00 C ATOM 202 C VAL A 30 -9.605 5.222 4.285 1.00 10.00 C ATOM 203 O VAL A 30 -9.659 5.781 3.188 1.00 10.00 O ATOM 204 CB VAL A 30 -8.065 3.288 3.964 1.00 10.00 C ATOM 205 CG1 VAL A 30 -7.027 3.901 4.890 1.00 10.00 C ATOM 206 CG2 VAL A 30 -7.936 1.774 3.938 1.00 10.00 C ATOM 0 H VAL A 30 -10.315 2.974 2.613 1.00 10.00 H new ATOM 0 HA VAL A 30 -9.649 3.416 5.429 1.00 10.00 H new ATOM 0 HB VAL A 30 -7.887 3.659 2.955 1.00 10.00 H new ATOM 0 HG11 VAL A 30 -6.030 3.594 4.574 1.00 10.00 H new ATOM 0 HG12 VAL A 30 -7.101 4.988 4.851 1.00 10.00 H new ATOM 0 HG13 VAL A 30 -7.204 3.562 5.911 1.00 10.00 H new ATOM 0 HG21 VAL A 30 -6.926 1.500 3.633 1.00 10.00 H new ATOM 0 HG22 VAL A 30 -8.136 1.375 4.932 1.00 10.00 H new ATOM 0 HG23 VAL A 30 -8.654 1.360 3.230 1.00 10.00 H new ATOM 216 N GLN A 31 -9.654 5.872 5.438 1.00 10.00 N ATOM 217 CA GLN A 31 -9.735 7.322 5.513 1.00 10.00 C ATOM 218 C GLN A 31 -8.336 7.870 5.766 1.00 10.00 C ATOM 219 O GLN A 31 -7.685 7.493 6.742 1.00 10.00 O ATOM 220 CB GLN A 31 -10.696 7.748 6.631 1.00 10.00 C ATOM 221 CG GLN A 31 -11.023 9.239 6.646 1.00 10.00 C ATOM 222 CD GLN A 31 -10.041 10.055 7.469 1.00 10.00 C ATOM 223 OE1 GLN A 31 -9.421 9.549 8.403 1.00 10.00 O ATOM 224 NE2 GLN A 31 -9.900 11.329 7.137 1.00 10.00 N ATOM 0 H GLN A 31 -9.639 5.409 6.347 1.00 10.00 H new ATOM 0 HA GLN A 31 -10.122 7.722 4.576 1.00 10.00 H new ATOM 0 HB2 GLN A 31 -11.624 7.186 6.530 1.00 10.00 H new ATOM 0 HB3 GLN A 31 -10.261 7.474 7.592 1.00 10.00 H new ATOM 0 HG2 GLN A 31 -11.030 9.614 5.623 1.00 10.00 H new ATOM 0 HG3 GLN A 31 -12.028 9.381 7.044 1.00 10.00 H new ATOM 0 HE21 GLN A 31 -10.431 11.714 6.356 1.00 10.00 H new ATOM 0 HE22 GLN A 31 -9.260 11.925 7.662 1.00 10.00 H new ATOM 233 N PHE A 32 -7.872 8.734 4.880 1.00 10.00 N ATOM 234 CA PHE A 32 -6.543 9.306 5.001 1.00 10.00 C ATOM 235 C PHE A 32 -6.587 10.800 5.288 1.00 10.00 C ATOM 236 O PHE A 32 -7.006 11.592 4.442 1.00 10.00 O ATOM 237 CB PHE A 32 -5.756 9.073 3.711 1.00 10.00 C ATOM 238 CG PHE A 32 -4.685 8.028 3.819 1.00 10.00 C ATOM 239 CD1 PHE A 32 -4.921 6.735 3.392 1.00 10.00 C ATOM 240 CD2 PHE A 32 -3.437 8.343 4.331 1.00 10.00 C ATOM 241 CE1 PHE A 32 -3.933 5.773 3.472 1.00 10.00 C ATOM 242 CE2 PHE A 32 -2.447 7.386 4.418 1.00 10.00 C ATOM 243 CZ PHE A 32 -2.696 6.099 3.986 1.00 10.00 C ATOM 0 H PHE A 32 -8.398 9.055 4.067 1.00 10.00 H new ATOM 0 HA PHE A 32 -6.055 8.811 5.841 1.00 10.00 H new ATOM 0 HB2 PHE A 32 -6.451 8.783 2.923 1.00 10.00 H new ATOM 0 HB3 PHE A 32 -5.299 10.014 3.403 1.00 10.00 H new ATOM 0 HD1 PHE A 32 -5.889 6.474 2.991 1.00 10.00 H new ATOM 0 HD2 PHE A 32 -3.237 9.350 4.666 1.00 10.00 H new ATOM 0 HE1 PHE A 32 -4.129 4.767 3.132 1.00 10.00 H new ATOM 0 HE2 PHE A 32 -1.480 7.643 4.823 1.00 10.00 H new ATOM 0 HZ PHE A 32 -1.923 5.348 4.051 1.00 10.00 H new ATOM 253 N LYS A 33 -6.170 11.182 6.486 1.00 10.00 N ATOM 254 CA LYS A 33 -6.107 12.588 6.846 1.00 10.00 C ATOM 255 C LYS A 33 -4.696 13.080 6.557 1.00 10.00 C ATOM 256 O LYS A 33 -3.812 13.005 7.412 1.00 10.00 O ATOM 257 CB LYS A 33 -6.471 12.820 8.318 1.00 10.00 C ATOM 258 CG LYS A 33 -6.691 14.289 8.657 1.00 10.00 C ATOM 259 CD LYS A 33 -7.205 14.479 10.076 1.00 10.00 C ATOM 260 CE LYS A 33 -7.567 15.935 10.338 1.00 10.00 C ATOM 261 NZ LYS A 33 -8.173 16.134 11.681 1.00 10.00 N ATOM 0 H LYS A 33 -5.872 10.541 7.221 1.00 10.00 H new ATOM 0 HA LYS A 33 -6.836 13.145 6.257 1.00 10.00 H new ATOM 0 HB2 LYS A 33 -7.376 12.260 8.555 1.00 10.00 H new ATOM 0 HB3 LYS A 33 -5.676 12.423 8.949 1.00 10.00 H new ATOM 0 HG2 LYS A 33 -5.754 14.833 8.536 1.00 10.00 H new ATOM 0 HG3 LYS A 33 -7.403 14.720 7.953 1.00 10.00 H new ATOM 0 HD2 LYS A 33 -8.080 13.849 10.237 1.00 10.00 H new ATOM 0 HD3 LYS A 33 -6.445 14.156 10.788 1.00 10.00 H new ATOM 0 HE2 LYS A 33 -6.672 16.551 10.251 1.00 10.00 H new ATOM 0 HE3 LYS A 33 -8.264 16.277 9.573 1.00 10.00 H new ATOM 0 HZ1 LYS A 33 -8.402 17.140 11.813 1.00 10.00 H new ATOM 0 HZ2 LYS A 33 -9.042 15.568 11.757 1.00 10.00 H new ATOM 0 HZ3 LYS A 33 -7.499 15.834 12.414 1.00 10.00 H new ATOM 275 N ILE A 34 -4.490 13.547 5.338 1.00 10.00 N ATOM 276 CA ILE A 34 -3.184 14.009 4.902 1.00 10.00 C ATOM 277 C ILE A 34 -3.247 15.472 4.452 1.00 10.00 C ATOM 278 O ILE A 34 -4.334 16.016 4.252 1.00 10.00 O ATOM 279 CB ILE A 34 -2.676 13.117 3.734 1.00 10.00 C ATOM 280 CG1 ILE A 34 -1.200 13.378 3.417 1.00 10.00 C ATOM 281 CG2 ILE A 34 -3.534 13.331 2.498 1.00 10.00 C ATOM 282 CD1 ILE A 34 -0.663 12.538 2.276 1.00 10.00 C ATOM 0 H ILE A 34 -5.218 13.616 4.627 1.00 10.00 H new ATOM 0 HA ILE A 34 -2.492 13.938 5.741 1.00 10.00 H new ATOM 0 HB ILE A 34 -2.761 12.077 4.050 1.00 10.00 H new ATOM 0 HG12 ILE A 34 -1.071 14.432 3.172 1.00 10.00 H new ATOM 0 HG13 ILE A 34 -0.606 13.184 4.310 1.00 10.00 H new ATOM 0 HG21 ILE A 34 -3.168 12.701 1.687 1.00 10.00 H new ATOM 0 HG22 ILE A 34 -4.568 13.069 2.723 1.00 10.00 H new ATOM 0 HG23 ILE A 34 -3.482 14.377 2.196 1.00 10.00 H new ATOM 0 HD11 ILE A 34 0.387 12.778 2.110 1.00 10.00 H new ATOM 0 HD12 ILE A 34 -0.758 11.481 2.526 1.00 10.00 H new ATOM 0 HD13 ILE A 34 -1.231 12.749 1.370 1.00 10.00 H new ATOM 294 N LYS A 35 -2.091 16.118 4.332 1.00 10.00 N ATOM 295 CA LYS A 35 -2.035 17.495 3.865 1.00 10.00 C ATOM 296 C LYS A 35 -2.000 17.488 2.343 1.00 10.00 C ATOM 297 O LYS A 35 -1.915 16.425 1.730 1.00 10.00 O ATOM 298 CB LYS A 35 -0.794 18.213 4.403 1.00 10.00 C ATOM 299 CG LYS A 35 -0.915 18.683 5.842 1.00 10.00 C ATOM 300 CD LYS A 35 -1.289 20.152 5.912 1.00 10.00 C ATOM 301 CE LYS A 35 -0.922 20.755 7.258 1.00 10.00 C ATOM 302 NZ LYS A 35 0.538 21.038 7.372 1.00 10.00 N ATOM 0 H LYS A 35 -1.183 15.709 4.552 1.00 10.00 H new ATOM 0 HA LYS A 35 -2.914 18.028 4.227 1.00 10.00 H new ATOM 0 HB2 LYS A 35 0.062 17.542 4.323 1.00 10.00 H new ATOM 0 HB3 LYS A 35 -0.584 19.074 3.769 1.00 10.00 H new ATOM 0 HG2 LYS A 35 -1.668 18.089 6.359 1.00 10.00 H new ATOM 0 HG3 LYS A 35 0.030 18.521 6.361 1.00 10.00 H new ATOM 0 HD2 LYS A 35 -0.780 20.697 5.117 1.00 10.00 H new ATOM 0 HD3 LYS A 35 -2.360 20.265 5.741 1.00 10.00 H new ATOM 0 HE2 LYS A 35 -1.481 21.679 7.404 1.00 10.00 H new ATOM 0 HE3 LYS A 35 -1.221 20.072 8.053 1.00 10.00 H new ATOM 0 HZ1 LYS A 35 0.728 21.525 8.271 1.00 10.00 H new ATOM 0 HZ2 LYS A 35 1.068 20.144 7.344 1.00 10.00 H new ATOM 0 HZ3 LYS A 35 0.837 21.643 6.581 1.00 10.00 H new ATOM 316 N ARG A 36 -2.047 18.655 1.725 1.00 10.00 N ATOM 317 CA ARG A 36 -2.020 18.723 0.271 1.00 10.00 C ATOM 318 C ARG A 36 -0.589 18.817 -0.245 1.00 10.00 C ATOM 319 O ARG A 36 -0.333 18.607 -1.431 1.00 10.00 O ATOM 320 CB ARG A 36 -2.852 19.906 -0.233 1.00 10.00 C ATOM 321 CG ARG A 36 -4.296 19.875 0.244 1.00 10.00 C ATOM 322 CD ARG A 36 -5.156 20.872 -0.514 1.00 10.00 C ATOM 323 NE ARG A 36 -5.881 20.248 -1.624 1.00 10.00 N ATOM 324 CZ ARG A 36 -7.202 20.340 -1.797 1.00 10.00 C ATOM 325 NH1 ARG A 36 -7.947 21.007 -0.923 1.00 10.00 N ATOM 326 NH2 ARG A 36 -7.781 19.756 -2.840 1.00 10.00 N ATOM 0 H ARG A 36 -2.103 19.557 2.197 1.00 10.00 H new ATOM 0 HA ARG A 36 -2.460 17.804 -0.116 1.00 10.00 H new ATOM 0 HB2 ARG A 36 -2.387 20.835 0.098 1.00 10.00 H new ATOM 0 HB3 ARG A 36 -2.837 19.913 -1.323 1.00 10.00 H new ATOM 0 HG2 ARG A 36 -4.701 18.871 0.115 1.00 10.00 H new ATOM 0 HG3 ARG A 36 -4.333 20.098 1.310 1.00 10.00 H new ATOM 0 HD2 ARG A 36 -5.869 21.329 0.172 1.00 10.00 H new ATOM 0 HD3 ARG A 36 -4.526 21.674 -0.899 1.00 10.00 H new ATOM 0 HE ARG A 36 -5.345 19.711 -2.305 1.00 10.00 H new ATOM 0 HH11 ARG A 36 -7.511 21.452 -0.115 1.00 10.00 H new ATOM 0 HH12 ARG A 36 -8.956 21.075 -1.059 1.00 10.00 H new ATOM 0 HH21 ARG A 36 -7.216 19.236 -3.511 1.00 10.00 H new ATOM 0 HH22 ARG A 36 -8.790 19.828 -2.970 1.00 10.00 H new ATOM 340 N HIS A 37 0.344 19.115 0.653 1.00 10.00 N ATOM 341 CA HIS A 37 1.751 19.234 0.277 1.00 10.00 C ATOM 342 C HIS A 37 2.538 17.973 0.652 1.00 10.00 C ATOM 343 O HIS A 37 3.652 17.765 0.171 1.00 10.00 O ATOM 344 CB HIS A 37 2.383 20.486 0.924 1.00 10.00 C ATOM 345 CG HIS A 37 2.903 20.287 2.317 1.00 10.00 C ATOM 346 ND1 HIS A 37 4.250 20.295 2.583 1.00 10.00 N ATOM 347 CD2 HIS A 37 2.229 20.077 3.469 1.00 10.00 C ATOM 348 CE1 HIS A 37 4.363 20.089 3.883 1.00 10.00 C ATOM 349 NE2 HIS A 37 3.165 19.949 4.463 1.00 10.00 N ATOM 0 H HIS A 37 0.154 19.278 1.642 1.00 10.00 H new ATOM 0 HA HIS A 37 1.798 19.344 -0.806 1.00 10.00 H new ATOM 0 HB2 HIS A 37 3.202 20.828 0.292 1.00 10.00 H new ATOM 0 HB3 HIS A 37 1.639 21.282 0.941 1.00 10.00 H new ATOM 0 HD2 HIS A 37 1.157 20.021 3.585 1.00 10.00 H new ATOM 0 HE1 HIS A 37 5.304 20.040 4.411 1.00 10.00 H new ATOM 0 HE2 HIS A 37 2.983 19.780 5.452 1.00 10.00 H new ATOM 357 N THR A 38 1.955 17.132 1.500 1.00 10.00 N ATOM 358 CA THR A 38 2.613 15.907 1.934 1.00 10.00 C ATOM 359 C THR A 38 2.693 14.893 0.786 1.00 10.00 C ATOM 360 O THR A 38 1.680 14.574 0.162 1.00 10.00 O ATOM 361 CB THR A 38 1.873 15.280 3.131 1.00 10.00 C ATOM 362 OG1 THR A 38 1.457 16.311 4.037 1.00 10.00 O ATOM 363 CG2 THR A 38 2.762 14.287 3.868 1.00 10.00 C ATOM 0 H THR A 38 1.028 17.277 1.900 1.00 10.00 H new ATOM 0 HA THR A 38 3.625 16.168 2.244 1.00 10.00 H new ATOM 0 HB THR A 38 1.002 14.747 2.750 1.00 10.00 H new ATOM 0 HG1 THR A 38 1.056 15.904 4.834 1.00 10.00 H new ATOM 0 HG21 THR A 38 2.213 13.861 4.708 1.00 10.00 H new ATOM 0 HG22 THR A 38 3.060 13.490 3.187 1.00 10.00 H new ATOM 0 HG23 THR A 38 3.650 14.799 4.238 1.00 10.00 H new ATOM 371 N PRO A 39 3.906 14.393 0.490 1.00 10.00 N ATOM 372 CA PRO A 39 4.136 13.418 -0.587 1.00 10.00 C ATOM 373 C PRO A 39 3.268 12.170 -0.468 1.00 10.00 C ATOM 374 O PRO A 39 3.117 11.598 0.616 1.00 10.00 O ATOM 375 CB PRO A 39 5.611 13.043 -0.423 1.00 10.00 C ATOM 376 CG PRO A 39 6.223 14.199 0.277 1.00 10.00 C ATOM 377 CD PRO A 39 5.157 14.757 1.174 1.00 10.00 C ATOM 0 HA PRO A 39 3.884 13.842 -1.559 1.00 10.00 H new ATOM 0 HB2 PRO A 39 5.724 12.126 0.155 1.00 10.00 H new ATOM 0 HB3 PRO A 39 6.085 12.870 -1.389 1.00 10.00 H new ATOM 0 HG2 PRO A 39 7.094 13.888 0.854 1.00 10.00 H new ATOM 0 HG3 PRO A 39 6.564 14.950 -0.436 1.00 10.00 H new ATOM 0 HD2 PRO A 39 5.208 14.326 2.174 1.00 10.00 H new ATOM 0 HD3 PRO A 39 5.253 15.837 1.287 1.00 10.00 H new ATOM 385 N LEU A 40 2.719 11.736 -1.600 1.00 10.00 N ATOM 386 CA LEU A 40 1.871 10.552 -1.644 1.00 10.00 C ATOM 387 C LEU A 40 2.695 9.297 -1.392 1.00 10.00 C ATOM 388 O LEU A 40 2.149 8.226 -1.127 1.00 10.00 O ATOM 389 CB LEU A 40 1.153 10.455 -2.993 1.00 10.00 C ATOM 390 CG LEU A 40 0.038 11.481 -3.210 1.00 10.00 C ATOM 391 CD1 LEU A 40 -0.486 11.403 -4.634 1.00 10.00 C ATOM 392 CD2 LEU A 40 -1.094 11.259 -2.218 1.00 10.00 C ATOM 0 H LEU A 40 2.849 12.191 -2.503 1.00 10.00 H new ATOM 0 HA LEU A 40 1.121 10.638 -0.858 1.00 10.00 H new ATOM 0 HB2 LEU A 40 1.890 10.568 -3.788 1.00 10.00 H new ATOM 0 HB3 LEU A 40 0.730 9.455 -3.091 1.00 10.00 H new ATOM 0 HG LEU A 40 0.451 12.476 -3.045 1.00 10.00 H new ATOM 0 HD11 LEU A 40 -1.278 12.139 -4.771 1.00 10.00 H new ATOM 0 HD12 LEU A 40 0.325 11.609 -5.332 1.00 10.00 H new ATOM 0 HD13 LEU A 40 -0.882 10.405 -4.822 1.00 10.00 H new ATOM 0 HD21 LEU A 40 -1.877 11.998 -2.388 1.00 10.00 H new ATOM 0 HD22 LEU A 40 -1.504 10.258 -2.352 1.00 10.00 H new ATOM 0 HD23 LEU A 40 -0.713 11.362 -1.202 1.00 10.00 H new ATOM 404 N SER A 41 4.013 9.434 -1.476 1.00 10.00 N ATOM 405 CA SER A 41 4.922 8.327 -1.230 1.00 10.00 C ATOM 406 C SER A 41 4.758 7.835 0.205 1.00 10.00 C ATOM 407 O SER A 41 4.812 6.634 0.481 1.00 10.00 O ATOM 408 CB SER A 41 6.354 8.789 -1.480 1.00 10.00 C ATOM 409 OG SER A 41 6.368 10.139 -1.924 1.00 10.00 O ATOM 0 H SER A 41 4.477 10.310 -1.715 1.00 10.00 H new ATOM 0 HA SER A 41 4.693 7.502 -1.905 1.00 10.00 H new ATOM 0 HB2 SER A 41 6.939 8.694 -0.565 1.00 10.00 H new ATOM 0 HB3 SER A 41 6.824 8.149 -2.226 1.00 10.00 H new ATOM 0 HG SER A 41 7.046 10.246 -2.623 1.00 10.00 H new ATOM 415 N LYS A 42 4.521 8.779 1.113 1.00 10.00 N ATOM 416 CA LYS A 42 4.325 8.458 2.515 1.00 10.00 C ATOM 417 C LYS A 42 2.968 7.793 2.695 1.00 10.00 C ATOM 418 O LYS A 42 2.815 6.871 3.495 1.00 10.00 O ATOM 419 CB LYS A 42 4.409 9.724 3.371 1.00 10.00 C ATOM 420 CG LYS A 42 4.991 9.481 4.754 1.00 10.00 C ATOM 421 CD LYS A 42 4.817 10.690 5.659 1.00 10.00 C ATOM 422 CE LYS A 42 5.717 10.597 6.879 1.00 10.00 C ATOM 423 NZ LYS A 42 5.316 11.546 7.951 1.00 10.00 N ATOM 0 H LYS A 42 4.461 9.774 0.897 1.00 10.00 H new ATOM 0 HA LYS A 42 5.110 7.774 2.838 1.00 10.00 H new ATOM 0 HB2 LYS A 42 5.019 10.464 2.853 1.00 10.00 H new ATOM 0 HB3 LYS A 42 3.411 10.150 3.475 1.00 10.00 H new ATOM 0 HG2 LYS A 42 4.506 8.616 5.206 1.00 10.00 H new ATOM 0 HG3 LYS A 42 6.051 9.242 4.666 1.00 10.00 H new ATOM 0 HD2 LYS A 42 5.046 11.599 5.103 1.00 10.00 H new ATOM 0 HD3 LYS A 42 3.777 10.764 5.976 1.00 10.00 H new ATOM 0 HE2 LYS A 42 5.692 9.580 7.270 1.00 10.00 H new ATOM 0 HE3 LYS A 42 6.747 10.800 6.584 1.00 10.00 H new ATOM 0 HZ1 LYS A 42 5.959 11.445 8.762 1.00 10.00 H new ATOM 0 HZ2 LYS A 42 5.365 12.520 7.589 1.00 10.00 H new ATOM 0 HZ3 LYS A 42 4.343 11.338 8.253 1.00 10.00 H new ATOM 437 N LEU A 43 1.996 8.260 1.917 1.00 10.00 N ATOM 438 CA LEU A 43 0.641 7.721 1.952 1.00 10.00 C ATOM 439 C LEU A 43 0.659 6.252 1.548 1.00 10.00 C ATOM 440 O LEU A 43 0.031 5.407 2.192 1.00 10.00 O ATOM 441 CB LEU A 43 -0.267 8.526 1.011 1.00 10.00 C ATOM 442 CG LEU A 43 -1.749 8.144 1.027 1.00 10.00 C ATOM 443 CD1 LEU A 43 -2.617 9.389 0.913 1.00 10.00 C ATOM 444 CD2 LEU A 43 -2.068 7.177 -0.105 1.00 10.00 C ATOM 0 H LEU A 43 2.125 9.019 1.248 1.00 10.00 H new ATOM 0 HA LEU A 43 0.248 7.800 2.966 1.00 10.00 H new ATOM 0 HB2 LEU A 43 -0.181 9.582 1.268 1.00 10.00 H new ATOM 0 HB3 LEU A 43 0.107 8.415 -0.007 1.00 10.00 H new ATOM 0 HG LEU A 43 -1.964 7.650 1.974 1.00 10.00 H new ATOM 0 HD11 LEU A 43 -3.668 9.102 0.926 1.00 10.00 H new ATOM 0 HD12 LEU A 43 -2.412 10.053 1.752 1.00 10.00 H new ATOM 0 HD13 LEU A 43 -2.393 9.905 -0.021 1.00 10.00 H new ATOM 0 HD21 LEU A 43 -3.126 6.918 -0.075 1.00 10.00 H new ATOM 0 HD22 LEU A 43 -1.836 7.647 -1.061 1.00 10.00 H new ATOM 0 HD23 LEU A 43 -1.470 6.273 0.010 1.00 10.00 H new ATOM 456 N MET A 44 1.398 5.956 0.482 1.00 10.00 N ATOM 457 CA MET A 44 1.521 4.592 -0.015 1.00 10.00 C ATOM 458 C MET A 44 2.141 3.699 1.049 1.00 10.00 C ATOM 459 O MET A 44 1.662 2.595 1.312 1.00 10.00 O ATOM 460 CB MET A 44 2.371 4.553 -1.289 1.00 10.00 C ATOM 461 CG MET A 44 1.726 5.240 -2.482 1.00 10.00 C ATOM 462 SD MET A 44 2.555 4.859 -4.039 1.00 10.00 S ATOM 463 CE MET A 44 4.077 5.786 -3.860 1.00 10.00 C ATOM 0 H MET A 44 1.922 6.647 -0.055 1.00 10.00 H new ATOM 0 HA MET A 44 0.523 4.224 -0.253 1.00 10.00 H new ATOM 0 HB2 MET A 44 3.333 5.025 -1.087 1.00 10.00 H new ATOM 0 HB3 MET A 44 2.574 3.514 -1.547 1.00 10.00 H new ATOM 0 HG2 MET A 44 0.681 4.938 -2.548 1.00 10.00 H new ATOM 0 HG3 MET A 44 1.737 6.318 -2.324 1.00 10.00 H new ATOM 0 HE1 MET A 44 4.717 5.605 -4.724 1.00 10.00 H new ATOM 0 HE2 MET A 44 3.849 6.850 -3.793 1.00 10.00 H new ATOM 0 HE3 MET A 44 4.592 5.468 -2.954 1.00 10.00 H new ATOM 473 N LYS A 45 3.198 4.200 1.675 1.00 10.00 N ATOM 474 CA LYS A 45 3.894 3.462 2.715 1.00 10.00 C ATOM 475 C LYS A 45 3.007 3.264 3.940 1.00 10.00 C ATOM 476 O LYS A 45 3.007 2.192 4.538 1.00 10.00 O ATOM 477 CB LYS A 45 5.179 4.186 3.116 1.00 10.00 C ATOM 478 CG LYS A 45 6.402 3.724 2.339 1.00 10.00 C ATOM 479 CD LYS A 45 7.671 4.403 2.827 1.00 10.00 C ATOM 480 CE LYS A 45 7.794 5.819 2.288 1.00 10.00 C ATOM 481 NZ LYS A 45 9.090 6.441 2.661 1.00 10.00 N ATOM 0 H LYS A 45 3.592 5.120 1.477 1.00 10.00 H new ATOM 0 HA LYS A 45 4.147 2.481 2.312 1.00 10.00 H new ATOM 0 HB2 LYS A 45 5.046 5.257 2.965 1.00 10.00 H new ATOM 0 HB3 LYS A 45 5.356 4.034 4.181 1.00 10.00 H new ATOM 0 HG2 LYS A 45 6.508 2.644 2.436 1.00 10.00 H new ATOM 0 HG3 LYS A 45 6.261 3.936 1.279 1.00 10.00 H new ATOM 0 HD2 LYS A 45 7.675 4.427 3.917 1.00 10.00 H new ATOM 0 HD3 LYS A 45 8.538 3.819 2.518 1.00 10.00 H new ATOM 0 HE2 LYS A 45 7.697 5.804 1.202 1.00 10.00 H new ATOM 0 HE3 LYS A 45 6.975 6.427 2.673 1.00 10.00 H new ATOM 0 HZ1 LYS A 45 9.136 7.406 2.275 1.00 10.00 H new ATOM 0 HZ2 LYS A 45 9.172 6.478 3.697 1.00 10.00 H new ATOM 0 HZ3 LYS A 45 9.871 5.875 2.272 1.00 10.00 H new ATOM 495 N ALA A 46 2.251 4.294 4.304 1.00 10.00 N ATOM 496 CA ALA A 46 1.359 4.229 5.458 1.00 10.00 C ATOM 497 C ALA A 46 0.352 3.091 5.307 1.00 10.00 C ATOM 498 O ALA A 46 0.164 2.293 6.227 1.00 10.00 O ATOM 499 CB ALA A 46 0.643 5.558 5.650 1.00 10.00 C ATOM 0 H ALA A 46 2.238 5.189 3.814 1.00 10.00 H new ATOM 0 HA ALA A 46 1.962 4.029 6.344 1.00 10.00 H new ATOM 0 HB1 ALA A 46 -0.018 5.494 6.514 1.00 10.00 H new ATOM 0 HB2 ALA A 46 1.377 6.347 5.813 1.00 10.00 H new ATOM 0 HB3 ALA A 46 0.056 5.787 4.760 1.00 10.00 H new ATOM 505 N TYR A 47 -0.283 3.010 4.143 1.00 10.00 N ATOM 506 CA TYR A 47 -1.252 1.950 3.884 1.00 10.00 C ATOM 507 C TYR A 47 -0.543 0.603 3.822 1.00 10.00 C ATOM 508 O TYR A 47 -1.068 -0.416 4.278 1.00 10.00 O ATOM 509 CB TYR A 47 -2.004 2.212 2.573 1.00 10.00 C ATOM 510 CG TYR A 47 -3.026 1.145 2.227 1.00 10.00 C ATOM 511 CD1 TYR A 47 -2.777 0.207 1.232 1.00 10.00 C ATOM 512 CD2 TYR A 47 -4.237 1.072 2.904 1.00 10.00 C ATOM 513 CE1 TYR A 47 -3.706 -0.768 0.920 1.00 10.00 C ATOM 514 CE2 TYR A 47 -5.170 0.098 2.598 1.00 10.00 C ATOM 515 CZ TYR A 47 -4.903 -0.818 1.607 1.00 10.00 C ATOM 516 OH TYR A 47 -5.828 -1.791 1.302 1.00 10.00 O ATOM 0 H TYR A 47 -0.146 3.660 3.369 1.00 10.00 H new ATOM 0 HA TYR A 47 -1.977 1.935 4.698 1.00 10.00 H new ATOM 0 HB2 TYR A 47 -2.508 3.176 2.641 1.00 10.00 H new ATOM 0 HB3 TYR A 47 -1.282 2.287 1.760 1.00 10.00 H new ATOM 0 HD1 TYR A 47 -1.842 0.240 0.693 1.00 10.00 H new ATOM 0 HD2 TYR A 47 -4.454 1.788 3.683 1.00 10.00 H new ATOM 0 HE1 TYR A 47 -3.497 -1.488 0.142 1.00 10.00 H new ATOM 0 HE2 TYR A 47 -6.106 0.057 3.136 1.00 10.00 H new ATOM 0 HH TYR A 47 -6.614 -1.687 1.878 1.00 10.00 H new ATOM 526 N CYS A 48 0.665 0.613 3.273 1.00 10.00 N ATOM 527 CA CYS A 48 1.463 -0.594 3.144 1.00 10.00 C ATOM 528 C CYS A 48 1.798 -1.178 4.514 1.00 10.00 C ATOM 529 O CYS A 48 1.664 -2.383 4.739 1.00 10.00 O ATOM 530 CB CYS A 48 2.747 -0.294 2.376 1.00 10.00 C ATOM 531 SG CYS A 48 3.476 -1.739 1.589 1.00 10.00 S ATOM 0 H CYS A 48 1.114 1.453 2.908 1.00 10.00 H new ATOM 0 HA CYS A 48 0.879 -1.331 2.592 1.00 10.00 H new ATOM 0 HB2 CYS A 48 2.537 0.456 1.614 1.00 10.00 H new ATOM 0 HB3 CYS A 48 3.475 0.142 3.060 1.00 10.00 H new ATOM 0 HG CYS A 48 3.981 -2.520 2.498 1.00 10.00 H new ATOM 537 N GLU A 49 2.217 -0.315 5.432 1.00 10.00 N ATOM 538 CA GLU A 49 2.559 -0.740 6.783 1.00 10.00 C ATOM 539 C GLU A 49 1.309 -1.214 7.519 1.00 10.00 C ATOM 540 O GLU A 49 1.375 -2.106 8.362 1.00 10.00 O ATOM 541 CB GLU A 49 3.215 0.408 7.555 1.00 10.00 C ATOM 542 CG GLU A 49 4.521 0.898 6.943 1.00 10.00 C ATOM 543 CD GLU A 49 5.601 -0.166 6.926 1.00 10.00 C ATOM 544 OE1 GLU A 49 5.973 -0.656 8.013 1.00 10.00 O ATOM 545 OE2 GLU A 49 6.095 -0.504 5.829 1.00 10.00 O ATOM 0 H GLU A 49 2.328 0.685 5.264 1.00 10.00 H new ATOM 0 HA GLU A 49 3.266 -1.567 6.716 1.00 10.00 H new ATOM 0 HB2 GLU A 49 2.516 1.242 7.610 1.00 10.00 H new ATOM 0 HB3 GLU A 49 3.404 0.083 8.578 1.00 10.00 H new ATOM 0 HG2 GLU A 49 4.334 1.235 5.923 1.00 10.00 H new ATOM 0 HG3 GLU A 49 4.878 1.762 7.504 1.00 10.00 H new ATOM 552 N ARG A 50 0.172 -0.612 7.188 1.00 10.00 N ATOM 553 CA ARG A 50 -1.099 -0.970 7.808 1.00 10.00 C ATOM 554 C ARG A 50 -1.521 -2.376 7.393 1.00 10.00 C ATOM 555 O ARG A 50 -2.104 -3.120 8.180 1.00 10.00 O ATOM 556 CB ARG A 50 -2.185 0.028 7.402 1.00 10.00 C ATOM 557 CG ARG A 50 -3.087 0.451 8.548 1.00 10.00 C ATOM 558 CD ARG A 50 -2.383 1.429 9.473 1.00 10.00 C ATOM 559 NE ARG A 50 -2.787 1.265 10.872 1.00 10.00 N ATOM 560 CZ ARG A 50 -3.989 1.585 11.352 1.00 10.00 C ATOM 561 NH1 ARG A 50 -4.955 2.010 10.544 1.00 10.00 N ATOM 562 NH2 ARG A 50 -4.236 1.445 12.645 1.00 10.00 N ATOM 0 H ARG A 50 0.104 0.129 6.491 1.00 10.00 H new ATOM 0 HA ARG A 50 -0.969 -0.943 8.890 1.00 10.00 H new ATOM 0 HB2 ARG A 50 -1.712 0.914 6.978 1.00 10.00 H new ATOM 0 HB3 ARG A 50 -2.796 -0.414 6.615 1.00 10.00 H new ATOM 0 HG2 ARG A 50 -3.992 0.910 8.151 1.00 10.00 H new ATOM 0 HG3 ARG A 50 -3.397 -0.428 9.113 1.00 10.00 H new ATOM 0 HD2 ARG A 50 -1.305 1.291 9.391 1.00 10.00 H new ATOM 0 HD3 ARG A 50 -2.599 2.448 9.152 1.00 10.00 H new ATOM 0 HE ARG A 50 -2.102 0.880 11.523 1.00 10.00 H new ATOM 0 HH11 ARG A 50 -4.782 2.095 9.542 1.00 10.00 H new ATOM 0 HH12 ARG A 50 -5.870 2.251 10.926 1.00 10.00 H new ATOM 0 HH21 ARG A 50 -3.509 1.094 13.268 1.00 10.00 H new ATOM 0 HH22 ARG A 50 -5.154 1.688 13.018 1.00 10.00 H new ATOM 576 N GLN A 51 -1.223 -2.730 6.150 1.00 10.00 N ATOM 577 CA GLN A 51 -1.575 -4.042 5.624 1.00 10.00 C ATOM 578 C GLN A 51 -0.504 -5.072 5.962 1.00 10.00 C ATOM 579 O GLN A 51 -0.765 -6.276 5.946 1.00 10.00 O ATOM 580 CB GLN A 51 -1.763 -3.969 4.111 1.00 10.00 C ATOM 581 CG GLN A 51 -2.987 -3.175 3.689 1.00 10.00 C ATOM 582 CD GLN A 51 -4.282 -3.908 3.976 1.00 10.00 C ATOM 583 OE1 GLN A 51 -4.840 -3.809 5.069 1.00 10.00 O ATOM 584 NE2 GLN A 51 -4.773 -4.645 2.993 1.00 10.00 N ATOM 0 H GLN A 51 -0.738 -2.126 5.486 1.00 10.00 H new ATOM 0 HA GLN A 51 -2.511 -4.353 6.089 1.00 10.00 H new ATOM 0 HB2 GLN A 51 -0.876 -3.519 3.664 1.00 10.00 H new ATOM 0 HB3 GLN A 51 -1.842 -4.981 3.714 1.00 10.00 H new ATOM 0 HG2 GLN A 51 -2.992 -2.218 4.210 1.00 10.00 H new ATOM 0 HG3 GLN A 51 -2.925 -2.958 2.623 1.00 10.00 H new ATOM 0 HE21 GLN A 51 -4.280 -4.701 2.102 1.00 10.00 H new ATOM 0 HE22 GLN A 51 -5.645 -5.157 3.126 1.00 10.00 H new ATOM 593 N GLY A 52 0.693 -4.596 6.277 1.00 10.00 N ATOM 594 CA GLY A 52 1.786 -5.491 6.598 1.00 10.00 C ATOM 595 C GLY A 52 2.356 -6.131 5.350 1.00 10.00 C ATOM 596 O GLY A 52 2.639 -7.331 5.322 1.00 10.00 O ATOM 0 H GLY A 52 0.927 -3.604 6.316 1.00 10.00 H new ATOM 0 HA2 GLY A 52 2.570 -4.940 7.117 1.00 10.00 H new ATOM 0 HA3 GLY A 52 1.436 -6.266 7.280 1.00 10.00 H new ATOM 600 N LEU A 53 2.517 -5.323 4.311 1.00 10.00 N ATOM 601 CA LEU A 53 3.037 -5.799 3.041 1.00 10.00 C ATOM 602 C LEU A 53 4.220 -4.953 2.592 1.00 10.00 C ATOM 603 O LEU A 53 4.583 -3.975 3.250 1.00 10.00 O ATOM 604 CB LEU A 53 1.940 -5.753 1.972 1.00 10.00 C ATOM 605 CG LEU A 53 0.695 -6.591 2.275 1.00 10.00 C ATOM 606 CD1 LEU A 53 -0.428 -6.248 1.307 1.00 10.00 C ATOM 607 CD2 LEU A 53 1.024 -8.074 2.206 1.00 10.00 C ATOM 0 H LEU A 53 2.292 -4.328 4.326 1.00 10.00 H new ATOM 0 HA LEU A 53 3.371 -6.828 3.174 1.00 10.00 H new ATOM 0 HB2 LEU A 53 1.635 -4.716 1.833 1.00 10.00 H new ATOM 0 HB3 LEU A 53 2.363 -6.090 1.026 1.00 10.00 H new ATOM 0 HG LEU A 53 0.360 -6.358 3.286 1.00 10.00 H new ATOM 0 HD11 LEU A 53 -1.305 -6.853 1.538 1.00 10.00 H new ATOM 0 HD12 LEU A 53 -0.681 -5.192 1.402 1.00 10.00 H new ATOM 0 HD13 LEU A 53 -0.104 -6.453 0.287 1.00 10.00 H new ATOM 0 HD21 LEU A 53 0.128 -8.656 2.424 1.00 10.00 H new ATOM 0 HD22 LEU A 53 1.383 -8.321 1.207 1.00 10.00 H new ATOM 0 HD23 LEU A 53 1.797 -8.310 2.938 1.00 10.00 H new ATOM 619 N SER A 54 4.813 -5.331 1.474 1.00 10.00 N ATOM 620 CA SER A 54 5.942 -4.608 0.921 1.00 10.00 C ATOM 621 C SER A 54 5.460 -3.600 -0.115 1.00 10.00 C ATOM 622 O SER A 54 4.555 -3.890 -0.902 1.00 10.00 O ATOM 623 CB SER A 54 6.932 -5.587 0.288 1.00 10.00 C ATOM 624 OG SER A 54 7.843 -4.917 -0.567 1.00 10.00 O ATOM 0 H SER A 54 4.527 -6.143 0.927 1.00 10.00 H new ATOM 0 HA SER A 54 6.446 -4.070 1.724 1.00 10.00 H new ATOM 0 HB2 SER A 54 7.482 -6.109 1.071 1.00 10.00 H new ATOM 0 HB3 SER A 54 6.388 -6.343 -0.278 1.00 10.00 H new ATOM 0 HG SER A 54 8.120 -4.073 -0.153 1.00 10.00 H new ATOM 630 N MET A 55 6.070 -2.417 -0.117 1.00 10.00 N ATOM 631 CA MET A 55 5.702 -1.365 -1.063 1.00 10.00 C ATOM 632 C MET A 55 6.052 -1.791 -2.485 1.00 10.00 C ATOM 633 O MET A 55 5.545 -1.243 -3.461 1.00 10.00 O ATOM 634 CB MET A 55 6.419 -0.057 -0.713 1.00 10.00 C ATOM 635 CG MET A 55 5.857 1.157 -1.439 1.00 10.00 C ATOM 636 SD MET A 55 6.902 2.619 -1.274 1.00 10.00 S ATOM 637 CE MET A 55 8.379 2.077 -2.133 1.00 10.00 C ATOM 0 H MET A 55 6.821 -2.162 0.525 1.00 10.00 H new ATOM 0 HA MET A 55 4.626 -1.200 -0.999 1.00 10.00 H new ATOM 0 HB2 MET A 55 6.351 0.109 0.362 1.00 10.00 H new ATOM 0 HB3 MET A 55 7.477 -0.157 -0.954 1.00 10.00 H new ATOM 0 HG2 MET A 55 5.738 0.919 -2.496 1.00 10.00 H new ATOM 0 HG3 MET A 55 4.864 1.380 -1.049 1.00 10.00 H new ATOM 0 HE1 MET A 55 8.912 2.944 -2.523 1.00 10.00 H new ATOM 0 HE2 MET A 55 9.024 1.535 -1.441 1.00 10.00 H new ATOM 0 HE3 MET A 55 8.100 1.421 -2.958 1.00 10.00 H new ATOM 647 N ARG A 56 6.915 -2.788 -2.583 1.00 10.00 N ATOM 648 CA ARG A 56 7.350 -3.314 -3.864 1.00 10.00 C ATOM 649 C ARG A 56 6.354 -4.354 -4.374 1.00 10.00 C ATOM 650 O ARG A 56 6.363 -4.722 -5.551 1.00 10.00 O ATOM 651 CB ARG A 56 8.740 -3.936 -3.706 1.00 10.00 C ATOM 652 CG ARG A 56 9.457 -4.215 -5.015 1.00 10.00 C ATOM 653 CD ARG A 56 10.964 -4.185 -4.822 1.00 10.00 C ATOM 654 NE ARG A 56 11.682 -4.648 -6.007 1.00 10.00 N ATOM 655 CZ ARG A 56 12.040 -3.861 -7.022 1.00 10.00 C ATOM 656 NH1 ARG A 56 11.712 -2.571 -7.026 1.00 10.00 N ATOM 657 NH2 ARG A 56 12.715 -4.374 -8.045 1.00 10.00 N ATOM 0 H ARG A 56 7.333 -3.254 -1.778 1.00 10.00 H new ATOM 0 HA ARG A 56 7.399 -2.504 -4.592 1.00 10.00 H new ATOM 0 HB2 ARG A 56 9.356 -3.269 -3.104 1.00 10.00 H new ATOM 0 HB3 ARG A 56 8.646 -4.870 -3.152 1.00 10.00 H new ATOM 0 HG2 ARG A 56 9.155 -5.189 -5.400 1.00 10.00 H new ATOM 0 HG3 ARG A 56 9.166 -3.474 -5.759 1.00 10.00 H new ATOM 0 HD2 ARG A 56 11.278 -3.169 -4.583 1.00 10.00 H new ATOM 0 HD3 ARG A 56 11.232 -4.810 -3.970 1.00 10.00 H new ATOM 0 HE ARG A 56 11.925 -5.637 -6.061 1.00 10.00 H new ATOM 0 HH11 ARG A 56 11.183 -2.177 -6.248 1.00 10.00 H new ATOM 0 HH12 ARG A 56 11.990 -1.976 -7.807 1.00 10.00 H new ATOM 0 HH21 ARG A 56 12.957 -5.365 -8.051 1.00 10.00 H new ATOM 0 HH22 ARG A 56 12.992 -3.777 -8.824 1.00 10.00 H new ATOM 671 N GLN A 57 5.475 -4.796 -3.480 1.00 10.00 N ATOM 672 CA GLN A 57 4.475 -5.805 -3.804 1.00 10.00 C ATOM 673 C GLN A 57 3.174 -5.168 -4.293 1.00 10.00 C ATOM 674 O GLN A 57 2.539 -5.668 -5.218 1.00 10.00 O ATOM 675 CB GLN A 57 4.202 -6.672 -2.572 1.00 10.00 C ATOM 676 CG GLN A 57 3.173 -7.766 -2.797 1.00 10.00 C ATOM 677 CD GLN A 57 2.742 -8.430 -1.504 1.00 10.00 C ATOM 678 OE1 GLN A 57 3.506 -8.498 -0.541 1.00 10.00 O ATOM 679 NE2 GLN A 57 1.510 -8.910 -1.469 1.00 10.00 N ATOM 0 H GLN A 57 5.436 -4.466 -2.516 1.00 10.00 H new ATOM 0 HA GLN A 57 4.866 -6.424 -4.611 1.00 10.00 H new ATOM 0 HB2 GLN A 57 5.137 -7.129 -2.249 1.00 10.00 H new ATOM 0 HB3 GLN A 57 3.863 -6.031 -1.758 1.00 10.00 H new ATOM 0 HG2 GLN A 57 2.300 -7.343 -3.293 1.00 10.00 H new ATOM 0 HG3 GLN A 57 3.588 -8.518 -3.468 1.00 10.00 H new ATOM 0 HE21 GLN A 57 0.909 -8.833 -2.290 1.00 10.00 H new ATOM 0 HE22 GLN A 57 1.161 -9.357 -0.621 1.00 10.00 H new ATOM 688 N ILE A 58 2.779 -4.062 -3.683 1.00 10.00 N ATOM 689 CA ILE A 58 1.542 -3.397 -4.072 1.00 10.00 C ATOM 690 C ILE A 58 1.811 -2.211 -4.997 1.00 10.00 C ATOM 691 O ILE A 58 2.948 -1.762 -5.134 1.00 10.00 O ATOM 692 CB ILE A 58 0.737 -2.923 -2.844 1.00 10.00 C ATOM 693 CG1 ILE A 58 1.606 -2.062 -1.922 1.00 10.00 C ATOM 694 CG2 ILE A 58 0.178 -4.120 -2.088 1.00 10.00 C ATOM 695 CD1 ILE A 58 0.863 -1.525 -0.716 1.00 10.00 C ATOM 0 H ILE A 58 3.289 -3.609 -2.925 1.00 10.00 H new ATOM 0 HA ILE A 58 0.949 -4.136 -4.611 1.00 10.00 H new ATOM 0 HB ILE A 58 -0.095 -2.311 -3.193 1.00 10.00 H new ATOM 0 HG12 ILE A 58 2.456 -2.653 -1.581 1.00 10.00 H new ATOM 0 HG13 ILE A 58 2.008 -1.225 -2.493 1.00 10.00 H new ATOM 0 HG21 ILE A 58 -0.388 -3.772 -1.224 1.00 10.00 H new ATOM 0 HG22 ILE A 58 -0.478 -4.692 -2.745 1.00 10.00 H new ATOM 0 HG23 ILE A 58 0.999 -4.754 -1.753 1.00 10.00 H new ATOM 0 HD11 ILE A 58 1.541 -0.925 -0.109 1.00 10.00 H new ATOM 0 HD12 ILE A 58 0.029 -0.906 -1.048 1.00 10.00 H new ATOM 0 HD13 ILE A 58 0.484 -2.357 -0.122 1.00 10.00 H new ATOM 707 N ARG A 59 0.762 -1.734 -5.655 1.00 10.00 N ATOM 708 CA ARG A 59 0.863 -0.598 -6.564 1.00 10.00 C ATOM 709 C ARG A 59 -0.308 0.345 -6.338 1.00 10.00 C ATOM 710 O ARG A 59 -1.419 -0.100 -6.064 1.00 10.00 O ATOM 711 CB ARG A 59 0.874 -1.064 -8.024 1.00 10.00 C ATOM 712 CG ARG A 59 2.165 -1.750 -8.447 1.00 10.00 C ATOM 713 CD ARG A 59 3.376 -0.852 -8.227 1.00 10.00 C ATOM 714 NE ARG A 59 4.608 -1.458 -8.725 1.00 10.00 N ATOM 715 CZ ARG A 59 5.295 -2.398 -8.075 1.00 10.00 C ATOM 716 NH1 ARG A 59 4.895 -2.814 -6.878 1.00 10.00 N ATOM 717 NH2 ARG A 59 6.395 -2.906 -8.614 1.00 10.00 N ATOM 0 H ARG A 59 -0.178 -2.121 -5.575 1.00 10.00 H new ATOM 0 HA ARG A 59 1.799 -0.078 -6.361 1.00 10.00 H new ATOM 0 HB2 ARG A 59 0.042 -1.750 -8.182 1.00 10.00 H new ATOM 0 HB3 ARG A 59 0.704 -0.203 -8.670 1.00 10.00 H new ATOM 0 HG2 ARG A 59 2.289 -2.674 -7.882 1.00 10.00 H new ATOM 0 HG3 ARG A 59 2.103 -2.026 -9.500 1.00 10.00 H new ATOM 0 HD2 ARG A 59 3.214 0.103 -8.727 1.00 10.00 H new ATOM 0 HD3 ARG A 59 3.481 -0.640 -7.163 1.00 10.00 H new ATOM 0 HE ARG A 59 4.965 -1.142 -9.627 1.00 10.00 H new ATOM 0 HH11 ARG A 59 4.059 -2.414 -6.452 1.00 10.00 H new ATOM 0 HH12 ARG A 59 5.424 -3.533 -6.385 1.00 10.00 H new ATOM 0 HH21 ARG A 59 6.715 -2.578 -9.525 1.00 10.00 H new ATOM 0 HH22 ARG A 59 6.921 -3.625 -8.117 1.00 10.00 H new ATOM 731 N PHE A 60 -0.060 1.639 -6.454 1.00 10.00 N ATOM 732 CA PHE A 60 -1.101 2.634 -6.249 1.00 10.00 C ATOM 733 C PHE A 60 -1.423 3.354 -7.548 1.00 10.00 C ATOM 734 O PHE A 60 -0.523 3.737 -8.299 1.00 10.00 O ATOM 735 CB PHE A 60 -0.677 3.649 -5.189 1.00 10.00 C ATOM 736 CG PHE A 60 -0.790 3.139 -3.779 1.00 10.00 C ATOM 737 CD1 PHE A 60 0.042 2.128 -3.323 1.00 10.00 C ATOM 738 CD2 PHE A 60 -1.720 3.683 -2.907 1.00 10.00 C ATOM 739 CE1 PHE A 60 -0.052 1.668 -2.025 1.00 10.00 C ATOM 740 CE2 PHE A 60 -1.818 3.223 -1.606 1.00 10.00 C ATOM 741 CZ PHE A 60 -0.982 2.217 -1.167 1.00 10.00 C ATOM 0 H PHE A 60 0.854 2.026 -6.689 1.00 10.00 H new ATOM 0 HA PHE A 60 -1.995 2.114 -5.904 1.00 10.00 H new ATOM 0 HB2 PHE A 60 0.355 3.946 -5.376 1.00 10.00 H new ATOM 0 HB3 PHE A 60 -1.290 4.545 -5.291 1.00 10.00 H new ATOM 0 HD1 PHE A 60 0.772 1.695 -3.991 1.00 10.00 H new ATOM 0 HD2 PHE A 60 -2.374 4.473 -3.246 1.00 10.00 H new ATOM 0 HE1 PHE A 60 0.601 0.880 -1.682 1.00 10.00 H new ATOM 0 HE2 PHE A 60 -2.548 3.651 -0.935 1.00 10.00 H new ATOM 0 HZ PHE A 60 -1.056 1.859 -0.151 1.00 10.00 H new ATOM 751 N ARG A 61 -2.708 3.543 -7.807 1.00 10.00 N ATOM 752 CA ARG A 61 -3.147 4.217 -9.018 1.00 10.00 C ATOM 753 C ARG A 61 -4.123 5.334 -8.698 1.00 10.00 C ATOM 754 O ARG A 61 -4.960 5.212 -7.800 1.00 10.00 O ATOM 755 CB ARG A 61 -3.799 3.231 -9.991 1.00 10.00 C ATOM 756 CG ARG A 61 -2.808 2.336 -10.710 1.00 10.00 C ATOM 757 CD ARG A 61 -3.235 2.086 -12.148 1.00 10.00 C ATOM 758 NE ARG A 61 -2.383 1.100 -12.809 1.00 10.00 N ATOM 759 CZ ARG A 61 -2.237 1.003 -14.128 1.00 10.00 C ATOM 760 NH1 ARG A 61 -2.838 1.866 -14.940 1.00 10.00 N ATOM 761 NH2 ARG A 61 -1.471 0.043 -14.639 1.00 10.00 N ATOM 0 H ARG A 61 -3.465 3.239 -7.194 1.00 10.00 H new ATOM 0 HA ARG A 61 -2.262 4.645 -9.489 1.00 10.00 H new ATOM 0 HB2 ARG A 61 -4.506 2.608 -9.443 1.00 10.00 H new ATOM 0 HB3 ARG A 61 -4.373 3.790 -10.730 1.00 10.00 H new ATOM 0 HG2 ARG A 61 -1.821 2.798 -10.696 1.00 10.00 H new ATOM 0 HG3 ARG A 61 -2.723 1.386 -10.183 1.00 10.00 H new ATOM 0 HD2 ARG A 61 -4.269 1.741 -12.164 1.00 10.00 H new ATOM 0 HD3 ARG A 61 -3.203 3.023 -12.704 1.00 10.00 H new ATOM 0 HE ARG A 61 -1.867 0.444 -12.222 1.00 10.00 H new ATOM 0 HH11 ARG A 61 -3.417 2.611 -14.554 1.00 10.00 H new ATOM 0 HH12 ARG A 61 -2.720 1.783 -15.950 1.00 10.00 H new ATOM 0 HH21 ARG A 61 -0.998 -0.616 -14.020 1.00 10.00 H new ATOM 0 HH22 ARG A 61 -1.357 -0.035 -15.650 1.00 10.00 H new ATOM 775 N PHE A 62 -4.000 6.425 -9.434 1.00 10.00 N ATOM 776 CA PHE A 62 -4.866 7.576 -9.274 1.00 10.00 C ATOM 777 C PHE A 62 -5.424 7.980 -10.628 1.00 10.00 C ATOM 778 O PHE A 62 -4.666 8.294 -11.548 1.00 10.00 O ATOM 779 CB PHE A 62 -4.104 8.749 -8.643 1.00 10.00 C ATOM 780 CG PHE A 62 -4.845 10.056 -8.708 1.00 10.00 C ATOM 781 CD1 PHE A 62 -5.936 10.291 -7.888 1.00 10.00 C ATOM 782 CD2 PHE A 62 -4.449 11.046 -9.595 1.00 10.00 C ATOM 783 CE1 PHE A 62 -6.620 11.489 -7.954 1.00 10.00 C ATOM 784 CE2 PHE A 62 -5.130 12.247 -9.662 1.00 10.00 C ATOM 785 CZ PHE A 62 -6.216 12.468 -8.842 1.00 10.00 C ATOM 0 H PHE A 62 -3.294 6.536 -10.161 1.00 10.00 H new ATOM 0 HA PHE A 62 -5.686 7.309 -8.608 1.00 10.00 H new ATOM 0 HB2 PHE A 62 -3.891 8.514 -7.600 1.00 10.00 H new ATOM 0 HB3 PHE A 62 -3.144 8.860 -9.147 1.00 10.00 H new ATOM 0 HD1 PHE A 62 -6.255 9.531 -7.191 1.00 10.00 H new ATOM 0 HD2 PHE A 62 -3.600 10.877 -10.240 1.00 10.00 H new ATOM 0 HE1 PHE A 62 -7.471 11.661 -7.311 1.00 10.00 H new ATOM 0 HE2 PHE A 62 -4.812 13.011 -10.356 1.00 10.00 H new ATOM 0 HZ PHE A 62 -6.750 13.405 -8.893 1.00 10.00 H new ATOM 795 N ASP A 63 -6.745 7.927 -10.754 1.00 10.00 N ATOM 796 CA ASP A 63 -7.431 8.297 -11.989 1.00 10.00 C ATOM 797 C ASP A 63 -6.980 7.416 -13.155 1.00 10.00 C ATOM 798 O ASP A 63 -6.970 7.841 -14.308 1.00 10.00 O ATOM 799 CB ASP A 63 -7.193 9.780 -12.307 1.00 10.00 C ATOM 800 CG ASP A 63 -8.267 10.364 -13.202 1.00 10.00 C ATOM 801 OD1 ASP A 63 -9.463 10.155 -12.913 1.00 10.00 O ATOM 802 OD2 ASP A 63 -7.922 11.044 -14.192 1.00 10.00 O ATOM 0 H ASP A 63 -7.370 7.627 -10.006 1.00 10.00 H new ATOM 0 HA ASP A 63 -8.500 8.138 -11.845 1.00 10.00 H new ATOM 0 HB2 ASP A 63 -7.154 10.346 -11.376 1.00 10.00 H new ATOM 0 HB3 ASP A 63 -6.222 9.893 -12.790 1.00 10.00 H new ATOM 807 N GLY A 64 -6.596 6.184 -12.840 1.00 10.00 N ATOM 808 CA GLY A 64 -6.161 5.251 -13.861 1.00 10.00 C ATOM 809 C GLY A 64 -4.662 5.279 -14.098 1.00 10.00 C ATOM 810 O GLY A 64 -4.110 4.362 -14.707 1.00 10.00 O ATOM 0 H GLY A 64 -6.579 5.814 -11.890 1.00 10.00 H new ATOM 0 HA2 GLY A 64 -6.458 4.243 -13.573 1.00 10.00 H new ATOM 0 HA3 GLY A 64 -6.674 5.479 -14.795 1.00 10.00 H new ATOM 814 N GLN A 65 -3.997 6.315 -13.606 1.00 10.00 N ATOM 815 CA GLN A 65 -2.557 6.456 -13.788 1.00 10.00 C ATOM 816 C GLN A 65 -1.807 6.087 -12.512 1.00 10.00 C ATOM 817 O GLN A 65 -2.224 6.457 -11.418 1.00 10.00 O ATOM 818 CB GLN A 65 -2.214 7.890 -14.195 1.00 10.00 C ATOM 819 CG GLN A 65 -2.789 8.295 -15.543 1.00 10.00 C ATOM 820 CD GLN A 65 -2.232 7.465 -16.683 1.00 10.00 C ATOM 821 OE1 GLN A 65 -2.775 6.415 -17.027 1.00 10.00 O ATOM 822 NE2 GLN A 65 -1.146 7.933 -17.274 1.00 10.00 N ATOM 0 H GLN A 65 -4.431 7.071 -13.077 1.00 10.00 H new ATOM 0 HA GLN A 65 -2.248 5.774 -14.580 1.00 10.00 H new ATOM 0 HB2 GLN A 65 -2.584 8.574 -13.431 1.00 10.00 H new ATOM 0 HB3 GLN A 65 -1.130 8.001 -14.224 1.00 10.00 H new ATOM 0 HG2 GLN A 65 -3.874 8.191 -15.518 1.00 10.00 H new ATOM 0 HG3 GLN A 65 -2.574 9.348 -15.725 1.00 10.00 H new ATOM 0 HE21 GLN A 65 -0.729 8.808 -16.956 1.00 10.00 H new ATOM 0 HE22 GLN A 65 -0.725 7.419 -18.048 1.00 10.00 H new ATOM 831 N PRO A 66 -0.701 5.337 -12.631 1.00 10.00 N ATOM 832 CA PRO A 66 0.106 4.936 -11.473 1.00 10.00 C ATOM 833 C PRO A 66 0.735 6.137 -10.770 1.00 10.00 C ATOM 834 O PRO A 66 1.242 7.060 -11.418 1.00 10.00 O ATOM 835 CB PRO A 66 1.188 4.033 -12.073 1.00 10.00 C ATOM 836 CG PRO A 66 1.234 4.378 -13.520 1.00 10.00 C ATOM 837 CD PRO A 66 -0.155 4.811 -13.896 1.00 10.00 C ATOM 0 HA PRO A 66 -0.495 4.439 -10.711 1.00 10.00 H new ATOM 0 HB2 PRO A 66 2.153 4.207 -11.597 1.00 10.00 H new ATOM 0 HB3 PRO A 66 0.946 2.980 -11.928 1.00 10.00 H new ATOM 0 HG2 PRO A 66 1.953 5.175 -13.707 1.00 10.00 H new ATOM 0 HG3 PRO A 66 1.548 3.520 -14.114 1.00 10.00 H new ATOM 0 HD2 PRO A 66 -0.142 5.573 -14.676 1.00 10.00 H new ATOM 0 HD3 PRO A 66 -0.747 3.978 -14.274 1.00 10.00 H new ATOM 845 N ILE A 67 0.697 6.123 -9.447 1.00 10.00 N ATOM 846 CA ILE A 67 1.255 7.211 -8.652 1.00 10.00 C ATOM 847 C ILE A 67 2.760 7.038 -8.489 1.00 10.00 C ATOM 848 O ILE A 67 3.246 5.924 -8.278 1.00 10.00 O ATOM 849 CB ILE A 67 0.593 7.287 -7.256 1.00 10.00 C ATOM 850 CG1 ILE A 67 -0.929 7.372 -7.394 1.00 10.00 C ATOM 851 CG2 ILE A 67 1.125 8.481 -6.471 1.00 10.00 C ATOM 852 CD1 ILE A 67 -1.658 7.452 -6.069 1.00 10.00 C ATOM 0 H ILE A 67 0.285 5.369 -8.898 1.00 10.00 H new ATOM 0 HA ILE A 67 1.052 8.140 -9.184 1.00 10.00 H new ATOM 0 HB ILE A 67 0.843 6.379 -6.707 1.00 10.00 H new ATOM 0 HG12 ILE A 67 -1.182 8.248 -7.991 1.00 10.00 H new ATOM 0 HG13 ILE A 67 -1.284 6.499 -7.942 1.00 10.00 H new ATOM 0 HG21 ILE A 67 0.646 8.516 -5.492 1.00 10.00 H new ATOM 0 HG22 ILE A 67 2.203 8.382 -6.344 1.00 10.00 H new ATOM 0 HG23 ILE A 67 0.907 9.400 -7.014 1.00 10.00 H new ATOM 0 HD11 ILE A 67 -2.732 7.510 -6.247 1.00 10.00 H new ATOM 0 HD12 ILE A 67 -1.436 6.564 -5.477 1.00 10.00 H new ATOM 0 HD13 ILE A 67 -1.332 8.340 -5.527 1.00 10.00 H new ATOM 864 N ASN A 68 3.497 8.137 -8.600 1.00 10.00 N ATOM 865 CA ASN A 68 4.942 8.102 -8.450 1.00 10.00 C ATOM 866 C ASN A 68 5.316 8.316 -6.993 1.00 10.00 C ATOM 867 O ASN A 68 4.520 8.835 -6.208 1.00 10.00 O ATOM 868 CB ASN A 68 5.614 9.178 -9.311 1.00 10.00 C ATOM 869 CG ASN A 68 5.341 9.005 -10.791 1.00 10.00 C ATOM 870 OD1 ASN A 68 6.032 8.254 -11.480 1.00 10.00 O ATOM 871 ND2 ASN A 68 4.335 9.707 -11.290 1.00 10.00 N ATOM 0 H ASN A 68 3.115 9.063 -8.794 1.00 10.00 H new ATOM 0 HA ASN A 68 5.292 7.124 -8.782 1.00 10.00 H new ATOM 0 HB2 ASN A 68 5.264 10.160 -8.995 1.00 10.00 H new ATOM 0 HB3 ASN A 68 6.690 9.153 -9.140 1.00 10.00 H new ATOM 0 HD21 ASN A 68 4.107 9.637 -12.282 1.00 10.00 H new ATOM 0 HD22 ASN A 68 3.788 10.317 -10.683 1.00 10.00 H new ATOM 878 N GLU A 69 6.535 7.950 -6.636 1.00 10.00 N ATOM 879 CA GLU A 69 7.008 8.100 -5.266 1.00 10.00 C ATOM 880 C GLU A 69 7.436 9.541 -4.992 1.00 10.00 C ATOM 881 O GLU A 69 8.097 9.822 -3.995 1.00 10.00 O ATOM 882 CB GLU A 69 8.171 7.142 -5.003 1.00 10.00 C ATOM 883 CG GLU A 69 7.785 5.676 -5.105 1.00 10.00 C ATOM 884 CD GLU A 69 8.990 4.762 -5.199 1.00 10.00 C ATOM 885 OE1 GLU A 69 10.059 5.115 -4.654 1.00 10.00 O ATOM 886 OE2 GLU A 69 8.878 3.687 -5.825 1.00 10.00 O ATOM 0 H GLU A 69 7.219 7.546 -7.276 1.00 10.00 H new ATOM 0 HA GLU A 69 6.188 7.855 -4.591 1.00 10.00 H new ATOM 0 HB2 GLU A 69 8.970 7.349 -5.715 1.00 10.00 H new ATOM 0 HB3 GLU A 69 8.572 7.335 -4.008 1.00 10.00 H new ATOM 0 HG2 GLU A 69 7.190 5.399 -4.234 1.00 10.00 H new ATOM 0 HG3 GLU A 69 7.154 5.530 -5.982 1.00 10.00 H new ATOM 893 N THR A 70 7.061 10.446 -5.880 1.00 10.00 N ATOM 894 CA THR A 70 7.396 11.852 -5.730 1.00 10.00 C ATOM 895 C THR A 70 6.184 12.736 -6.019 1.00 10.00 C ATOM 896 O THR A 70 6.299 13.959 -6.126 1.00 10.00 O ATOM 897 CB THR A 70 8.552 12.242 -6.667 1.00 10.00 C ATOM 898 OG1 THR A 70 8.506 11.433 -7.852 1.00 10.00 O ATOM 899 CG2 THR A 70 9.895 12.061 -5.978 1.00 10.00 C ATOM 0 H THR A 70 6.521 10.230 -6.718 1.00 10.00 H new ATOM 0 HA THR A 70 7.708 12.007 -4.697 1.00 10.00 H new ATOM 0 HB THR A 70 8.440 13.293 -6.933 1.00 10.00 H new ATOM 0 HG1 THR A 70 9.242 11.684 -8.448 1.00 10.00 H new ATOM 0 HG21 THR A 70 10.696 12.343 -6.662 1.00 10.00 H new ATOM 0 HG22 THR A 70 9.936 12.692 -5.090 1.00 10.00 H new ATOM 0 HG23 THR A 70 10.017 11.018 -5.688 1.00 10.00 H new ATOM 907 N ASP A 71 5.020 12.108 -6.131 1.00 10.00 N ATOM 908 CA ASP A 71 3.785 12.829 -6.416 1.00 10.00 C ATOM 909 C ASP A 71 3.146 13.332 -5.129 1.00 10.00 C ATOM 910 O ASP A 71 3.328 12.744 -4.060 1.00 10.00 O ATOM 911 CB ASP A 71 2.787 11.930 -7.157 1.00 10.00 C ATOM 912 CG ASP A 71 3.019 11.886 -8.658 1.00 10.00 C ATOM 913 OD1 ASP A 71 3.325 12.939 -9.249 1.00 10.00 O ATOM 914 OD2 ASP A 71 2.876 10.793 -9.252 1.00 10.00 O ATOM 0 H ASP A 71 4.905 11.100 -6.029 1.00 10.00 H new ATOM 0 HA ASP A 71 4.038 13.680 -7.049 1.00 10.00 H new ATOM 0 HB2 ASP A 71 2.852 10.918 -6.756 1.00 10.00 H new ATOM 0 HB3 ASP A 71 1.775 12.285 -6.963 1.00 10.00 H new ATOM 919 N THR A 72 2.412 14.427 -5.235 1.00 10.00 N ATOM 920 CA THR A 72 1.722 15.007 -4.096 1.00 10.00 C ATOM 921 C THR A 72 0.270 15.279 -4.474 1.00 10.00 C ATOM 922 O THR A 72 -0.046 15.387 -5.662 1.00 10.00 O ATOM 923 CB THR A 72 2.389 16.322 -3.631 1.00 10.00 C ATOM 924 OG1 THR A 72 2.737 17.125 -4.762 1.00 10.00 O ATOM 925 CG2 THR A 72 3.631 16.048 -2.802 1.00 10.00 C ATOM 0 H THR A 72 2.278 14.936 -6.108 1.00 10.00 H new ATOM 0 HA THR A 72 1.774 14.297 -3.271 1.00 10.00 H new ATOM 0 HB THR A 72 1.671 16.857 -3.009 1.00 10.00 H new ATOM 0 HG1 THR A 72 3.157 17.956 -4.456 1.00 10.00 H new ATOM 0 HG21 THR A 72 4.076 16.993 -2.491 1.00 10.00 H new ATOM 0 HG22 THR A 72 3.359 15.467 -1.921 1.00 10.00 H new ATOM 0 HG23 THR A 72 4.350 15.487 -3.399 1.00 10.00 H new ATOM 933 N PRO A 73 -0.637 15.386 -3.485 1.00 10.00 N ATOM 934 CA PRO A 73 -2.054 15.657 -3.750 1.00 10.00 C ATOM 935 C PRO A 73 -2.245 16.903 -4.609 1.00 10.00 C ATOM 936 O PRO A 73 -3.029 16.902 -5.555 1.00 10.00 O ATOM 937 CB PRO A 73 -2.649 15.868 -2.354 1.00 10.00 C ATOM 938 CG PRO A 73 -1.737 15.130 -1.438 1.00 10.00 C ATOM 939 CD PRO A 73 -0.366 15.235 -2.041 1.00 10.00 C ATOM 0 HA PRO A 73 -2.529 14.848 -4.305 1.00 10.00 H new ATOM 0 HB2 PRO A 73 -2.694 16.927 -2.099 1.00 10.00 H new ATOM 0 HB3 PRO A 73 -3.667 15.482 -2.295 1.00 10.00 H new ATOM 0 HG2 PRO A 73 -1.757 15.562 -0.437 1.00 10.00 H new ATOM 0 HG3 PRO A 73 -2.041 14.088 -1.341 1.00 10.00 H new ATOM 0 HD2 PRO A 73 0.183 16.089 -1.644 1.00 10.00 H new ATOM 0 HD3 PRO A 73 0.232 14.347 -1.835 1.00 10.00 H new ATOM 947 N ALA A 74 -1.507 17.955 -4.286 1.00 10.00 N ATOM 948 CA ALA A 74 -1.592 19.205 -5.028 1.00 10.00 C ATOM 949 C ALA A 74 -1.009 19.063 -6.434 1.00 10.00 C ATOM 950 O ALA A 74 -1.534 19.626 -7.393 1.00 10.00 O ATOM 951 CB ALA A 74 -0.880 20.311 -4.268 1.00 10.00 C ATOM 0 H ALA A 74 -0.841 17.968 -3.513 1.00 10.00 H new ATOM 0 HA ALA A 74 -2.646 19.464 -5.133 1.00 10.00 H new ATOM 0 HB1 ALA A 74 -0.949 21.242 -4.831 1.00 10.00 H new ATOM 0 HB2 ALA A 74 -1.348 20.441 -3.292 1.00 10.00 H new ATOM 0 HB3 ALA A 74 0.168 20.044 -4.135 1.00 10.00 H new ATOM 957 N GLN A 75 0.066 18.286 -6.550 1.00 10.00 N ATOM 958 CA GLN A 75 0.730 18.065 -7.836 1.00 10.00 C ATOM 959 C GLN A 75 -0.212 17.409 -8.837 1.00 10.00 C ATOM 960 O GLN A 75 -0.246 17.784 -10.009 1.00 10.00 O ATOM 961 CB GLN A 75 1.964 17.179 -7.652 1.00 10.00 C ATOM 962 CG GLN A 75 2.905 17.176 -8.845 1.00 10.00 C ATOM 963 CD GLN A 75 3.647 18.488 -9.004 1.00 10.00 C ATOM 964 OE1 GLN A 75 3.891 19.199 -8.032 1.00 10.00 O ATOM 965 NE2 GLN A 75 4.018 18.815 -10.228 1.00 10.00 N ATOM 0 H GLN A 75 0.498 17.797 -5.766 1.00 10.00 H new ATOM 0 HA GLN A 75 1.031 19.038 -8.223 1.00 10.00 H new ATOM 0 HB2 GLN A 75 2.511 17.514 -6.771 1.00 10.00 H new ATOM 0 HB3 GLN A 75 1.639 16.157 -7.456 1.00 10.00 H new ATOM 0 HG2 GLN A 75 3.626 16.366 -8.733 1.00 10.00 H new ATOM 0 HG3 GLN A 75 2.336 16.972 -9.752 1.00 10.00 H new ATOM 0 HE21 GLN A 75 3.797 18.198 -11.010 1.00 10.00 H new ATOM 0 HE22 GLN A 75 4.526 19.684 -10.392 1.00 10.00 H new ATOM 974 N LEU A 76 -0.975 16.430 -8.370 1.00 10.00 N ATOM 975 CA LEU A 76 -1.910 15.715 -9.231 1.00 10.00 C ATOM 976 C LEU A 76 -3.278 16.390 -9.244 1.00 10.00 C ATOM 977 O LEU A 76 -4.231 15.855 -9.812 1.00 10.00 O ATOM 978 CB LEU A 76 -2.057 14.262 -8.772 1.00 10.00 C ATOM 979 CG LEU A 76 -0.750 13.480 -8.636 1.00 10.00 C ATOM 980 CD1 LEU A 76 -1.034 12.045 -8.232 1.00 10.00 C ATOM 981 CD2 LEU A 76 0.035 13.519 -9.936 1.00 10.00 C ATOM 0 H LEU A 76 -0.966 16.112 -7.401 1.00 10.00 H new ATOM 0 HA LEU A 76 -1.506 15.734 -10.243 1.00 10.00 H new ATOM 0 HB2 LEU A 76 -2.567 14.253 -7.809 1.00 10.00 H new ATOM 0 HB3 LEU A 76 -2.701 13.739 -9.479 1.00 10.00 H new ATOM 0 HG LEU A 76 -0.148 13.949 -7.858 1.00 10.00 H new ATOM 0 HD11 LEU A 76 -0.094 11.500 -8.139 1.00 10.00 H new ATOM 0 HD12 LEU A 76 -1.557 12.033 -7.276 1.00 10.00 H new ATOM 0 HD13 LEU A 76 -1.655 11.570 -8.991 1.00 10.00 H new ATOM 0 HD21 LEU A 76 0.962 12.957 -9.819 1.00 10.00 H new ATOM 0 HD22 LEU A 76 -0.560 13.075 -10.734 1.00 10.00 H new ATOM 0 HD23 LEU A 76 0.268 14.553 -10.190 1.00 10.00 H new ATOM 993 N GLU A 77 -3.362 17.563 -8.615 1.00 10.00 N ATOM 994 CA GLU A 77 -4.609 18.330 -8.549 1.00 10.00 C ATOM 995 C GLU A 77 -5.727 17.508 -7.918 1.00 10.00 C ATOM 996 O GLU A 77 -6.865 17.523 -8.384 1.00 10.00 O ATOM 997 CB GLU A 77 -5.023 18.802 -9.945 1.00 10.00 C ATOM 998 CG GLU A 77 -4.113 19.874 -10.517 1.00 10.00 C ATOM 999 CD GLU A 77 -4.491 21.268 -10.059 1.00 10.00 C ATOM 1000 OE1 GLU A 77 -5.093 21.404 -8.973 1.00 10.00 O ATOM 1001 OE2 GLU A 77 -4.186 22.238 -10.787 1.00 10.00 O ATOM 0 H GLU A 77 -2.575 18.006 -8.140 1.00 10.00 H new ATOM 0 HA GLU A 77 -4.432 19.203 -7.921 1.00 10.00 H new ATOM 0 HB2 GLU A 77 -5.033 17.947 -10.621 1.00 10.00 H new ATOM 0 HB3 GLU A 77 -6.042 19.187 -9.902 1.00 10.00 H new ATOM 0 HG2 GLU A 77 -3.084 19.666 -10.223 1.00 10.00 H new ATOM 0 HG3 GLU A 77 -4.148 19.832 -11.606 1.00 10.00 H new ATOM 1008 N MET A 78 -5.397 16.799 -6.850 1.00 10.00 N ATOM 1009 CA MET A 78 -6.370 15.969 -6.154 1.00 10.00 C ATOM 1010 C MET A 78 -7.262 16.830 -5.278 1.00 10.00 C ATOM 1011 O MET A 78 -6.787 17.734 -4.581 1.00 10.00 O ATOM 1012 CB MET A 78 -5.670 14.909 -5.300 1.00 10.00 C ATOM 1013 CG MET A 78 -4.694 14.050 -6.083 1.00 10.00 C ATOM 1014 SD MET A 78 -3.791 12.886 -5.043 1.00 10.00 S ATOM 1015 CE MET A 78 -5.104 11.760 -4.574 1.00 10.00 C ATOM 0 H MET A 78 -4.461 16.781 -6.445 1.00 10.00 H new ATOM 0 HA MET A 78 -6.982 15.463 -6.901 1.00 10.00 H new ATOM 0 HB2 MET A 78 -5.137 15.402 -4.487 1.00 10.00 H new ATOM 0 HB3 MET A 78 -6.423 14.266 -4.844 1.00 10.00 H new ATOM 0 HG2 MET A 78 -5.238 13.498 -6.849 1.00 10.00 H new ATOM 0 HG3 MET A 78 -3.983 14.695 -6.599 1.00 10.00 H new ATOM 0 HE1 MET A 78 -5.344 11.900 -3.520 1.00 10.00 H new ATOM 0 HE2 MET A 78 -5.989 11.961 -5.178 1.00 10.00 H new ATOM 0 HE3 MET A 78 -4.779 10.733 -4.739 1.00 10.00 H new ATOM 1025 N GLU A 79 -8.553 16.559 -5.315 1.00 10.00 N ATOM 1026 CA GLU A 79 -9.499 17.314 -4.521 1.00 10.00 C ATOM 1027 C GLU A 79 -9.986 16.486 -3.344 1.00 10.00 C ATOM 1028 O GLU A 79 -9.713 15.288 -3.256 1.00 10.00 O ATOM 1029 CB GLU A 79 -10.682 17.774 -5.374 1.00 10.00 C ATOM 1030 CG GLU A 79 -10.678 19.266 -5.668 1.00 10.00 C ATOM 1031 CD GLU A 79 -11.009 20.109 -4.452 1.00 10.00 C ATOM 1032 OE1 GLU A 79 -11.887 20.993 -4.551 1.00 10.00 O ATOM 1033 OE2 GLU A 79 -10.393 19.900 -3.383 1.00 10.00 O ATOM 0 H GLU A 79 -8.968 15.823 -5.886 1.00 10.00 H new ATOM 0 HA GLU A 79 -8.990 18.199 -4.138 1.00 10.00 H new ATOM 0 HB2 GLU A 79 -10.674 17.227 -6.317 1.00 10.00 H new ATOM 0 HB3 GLU A 79 -11.610 17.515 -4.863 1.00 10.00 H new ATOM 0 HG2 GLU A 79 -9.697 19.554 -6.047 1.00 10.00 H new ATOM 0 HG3 GLU A 79 -11.399 19.477 -6.457 1.00 10.00 H new ATOM 1040 N ASP A 80 -10.702 17.136 -2.442 1.00 10.00 N ATOM 1041 CA ASP A 80 -11.228 16.476 -1.256 1.00 10.00 C ATOM 1042 C ASP A 80 -12.254 15.414 -1.641 1.00 10.00 C ATOM 1043 O ASP A 80 -12.915 15.532 -2.679 1.00 10.00 O ATOM 1044 CB ASP A 80 -11.864 17.514 -0.323 1.00 10.00 C ATOM 1045 CG ASP A 80 -11.872 17.073 1.126 1.00 10.00 C ATOM 1046 OD1 ASP A 80 -12.910 16.567 1.591 1.00 10.00 O ATOM 1047 OD2 ASP A 80 -10.836 17.241 1.807 1.00 10.00 O ATOM 0 H ASP A 80 -10.934 18.127 -2.508 1.00 10.00 H new ATOM 0 HA ASP A 80 -10.406 15.984 -0.736 1.00 10.00 H new ATOM 0 HB2 ASP A 80 -11.320 18.455 -0.409 1.00 10.00 H new ATOM 0 HB3 ASP A 80 -12.887 17.707 -0.645 1.00 10.00 H new ATOM 1052 N GLU A 81 -12.353 14.371 -0.816 1.00 10.00 N ATOM 1053 CA GLU A 81 -13.293 13.271 -1.033 1.00 10.00 C ATOM 1054 C GLU A 81 -12.941 12.461 -2.279 1.00 10.00 C ATOM 1055 O GLU A 81 -13.826 11.953 -2.972 1.00 10.00 O ATOM 1056 CB GLU A 81 -14.729 13.792 -1.136 1.00 10.00 C ATOM 1057 CG GLU A 81 -15.441 13.888 0.202 1.00 10.00 C ATOM 1058 CD GLU A 81 -15.627 12.539 0.861 1.00 10.00 C ATOM 1059 OE1 GLU A 81 -16.093 11.597 0.183 1.00 10.00 O ATOM 1060 OE2 GLU A 81 -15.322 12.412 2.064 1.00 10.00 O ATOM 0 H GLU A 81 -11.783 14.265 0.023 1.00 10.00 H new ATOM 0 HA GLU A 81 -13.217 12.611 -0.169 1.00 10.00 H new ATOM 0 HB2 GLU A 81 -14.716 14.777 -1.602 1.00 10.00 H new ATOM 0 HB3 GLU A 81 -15.298 13.135 -1.794 1.00 10.00 H new ATOM 0 HG2 GLU A 81 -14.871 14.537 0.867 1.00 10.00 H new ATOM 0 HG3 GLU A 81 -16.415 14.355 0.058 1.00 10.00 H new ATOM 1067 N ASP A 82 -11.651 12.330 -2.552 1.00 10.00 N ATOM 1068 CA ASP A 82 -11.201 11.570 -3.712 1.00 10.00 C ATOM 1069 C ASP A 82 -10.953 10.115 -3.331 1.00 10.00 C ATOM 1070 O ASP A 82 -11.010 9.756 -2.153 1.00 10.00 O ATOM 1071 CB ASP A 82 -9.932 12.179 -4.310 1.00 10.00 C ATOM 1072 CG ASP A 82 -9.932 12.108 -5.823 1.00 10.00 C ATOM 1073 OD1 ASP A 82 -9.980 10.985 -6.371 1.00 10.00 O ATOM 1074 OD2 ASP A 82 -9.897 13.174 -6.472 1.00 10.00 O ATOM 0 H ASP A 82 -10.902 12.736 -1.992 1.00 10.00 H new ATOM 0 HA ASP A 82 -11.988 11.610 -4.465 1.00 10.00 H new ATOM 0 HB2 ASP A 82 -9.845 13.219 -3.995 1.00 10.00 H new ATOM 0 HB3 ASP A 82 -9.059 11.654 -3.922 1.00 10.00 H new ATOM 1079 N THR A 83 -10.672 9.282 -4.322 1.00 10.00 N ATOM 1080 CA THR A 83 -10.436 7.865 -4.088 1.00 10.00 C ATOM 1081 C THR A 83 -9.152 7.388 -4.773 1.00 10.00 C ATOM 1082 O THR A 83 -8.878 7.746 -5.917 1.00 10.00 O ATOM 1083 CB THR A 83 -11.629 7.025 -4.592 1.00 10.00 C ATOM 1084 OG1 THR A 83 -12.857 7.586 -4.101 1.00 10.00 O ATOM 1085 CG2 THR A 83 -11.510 5.577 -4.137 1.00 10.00 C ATOM 0 H THR A 83 -10.602 9.564 -5.300 1.00 10.00 H new ATOM 0 HA THR A 83 -10.325 7.729 -3.012 1.00 10.00 H new ATOM 0 HB THR A 83 -11.625 7.044 -5.682 1.00 10.00 H new ATOM 0 HG1 THR A 83 -13.613 7.052 -4.424 1.00 10.00 H new ATOM 0 HG21 THR A 83 -12.364 5.008 -4.506 1.00 10.00 H new ATOM 0 HG22 THR A 83 -10.589 5.146 -4.531 1.00 10.00 H new ATOM 0 HG23 THR A 83 -11.492 5.538 -3.048 1.00 10.00 H new ATOM 1093 N ILE A 84 -8.367 6.591 -4.056 1.00 10.00 N ATOM 1094 CA ILE A 84 -7.121 6.049 -4.582 1.00 10.00 C ATOM 1095 C ILE A 84 -7.230 4.528 -4.709 1.00 10.00 C ATOM 1096 O ILE A 84 -7.813 3.868 -3.844 1.00 10.00 O ATOM 1097 CB ILE A 84 -5.920 6.411 -3.678 1.00 10.00 C ATOM 1098 CG1 ILE A 84 -5.887 7.922 -3.423 1.00 10.00 C ATOM 1099 CG2 ILE A 84 -4.610 5.947 -4.306 1.00 10.00 C ATOM 1100 CD1 ILE A 84 -4.825 8.354 -2.434 1.00 10.00 C ATOM 0 H ILE A 84 -8.575 6.304 -3.100 1.00 10.00 H new ATOM 0 HA ILE A 84 -6.951 6.491 -5.564 1.00 10.00 H new ATOM 0 HB ILE A 84 -6.039 5.897 -2.724 1.00 10.00 H new ATOM 0 HG12 ILE A 84 -5.719 8.437 -4.369 1.00 10.00 H new ATOM 0 HG13 ILE A 84 -6.863 8.240 -3.056 1.00 10.00 H new ATOM 0 HG21 ILE A 84 -3.779 6.212 -3.652 1.00 10.00 H new ATOM 0 HG22 ILE A 84 -4.634 4.866 -4.441 1.00 10.00 H new ATOM 0 HG23 ILE A 84 -4.479 6.431 -5.274 1.00 10.00 H new ATOM 0 HD11 ILE A 84 -4.865 9.436 -2.307 1.00 10.00 H new ATOM 0 HD12 ILE A 84 -5.003 7.869 -1.474 1.00 10.00 H new ATOM 0 HD13 ILE A 84 -3.842 8.069 -2.808 1.00 10.00 H new ATOM 1112 N ASP A 85 -6.674 3.983 -5.785 1.00 10.00 N ATOM 1113 CA ASP A 85 -6.731 2.547 -6.040 1.00 10.00 C ATOM 1114 C ASP A 85 -5.428 1.857 -5.641 1.00 10.00 C ATOM 1115 O ASP A 85 -4.349 2.447 -5.736 1.00 10.00 O ATOM 1116 CB ASP A 85 -7.010 2.295 -7.522 1.00 10.00 C ATOM 1117 CG ASP A 85 -7.906 1.097 -7.752 1.00 10.00 C ATOM 1118 OD1 ASP A 85 -7.849 0.141 -6.959 1.00 10.00 O ATOM 1119 OD2 ASP A 85 -8.679 1.111 -8.730 1.00 10.00 O ATOM 0 H ASP A 85 -6.176 4.516 -6.498 1.00 10.00 H new ATOM 0 HA ASP A 85 -7.536 2.130 -5.435 1.00 10.00 H new ATOM 0 HB2 ASP A 85 -7.475 3.180 -7.956 1.00 10.00 H new ATOM 0 HB3 ASP A 85 -6.066 2.143 -8.045 1.00 10.00 H new ATOM 1124 N VAL A 86 -5.535 0.604 -5.202 1.00 10.00 N ATOM 1125 CA VAL A 86 -4.372 -0.179 -4.789 1.00 10.00 C ATOM 1126 C VAL A 86 -4.412 -1.568 -5.416 1.00 10.00 C ATOM 1127 O VAL A 86 -5.305 -2.364 -5.124 1.00 10.00 O ATOM 1128 CB VAL A 86 -4.291 -0.338 -3.255 1.00 10.00 C ATOM 1129 CG1 VAL A 86 -3.000 -1.041 -2.857 1.00 10.00 C ATOM 1130 CG2 VAL A 86 -4.398 1.010 -2.560 1.00 10.00 C ATOM 0 H VAL A 86 -6.422 0.107 -5.123 1.00 10.00 H new ATOM 0 HA VAL A 86 -3.493 0.367 -5.131 1.00 10.00 H new ATOM 0 HB VAL A 86 -5.133 -0.952 -2.936 1.00 10.00 H new ATOM 0 HG11 VAL A 86 -2.961 -1.144 -1.773 1.00 10.00 H new ATOM 0 HG12 VAL A 86 -2.967 -2.029 -3.317 1.00 10.00 H new ATOM 0 HG13 VAL A 86 -2.147 -0.454 -3.197 1.00 10.00 H new ATOM 0 HG21 VAL A 86 -4.338 0.869 -1.481 1.00 10.00 H new ATOM 0 HG22 VAL A 86 -3.582 1.654 -2.888 1.00 10.00 H new ATOM 0 HG23 VAL A 86 -5.351 1.475 -2.813 1.00 10.00 H new ATOM 1140 N PHE A 87 -3.449 -1.858 -6.272 1.00 10.00 N ATOM 1141 CA PHE A 87 -3.380 -3.150 -6.941 1.00 10.00 C ATOM 1142 C PHE A 87 -2.228 -3.984 -6.395 1.00 10.00 C ATOM 1143 O PHE A 87 -1.387 -3.484 -5.647 1.00 10.00 O ATOM 1144 CB PHE A 87 -3.210 -2.960 -8.453 1.00 10.00 C ATOM 1145 CG PHE A 87 -4.407 -2.347 -9.123 1.00 10.00 C ATOM 1146 CD1 PHE A 87 -5.505 -3.125 -9.447 1.00 10.00 C ATOM 1147 CD2 PHE A 87 -4.432 -0.997 -9.430 1.00 10.00 C ATOM 1148 CE1 PHE A 87 -6.608 -2.569 -10.064 1.00 10.00 C ATOM 1149 CE2 PHE A 87 -5.533 -0.434 -10.047 1.00 10.00 C ATOM 1150 CZ PHE A 87 -6.621 -1.221 -10.364 1.00 10.00 C ATOM 0 H PHE A 87 -2.699 -1.214 -6.523 1.00 10.00 H new ATOM 0 HA PHE A 87 -4.314 -3.678 -6.749 1.00 10.00 H new ATOM 0 HB2 PHE A 87 -2.340 -2.329 -8.635 1.00 10.00 H new ATOM 0 HB3 PHE A 87 -3.004 -3.927 -8.911 1.00 10.00 H new ATOM 0 HD1 PHE A 87 -5.499 -4.180 -9.214 1.00 10.00 H new ATOM 0 HD2 PHE A 87 -3.582 -0.377 -9.185 1.00 10.00 H new ATOM 0 HE1 PHE A 87 -7.459 -3.187 -10.311 1.00 10.00 H new ATOM 0 HE2 PHE A 87 -5.542 0.620 -10.281 1.00 10.00 H new ATOM 0 HZ PHE A 87 -7.482 -0.783 -10.846 1.00 10.00 H new ATOM 1160 N GLN A 88 -2.198 -5.253 -6.774 1.00 10.00 N ATOM 1161 CA GLN A 88 -1.154 -6.165 -6.333 1.00 10.00 C ATOM 1162 C GLN A 88 -0.310 -6.605 -7.523 1.00 10.00 C ATOM 1163 O GLN A 88 -0.844 -6.876 -8.602 1.00 10.00 O ATOM 1164 CB GLN A 88 -1.769 -7.389 -5.649 1.00 10.00 C ATOM 1165 CG GLN A 88 -2.372 -7.089 -4.284 1.00 10.00 C ATOM 1166 CD GLN A 88 -1.456 -7.480 -3.137 1.00 10.00 C ATOM 1167 OE1 GLN A 88 -0.234 -7.488 -3.274 1.00 10.00 O ATOM 1168 NE2 GLN A 88 -2.043 -7.803 -1.996 1.00 10.00 N ATOM 0 H GLN A 88 -2.891 -5.677 -7.391 1.00 10.00 H new ATOM 0 HA GLN A 88 -0.518 -5.646 -5.616 1.00 10.00 H new ATOM 0 HB2 GLN A 88 -2.543 -7.804 -6.295 1.00 10.00 H new ATOM 0 HB3 GLN A 88 -1.002 -8.155 -5.537 1.00 10.00 H new ATOM 0 HG2 GLN A 88 -2.596 -6.024 -4.217 1.00 10.00 H new ATOM 0 HG3 GLN A 88 -3.318 -7.621 -4.185 1.00 10.00 H new ATOM 0 HE21 GLN A 88 -3.060 -7.784 -1.922 1.00 10.00 H new ATOM 0 HE22 GLN A 88 -1.478 -8.071 -1.190 1.00 10.00 H new ATOM 1177 N GLN A 89 1.000 -6.663 -7.329 1.00 10.00 N ATOM 1178 CA GLN A 89 1.913 -7.074 -8.388 1.00 10.00 C ATOM 1179 C GLN A 89 1.743 -8.561 -8.687 1.00 10.00 C ATOM 1180 O GLN A 89 1.610 -9.375 -7.774 1.00 10.00 O ATOM 1181 CB GLN A 89 3.361 -6.765 -7.986 1.00 10.00 C ATOM 1182 CG GLN A 89 4.404 -7.241 -8.986 1.00 10.00 C ATOM 1183 CD GLN A 89 4.205 -6.664 -10.375 1.00 10.00 C ATOM 1184 OE1 GLN A 89 3.691 -5.555 -10.541 1.00 10.00 O ATOM 1185 NE2 GLN A 89 4.609 -7.416 -11.386 1.00 10.00 N ATOM 0 H GLN A 89 1.456 -6.430 -6.447 1.00 10.00 H new ATOM 0 HA GLN A 89 1.678 -6.514 -9.293 1.00 10.00 H new ATOM 0 HB2 GLN A 89 3.467 -5.688 -7.853 1.00 10.00 H new ATOM 0 HB3 GLN A 89 3.564 -7.227 -7.020 1.00 10.00 H new ATOM 0 HG2 GLN A 89 5.396 -6.969 -8.625 1.00 10.00 H new ATOM 0 HG3 GLN A 89 4.373 -8.329 -9.043 1.00 10.00 H new ATOM 0 HE21 GLN A 89 5.030 -8.328 -11.207 1.00 10.00 H new ATOM 0 HE22 GLN A 89 4.500 -7.084 -12.344 1.00 10.00 H new ATOM 1194 N GLN A 90 1.723 -8.896 -9.971 1.00 10.00 N ATOM 1195 CA GLN A 90 1.570 -10.277 -10.408 1.00 10.00 C ATOM 1196 C GLN A 90 2.747 -11.126 -9.944 1.00 10.00 C ATOM 1197 O GLN A 90 3.903 -10.711 -10.047 1.00 10.00 O ATOM 1198 CB GLN A 90 1.447 -10.349 -11.935 1.00 10.00 C ATOM 1199 CG GLN A 90 0.115 -9.845 -12.475 1.00 10.00 C ATOM 1200 CD GLN A 90 -0.016 -8.336 -12.412 1.00 10.00 C ATOM 1201 OE1 GLN A 90 0.970 -7.606 -12.527 1.00 10.00 O ATOM 1202 NE2 GLN A 90 -1.235 -7.855 -12.226 1.00 10.00 N ATOM 0 H GLN A 90 1.812 -8.224 -10.733 1.00 10.00 H new ATOM 0 HA GLN A 90 0.657 -10.671 -9.960 1.00 10.00 H new ATOM 0 HB2 GLN A 90 2.252 -9.766 -12.382 1.00 10.00 H new ATOM 0 HB3 GLN A 90 1.588 -11.382 -12.252 1.00 10.00 H new ATOM 0 HG2 GLN A 90 0.001 -10.171 -13.509 1.00 10.00 H new ATOM 0 HG3 GLN A 90 -0.697 -10.299 -11.906 1.00 10.00 H new ATOM 0 HE21 GLN A 90 -2.026 -8.492 -12.135 1.00 10.00 H new ATOM 0 HE22 GLN A 90 -1.383 -6.847 -12.173 1.00 10.00 H new ATOM 1211 N THR A 91 2.448 -12.318 -9.452 1.00 10.00 N ATOM 1212 CA THR A 91 3.470 -13.227 -8.967 1.00 10.00 C ATOM 1213 C THR A 91 3.925 -14.191 -10.060 1.00 10.00 C ATOM 1214 O THR A 91 4.692 -15.122 -9.806 1.00 10.00 O ATOM 1215 CB THR A 91 2.949 -14.023 -7.760 1.00 10.00 C ATOM 1216 OG1 THR A 91 1.520 -14.136 -7.839 1.00 10.00 O ATOM 1217 CG2 THR A 91 3.339 -13.344 -6.457 1.00 10.00 C ATOM 0 H THR A 91 1.497 -12.679 -9.379 1.00 10.00 H new ATOM 0 HA THR A 91 4.327 -12.626 -8.663 1.00 10.00 H new ATOM 0 HB THR A 91 3.397 -15.016 -7.779 1.00 10.00 H new ATOM 0 HG1 THR A 91 1.189 -14.645 -7.070 1.00 10.00 H new ATOM 0 HG21 THR A 91 2.960 -13.925 -5.616 1.00 10.00 H new ATOM 0 HG22 THR A 91 4.425 -13.278 -6.392 1.00 10.00 H new ATOM 0 HG23 THR A 91 2.912 -12.341 -6.427 1.00 10.00 H new ATOM 1225 N GLY A 92 3.457 -13.963 -11.279 1.00 10.00 N ATOM 1226 CA GLY A 92 3.831 -14.814 -12.388 1.00 10.00 C ATOM 1227 C GLY A 92 4.108 -14.010 -13.635 1.00 10.00 C ATOM 1228 O GLY A 92 3.410 -12.997 -13.857 1.00 10.00 O ATOM 0 H GLY A 92 2.823 -13.201 -11.519 1.00 10.00 H new ATOM 0 HA2 GLY A 92 4.717 -15.391 -12.122 1.00 10.00 H new ATOM 0 HA3 GLY A 92 3.032 -15.529 -12.585 1.00 10.00 H new ATOM 1233 N ASN B 357 -18.924 -3.650 5.449 1.00 10.00 N ATOM 1234 CA ASN B 357 -18.278 -2.325 5.488 1.00 10.00 C ATOM 1235 C ASN B 357 -17.157 -2.323 6.510 1.00 10.00 C ATOM 1236 O ASN B 357 -17.399 -2.351 7.713 1.00 10.00 O ATOM 1237 CB ASN B 357 -19.310 -1.233 5.838 1.00 10.00 C ATOM 1238 CG ASN B 357 -18.744 0.186 5.804 1.00 10.00 C ATOM 1239 OD1 ASN B 357 -17.570 0.416 6.084 1.00 10.00 O ATOM 1240 ND2 ASN B 357 -19.580 1.155 5.458 1.00 10.00 N ATOM 0 HA ASN B 357 -17.863 -2.112 4.503 1.00 10.00 H new ATOM 0 HB2 ASN B 357 -20.144 -1.298 5.140 1.00 10.00 H new ATOM 0 HB3 ASN B 357 -19.711 -1.430 6.832 1.00 10.00 H new ATOM 0 HD21 ASN B 357 -19.254 2.121 5.419 1.00 10.00 H new ATOM 0 HD22 ASN B 357 -20.550 0.935 5.231 1.00 10.00 H new ATOM 1247 N ASN B 358 -15.933 -2.280 6.021 1.00 10.00 N ATOM 1248 CA ASN B 358 -14.775 -2.241 6.886 1.00 10.00 C ATOM 1249 C ASN B 358 -14.056 -0.931 6.639 1.00 10.00 C ATOM 1250 O ASN B 358 -13.746 -0.583 5.501 1.00 10.00 O ATOM 1251 CB ASN B 358 -13.845 -3.435 6.619 1.00 10.00 C ATOM 1252 CG ASN B 358 -12.722 -3.539 7.635 1.00 10.00 C ATOM 1253 OD1 ASN B 358 -12.875 -3.137 8.793 1.00 10.00 O ATOM 1254 ND2 ASN B 358 -11.587 -4.086 7.219 1.00 10.00 N ATOM 0 H ASN B 358 -15.717 -2.271 5.024 1.00 10.00 H new ATOM 0 HA ASN B 358 -15.086 -2.309 7.928 1.00 10.00 H new ATOM 0 HB2 ASN B 358 -14.429 -4.355 6.633 1.00 10.00 H new ATOM 0 HB3 ASN B 358 -13.419 -3.343 5.620 1.00 10.00 H new ATOM 0 HD21 ASN B 358 -10.803 -4.186 7.864 1.00 10.00 H new ATOM 0 HD22 ASN B 358 -11.499 -4.406 6.255 1.00 10.00 H new ATOM 1261 N ARG B 359 -13.802 -0.212 7.709 1.00 10.00 N ATOM 1262 CA ARG B 359 -13.159 1.080 7.615 1.00 10.00 C ATOM 1263 C ARG B 359 -11.866 1.100 8.395 1.00 10.00 C ATOM 1264 O ARG B 359 -11.808 0.688 9.554 1.00 10.00 O ATOM 1265 CB ARG B 359 -14.099 2.183 8.106 1.00 10.00 C ATOM 1266 CG ARG B 359 -14.996 1.755 9.255 1.00 10.00 C ATOM 1267 CD ARG B 359 -16.042 2.807 9.569 1.00 10.00 C ATOM 1268 NE ARG B 359 -17.080 2.296 10.463 1.00 10.00 N ATOM 1269 CZ ARG B 359 -17.655 3.019 11.422 1.00 10.00 C ATOM 1270 NH1 ARG B 359 -17.257 4.265 11.647 1.00 10.00 N ATOM 1271 NH2 ARG B 359 -18.624 2.494 12.162 1.00 10.00 N ATOM 0 H ARG B 359 -14.032 -0.502 8.660 1.00 10.00 H new ATOM 0 HA ARG B 359 -12.924 1.265 6.567 1.00 10.00 H new ATOM 0 HB2 ARG B 359 -13.505 3.041 8.421 1.00 10.00 H new ATOM 0 HB3 ARG B 359 -14.721 2.514 7.275 1.00 10.00 H new ATOM 0 HG2 ARG B 359 -15.488 0.816 9.003 1.00 10.00 H new ATOM 0 HG3 ARG B 359 -14.389 1.569 10.141 1.00 10.00 H new ATOM 0 HD2 ARG B 359 -15.561 3.671 10.028 1.00 10.00 H new ATOM 0 HD3 ARG B 359 -16.499 3.152 8.642 1.00 10.00 H new ATOM 0 HE ARG B 359 -17.381 1.329 10.345 1.00 10.00 H new ATOM 0 HH11 ARG B 359 -16.509 4.671 11.085 1.00 10.00 H new ATOM 0 HH12 ARG B 359 -17.699 4.817 12.382 1.00 10.00 H new ATOM 0 HH21 ARG B 359 -18.929 1.535 11.997 1.00 10.00 H new ATOM 0 HH22 ARG B 359 -19.063 3.050 12.896 1.00 10.00 H new ATOM 1285 N ASP B 360 -10.832 1.581 7.742 1.00 10.00 N ATOM 1286 CA ASP B 360 -9.521 1.687 8.344 1.00 10.00 C ATOM 1287 C ASP B 360 -9.155 3.150 8.378 1.00 10.00 C ATOM 1288 O ASP B 360 -9.290 3.847 7.370 1.00 10.00 O ATOM 1289 CB ASP B 360 -8.474 0.906 7.542 1.00 10.00 C ATOM 1290 CG ASP B 360 -7.170 0.737 8.308 1.00 10.00 C ATOM 1291 OD1 ASP B 360 -6.209 1.482 8.034 1.00 10.00 O ATOM 1292 OD2 ASP B 360 -7.113 -0.142 9.197 1.00 10.00 O ATOM 0 H ASP B 360 -10.876 1.910 6.778 1.00 10.00 H new ATOM 0 HA ASP B 360 -9.542 1.263 9.348 1.00 10.00 H new ATOM 0 HB2 ASP B 360 -8.873 -0.076 7.287 1.00 10.00 H new ATOM 0 HB3 ASP B 360 -8.277 1.424 6.603 1.00 10.00 H new ATOM 1297 N PRO B 361 -8.703 3.671 9.513 1.00 10.00 N ATOM 1298 CA PRO B 361 -8.359 5.061 9.610 1.00 10.00 C ATOM 1299 C PRO B 361 -6.866 5.272 9.742 1.00 10.00 C ATOM 1300 O PRO B 361 -6.198 4.717 10.617 1.00 10.00 O ATOM 1301 CB PRO B 361 -9.050 5.432 10.921 1.00 10.00 C ATOM 1302 CG PRO B 361 -8.996 4.175 11.755 1.00 10.00 C ATOM 1303 CD PRO B 361 -8.629 3.030 10.826 1.00 10.00 C ATOM 0 HA PRO B 361 -8.652 5.644 8.737 1.00 10.00 H new ATOM 0 HB2 PRO B 361 -8.540 6.258 11.417 1.00 10.00 H new ATOM 0 HB3 PRO B 361 -10.079 5.749 10.750 1.00 10.00 H new ATOM 0 HG2 PRO B 361 -8.259 4.274 12.552 1.00 10.00 H new ATOM 0 HG3 PRO B 361 -9.958 3.989 12.232 1.00 10.00 H new ATOM 0 HD2 PRO B 361 -7.633 2.639 11.034 1.00 10.00 H new ATOM 0 HD3 PRO B 361 -9.324 2.195 10.913 1.00 10.00 H new ATOM 1311 N ILE B 362 -6.350 6.090 8.852 1.00 10.00 N ATOM 1312 CA ILE B 362 -4.945 6.395 8.836 1.00 10.00 C ATOM 1313 C ILE B 362 -4.727 7.882 9.012 1.00 10.00 C ATOM 1314 O ILE B 362 -5.358 8.713 8.361 1.00 10.00 O ATOM 1315 CB ILE B 362 -4.249 5.900 7.550 1.00 10.00 C ATOM 1316 CG1 ILE B 362 -4.506 4.395 7.367 1.00 10.00 C ATOM 1317 CG2 ILE B 362 -2.753 6.187 7.612 1.00 10.00 C ATOM 1318 CD1 ILE B 362 -3.612 3.729 6.341 1.00 10.00 C ATOM 0 H ILE B 362 -6.892 6.558 8.125 1.00 10.00 H new ATOM 0 HA ILE B 362 -4.492 5.862 9.672 1.00 10.00 H new ATOM 0 HB ILE B 362 -4.661 6.433 6.693 1.00 10.00 H new ATOM 0 HG12 ILE B 362 -4.372 3.896 8.327 1.00 10.00 H new ATOM 0 HG13 ILE B 362 -5.546 4.249 7.075 1.00 10.00 H new ATOM 0 HG21 ILE B 362 -2.276 5.832 6.698 1.00 10.00 H new ATOM 0 HG22 ILE B 362 -2.592 7.260 7.712 1.00 10.00 H new ATOM 0 HG23 ILE B 362 -2.319 5.674 8.470 1.00 10.00 H new ATOM 0 HD11 ILE B 362 -3.860 2.670 6.275 1.00 10.00 H new ATOM 0 HD12 ILE B 362 -3.762 4.198 5.369 1.00 10.00 H new ATOM 0 HD13 ILE B 362 -2.570 3.840 6.640 1.00 10.00 H new ATOM 1330 N VAL B 363 -3.826 8.201 9.906 1.00 10.00 N ATOM 1331 CA VAL B 363 -3.486 9.565 10.208 1.00 10.00 C ATOM 1332 C VAL B 363 -2.048 9.779 9.795 1.00 10.00 C ATOM 1333 O VAL B 363 -1.188 8.927 10.014 1.00 10.00 O ATOM 1334 CB VAL B 363 -3.673 9.912 11.696 1.00 10.00 C ATOM 1335 CG1 VAL B 363 -3.540 11.409 11.901 1.00 10.00 C ATOM 1336 CG2 VAL B 363 -5.025 9.428 12.203 1.00 10.00 C ATOM 0 H VAL B 363 -3.304 7.513 10.449 1.00 10.00 H new ATOM 0 HA VAL B 363 -4.159 10.224 9.660 1.00 10.00 H new ATOM 0 HB VAL B 363 -2.896 9.404 12.267 1.00 10.00 H new ATOM 0 HG11 VAL B 363 -3.674 11.645 12.957 1.00 10.00 H new ATOM 0 HG12 VAL B 363 -2.551 11.734 11.579 1.00 10.00 H new ATOM 0 HG13 VAL B 363 -4.300 11.925 11.315 1.00 10.00 H new ATOM 0 HG21 VAL B 363 -5.132 9.686 13.257 1.00 10.00 H new ATOM 0 HG22 VAL B 363 -5.820 9.905 11.630 1.00 10.00 H new ATOM 0 HG23 VAL B 363 -5.092 8.346 12.085 1.00 10.00 H new ATOM 1346 N ILE B 364 -1.808 10.913 9.189 1.00 10.00 N ATOM 1347 CA ILE B 364 -0.507 11.243 8.658 1.00 10.00 C ATOM 1348 C ILE B 364 0.125 12.330 9.487 1.00 10.00 C ATOM 1349 O ILE B 364 -0.555 13.207 10.022 1.00 10.00 O ATOM 1350 CB ILE B 364 -0.569 11.677 7.170 1.00 10.00 C ATOM 1351 CG1 ILE B 364 0.513 10.957 6.359 1.00 10.00 C ATOM 1352 CG2 ILE B 364 -0.416 13.191 7.008 1.00 10.00 C ATOM 1353 CD1 ILE B 364 0.195 9.503 6.088 1.00 10.00 C ATOM 0 H ILE B 364 -2.511 11.638 9.048 1.00 10.00 H new ATOM 0 HA ILE B 364 0.102 10.340 8.706 1.00 10.00 H new ATOM 0 HB ILE B 364 -1.553 11.398 6.793 1.00 10.00 H new ATOM 0 HG12 ILE B 364 0.649 11.474 5.409 1.00 10.00 H new ATOM 0 HG13 ILE B 364 1.460 11.020 6.895 1.00 10.00 H new ATOM 0 HG21 ILE B 364 -0.465 13.451 5.951 1.00 10.00 H new ATOM 0 HG22 ILE B 364 -1.219 13.697 7.544 1.00 10.00 H new ATOM 0 HG23 ILE B 364 0.546 13.505 7.414 1.00 10.00 H new ATOM 0 HD11 ILE B 364 1.003 9.055 5.510 1.00 10.00 H new ATOM 0 HD12 ILE B 364 0.088 8.972 7.034 1.00 10.00 H new ATOM 0 HD13 ILE B 364 -0.736 9.433 5.525 1.00 10.00 H new