USER MOD reduce.3.24.130724 H: found=0, std=0, add=662, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 662 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 89 GLN : amide:sc= -0.562 X(o=-0.51,f=-0.37) USER MOD Set 1.2: A 90 GLN : amide:sc= 0.0497 K(o=-0.51,f=-3.5!) USER MOD Set 2.1: A 57 GLN : amide:sc= 0.983 K(o=1.7,f=-0.69) USER MOD Set 2.2: A 88 GLN : amide:sc= 0.699 K(o=1.7,f=-0.69) USER MOD Set 3.1: A 19 ASN : amide:sc= 2.2 K(o=3.2,f=-2.3) USER MOD Set 3.2: A 31 GLN : amide:sc= 1.01 K(o=3.2,f=0.11) USER MOD Set 4.1: A 28 SER OG : rot -87:sc= 1.24 USER MOD Set 4.2: A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 HIS : no HD1:sc= 0 X(o=0,f=-0.014) USER MOD Single : A 21 LYS NZ :NH3+ -172:sc= 1.25 (180deg=1.24) USER MOD Single : A 25 GLN : amide:sc= 2.29 K(o=2.3,f=-0.42) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 HIS : no HD1:sc= -0.248 X(o=-0.25,f=-0.15) USER MOD Single : A 38 THR OG1 : rot -150:sc= -0.597 USER MOD Single : A 41 SER OG : rot -121:sc= 1.48 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 MET CE :methyl 175:sc= -0.544 (180deg=-0.581) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 CYS SG : rot -81:sc= -2! USER MOD Single : A 51 GLN : amide:sc= -0.0331 X(o=-0.033,f=-0.033) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 55 MET CE :methyl -138:sc= 0 (180deg=-0.991) USER MOD Single : A 65 GLN : amide:sc= -0.0493 X(o=-0.049,f=-0.098) USER MOD Single : A 68 ASN : amide:sc= 1.25 K(o=1.2,f=-0.079) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 THR OG1 : rot 180:sc= -0.127 USER MOD Single : A 75 GLN : amide:sc=-0.00316 K(o=-0.0032,f=-0.75) USER MOD Single : A 78 MET CE :methyl -155:sc= -0.923 (180deg=-2.13) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : B 358 ASN : amide:sc= -0.0903 K(o=-0.09,f=-1.3) USER MOD Single : B 365 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 13 N HIS A 17 -6.336 12.417 11.753 1.00 10.00 N ATOM 14 CA HIS A 17 -5.995 11.185 11.050 1.00 10.00 C ATOM 15 C HIS A 17 -6.953 10.913 9.893 1.00 10.00 C ATOM 16 O HIS A 17 -8.049 11.474 9.828 1.00 10.00 O ATOM 17 CB HIS A 17 -6.018 9.998 12.013 1.00 10.00 C ATOM 18 CG HIS A 17 -4.921 10.019 13.030 1.00 10.00 C ATOM 19 ND1 HIS A 17 -5.019 10.766 14.176 1.00 10.00 N ATOM 20 CD2 HIS A 17 -3.737 9.363 13.029 1.00 10.00 C ATOM 21 CE1 HIS A 17 -3.900 10.546 14.846 1.00 10.00 C ATOM 22 NE2 HIS A 17 -3.092 9.705 14.189 1.00 10.00 N ATOM 0 HA HIS A 17 -4.991 11.311 10.645 1.00 10.00 H new ATOM 0 HB2 HIS A 17 -6.978 9.980 12.529 1.00 10.00 H new ATOM 0 HB3 HIS A 17 -5.949 9.075 11.438 1.00 10.00 H new ATOM 0 HD2 HIS A 17 -3.371 8.698 12.261 1.00 10.00 H new ATOM 0 HE1 HIS A 17 -3.667 10.989 15.803 1.00 10.00 H new ATOM 0 HE2 HIS A 17 -2.174 9.381 14.493 1.00 10.00 H new ATOM 30 N ILE A 18 -6.531 10.046 8.990 1.00 10.00 N ATOM 31 CA ILE A 18 -7.328 9.670 7.835 1.00 10.00 C ATOM 32 C ILE A 18 -7.451 8.149 7.780 1.00 10.00 C ATOM 33 O ILE A 18 -6.464 7.433 7.945 1.00 10.00 O ATOM 34 CB ILE A 18 -6.711 10.213 6.521 1.00 10.00 C ATOM 35 CG1 ILE A 18 -7.499 9.718 5.305 1.00 10.00 C ATOM 36 CG2 ILE A 18 -5.243 9.822 6.406 1.00 10.00 C ATOM 37 CD1 ILE A 18 -7.018 10.299 3.993 1.00 10.00 C ATOM 0 H ILE A 18 -5.624 9.582 9.037 1.00 10.00 H new ATOM 0 HA ILE A 18 -8.319 10.113 7.937 1.00 10.00 H new ATOM 0 HB ILE A 18 -6.770 11.301 6.547 1.00 10.00 H new ATOM 0 HG12 ILE A 18 -7.432 8.631 5.257 1.00 10.00 H new ATOM 0 HG13 ILE A 18 -8.552 9.967 5.439 1.00 10.00 H new ATOM 0 HG21 ILE A 18 -4.834 10.215 5.475 1.00 10.00 H new ATOM 0 HG22 ILE A 18 -4.689 10.235 7.249 1.00 10.00 H new ATOM 0 HG23 ILE A 18 -5.154 8.736 6.411 1.00 10.00 H new ATOM 0 HD11 ILE A 18 -7.622 9.904 3.177 1.00 10.00 H new ATOM 0 HD12 ILE A 18 -7.111 11.385 4.020 1.00 10.00 H new ATOM 0 HD13 ILE A 18 -5.974 10.028 3.836 1.00 10.00 H new ATOM 49 N ASN A 19 -8.665 7.657 7.586 1.00 10.00 N ATOM 50 CA ASN A 19 -8.896 6.220 7.536 1.00 10.00 C ATOM 51 C ASN A 19 -8.839 5.703 6.110 1.00 10.00 C ATOM 52 O ASN A 19 -9.729 5.970 5.304 1.00 10.00 O ATOM 53 CB ASN A 19 -10.249 5.871 8.153 1.00 10.00 C ATOM 54 CG ASN A 19 -10.334 6.241 9.619 1.00 10.00 C ATOM 55 OD1 ASN A 19 -9.931 5.472 10.490 1.00 10.00 O ATOM 56 ND2 ASN A 19 -10.868 7.417 9.898 1.00 10.00 N ATOM 0 H ASN A 19 -9.502 8.227 7.461 1.00 10.00 H new ATOM 0 HA ASN A 19 -8.104 5.740 8.111 1.00 10.00 H new ATOM 0 HB2 ASN A 19 -11.038 6.387 7.606 1.00 10.00 H new ATOM 0 HB3 ASN A 19 -10.430 4.802 8.041 1.00 10.00 H new ATOM 0 HD21 ASN A 19 -10.959 7.719 10.868 1.00 10.00 H new ATOM 0 HD22 ASN A 19 -11.189 8.023 9.143 1.00 10.00 H new ATOM 63 N LEU A 20 -7.784 4.973 5.800 1.00 10.00 N ATOM 64 CA LEU A 20 -7.610 4.404 4.475 1.00 10.00 C ATOM 65 C LEU A 20 -7.881 2.906 4.517 1.00 10.00 C ATOM 66 O LEU A 20 -7.249 2.173 5.280 1.00 10.00 O ATOM 67 CB LEU A 20 -6.195 4.677 3.957 1.00 10.00 C ATOM 68 CG LEU A 20 -5.842 6.157 3.781 1.00 10.00 C ATOM 69 CD1 LEU A 20 -4.383 6.318 3.384 1.00 10.00 C ATOM 70 CD2 LEU A 20 -6.754 6.799 2.745 1.00 10.00 C ATOM 0 H LEU A 20 -7.029 4.759 6.452 1.00 10.00 H new ATOM 0 HA LEU A 20 -8.320 4.873 3.793 1.00 10.00 H new ATOM 0 HB2 LEU A 20 -5.480 4.228 4.646 1.00 10.00 H new ATOM 0 HB3 LEU A 20 -6.072 4.174 2.998 1.00 10.00 H new ATOM 0 HG LEU A 20 -5.992 6.663 4.735 1.00 10.00 H new ATOM 0 HD11 LEU A 20 -4.153 7.377 3.264 1.00 10.00 H new ATOM 0 HD12 LEU A 20 -3.746 5.894 4.160 1.00 10.00 H new ATOM 0 HD13 LEU A 20 -4.203 5.799 2.443 1.00 10.00 H new ATOM 0 HD21 LEU A 20 -6.491 7.851 2.631 1.00 10.00 H new ATOM 0 HD22 LEU A 20 -6.634 6.289 1.789 1.00 10.00 H new ATOM 0 HD23 LEU A 20 -7.790 6.718 3.072 1.00 10.00 H new ATOM 82 N LYS A 21 -8.823 2.456 3.704 1.00 10.00 N ATOM 83 CA LYS A 21 -9.186 1.048 3.663 1.00 10.00 C ATOM 84 C LYS A 21 -8.354 0.303 2.630 1.00 10.00 C ATOM 85 O LYS A 21 -8.465 0.554 1.429 1.00 10.00 O ATOM 86 CB LYS A 21 -10.672 0.881 3.331 1.00 10.00 C ATOM 87 CG LYS A 21 -11.611 1.512 4.346 1.00 10.00 C ATOM 88 CD LYS A 21 -13.066 1.298 3.954 1.00 10.00 C ATOM 89 CE LYS A 21 -14.014 2.078 4.847 1.00 10.00 C ATOM 90 NZ LYS A 21 -15.416 2.017 4.355 1.00 10.00 N ATOM 0 H LYS A 21 -9.351 3.047 3.062 1.00 10.00 H new ATOM 0 HA LYS A 21 -8.989 0.628 4.649 1.00 10.00 H new ATOM 0 HB2 LYS A 21 -10.866 1.319 2.352 1.00 10.00 H new ATOM 0 HB3 LYS A 21 -10.899 -0.182 3.255 1.00 10.00 H new ATOM 0 HG2 LYS A 21 -11.429 1.081 5.331 1.00 10.00 H new ATOM 0 HG3 LYS A 21 -11.405 2.580 4.422 1.00 10.00 H new ATOM 0 HD2 LYS A 21 -13.211 1.602 2.917 1.00 10.00 H new ATOM 0 HD3 LYS A 21 -13.305 0.236 4.011 1.00 10.00 H new ATOM 0 HE2 LYS A 21 -13.967 1.680 5.861 1.00 10.00 H new ATOM 0 HE3 LYS A 21 -13.692 3.118 4.897 1.00 10.00 H new ATOM 0 HZ1 LYS A 21 -16.007 2.668 4.910 1.00 10.00 H new ATOM 0 HZ2 LYS A 21 -15.444 2.292 3.352 1.00 10.00 H new ATOM 0 HZ3 LYS A 21 -15.778 1.048 4.458 1.00 10.00 H new ATOM 104 N VAL A 22 -7.519 -0.604 3.099 1.00 10.00 N ATOM 105 CA VAL A 22 -6.687 -1.401 2.215 1.00 10.00 C ATOM 106 C VAL A 22 -7.328 -2.771 2.042 1.00 10.00 C ATOM 107 O VAL A 22 -7.303 -3.601 2.955 1.00 10.00 O ATOM 108 CB VAL A 22 -5.250 -1.549 2.763 1.00 10.00 C ATOM 109 CG1 VAL A 22 -4.409 -2.445 1.867 1.00 10.00 C ATOM 110 CG2 VAL A 22 -4.597 -0.183 2.909 1.00 10.00 C ATOM 0 H VAL A 22 -7.398 -0.809 4.091 1.00 10.00 H new ATOM 0 HA VAL A 22 -6.615 -0.895 1.252 1.00 10.00 H new ATOM 0 HB VAL A 22 -5.310 -2.018 3.745 1.00 10.00 H new ATOM 0 HG11 VAL A 22 -3.403 -2.530 2.278 1.00 10.00 H new ATOM 0 HG12 VAL A 22 -4.863 -3.434 1.812 1.00 10.00 H new ATOM 0 HG13 VAL A 22 -4.357 -2.014 0.867 1.00 10.00 H new ATOM 0 HG21 VAL A 22 -3.585 -0.303 3.296 1.00 10.00 H new ATOM 0 HG22 VAL A 22 -4.558 0.307 1.936 1.00 10.00 H new ATOM 0 HG23 VAL A 22 -5.180 0.427 3.599 1.00 10.00 H new ATOM 120 N ALA A 23 -7.916 -2.995 0.879 1.00 10.00 N ATOM 121 CA ALA A 23 -8.596 -4.248 0.603 1.00 10.00 C ATOM 122 C ALA A 23 -7.808 -5.122 -0.357 1.00 10.00 C ATOM 123 O ALA A 23 -7.291 -4.650 -1.372 1.00 10.00 O ATOM 124 CB ALA A 23 -9.985 -3.971 0.050 1.00 10.00 C ATOM 0 H ALA A 23 -7.936 -2.325 0.111 1.00 10.00 H new ATOM 0 HA ALA A 23 -8.682 -4.795 1.542 1.00 10.00 H new ATOM 0 HB1 ALA A 23 -10.490 -4.915 -0.155 1.00 10.00 H new ATOM 0 HB2 ALA A 23 -10.561 -3.403 0.780 1.00 10.00 H new ATOM 0 HB3 ALA A 23 -9.901 -3.396 -0.872 1.00 10.00 H new ATOM 130 N GLY A 24 -7.716 -6.397 -0.019 1.00 10.00 N ATOM 131 CA GLY A 24 -7.016 -7.335 -0.861 1.00 10.00 C ATOM 132 C GLY A 24 -7.979 -8.067 -1.765 1.00 10.00 C ATOM 133 O GLY A 24 -9.191 -8.039 -1.534 1.00 10.00 O ATOM 0 H GLY A 24 -8.117 -6.799 0.829 1.00 10.00 H new ATOM 0 HA2 GLY A 24 -6.275 -6.808 -1.462 1.00 10.00 H new ATOM 0 HA3 GLY A 24 -6.474 -8.051 -0.243 1.00 10.00 H new ATOM 137 N GLN A 25 -7.456 -8.743 -2.775 1.00 10.00 N ATOM 138 CA GLN A 25 -8.290 -9.479 -3.721 1.00 10.00 C ATOM 139 C GLN A 25 -8.700 -10.833 -3.139 1.00 10.00 C ATOM 140 O GLN A 25 -8.694 -11.850 -3.837 1.00 10.00 O ATOM 141 CB GLN A 25 -7.545 -9.688 -5.043 1.00 10.00 C ATOM 142 CG GLN A 25 -6.830 -8.444 -5.556 1.00 10.00 C ATOM 143 CD GLN A 25 -7.746 -7.239 -5.684 1.00 10.00 C ATOM 144 OE1 GLN A 25 -8.936 -7.372 -5.971 1.00 10.00 O ATOM 145 NE2 GLN A 25 -7.194 -6.059 -5.461 1.00 10.00 N ATOM 0 H GLN A 25 -6.455 -8.799 -2.964 1.00 10.00 H new ATOM 0 HA GLN A 25 -9.188 -8.890 -3.909 1.00 10.00 H new ATOM 0 HB2 GLN A 25 -6.815 -10.487 -4.914 1.00 10.00 H new ATOM 0 HB3 GLN A 25 -8.255 -10.024 -5.799 1.00 10.00 H new ATOM 0 HG2 GLN A 25 -6.010 -8.199 -4.881 1.00 10.00 H new ATOM 0 HG3 GLN A 25 -6.388 -8.662 -6.528 1.00 10.00 H new ATOM 0 HE21 GLN A 25 -6.203 -5.996 -5.226 1.00 10.00 H new ATOM 0 HE22 GLN A 25 -7.759 -5.212 -5.524 1.00 10.00 H new ATOM 154 N ASP A 26 -9.066 -10.830 -1.864 1.00 10.00 N ATOM 155 CA ASP A 26 -9.470 -12.047 -1.169 1.00 10.00 C ATOM 156 C ASP A 26 -10.661 -11.783 -0.246 1.00 10.00 C ATOM 157 O ASP A 26 -11.664 -12.498 -0.297 1.00 10.00 O ATOM 158 CB ASP A 26 -8.293 -12.631 -0.371 1.00 10.00 C ATOM 159 CG ASP A 26 -7.591 -11.608 0.505 1.00 10.00 C ATOM 160 OD1 ASP A 26 -6.601 -11.003 0.039 1.00 10.00 O ATOM 161 OD2 ASP A 26 -8.016 -11.411 1.666 1.00 10.00 O ATOM 0 H ASP A 26 -9.092 -9.991 -1.285 1.00 10.00 H new ATOM 0 HA ASP A 26 -9.777 -12.776 -1.919 1.00 10.00 H new ATOM 0 HB2 ASP A 26 -8.657 -13.446 0.255 1.00 10.00 H new ATOM 0 HB3 ASP A 26 -7.571 -13.061 -1.065 1.00 10.00 H new ATOM 166 N GLY A 27 -10.552 -10.760 0.597 1.00 10.00 N ATOM 167 CA GLY A 27 -11.638 -10.436 1.506 1.00 10.00 C ATOM 168 C GLY A 27 -11.184 -9.622 2.700 1.00 10.00 C ATOM 169 O GLY A 27 -11.989 -8.941 3.331 1.00 10.00 O ATOM 0 H GLY A 27 -9.736 -10.152 0.667 1.00 10.00 H new ATOM 0 HA2 GLY A 27 -12.405 -9.882 0.965 1.00 10.00 H new ATOM 0 HA3 GLY A 27 -12.100 -11.359 1.856 1.00 10.00 H new ATOM 173 N SER A 28 -9.899 -9.700 3.025 1.00 10.00 N ATOM 174 CA SER A 28 -9.360 -8.949 4.153 1.00 10.00 C ATOM 175 C SER A 28 -9.381 -7.448 3.863 1.00 10.00 C ATOM 176 O SER A 28 -8.920 -7.007 2.804 1.00 10.00 O ATOM 177 CB SER A 28 -7.933 -9.409 4.456 1.00 10.00 C ATOM 178 OG SER A 28 -7.150 -9.482 3.274 1.00 10.00 O ATOM 0 H SER A 28 -9.215 -10.271 2.528 1.00 10.00 H new ATOM 0 HA SER A 28 -9.986 -9.138 5.025 1.00 10.00 H new ATOM 0 HB2 SER A 28 -7.468 -8.719 5.160 1.00 10.00 H new ATOM 0 HB3 SER A 28 -7.959 -10.386 4.938 1.00 10.00 H new ATOM 0 HG SER A 28 -7.263 -10.363 2.860 1.00 10.00 H new ATOM 184 N VAL A 29 -9.931 -6.664 4.792 1.00 10.00 N ATOM 185 CA VAL A 29 -9.996 -5.214 4.609 1.00 10.00 C ATOM 186 C VAL A 29 -9.454 -4.496 5.838 1.00 10.00 C ATOM 187 O VAL A 29 -10.189 -4.224 6.785 1.00 10.00 O ATOM 188 CB VAL A 29 -11.436 -4.720 4.332 1.00 10.00 C ATOM 189 CG1 VAL A 29 -11.425 -3.257 3.904 1.00 10.00 C ATOM 190 CG2 VAL A 29 -12.119 -5.577 3.275 1.00 10.00 C ATOM 0 H VAL A 29 -10.332 -7.003 5.666 1.00 10.00 H new ATOM 0 HA VAL A 29 -9.383 -4.982 3.738 1.00 10.00 H new ATOM 0 HB VAL A 29 -12.005 -4.810 5.257 1.00 10.00 H new ATOM 0 HG11 VAL A 29 -12.446 -2.926 3.713 1.00 10.00 H new ATOM 0 HG12 VAL A 29 -10.989 -2.649 4.697 1.00 10.00 H new ATOM 0 HG13 VAL A 29 -10.833 -3.148 2.996 1.00 10.00 H new ATOM 0 HG21 VAL A 29 -13.129 -5.205 3.102 1.00 10.00 H new ATOM 0 HG22 VAL A 29 -11.551 -5.530 2.346 1.00 10.00 H new ATOM 0 HG23 VAL A 29 -12.167 -6.610 3.619 1.00 10.00 H new ATOM 200 N VAL A 30 -8.168 -4.191 5.819 1.00 10.00 N ATOM 201 CA VAL A 30 -7.534 -3.515 6.940 1.00 10.00 C ATOM 202 C VAL A 30 -7.734 -2.004 6.843 1.00 10.00 C ATOM 203 O VAL A 30 -7.775 -1.440 5.747 1.00 10.00 O ATOM 204 CB VAL A 30 -6.028 -3.847 7.029 1.00 10.00 C ATOM 205 CG1 VAL A 30 -5.832 -5.339 7.246 1.00 10.00 C ATOM 206 CG2 VAL A 30 -5.293 -3.386 5.782 1.00 10.00 C ATOM 0 H VAL A 30 -7.542 -4.400 5.041 1.00 10.00 H new ATOM 0 HA VAL A 30 -8.012 -3.878 7.850 1.00 10.00 H new ATOM 0 HB VAL A 30 -5.609 -3.311 7.881 1.00 10.00 H new ATOM 0 HG11 VAL A 30 -4.767 -5.561 7.307 1.00 10.00 H new ATOM 0 HG12 VAL A 30 -6.319 -5.639 8.174 1.00 10.00 H new ATOM 0 HG13 VAL A 30 -6.270 -5.888 6.413 1.00 10.00 H new ATOM 0 HG21 VAL A 30 -4.235 -3.632 5.871 1.00 10.00 H new ATOM 0 HG22 VAL A 30 -5.710 -3.887 4.908 1.00 10.00 H new ATOM 0 HG23 VAL A 30 -5.406 -2.308 5.671 1.00 10.00 H new ATOM 216 N GLN A 31 -7.874 -1.356 7.989 1.00 10.00 N ATOM 217 CA GLN A 31 -8.090 0.082 8.029 1.00 10.00 C ATOM 218 C GLN A 31 -6.866 0.798 8.585 1.00 10.00 C ATOM 219 O GLN A 31 -6.515 0.645 9.753 1.00 10.00 O ATOM 220 CB GLN A 31 -9.329 0.398 8.871 1.00 10.00 C ATOM 221 CG GLN A 31 -9.683 1.875 8.923 1.00 10.00 C ATOM 222 CD GLN A 31 -11.130 2.109 9.315 1.00 10.00 C ATOM 223 OE1 GLN A 31 -12.020 1.338 8.953 1.00 10.00 O ATOM 224 NE2 GLN A 31 -11.381 3.167 10.066 1.00 10.00 N ATOM 0 H GLN A 31 -7.842 -1.804 8.905 1.00 10.00 H new ATOM 0 HA GLN A 31 -8.254 0.439 7.012 1.00 10.00 H new ATOM 0 HB2 GLN A 31 -10.179 -0.154 8.470 1.00 10.00 H new ATOM 0 HB3 GLN A 31 -9.166 0.038 9.887 1.00 10.00 H new ATOM 0 HG2 GLN A 31 -9.030 2.377 9.637 1.00 10.00 H new ATOM 0 HG3 GLN A 31 -9.496 2.325 7.948 1.00 10.00 H new ATOM 0 HE21 GLN A 31 -10.620 3.785 10.348 1.00 10.00 H new ATOM 0 HE22 GLN A 31 -12.336 3.366 10.364 1.00 10.00 H new ATOM 233 N PHE A 32 -6.214 1.577 7.744 1.00 10.00 N ATOM 234 CA PHE A 32 -5.035 2.312 8.155 1.00 10.00 C ATOM 235 C PHE A 32 -5.403 3.734 8.542 1.00 10.00 C ATOM 236 O PHE A 32 -5.779 4.540 7.693 1.00 10.00 O ATOM 237 CB PHE A 32 -3.997 2.323 7.035 1.00 10.00 C ATOM 238 CG PHE A 32 -3.114 1.109 7.027 1.00 10.00 C ATOM 239 CD1 PHE A 32 -3.408 0.028 6.215 1.00 10.00 C ATOM 240 CD2 PHE A 32 -1.989 1.053 7.833 1.00 10.00 C ATOM 241 CE1 PHE A 32 -2.598 -1.091 6.207 1.00 10.00 C ATOM 242 CE2 PHE A 32 -1.176 -0.064 7.831 1.00 10.00 C ATOM 243 CZ PHE A 32 -1.481 -1.137 7.017 1.00 10.00 C ATOM 0 H PHE A 32 -6.482 1.717 6.770 1.00 10.00 H new ATOM 0 HA PHE A 32 -4.606 1.815 9.025 1.00 10.00 H new ATOM 0 HB2 PHE A 32 -4.509 2.396 6.076 1.00 10.00 H new ATOM 0 HB3 PHE A 32 -3.376 3.214 7.134 1.00 10.00 H new ATOM 0 HD1 PHE A 32 -4.281 0.059 5.580 1.00 10.00 H new ATOM 0 HD2 PHE A 32 -1.745 1.891 8.469 1.00 10.00 H new ATOM 0 HE1 PHE A 32 -2.838 -1.928 5.568 1.00 10.00 H new ATOM 0 HE2 PHE A 32 -0.303 -0.098 8.465 1.00 10.00 H new ATOM 0 HZ PHE A 32 -0.847 -2.011 7.014 1.00 10.00 H new ATOM 253 N LYS A 33 -5.301 4.031 9.824 1.00 10.00 N ATOM 254 CA LYS A 33 -5.622 5.352 10.327 1.00 10.00 C ATOM 255 C LYS A 33 -4.333 6.138 10.541 1.00 10.00 C ATOM 256 O LYS A 33 -3.845 6.273 11.664 1.00 10.00 O ATOM 257 CB LYS A 33 -6.416 5.250 11.631 1.00 10.00 C ATOM 258 CG LYS A 33 -7.184 6.514 11.975 1.00 10.00 C ATOM 259 CD LYS A 33 -8.017 6.331 13.231 1.00 10.00 C ATOM 260 CE LYS A 33 -8.823 7.577 13.555 1.00 10.00 C ATOM 261 NZ LYS A 33 -9.539 7.448 14.852 1.00 10.00 N ATOM 0 H LYS A 33 -4.996 3.370 10.539 1.00 10.00 H new ATOM 0 HA LYS A 33 -6.241 5.875 9.598 1.00 10.00 H new ATOM 0 HB2 LYS A 33 -7.116 4.418 11.556 1.00 10.00 H new ATOM 0 HB3 LYS A 33 -5.731 5.018 12.447 1.00 10.00 H new ATOM 0 HG2 LYS A 33 -6.486 7.339 12.117 1.00 10.00 H new ATOM 0 HG3 LYS A 33 -7.833 6.785 11.142 1.00 10.00 H new ATOM 0 HD2 LYS A 33 -8.691 5.485 13.101 1.00 10.00 H new ATOM 0 HD3 LYS A 33 -7.363 6.092 14.070 1.00 10.00 H new ATOM 0 HE2 LYS A 33 -8.159 8.441 13.590 1.00 10.00 H new ATOM 0 HE3 LYS A 33 -9.544 7.761 12.758 1.00 10.00 H new ATOM 0 HZ1 LYS A 33 -10.078 8.318 15.039 1.00 10.00 H new ATOM 0 HZ2 LYS A 33 -10.191 6.639 14.810 1.00 10.00 H new ATOM 0 HZ3 LYS A 33 -8.849 7.297 15.616 1.00 10.00 H new ATOM 275 N ILE A 34 -3.777 6.633 9.449 1.00 10.00 N ATOM 276 CA ILE A 34 -2.539 7.393 9.497 1.00 10.00 C ATOM 277 C ILE A 34 -2.825 8.885 9.427 1.00 10.00 C ATOM 278 O ILE A 34 -3.981 9.300 9.413 1.00 10.00 O ATOM 279 CB ILE A 34 -1.592 6.995 8.343 1.00 10.00 C ATOM 280 CG1 ILE A 34 -2.250 7.269 6.987 1.00 10.00 C ATOM 281 CG2 ILE A 34 -1.209 5.526 8.461 1.00 10.00 C ATOM 282 CD1 ILE A 34 -1.298 7.159 5.817 1.00 10.00 C ATOM 0 H ILE A 34 -4.166 6.522 8.513 1.00 10.00 H new ATOM 0 HA ILE A 34 -2.050 7.163 10.444 1.00 10.00 H new ATOM 0 HB ILE A 34 -0.687 7.599 8.412 1.00 10.00 H new ATOM 0 HG12 ILE A 34 -3.071 6.567 6.843 1.00 10.00 H new ATOM 0 HG13 ILE A 34 -2.684 8.269 6.999 1.00 10.00 H new ATOM 0 HG21 ILE A 34 -0.541 5.257 7.642 1.00 10.00 H new ATOM 0 HG22 ILE A 34 -0.703 5.357 9.412 1.00 10.00 H new ATOM 0 HG23 ILE A 34 -2.108 4.911 8.413 1.00 10.00 H new ATOM 0 HD11 ILE A 34 -1.834 7.366 4.891 1.00 10.00 H new ATOM 0 HD12 ILE A 34 -0.489 7.880 5.937 1.00 10.00 H new ATOM 0 HD13 ILE A 34 -0.883 6.152 5.779 1.00 10.00 H new ATOM 294 N LYS A 35 -1.779 9.689 9.382 1.00 10.00 N ATOM 295 CA LYS A 35 -1.945 11.128 9.305 1.00 10.00 C ATOM 296 C LYS A 35 -1.845 11.577 7.854 1.00 10.00 C ATOM 297 O LYS A 35 -1.316 10.856 7.008 1.00 10.00 O ATOM 298 CB LYS A 35 -0.904 11.836 10.175 1.00 10.00 C ATOM 299 CG LYS A 35 -0.992 11.448 11.643 1.00 10.00 C ATOM 300 CD LYS A 35 0.003 12.220 12.492 1.00 10.00 C ATOM 301 CE LYS A 35 -0.061 11.787 13.948 1.00 10.00 C ATOM 302 NZ LYS A 35 0.769 12.652 14.824 1.00 10.00 N ATOM 0 H LYS A 35 -0.810 9.372 9.397 1.00 10.00 H new ATOM 0 HA LYS A 35 -2.931 11.397 9.685 1.00 10.00 H new ATOM 0 HB2 LYS A 35 0.093 11.601 9.802 1.00 10.00 H new ATOM 0 HB3 LYS A 35 -1.034 12.914 10.082 1.00 10.00 H new ATOM 0 HG2 LYS A 35 -2.002 11.634 12.008 1.00 10.00 H new ATOM 0 HG3 LYS A 35 -0.807 10.379 11.748 1.00 10.00 H new ATOM 0 HD2 LYS A 35 1.011 12.063 12.108 1.00 10.00 H new ATOM 0 HD3 LYS A 35 -0.204 13.288 12.418 1.00 10.00 H new ATOM 0 HE2 LYS A 35 -1.096 11.813 14.289 1.00 10.00 H new ATOM 0 HE3 LYS A 35 0.277 10.754 14.034 1.00 10.00 H new ATOM 0 HZ1 LYS A 35 0.696 12.322 15.807 1.00 10.00 H new ATOM 0 HZ2 LYS A 35 1.761 12.607 14.516 1.00 10.00 H new ATOM 0 HZ3 LYS A 35 0.431 13.634 14.763 1.00 10.00 H new ATOM 316 N ARG A 36 -2.348 12.771 7.567 1.00 10.00 N ATOM 317 CA ARG A 36 -2.329 13.301 6.209 1.00 10.00 C ATOM 318 C ARG A 36 -0.903 13.527 5.711 1.00 10.00 C ATOM 319 O ARG A 36 -0.662 13.586 4.506 1.00 10.00 O ATOM 320 CB ARG A 36 -3.112 14.614 6.140 1.00 10.00 C ATOM 321 CG ARG A 36 -4.152 14.645 5.031 1.00 10.00 C ATOM 322 CD ARG A 36 -5.467 14.022 5.474 1.00 10.00 C ATOM 323 NE ARG A 36 -6.397 13.875 4.356 1.00 10.00 N ATOM 324 CZ ARG A 36 -7.724 13.933 4.460 1.00 10.00 C ATOM 325 NH1 ARG A 36 -8.303 14.164 5.634 1.00 10.00 N ATOM 326 NH2 ARG A 36 -8.471 13.767 3.378 1.00 10.00 N ATOM 0 H ARG A 36 -2.774 13.391 8.256 1.00 10.00 H new ATOM 0 HA ARG A 36 -2.801 12.560 5.563 1.00 10.00 H new ATOM 0 HB2 ARG A 36 -3.607 14.783 7.096 1.00 10.00 H new ATOM 0 HB3 ARG A 36 -2.413 15.437 5.994 1.00 10.00 H new ATOM 0 HG2 ARG A 36 -4.324 15.676 4.722 1.00 10.00 H new ATOM 0 HG3 ARG A 36 -3.771 14.111 4.160 1.00 10.00 H new ATOM 0 HD2 ARG A 36 -5.276 13.046 5.920 1.00 10.00 H new ATOM 0 HD3 ARG A 36 -5.922 14.642 6.247 1.00 10.00 H new ATOM 0 HE ARG A 36 -6.002 13.717 3.429 1.00 10.00 H new ATOM 0 HH11 ARG A 36 -7.730 14.299 6.467 1.00 10.00 H new ATOM 0 HH12 ARG A 36 -9.320 14.206 5.702 1.00 10.00 H new ATOM 0 HH21 ARG A 36 -8.029 13.596 2.475 1.00 10.00 H new ATOM 0 HH22 ARG A 36 -9.488 13.810 3.449 1.00 10.00 H new ATOM 340 N HIS A 37 0.037 13.633 6.643 1.00 10.00 N ATOM 341 CA HIS A 37 1.435 13.870 6.301 1.00 10.00 C ATOM 342 C HIS A 37 2.283 12.612 6.478 1.00 10.00 C ATOM 343 O HIS A 37 3.507 12.691 6.575 1.00 10.00 O ATOM 344 CB HIS A 37 2.018 15.026 7.136 1.00 10.00 C ATOM 345 CG HIS A 37 1.508 15.103 8.549 1.00 10.00 C ATOM 346 ND1 HIS A 37 2.226 14.591 9.602 1.00 10.00 N ATOM 347 CD2 HIS A 37 0.367 15.661 9.024 1.00 10.00 C ATOM 348 CE1 HIS A 37 1.508 14.843 10.685 1.00 10.00 C ATOM 349 NE2 HIS A 37 0.376 15.489 10.383 1.00 10.00 N ATOM 0 H HIS A 37 -0.144 13.558 7.644 1.00 10.00 H new ATOM 0 HA HIS A 37 1.464 14.148 5.248 1.00 10.00 H new ATOM 0 HB2 HIS A 37 3.103 14.926 7.161 1.00 10.00 H new ATOM 0 HB3 HIS A 37 1.796 15.967 6.633 1.00 10.00 H new ATOM 0 HD2 HIS A 37 -0.402 16.148 8.442 1.00 10.00 H new ATOM 0 HE1 HIS A 37 1.799 14.562 11.686 1.00 10.00 H new ATOM 0 HE2 HIS A 37 -0.343 15.795 11.039 1.00 10.00 H new ATOM 357 N THR A 38 1.640 11.456 6.518 1.00 10.00 N ATOM 358 CA THR A 38 2.358 10.199 6.664 1.00 10.00 C ATOM 359 C THR A 38 2.572 9.549 5.294 1.00 10.00 C ATOM 360 O THR A 38 1.608 9.273 4.580 1.00 10.00 O ATOM 361 CB THR A 38 1.599 9.224 7.586 1.00 10.00 C ATOM 362 OG1 THR A 38 1.219 9.898 8.793 1.00 10.00 O ATOM 363 CG2 THR A 38 2.456 8.013 7.930 1.00 10.00 C ATOM 0 H THR A 38 0.627 11.361 6.452 1.00 10.00 H new ATOM 0 HA THR A 38 3.324 10.419 7.117 1.00 10.00 H new ATOM 0 HB THR A 38 0.710 8.878 7.058 1.00 10.00 H new ATOM 0 HG1 THR A 38 1.187 9.254 9.531 1.00 10.00 H new ATOM 0 HG21 THR A 38 1.895 7.343 8.581 1.00 10.00 H new ATOM 0 HG22 THR A 38 2.726 7.487 7.015 1.00 10.00 H new ATOM 0 HG23 THR A 38 3.361 8.341 8.441 1.00 10.00 H new ATOM 371 N PRO A 39 3.842 9.329 4.898 1.00 10.00 N ATOM 372 CA PRO A 39 4.178 8.709 3.607 1.00 10.00 C ATOM 373 C PRO A 39 3.488 7.361 3.409 1.00 10.00 C ATOM 374 O PRO A 39 3.548 6.485 4.279 1.00 10.00 O ATOM 375 CB PRO A 39 5.696 8.524 3.684 1.00 10.00 C ATOM 376 CG PRO A 39 6.158 9.543 4.666 1.00 10.00 C ATOM 377 CD PRO A 39 5.050 9.683 5.670 1.00 10.00 C ATOM 0 HA PRO A 39 3.851 9.321 2.767 1.00 10.00 H new ATOM 0 HB2 PRO A 39 5.955 7.516 4.009 1.00 10.00 H new ATOM 0 HB3 PRO A 39 6.162 8.674 2.710 1.00 10.00 H new ATOM 0 HG2 PRO A 39 7.084 9.229 5.148 1.00 10.00 H new ATOM 0 HG3 PRO A 39 6.362 10.494 4.174 1.00 10.00 H new ATOM 0 HD2 PRO A 39 5.192 9.017 6.521 1.00 10.00 H new ATOM 0 HD3 PRO A 39 4.992 10.697 6.065 1.00 10.00 H new ATOM 385 N LEU A 40 2.860 7.193 2.251 1.00 10.00 N ATOM 386 CA LEU A 40 2.147 5.959 1.930 1.00 10.00 C ATOM 387 C LEU A 40 3.102 4.774 1.810 1.00 10.00 C ATOM 388 O LEU A 40 2.679 3.618 1.851 1.00 10.00 O ATOM 389 CB LEU A 40 1.355 6.127 0.634 1.00 10.00 C ATOM 390 CG LEU A 40 0.167 7.089 0.720 1.00 10.00 C ATOM 391 CD1 LEU A 40 -0.359 7.405 -0.671 1.00 10.00 C ATOM 392 CD2 LEU A 40 -0.937 6.497 1.585 1.00 10.00 C ATOM 0 H LEU A 40 2.829 7.898 1.515 1.00 10.00 H new ATOM 0 HA LEU A 40 1.458 5.752 2.749 1.00 10.00 H new ATOM 0 HB2 LEU A 40 2.032 6.479 -0.144 1.00 10.00 H new ATOM 0 HB3 LEU A 40 0.989 5.149 0.320 1.00 10.00 H new ATOM 0 HG LEU A 40 0.505 8.017 1.182 1.00 10.00 H new ATOM 0 HD11 LEU A 40 -1.203 8.090 -0.594 1.00 10.00 H new ATOM 0 HD12 LEU A 40 0.431 7.868 -1.262 1.00 10.00 H new ATOM 0 HD13 LEU A 40 -0.682 6.484 -1.156 1.00 10.00 H new ATOM 0 HD21 LEU A 40 -1.773 7.194 1.635 1.00 10.00 H new ATOM 0 HD22 LEU A 40 -1.274 5.556 1.151 1.00 10.00 H new ATOM 0 HD23 LEU A 40 -0.555 6.316 2.590 1.00 10.00 H new ATOM 404 N SER A 41 4.388 5.067 1.674 1.00 10.00 N ATOM 405 CA SER A 41 5.407 4.036 1.560 1.00 10.00 C ATOM 406 C SER A 41 5.419 3.153 2.805 1.00 10.00 C ATOM 407 O SER A 41 5.468 1.926 2.714 1.00 10.00 O ATOM 408 CB SER A 41 6.767 4.697 1.368 1.00 10.00 C ATOM 409 OG SER A 41 6.651 6.109 1.490 1.00 10.00 O ATOM 0 H SER A 41 4.751 6.020 1.640 1.00 10.00 H new ATOM 0 HA SER A 41 5.184 3.404 0.700 1.00 10.00 H new ATOM 0 HB2 SER A 41 7.471 4.318 2.109 1.00 10.00 H new ATOM 0 HB3 SER A 41 7.168 4.442 0.387 1.00 10.00 H new ATOM 0 HG SER A 41 6.956 6.535 0.662 1.00 10.00 H new ATOM 415 N LYS A 42 5.336 3.788 3.969 1.00 10.00 N ATOM 416 CA LYS A 42 5.339 3.067 5.235 1.00 10.00 C ATOM 417 C LYS A 42 4.031 2.304 5.407 1.00 10.00 C ATOM 418 O LYS A 42 3.988 1.258 6.054 1.00 10.00 O ATOM 419 CB LYS A 42 5.561 4.039 6.397 1.00 10.00 C ATOM 420 CG LYS A 42 6.800 4.903 6.219 1.00 10.00 C ATOM 421 CD LYS A 42 7.184 5.635 7.495 1.00 10.00 C ATOM 422 CE LYS A 42 8.428 6.485 7.283 1.00 10.00 C ATOM 423 NZ LYS A 42 9.011 6.971 8.561 1.00 10.00 N ATOM 0 H LYS A 42 5.266 4.801 4.061 1.00 10.00 H new ATOM 0 HA LYS A 42 6.158 2.347 5.232 1.00 10.00 H new ATOM 0 HB2 LYS A 42 4.687 4.683 6.497 1.00 10.00 H new ATOM 0 HB3 LYS A 42 5.649 3.474 7.325 1.00 10.00 H new ATOM 0 HG2 LYS A 42 7.633 4.277 5.898 1.00 10.00 H new ATOM 0 HG3 LYS A 42 6.622 5.629 5.426 1.00 10.00 H new ATOM 0 HD2 LYS A 42 6.358 6.268 7.818 1.00 10.00 H new ATOM 0 HD3 LYS A 42 7.364 4.914 8.292 1.00 10.00 H new ATOM 0 HE2 LYS A 42 9.175 5.901 6.745 1.00 10.00 H new ATOM 0 HE3 LYS A 42 8.177 7.339 6.654 1.00 10.00 H new ATOM 0 HZ1 LYS A 42 9.855 7.544 8.362 1.00 10.00 H new ATOM 0 HZ2 LYS A 42 8.310 7.551 9.064 1.00 10.00 H new ATOM 0 HZ3 LYS A 42 9.277 6.158 9.153 1.00 10.00 H new ATOM 437 N LEU A 43 2.972 2.831 4.803 1.00 10.00 N ATOM 438 CA LEU A 43 1.660 2.204 4.858 1.00 10.00 C ATOM 439 C LEU A 43 1.690 0.895 4.080 1.00 10.00 C ATOM 440 O LEU A 43 1.194 -0.133 4.543 1.00 10.00 O ATOM 441 CB LEU A 43 0.597 3.148 4.279 1.00 10.00 C ATOM 442 CG LEU A 43 -0.838 2.607 4.253 1.00 10.00 C ATOM 443 CD1 LEU A 43 -1.822 3.710 4.608 1.00 10.00 C ATOM 444 CD2 LEU A 43 -1.172 2.024 2.886 1.00 10.00 C ATOM 0 H LEU A 43 2.999 3.698 4.266 1.00 10.00 H new ATOM 0 HA LEU A 43 1.403 1.995 5.897 1.00 10.00 H new ATOM 0 HB2 LEU A 43 0.606 4.072 4.857 1.00 10.00 H new ATOM 0 HB3 LEU A 43 0.885 3.407 3.260 1.00 10.00 H new ATOM 0 HG LEU A 43 -0.917 1.811 4.993 1.00 10.00 H new ATOM 0 HD11 LEU A 43 -2.837 3.313 4.586 1.00 10.00 H new ATOM 0 HD12 LEU A 43 -1.601 4.087 5.607 1.00 10.00 H new ATOM 0 HD13 LEU A 43 -1.734 4.522 3.886 1.00 10.00 H new ATOM 0 HD21 LEU A 43 -2.195 1.647 2.891 1.00 10.00 H new ATOM 0 HD22 LEU A 43 -1.076 2.800 2.126 1.00 10.00 H new ATOM 0 HD23 LEU A 43 -0.485 1.208 2.661 1.00 10.00 H new ATOM 456 N MET A 44 2.293 0.948 2.896 1.00 10.00 N ATOM 457 CA MET A 44 2.408 -0.227 2.041 1.00 10.00 C ATOM 458 C MET A 44 3.277 -1.285 2.704 1.00 10.00 C ATOM 459 O MET A 44 2.938 -2.470 2.710 1.00 10.00 O ATOM 460 CB MET A 44 2.995 0.152 0.677 1.00 10.00 C ATOM 461 CG MET A 44 2.097 1.065 -0.142 1.00 10.00 C ATOM 462 SD MET A 44 2.692 1.311 -1.828 1.00 10.00 S ATOM 463 CE MET A 44 4.177 2.274 -1.538 1.00 10.00 C ATOM 0 H MET A 44 2.710 1.794 2.507 1.00 10.00 H new ATOM 0 HA MET A 44 1.409 -0.635 1.890 1.00 10.00 H new ATOM 0 HB2 MET A 44 3.956 0.643 0.829 1.00 10.00 H new ATOM 0 HB3 MET A 44 3.188 -0.758 0.109 1.00 10.00 H new ATOM 0 HG2 MET A 44 1.092 0.643 -0.175 1.00 10.00 H new ATOM 0 HG3 MET A 44 2.021 2.032 0.355 1.00 10.00 H new ATOM 0 HE1 MET A 44 4.702 2.427 -2.481 1.00 10.00 H new ATOM 0 HE2 MET A 44 3.907 3.240 -1.112 1.00 10.00 H new ATOM 0 HE3 MET A 44 4.827 1.741 -0.844 1.00 10.00 H new ATOM 473 N LYS A 45 4.392 -0.846 3.282 1.00 10.00 N ATOM 474 CA LYS A 45 5.317 -1.750 3.958 1.00 10.00 C ATOM 475 C LYS A 45 4.647 -2.446 5.138 1.00 10.00 C ATOM 476 O LYS A 45 4.838 -3.641 5.344 1.00 10.00 O ATOM 477 CB LYS A 45 6.550 -0.986 4.444 1.00 10.00 C ATOM 478 CG LYS A 45 7.482 -0.548 3.326 1.00 10.00 C ATOM 479 CD LYS A 45 8.682 0.206 3.874 1.00 10.00 C ATOM 480 CE LYS A 45 9.626 0.634 2.763 1.00 10.00 C ATOM 481 NZ LYS A 45 10.885 1.215 3.297 1.00 10.00 N ATOM 0 H LYS A 45 4.677 0.133 3.295 1.00 10.00 H new ATOM 0 HA LYS A 45 5.623 -2.509 3.238 1.00 10.00 H new ATOM 0 HB2 LYS A 45 6.225 -0.106 4.999 1.00 10.00 H new ATOM 0 HB3 LYS A 45 7.104 -1.615 5.141 1.00 10.00 H new ATOM 0 HG2 LYS A 45 7.821 -1.421 2.769 1.00 10.00 H new ATOM 0 HG3 LYS A 45 6.940 0.086 2.625 1.00 10.00 H new ATOM 0 HD2 LYS A 45 8.342 1.085 4.422 1.00 10.00 H new ATOM 0 HD3 LYS A 45 9.216 -0.425 4.584 1.00 10.00 H new ATOM 0 HE2 LYS A 45 9.861 -0.226 2.135 1.00 10.00 H new ATOM 0 HE3 LYS A 45 9.129 1.367 2.127 1.00 10.00 H new ATOM 0 HZ1 LYS A 45 11.501 1.494 2.507 1.00 10.00 H new ATOM 0 HZ2 LYS A 45 10.664 2.051 3.875 1.00 10.00 H new ATOM 0 HZ3 LYS A 45 11.373 0.508 3.883 1.00 10.00 H new ATOM 495 N ALA A 46 3.852 -1.695 5.899 1.00 10.00 N ATOM 496 CA ALA A 46 3.161 -2.240 7.065 1.00 10.00 C ATOM 497 C ALA A 46 2.290 -3.438 6.693 1.00 10.00 C ATOM 498 O ALA A 46 2.348 -4.482 7.340 1.00 10.00 O ATOM 499 CB ALA A 46 2.318 -1.163 7.732 1.00 10.00 C ATOM 0 H ALA A 46 3.671 -0.706 5.728 1.00 10.00 H new ATOM 0 HA ALA A 46 3.919 -2.585 7.768 1.00 10.00 H new ATOM 0 HB1 ALA A 46 1.809 -1.584 8.599 1.00 10.00 H new ATOM 0 HB2 ALA A 46 2.961 -0.343 8.052 1.00 10.00 H new ATOM 0 HB3 ALA A 46 1.579 -0.789 7.024 1.00 10.00 H new ATOM 505 N TYR A 47 1.491 -3.288 5.646 1.00 10.00 N ATOM 506 CA TYR A 47 0.615 -4.365 5.204 1.00 10.00 C ATOM 507 C TYR A 47 1.424 -5.487 4.558 1.00 10.00 C ATOM 508 O TYR A 47 1.138 -6.667 4.755 1.00 10.00 O ATOM 509 CB TYR A 47 -0.430 -3.835 4.214 1.00 10.00 C ATOM 510 CG TYR A 47 -1.475 -4.855 3.818 1.00 10.00 C ATOM 511 CD1 TYR A 47 -1.588 -5.286 2.502 1.00 10.00 C ATOM 512 CD2 TYR A 47 -2.345 -5.391 4.759 1.00 10.00 C ATOM 513 CE1 TYR A 47 -2.540 -6.219 2.138 1.00 10.00 C ATOM 514 CE2 TYR A 47 -3.299 -6.324 4.403 1.00 10.00 C ATOM 515 CZ TYR A 47 -3.393 -6.736 3.090 1.00 10.00 C ATOM 516 OH TYR A 47 -4.343 -7.665 2.730 1.00 10.00 O ATOM 0 H TYR A 47 1.431 -2.436 5.089 1.00 10.00 H new ATOM 0 HA TYR A 47 0.101 -4.765 6.078 1.00 10.00 H new ATOM 0 HB2 TYR A 47 -0.928 -2.972 4.655 1.00 10.00 H new ATOM 0 HB3 TYR A 47 0.080 -3.485 3.316 1.00 10.00 H new ATOM 0 HD1 TYR A 47 -0.922 -4.886 1.752 1.00 10.00 H new ATOM 0 HD2 TYR A 47 -2.274 -5.072 5.788 1.00 10.00 H new ATOM 0 HE1 TYR A 47 -2.616 -6.542 1.110 1.00 10.00 H new ATOM 0 HE2 TYR A 47 -3.968 -6.729 5.148 1.00 10.00 H new ATOM 0 HH TYR A 47 -4.860 -7.927 3.520 1.00 10.00 H new ATOM 526 N CYS A 48 2.441 -5.107 3.799 1.00 10.00 N ATOM 527 CA CYS A 48 3.291 -6.065 3.108 1.00 10.00 C ATOM 528 C CYS A 48 4.023 -6.973 4.095 1.00 10.00 C ATOM 529 O CYS A 48 4.003 -8.199 3.956 1.00 10.00 O ATOM 530 CB CYS A 48 4.297 -5.323 2.232 1.00 10.00 C ATOM 531 SG CYS A 48 4.958 -6.306 0.873 1.00 10.00 S ATOM 0 H CYS A 48 2.699 -4.132 3.645 1.00 10.00 H new ATOM 0 HA CYS A 48 2.657 -6.694 2.483 1.00 10.00 H new ATOM 0 HB2 CYS A 48 3.819 -4.433 1.823 1.00 10.00 H new ATOM 0 HB3 CYS A 48 5.124 -4.983 2.856 1.00 10.00 H new ATOM 0 HG CYS A 48 5.916 -7.066 1.313 1.00 10.00 H new ATOM 537 N GLU A 49 4.654 -6.369 5.097 1.00 10.00 N ATOM 538 CA GLU A 49 5.391 -7.123 6.104 1.00 10.00 C ATOM 539 C GLU A 49 4.448 -7.966 6.951 1.00 10.00 C ATOM 540 O GLU A 49 4.825 -9.030 7.445 1.00 10.00 O ATOM 541 CB GLU A 49 6.198 -6.178 6.996 1.00 10.00 C ATOM 542 CG GLU A 49 7.411 -5.572 6.305 1.00 10.00 C ATOM 543 CD GLU A 49 8.309 -6.623 5.688 1.00 10.00 C ATOM 544 OE1 GLU A 49 8.947 -7.385 6.446 1.00 10.00 O ATOM 545 OE2 GLU A 49 8.391 -6.686 4.445 1.00 10.00 O ATOM 0 H GLU A 49 4.669 -5.358 5.233 1.00 10.00 H new ATOM 0 HA GLU A 49 6.079 -7.792 5.587 1.00 10.00 H new ATOM 0 HB2 GLU A 49 5.548 -5.374 7.341 1.00 10.00 H new ATOM 0 HB3 GLU A 49 6.529 -6.722 7.881 1.00 10.00 H new ATOM 0 HG2 GLU A 49 7.077 -4.883 5.529 1.00 10.00 H new ATOM 0 HG3 GLU A 49 7.982 -4.988 7.026 1.00 10.00 H new ATOM 552 N ARG A 50 3.219 -7.490 7.109 1.00 10.00 N ATOM 553 CA ARG A 50 2.218 -8.203 7.889 1.00 10.00 C ATOM 554 C ARG A 50 1.847 -9.512 7.202 1.00 10.00 C ATOM 555 O ARG A 50 1.646 -10.530 7.859 1.00 10.00 O ATOM 556 CB ARG A 50 0.974 -7.339 8.079 1.00 10.00 C ATOM 557 CG ARG A 50 0.034 -7.856 9.153 1.00 10.00 C ATOM 558 CD ARG A 50 -1.292 -7.118 9.128 1.00 10.00 C ATOM 559 NE ARG A 50 -1.501 -6.338 10.342 1.00 10.00 N ATOM 560 CZ ARG A 50 -2.662 -5.775 10.673 1.00 10.00 C ATOM 561 NH1 ARG A 50 -3.722 -5.927 9.888 1.00 10.00 N ATOM 562 NH2 ARG A 50 -2.765 -5.076 11.794 1.00 10.00 N ATOM 0 H ARG A 50 2.892 -6.612 6.706 1.00 10.00 H new ATOM 0 HA ARG A 50 2.639 -8.427 8.869 1.00 10.00 H new ATOM 0 HB2 ARG A 50 1.282 -6.325 8.334 1.00 10.00 H new ATOM 0 HB3 ARG A 50 0.435 -7.280 7.134 1.00 10.00 H new ATOM 0 HG2 ARG A 50 -0.138 -8.922 9.006 1.00 10.00 H new ATOM 0 HG3 ARG A 50 0.499 -7.740 10.132 1.00 10.00 H new ATOM 0 HD2 ARG A 50 -1.324 -6.457 8.262 1.00 10.00 H new ATOM 0 HD3 ARG A 50 -2.105 -7.835 9.012 1.00 10.00 H new ATOM 0 HE ARG A 50 -0.711 -6.216 10.976 1.00 10.00 H new ATOM 0 HH11 ARG A 50 -3.648 -6.475 9.031 1.00 10.00 H new ATOM 0 HH12 ARG A 50 -4.611 -5.496 10.142 1.00 10.00 H new ATOM 0 HH21 ARG A 50 -1.955 -4.969 12.404 1.00 10.00 H new ATOM 0 HH22 ARG A 50 -3.654 -4.645 12.047 1.00 10.00 H new ATOM 576 N GLN A 51 1.760 -9.477 5.877 1.00 10.00 N ATOM 577 CA GLN A 51 1.426 -10.669 5.106 1.00 10.00 C ATOM 578 C GLN A 51 2.660 -11.551 4.946 1.00 10.00 C ATOM 579 O GLN A 51 2.558 -12.740 4.645 1.00 10.00 O ATOM 580 CB GLN A 51 0.874 -10.289 3.727 1.00 10.00 C ATOM 581 CG GLN A 51 -0.279 -9.297 3.771 1.00 10.00 C ATOM 582 CD GLN A 51 -1.445 -9.783 4.613 1.00 10.00 C ATOM 583 OE1 GLN A 51 -1.510 -9.524 5.813 1.00 10.00 O ATOM 584 NE2 GLN A 51 -2.380 -10.484 3.987 1.00 10.00 N ATOM 0 H GLN A 51 1.915 -8.639 5.316 1.00 10.00 H new ATOM 0 HA GLN A 51 0.657 -11.221 5.646 1.00 10.00 H new ATOM 0 HB2 GLN A 51 1.681 -9.866 3.129 1.00 10.00 H new ATOM 0 HB3 GLN A 51 0.541 -11.194 3.219 1.00 10.00 H new ATOM 0 HG2 GLN A 51 0.080 -8.348 4.170 1.00 10.00 H new ATOM 0 HG3 GLN A 51 -0.626 -9.105 2.756 1.00 10.00 H new ATOM 0 HE21 GLN A 51 -2.290 -10.678 2.990 1.00 10.00 H new ATOM 0 HE22 GLN A 51 -3.190 -10.829 4.503 1.00 10.00 H new ATOM 593 N GLY A 52 3.827 -10.953 5.151 1.00 10.00 N ATOM 594 CA GLY A 52 5.073 -11.683 5.037 1.00 10.00 C ATOM 595 C GLY A 52 5.518 -11.828 3.599 1.00 10.00 C ATOM 596 O GLY A 52 5.997 -12.889 3.193 1.00 10.00 O ATOM 0 H GLY A 52 3.932 -9.968 5.396 1.00 10.00 H new ATOM 0 HA2 GLY A 52 5.848 -11.168 5.606 1.00 10.00 H new ATOM 0 HA3 GLY A 52 4.955 -12.671 5.481 1.00 10.00 H new ATOM 600 N LEU A 53 5.353 -10.766 2.826 1.00 10.00 N ATOM 601 CA LEU A 53 5.737 -10.770 1.423 1.00 10.00 C ATOM 602 C LEU A 53 6.613 -9.566 1.114 1.00 10.00 C ATOM 603 O LEU A 53 6.560 -8.558 1.817 1.00 10.00 O ATOM 604 CB LEU A 53 4.491 -10.755 0.531 1.00 10.00 C ATOM 605 CG LEU A 53 3.613 -12.007 0.614 1.00 10.00 C ATOM 606 CD1 LEU A 53 2.290 -11.777 -0.102 1.00 10.00 C ATOM 607 CD2 LEU A 53 4.336 -13.211 0.024 1.00 10.00 C ATOM 0 H LEU A 53 4.953 -9.885 3.149 1.00 10.00 H new ATOM 0 HA LEU A 53 6.303 -11.679 1.220 1.00 10.00 H new ATOM 0 HB2 LEU A 53 3.885 -9.888 0.795 1.00 10.00 H new ATOM 0 HB3 LEU A 53 4.806 -10.620 -0.504 1.00 10.00 H new ATOM 0 HG LEU A 53 3.407 -12.212 1.665 1.00 10.00 H new ATOM 0 HD11 LEU A 53 1.678 -12.676 -0.034 1.00 10.00 H new ATOM 0 HD12 LEU A 53 1.764 -10.944 0.364 1.00 10.00 H new ATOM 0 HD13 LEU A 53 2.479 -11.546 -1.150 1.00 10.00 H new ATOM 0 HD21 LEU A 53 3.695 -14.090 0.093 1.00 10.00 H new ATOM 0 HD22 LEU A 53 4.574 -13.016 -1.022 1.00 10.00 H new ATOM 0 HD23 LEU A 53 5.257 -13.390 0.578 1.00 10.00 H new ATOM 619 N SER A 54 7.422 -9.676 0.073 1.00 10.00 N ATOM 620 CA SER A 54 8.293 -8.587 -0.326 1.00 10.00 C ATOM 621 C SER A 54 7.480 -7.491 -1.003 1.00 10.00 C ATOM 622 O SER A 54 6.565 -7.777 -1.783 1.00 10.00 O ATOM 623 CB SER A 54 9.375 -9.099 -1.276 1.00 10.00 C ATOM 624 OG SER A 54 10.357 -8.106 -1.522 1.00 10.00 O ATOM 0 H SER A 54 7.492 -10.510 -0.510 1.00 10.00 H new ATOM 0 HA SER A 54 8.772 -8.175 0.563 1.00 10.00 H new ATOM 0 HB2 SER A 54 9.848 -9.983 -0.849 1.00 10.00 H new ATOM 0 HB3 SER A 54 8.920 -9.405 -2.218 1.00 10.00 H new ATOM 0 HG SER A 54 11.037 -8.462 -2.131 1.00 10.00 H new ATOM 630 N MET A 55 7.817 -6.237 -0.712 1.00 10.00 N ATOM 631 CA MET A 55 7.114 -5.095 -1.294 1.00 10.00 C ATOM 632 C MET A 55 7.309 -5.050 -2.806 1.00 10.00 C ATOM 633 O MET A 55 6.564 -4.388 -3.523 1.00 10.00 O ATOM 634 CB MET A 55 7.602 -3.786 -0.666 1.00 10.00 C ATOM 635 CG MET A 55 6.577 -2.665 -0.740 1.00 10.00 C ATOM 636 SD MET A 55 7.314 -1.026 -0.594 1.00 10.00 S ATOM 637 CE MET A 55 8.001 -0.819 -2.236 1.00 10.00 C ATOM 0 H MET A 55 8.573 -5.985 -0.076 1.00 10.00 H new ATOM 0 HA MET A 55 6.051 -5.213 -1.084 1.00 10.00 H new ATOM 0 HB2 MET A 55 7.859 -3.966 0.378 1.00 10.00 H new ATOM 0 HB3 MET A 55 8.515 -3.468 -1.169 1.00 10.00 H new ATOM 0 HG2 MET A 55 6.040 -2.733 -1.686 1.00 10.00 H new ATOM 0 HG3 MET A 55 5.842 -2.799 0.054 1.00 10.00 H new ATOM 0 HE1 MET A 55 8.992 -0.371 -2.162 1.00 10.00 H new ATOM 0 HE2 MET A 55 8.077 -1.791 -2.724 1.00 10.00 H new ATOM 0 HE3 MET A 55 7.352 -0.169 -2.823 1.00 10.00 H new ATOM 647 N ARG A 56 8.315 -5.770 -3.286 1.00 10.00 N ATOM 648 CA ARG A 56 8.602 -5.820 -4.712 1.00 10.00 C ATOM 649 C ARG A 56 7.720 -6.861 -5.404 1.00 10.00 C ATOM 650 O ARG A 56 7.686 -6.943 -6.631 1.00 10.00 O ATOM 651 CB ARG A 56 10.082 -6.132 -4.958 1.00 10.00 C ATOM 652 CG ARG A 56 10.516 -5.872 -6.390 1.00 10.00 C ATOM 653 CD ARG A 56 11.988 -6.180 -6.598 1.00 10.00 C ATOM 654 NE ARG A 56 12.416 -5.886 -7.965 1.00 10.00 N ATOM 655 CZ ARG A 56 12.849 -4.691 -8.370 1.00 10.00 C ATOM 656 NH1 ARG A 56 12.960 -3.688 -7.505 1.00 10.00 N ATOM 657 NH2 ARG A 56 13.191 -4.500 -9.640 1.00 10.00 N ATOM 0 H ARG A 56 8.945 -6.327 -2.708 1.00 10.00 H new ATOM 0 HA ARG A 56 8.380 -4.840 -5.135 1.00 10.00 H new ATOM 0 HB2 ARG A 56 10.691 -5.529 -4.285 1.00 10.00 H new ATOM 0 HB3 ARG A 56 10.273 -7.176 -4.711 1.00 10.00 H new ATOM 0 HG2 ARG A 56 9.918 -6.482 -7.067 1.00 10.00 H new ATOM 0 HG3 ARG A 56 10.323 -4.830 -6.645 1.00 10.00 H new ATOM 0 HD2 ARG A 56 12.584 -5.596 -5.897 1.00 10.00 H new ATOM 0 HD3 ARG A 56 12.174 -7.231 -6.377 1.00 10.00 H new ATOM 0 HE ARG A 56 12.381 -6.640 -8.651 1.00 10.00 H new ATOM 0 HH11 ARG A 56 12.714 -3.830 -6.525 1.00 10.00 H new ATOM 0 HH12 ARG A 56 13.292 -2.777 -7.821 1.00 10.00 H new ATOM 0 HH21 ARG A 56 13.123 -5.268 -10.308 1.00 10.00 H new ATOM 0 HH22 ARG A 56 13.522 -3.585 -9.947 1.00 10.00 H new ATOM 671 N GLN A 57 6.973 -7.624 -4.615 1.00 10.00 N ATOM 672 CA GLN A 57 6.102 -8.659 -5.156 1.00 10.00 C ATOM 673 C GLN A 57 4.680 -8.135 -5.373 1.00 10.00 C ATOM 674 O GLN A 57 4.053 -8.432 -6.391 1.00 10.00 O ATOM 675 CB GLN A 57 6.083 -9.874 -4.224 1.00 10.00 C ATOM 676 CG GLN A 57 5.137 -10.975 -4.676 1.00 10.00 C ATOM 677 CD GLN A 57 5.308 -12.251 -3.877 1.00 10.00 C ATOM 678 OE1 GLN A 57 6.415 -12.592 -3.461 1.00 10.00 O ATOM 679 NE2 GLN A 57 4.213 -12.957 -3.651 1.00 10.00 N ATOM 0 H GLN A 57 6.953 -7.545 -3.598 1.00 10.00 H new ATOM 0 HA GLN A 57 6.499 -8.959 -6.126 1.00 10.00 H new ATOM 0 HB2 GLN A 57 7.092 -10.281 -4.151 1.00 10.00 H new ATOM 0 HB3 GLN A 57 5.797 -9.549 -3.224 1.00 10.00 H new ATOM 0 HG2 GLN A 57 4.108 -10.627 -4.583 1.00 10.00 H new ATOM 0 HG3 GLN A 57 5.308 -11.186 -5.732 1.00 10.00 H new ATOM 0 HE21 GLN A 57 3.316 -12.637 -4.015 1.00 10.00 H new ATOM 0 HE22 GLN A 57 4.266 -13.822 -3.113 1.00 10.00 H new ATOM 688 N ILE A 58 4.176 -7.346 -4.430 1.00 10.00 N ATOM 689 CA ILE A 58 2.823 -6.810 -4.542 1.00 10.00 C ATOM 690 C ILE A 58 2.834 -5.346 -4.975 1.00 10.00 C ATOM 691 O ILE A 58 3.849 -4.660 -4.859 1.00 10.00 O ATOM 692 CB ILE A 58 2.035 -6.949 -3.221 1.00 10.00 C ATOM 693 CG1 ILE A 58 2.742 -6.211 -2.083 1.00 10.00 C ATOM 694 CG2 ILE A 58 1.852 -8.420 -2.871 1.00 10.00 C ATOM 695 CD1 ILE A 58 1.941 -6.186 -0.799 1.00 10.00 C ATOM 0 H ILE A 58 4.678 -7.065 -3.587 1.00 10.00 H new ATOM 0 HA ILE A 58 2.322 -7.402 -5.308 1.00 10.00 H new ATOM 0 HB ILE A 58 1.053 -6.496 -3.357 1.00 10.00 H new ATOM 0 HG12 ILE A 58 3.705 -6.686 -1.894 1.00 10.00 H new ATOM 0 HG13 ILE A 58 2.948 -5.187 -2.395 1.00 10.00 H new ATOM 0 HG21 ILE A 58 1.295 -8.505 -1.938 1.00 10.00 H new ATOM 0 HG22 ILE A 58 1.301 -8.918 -3.669 1.00 10.00 H new ATOM 0 HG23 ILE A 58 2.828 -8.891 -2.755 1.00 10.00 H new ATOM 0 HD11 ILE A 58 2.499 -5.648 -0.033 1.00 10.00 H new ATOM 0 HD12 ILE A 58 0.989 -5.685 -0.974 1.00 10.00 H new ATOM 0 HD13 ILE A 58 1.758 -7.207 -0.465 1.00 10.00 H new ATOM 707 N ARG A 59 1.707 -4.882 -5.496 1.00 10.00 N ATOM 708 CA ARG A 59 1.574 -3.505 -5.952 1.00 10.00 C ATOM 709 C ARG A 59 0.320 -2.880 -5.363 1.00 10.00 C ATOM 710 O ARG A 59 -0.689 -3.562 -5.173 1.00 10.00 O ATOM 711 CB ARG A 59 1.501 -3.440 -7.480 1.00 10.00 C ATOM 712 CG ARG A 59 2.763 -3.908 -8.184 1.00 10.00 C ATOM 713 CD ARG A 59 3.953 -3.024 -7.851 1.00 10.00 C ATOM 714 NE ARG A 59 5.171 -3.489 -8.510 1.00 10.00 N ATOM 715 CZ ARG A 59 5.972 -4.429 -8.014 1.00 10.00 C ATOM 716 NH1 ARG A 59 5.716 -4.969 -6.831 1.00 10.00 N ATOM 717 NH2 ARG A 59 7.037 -4.831 -8.699 1.00 10.00 N ATOM 0 H ARG A 59 0.864 -5.445 -5.614 1.00 10.00 H new ATOM 0 HA ARG A 59 2.452 -2.952 -5.618 1.00 10.00 H new ATOM 0 HB2 ARG A 59 0.663 -4.049 -7.819 1.00 10.00 H new ATOM 0 HB3 ARG A 59 1.291 -2.413 -7.779 1.00 10.00 H new ATOM 0 HG2 ARG A 59 2.981 -4.936 -7.895 1.00 10.00 H new ATOM 0 HG3 ARG A 59 2.600 -3.908 -9.262 1.00 10.00 H new ATOM 0 HD2 ARG A 59 3.742 -1.999 -8.157 1.00 10.00 H new ATOM 0 HD3 ARG A 59 4.105 -3.010 -6.772 1.00 10.00 H new ATOM 0 HE ARG A 59 5.423 -3.068 -9.404 1.00 10.00 H new ATOM 0 HH11 ARG A 59 4.902 -4.664 -6.297 1.00 10.00 H new ATOM 0 HH12 ARG A 59 6.333 -5.689 -6.455 1.00 10.00 H new ATOM 0 HH21 ARG A 59 7.244 -4.419 -9.609 1.00 10.00 H new ATOM 0 HH22 ARG A 59 7.648 -5.552 -8.315 1.00 10.00 H new ATOM 731 N PHE A 60 0.385 -1.590 -5.078 1.00 10.00 N ATOM 732 CA PHE A 60 -0.748 -0.867 -4.517 1.00 10.00 C ATOM 733 C PHE A 60 -1.258 0.156 -5.525 1.00 10.00 C ATOM 734 O PHE A 60 -0.476 0.925 -6.092 1.00 10.00 O ATOM 735 CB PHE A 60 -0.351 -0.171 -3.210 1.00 10.00 C ATOM 736 CG PHE A 60 -0.145 -1.112 -2.055 1.00 10.00 C ATOM 737 CD1 PHE A 60 0.996 -1.895 -1.975 1.00 10.00 C ATOM 738 CD2 PHE A 60 -1.091 -1.210 -1.048 1.00 10.00 C ATOM 739 CE1 PHE A 60 1.188 -2.759 -0.915 1.00 10.00 C ATOM 740 CE2 PHE A 60 -0.904 -2.070 0.016 1.00 10.00 C ATOM 741 CZ PHE A 60 0.236 -2.847 0.082 1.00 10.00 C ATOM 0 H PHE A 60 1.216 -1.017 -5.227 1.00 10.00 H new ATOM 0 HA PHE A 60 -1.543 -1.579 -4.297 1.00 10.00 H new ATOM 0 HB2 PHE A 60 0.567 0.393 -3.375 1.00 10.00 H new ATOM 0 HB3 PHE A 60 -1.124 0.550 -2.945 1.00 10.00 H new ATOM 0 HD1 PHE A 60 1.744 -1.829 -2.751 1.00 10.00 H new ATOM 0 HD2 PHE A 60 -1.985 -0.607 -1.096 1.00 10.00 H new ATOM 0 HE1 PHE A 60 2.081 -3.365 -0.866 1.00 10.00 H new ATOM 0 HE2 PHE A 60 -1.648 -2.135 0.796 1.00 10.00 H new ATOM 0 HZ PHE A 60 0.383 -3.522 0.912 1.00 10.00 H new ATOM 751 N ARG A 61 -2.562 0.152 -5.759 1.00 10.00 N ATOM 752 CA ARG A 61 -3.167 1.075 -6.709 1.00 10.00 C ATOM 753 C ARG A 61 -4.263 1.903 -6.053 1.00 10.00 C ATOM 754 O ARG A 61 -5.049 1.398 -5.249 1.00 10.00 O ATOM 755 CB ARG A 61 -3.750 0.321 -7.906 1.00 10.00 C ATOM 756 CG ARG A 61 -2.705 -0.331 -8.797 1.00 10.00 C ATOM 757 CD ARG A 61 -3.344 -0.937 -10.038 1.00 10.00 C ATOM 758 NE ARG A 61 -2.401 -1.743 -10.815 1.00 10.00 N ATOM 759 CZ ARG A 61 -2.763 -2.595 -11.775 1.00 10.00 C ATOM 760 NH1 ARG A 61 -4.044 -2.760 -12.081 1.00 10.00 N ATOM 761 NH2 ARG A 61 -1.839 -3.281 -12.434 1.00 10.00 N ATOM 0 H ARG A 61 -3.222 -0.480 -5.305 1.00 10.00 H new ATOM 0 HA ARG A 61 -2.379 1.744 -7.055 1.00 10.00 H new ATOM 0 HB2 ARG A 61 -4.431 -0.447 -7.541 1.00 10.00 H new ATOM 0 HB3 ARG A 61 -4.342 1.013 -8.505 1.00 10.00 H new ATOM 0 HG2 ARG A 61 -1.961 0.409 -9.092 1.00 10.00 H new ATOM 0 HG3 ARG A 61 -2.180 -1.106 -8.239 1.00 10.00 H new ATOM 0 HD2 ARG A 61 -4.190 -1.558 -9.742 1.00 10.00 H new ATOM 0 HD3 ARG A 61 -3.739 -0.139 -10.666 1.00 10.00 H new ATOM 0 HE ARG A 61 -1.406 -1.647 -10.610 1.00 10.00 H new ATOM 0 HH11 ARG A 61 -4.760 -2.233 -11.581 1.00 10.00 H new ATOM 0 HH12 ARG A 61 -4.313 -3.414 -12.817 1.00 10.00 H new ATOM 0 HH21 ARG A 61 -0.853 -3.157 -12.206 1.00 10.00 H new ATOM 0 HH22 ARG A 61 -2.115 -3.933 -13.168 1.00 10.00 H new ATOM 775 N PHE A 62 -4.304 3.175 -6.407 1.00 10.00 N ATOM 776 CA PHE A 62 -5.300 4.093 -5.891 1.00 10.00 C ATOM 777 C PHE A 62 -6.075 4.696 -7.053 1.00 10.00 C ATOM 778 O PHE A 62 -5.529 5.478 -7.831 1.00 10.00 O ATOM 779 CB PHE A 62 -4.642 5.196 -5.058 1.00 10.00 C ATOM 780 CG PHE A 62 -5.625 6.169 -4.469 1.00 10.00 C ATOM 781 CD1 PHE A 62 -6.564 5.749 -3.543 1.00 10.00 C ATOM 782 CD2 PHE A 62 -5.607 7.505 -4.840 1.00 10.00 C ATOM 783 CE1 PHE A 62 -7.469 6.638 -3.000 1.00 10.00 C ATOM 784 CE2 PHE A 62 -6.509 8.399 -4.299 1.00 10.00 C ATOM 785 CZ PHE A 62 -7.441 7.966 -3.378 1.00 10.00 C ATOM 0 H PHE A 62 -3.646 3.600 -7.061 1.00 10.00 H new ATOM 0 HA PHE A 62 -5.985 3.548 -5.242 1.00 10.00 H new ATOM 0 HB2 PHE A 62 -4.068 4.738 -4.252 1.00 10.00 H new ATOM 0 HB3 PHE A 62 -3.935 5.740 -5.684 1.00 10.00 H new ATOM 0 HD1 PHE A 62 -6.589 4.712 -3.242 1.00 10.00 H new ATOM 0 HD2 PHE A 62 -4.879 7.850 -5.560 1.00 10.00 H new ATOM 0 HE1 PHE A 62 -8.198 6.296 -2.280 1.00 10.00 H new ATOM 0 HE2 PHE A 62 -6.485 9.437 -4.596 1.00 10.00 H new ATOM 0 HZ PHE A 62 -8.147 8.664 -2.954 1.00 10.00 H new ATOM 795 N ASP A 63 -7.333 4.288 -7.184 1.00 10.00 N ATOM 796 CA ASP A 63 -8.210 4.767 -8.252 1.00 10.00 C ATOM 797 C ASP A 63 -7.639 4.406 -9.622 1.00 10.00 C ATOM 798 O ASP A 63 -7.745 5.165 -10.584 1.00 10.00 O ATOM 799 CB ASP A 63 -8.437 6.282 -8.139 1.00 10.00 C ATOM 800 CG ASP A 63 -9.616 6.757 -8.968 1.00 10.00 C ATOM 801 OD1 ASP A 63 -10.598 5.992 -9.115 1.00 10.00 O ATOM 802 OD2 ASP A 63 -9.570 7.903 -9.466 1.00 10.00 O ATOM 0 H ASP A 63 -7.775 3.617 -6.555 1.00 10.00 H new ATOM 0 HA ASP A 63 -9.176 4.273 -8.143 1.00 10.00 H new ATOM 0 HB2 ASP A 63 -8.603 6.544 -7.094 1.00 10.00 H new ATOM 0 HB3 ASP A 63 -7.537 6.806 -8.460 1.00 10.00 H new ATOM 807 N GLY A 64 -7.011 3.240 -9.692 1.00 10.00 N ATOM 808 CA GLY A 64 -6.436 2.779 -10.941 1.00 10.00 C ATOM 809 C GLY A 64 -5.000 3.229 -11.137 1.00 10.00 C ATOM 810 O GLY A 64 -4.256 2.620 -11.906 1.00 10.00 O ATOM 0 H GLY A 64 -6.889 2.604 -8.904 1.00 10.00 H new ATOM 0 HA2 GLY A 64 -6.477 1.690 -10.973 1.00 10.00 H new ATOM 0 HA3 GLY A 64 -7.042 3.145 -11.770 1.00 10.00 H new ATOM 814 N GLN A 65 -4.606 4.283 -10.437 1.00 10.00 N ATOM 815 CA GLN A 65 -3.254 4.815 -10.551 1.00 10.00 C ATOM 816 C GLN A 65 -2.339 4.202 -9.495 1.00 10.00 C ATOM 817 O GLN A 65 -2.740 4.036 -8.347 1.00 10.00 O ATOM 818 CB GLN A 65 -3.269 6.340 -10.410 1.00 10.00 C ATOM 819 CG GLN A 65 -4.057 7.045 -11.502 1.00 10.00 C ATOM 820 CD GLN A 65 -3.454 6.850 -12.880 1.00 10.00 C ATOM 821 OE1 GLN A 65 -3.795 5.909 -13.598 1.00 10.00 O ATOM 822 NE2 GLN A 65 -2.551 7.737 -13.260 1.00 10.00 N ATOM 0 H GLN A 65 -5.204 4.788 -9.783 1.00 10.00 H new ATOM 0 HA GLN A 65 -2.868 4.553 -11.536 1.00 10.00 H new ATOM 0 HB2 GLN A 65 -3.693 6.603 -9.441 1.00 10.00 H new ATOM 0 HB3 GLN A 65 -2.243 6.707 -10.419 1.00 10.00 H new ATOM 0 HG2 GLN A 65 -5.081 6.673 -11.503 1.00 10.00 H new ATOM 0 HG3 GLN A 65 -4.105 8.111 -11.279 1.00 10.00 H new ATOM 0 HE21 GLN A 65 -2.295 8.503 -12.637 1.00 10.00 H new ATOM 0 HE22 GLN A 65 -2.110 7.656 -14.176 1.00 10.00 H new ATOM 831 N PRO A 66 -1.106 3.834 -9.873 1.00 10.00 N ATOM 832 CA PRO A 66 -0.136 3.242 -8.944 1.00 10.00 C ATOM 833 C PRO A 66 0.361 4.243 -7.905 1.00 10.00 C ATOM 834 O PRO A 66 0.630 5.400 -8.229 1.00 10.00 O ATOM 835 CB PRO A 66 1.028 2.808 -9.848 1.00 10.00 C ATOM 836 CG PRO A 66 0.517 2.901 -11.244 1.00 10.00 C ATOM 837 CD PRO A 66 -0.556 3.948 -11.232 1.00 10.00 C ATOM 0 HA PRO A 66 -0.580 2.425 -8.376 1.00 10.00 H new ATOM 0 HB2 PRO A 66 1.895 3.453 -9.706 1.00 10.00 H new ATOM 0 HB3 PRO A 66 1.346 1.792 -9.615 1.00 10.00 H new ATOM 0 HG2 PRO A 66 1.317 3.172 -11.933 1.00 10.00 H new ATOM 0 HG3 PRO A 66 0.120 1.942 -11.577 1.00 10.00 H new ATOM 0 HD2 PRO A 66 -0.153 4.943 -11.423 1.00 10.00 H new ATOM 0 HD3 PRO A 66 -1.314 3.759 -11.992 1.00 10.00 H new ATOM 845 N ILE A 67 0.479 3.791 -6.662 1.00 10.00 N ATOM 846 CA ILE A 67 0.952 4.645 -5.578 1.00 10.00 C ATOM 847 C ILE A 67 2.477 4.682 -5.565 1.00 10.00 C ATOM 848 O ILE A 67 3.133 3.642 -5.651 1.00 10.00 O ATOM 849 CB ILE A 67 0.432 4.156 -4.205 1.00 10.00 C ATOM 850 CG1 ILE A 67 -1.098 4.218 -4.167 1.00 10.00 C ATOM 851 CG2 ILE A 67 1.029 4.984 -3.073 1.00 10.00 C ATOM 852 CD1 ILE A 67 -1.695 3.653 -2.899 1.00 10.00 C ATOM 0 H ILE A 67 0.254 2.837 -6.379 1.00 10.00 H new ATOM 0 HA ILE A 67 0.564 5.648 -5.753 1.00 10.00 H new ATOM 0 HB ILE A 67 0.744 3.121 -4.067 1.00 10.00 H new ATOM 0 HG12 ILE A 67 -1.414 5.255 -4.277 1.00 10.00 H new ATOM 0 HG13 ILE A 67 -1.497 3.671 -5.021 1.00 10.00 H new ATOM 0 HG21 ILE A 67 0.649 4.622 -2.118 1.00 10.00 H new ATOM 0 HG22 ILE A 67 2.115 4.893 -3.089 1.00 10.00 H new ATOM 0 HG23 ILE A 67 0.750 6.030 -3.201 1.00 10.00 H new ATOM 0 HD11 ILE A 67 -2.781 3.730 -2.942 1.00 10.00 H new ATOM 0 HD12 ILE A 67 -1.409 2.606 -2.797 1.00 10.00 H new ATOM 0 HD13 ILE A 67 -1.325 4.215 -2.041 1.00 10.00 H new ATOM 864 N ASN A 68 3.040 5.879 -5.471 1.00 10.00 N ATOM 865 CA ASN A 68 4.488 6.034 -5.451 1.00 10.00 C ATOM 866 C ASN A 68 5.023 5.932 -4.029 1.00 10.00 C ATOM 867 O ASN A 68 4.308 6.203 -3.061 1.00 10.00 O ATOM 868 CB ASN A 68 4.900 7.375 -6.057 1.00 10.00 C ATOM 869 CG ASN A 68 4.526 7.496 -7.519 1.00 10.00 C ATOM 870 OD1 ASN A 68 5.262 7.051 -8.399 1.00 10.00 O ATOM 871 ND2 ASN A 68 3.380 8.099 -7.785 1.00 10.00 N ATOM 0 H ASN A 68 2.519 6.753 -5.408 1.00 10.00 H new ATOM 0 HA ASN A 68 4.915 5.229 -6.049 1.00 10.00 H new ATOM 0 HB2 ASN A 68 4.427 8.182 -5.497 1.00 10.00 H new ATOM 0 HB3 ASN A 68 5.977 7.501 -5.950 1.00 10.00 H new ATOM 0 HD21 ASN A 68 3.075 8.210 -8.752 1.00 10.00 H new ATOM 0 HD22 ASN A 68 2.801 8.453 -7.023 1.00 10.00 H new ATOM 878 N GLU A 69 6.293 5.564 -3.906 1.00 10.00 N ATOM 879 CA GLU A 69 6.932 5.423 -2.604 1.00 10.00 C ATOM 880 C GLU A 69 7.195 6.787 -1.969 1.00 10.00 C ATOM 881 O GLU A 69 7.670 6.877 -0.835 1.00 10.00 O ATOM 882 CB GLU A 69 8.246 4.657 -2.742 1.00 10.00 C ATOM 883 CG GLU A 69 8.075 3.238 -3.251 1.00 10.00 C ATOM 884 CD GLU A 69 9.351 2.436 -3.145 1.00 10.00 C ATOM 885 OE1 GLU A 69 9.799 2.171 -2.008 1.00 10.00 O ATOM 886 OE2 GLU A 69 9.922 2.075 -4.192 1.00 10.00 O ATOM 0 H GLU A 69 6.903 5.357 -4.697 1.00 10.00 H new ATOM 0 HA GLU A 69 6.255 4.866 -1.956 1.00 10.00 H new ATOM 0 HB2 GLU A 69 8.903 5.200 -3.421 1.00 10.00 H new ATOM 0 HB3 GLU A 69 8.743 4.628 -1.772 1.00 10.00 H new ATOM 0 HG2 GLU A 69 7.288 2.742 -2.683 1.00 10.00 H new ATOM 0 HG3 GLU A 69 7.749 3.264 -4.291 1.00 10.00 H new ATOM 893 N THR A 70 6.902 7.843 -2.705 1.00 10.00 N ATOM 894 CA THR A 70 7.098 9.192 -2.211 1.00 10.00 C ATOM 895 C THR A 70 5.779 9.956 -2.210 1.00 10.00 C ATOM 896 O THR A 70 5.758 11.187 -2.182 1.00 10.00 O ATOM 897 CB THR A 70 8.134 9.945 -3.067 1.00 10.00 C ATOM 898 OG1 THR A 70 8.841 9.017 -3.907 1.00 10.00 O ATOM 899 CG2 THR A 70 9.128 10.688 -2.183 1.00 10.00 C ATOM 0 H THR A 70 6.526 7.791 -3.652 1.00 10.00 H new ATOM 0 HA THR A 70 7.472 9.124 -1.189 1.00 10.00 H new ATOM 0 HB THR A 70 7.605 10.670 -3.685 1.00 10.00 H new ATOM 0 HG1 THR A 70 9.497 9.502 -4.450 1.00 10.00 H new ATOM 0 HG21 THR A 70 9.850 11.212 -2.809 1.00 10.00 H new ATOM 0 HG22 THR A 70 8.595 11.408 -1.562 1.00 10.00 H new ATOM 0 HG23 THR A 70 9.651 9.976 -1.545 1.00 10.00 H new ATOM 907 N ASP A 71 4.674 9.222 -2.237 1.00 10.00 N ATOM 908 CA ASP A 71 3.354 9.835 -2.243 1.00 10.00 C ATOM 909 C ASP A 71 2.760 9.879 -0.844 1.00 10.00 C ATOM 910 O ASP A 71 3.110 9.072 0.024 1.00 10.00 O ATOM 911 CB ASP A 71 2.407 9.079 -3.173 1.00 10.00 C ATOM 912 CG ASP A 71 2.433 9.612 -4.591 1.00 10.00 C ATOM 913 OD1 ASP A 71 2.793 10.794 -4.784 1.00 10.00 O ATOM 914 OD2 ASP A 71 2.090 8.849 -5.521 1.00 10.00 O ATOM 0 H ASP A 71 4.667 8.202 -2.255 1.00 10.00 H new ATOM 0 HA ASP A 71 3.473 10.856 -2.606 1.00 10.00 H new ATOM 0 HB2 ASP A 71 2.678 8.023 -3.181 1.00 10.00 H new ATOM 0 HB3 ASP A 71 1.391 9.145 -2.783 1.00 10.00 H new ATOM 919 N THR A 72 1.855 10.823 -0.637 1.00 10.00 N ATOM 920 CA THR A 72 1.187 10.993 0.641 1.00 10.00 C ATOM 921 C THR A 72 -0.320 11.122 0.420 1.00 10.00 C ATOM 922 O THR A 72 -0.753 11.410 -0.699 1.00 10.00 O ATOM 923 CB THR A 72 1.702 12.251 1.367 1.00 10.00 C ATOM 924 OG1 THR A 72 1.920 13.303 0.420 1.00 10.00 O ATOM 925 CG2 THR A 72 2.991 11.960 2.123 1.00 10.00 C ATOM 0 H THR A 72 1.564 11.492 -1.350 1.00 10.00 H new ATOM 0 HA THR A 72 1.401 10.120 1.258 1.00 10.00 H new ATOM 0 HB THR A 72 0.947 12.561 2.089 1.00 10.00 H new ATOM 0 HG1 THR A 72 2.246 14.101 0.887 1.00 10.00 H new ATOM 0 HG21 THR A 72 3.331 12.866 2.625 1.00 10.00 H new ATOM 0 HG22 THR A 72 2.811 11.181 2.863 1.00 10.00 H new ATOM 0 HG23 THR A 72 3.756 11.625 1.422 1.00 10.00 H new ATOM 933 N PRO A 73 -1.141 10.907 1.466 1.00 10.00 N ATOM 934 CA PRO A 73 -2.600 11.020 1.356 1.00 10.00 C ATOM 935 C PRO A 73 -3.027 12.393 0.843 1.00 10.00 C ATOM 936 O PRO A 73 -3.938 12.507 0.023 1.00 10.00 O ATOM 937 CB PRO A 73 -3.094 10.804 2.793 1.00 10.00 C ATOM 938 CG PRO A 73 -2.002 10.050 3.463 1.00 10.00 C ATOM 939 CD PRO A 73 -0.723 10.513 2.825 1.00 10.00 C ATOM 0 HA PRO A 73 -3.013 10.303 0.646 1.00 10.00 H new ATOM 0 HB2 PRO A 73 -3.283 11.754 3.293 1.00 10.00 H new ATOM 0 HB3 PRO A 73 -4.029 10.244 2.810 1.00 10.00 H new ATOM 0 HG2 PRO A 73 -1.995 10.245 4.535 1.00 10.00 H new ATOM 0 HG3 PRO A 73 -2.135 8.976 3.335 1.00 10.00 H new ATOM 0 HD2 PRO A 73 -0.283 11.349 3.368 1.00 10.00 H new ATOM 0 HD3 PRO A 73 0.024 9.720 2.801 1.00 10.00 H new ATOM 947 N ALA A 74 -2.337 13.425 1.312 1.00 10.00 N ATOM 948 CA ALA A 74 -2.634 14.795 0.912 1.00 10.00 C ATOM 949 C ALA A 74 -2.204 15.056 -0.529 1.00 10.00 C ATOM 950 O ALA A 74 -2.786 15.891 -1.219 1.00 10.00 O ATOM 951 CB ALA A 74 -1.951 15.774 1.856 1.00 10.00 C ATOM 0 H ALA A 74 -1.565 13.339 1.973 1.00 10.00 H new ATOM 0 HA ALA A 74 -3.713 14.940 0.969 1.00 10.00 H new ATOM 0 HB1 ALA A 74 -2.179 16.795 1.549 1.00 10.00 H new ATOM 0 HB2 ALA A 74 -2.311 15.612 2.872 1.00 10.00 H new ATOM 0 HB3 ALA A 74 -0.873 15.618 1.824 1.00 10.00 H new ATOM 957 N GLN A 75 -1.190 14.326 -0.982 1.00 10.00 N ATOM 958 CA GLN A 75 -0.677 14.484 -2.337 1.00 10.00 C ATOM 959 C GLN A 75 -1.613 13.840 -3.358 1.00 10.00 C ATOM 960 O GLN A 75 -1.924 14.436 -4.389 1.00 10.00 O ATOM 961 CB GLN A 75 0.721 13.864 -2.450 1.00 10.00 C ATOM 962 CG GLN A 75 1.336 13.976 -3.837 1.00 10.00 C ATOM 963 CD GLN A 75 1.686 15.401 -4.211 1.00 10.00 C ATOM 964 OE1 GLN A 75 2.026 16.218 -3.353 1.00 10.00 O ATOM 965 NE2 GLN A 75 1.604 15.710 -5.495 1.00 10.00 N ATOM 0 H GLN A 75 -0.707 13.618 -0.429 1.00 10.00 H new ATOM 0 HA GLN A 75 -0.616 15.551 -2.551 1.00 10.00 H new ATOM 0 HB2 GLN A 75 1.381 14.348 -1.731 1.00 10.00 H new ATOM 0 HB3 GLN A 75 0.664 12.811 -2.173 1.00 10.00 H new ATOM 0 HG2 GLN A 75 2.236 13.362 -3.881 1.00 10.00 H new ATOM 0 HG3 GLN A 75 0.639 13.573 -4.572 1.00 10.00 H new ATOM 0 HE21 GLN A 75 1.318 15.003 -6.172 1.00 10.00 H new ATOM 0 HE22 GLN A 75 1.827 16.655 -5.807 1.00 10.00 H new ATOM 974 N LEU A 76 -2.080 12.633 -3.054 1.00 10.00 N ATOM 975 CA LEU A 76 -2.961 11.905 -3.963 1.00 10.00 C ATOM 976 C LEU A 76 -4.427 12.296 -3.790 1.00 10.00 C ATOM 977 O LEU A 76 -5.309 11.654 -4.362 1.00 10.00 O ATOM 978 CB LEU A 76 -2.800 10.398 -3.761 1.00 10.00 C ATOM 979 CG LEU A 76 -1.748 9.728 -4.653 1.00 10.00 C ATOM 980 CD1 LEU A 76 -1.533 8.286 -4.226 1.00 10.00 C ATOM 981 CD2 LEU A 76 -2.166 9.787 -6.114 1.00 10.00 C ATOM 0 H LEU A 76 -1.864 12.139 -2.188 1.00 10.00 H new ATOM 0 HA LEU A 76 -2.667 12.175 -4.977 1.00 10.00 H new ATOM 0 HB2 LEU A 76 -2.540 10.213 -2.719 1.00 10.00 H new ATOM 0 HB3 LEU A 76 -3.763 9.919 -3.939 1.00 10.00 H new ATOM 0 HG LEU A 76 -0.809 10.270 -4.541 1.00 10.00 H new ATOM 0 HD11 LEU A 76 -0.784 7.824 -4.869 1.00 10.00 H new ATOM 0 HD12 LEU A 76 -1.190 8.260 -3.192 1.00 10.00 H new ATOM 0 HD13 LEU A 76 -2.471 7.738 -4.311 1.00 10.00 H new ATOM 0 HD21 LEU A 76 -1.406 9.306 -6.730 1.00 10.00 H new ATOM 0 HD22 LEU A 76 -3.117 9.270 -6.242 1.00 10.00 H new ATOM 0 HD23 LEU A 76 -2.275 10.828 -6.419 1.00 10.00 H new ATOM 993 N GLU A 77 -4.678 13.343 -3.005 1.00 10.00 N ATOM 994 CA GLU A 77 -6.040 13.829 -2.758 1.00 10.00 C ATOM 995 C GLU A 77 -6.929 12.720 -2.200 1.00 10.00 C ATOM 996 O GLU A 77 -8.073 12.538 -2.631 1.00 10.00 O ATOM 997 CB GLU A 77 -6.650 14.393 -4.047 1.00 10.00 C ATOM 998 CG GLU A 77 -6.050 15.721 -4.476 1.00 10.00 C ATOM 999 CD GLU A 77 -6.522 16.873 -3.616 1.00 10.00 C ATOM 1000 OE1 GLU A 77 -7.407 17.633 -4.068 1.00 10.00 O ATOM 1001 OE2 GLU A 77 -6.023 17.025 -2.484 1.00 10.00 O ATOM 0 H GLU A 77 -3.952 13.876 -2.525 1.00 10.00 H new ATOM 0 HA GLU A 77 -5.980 14.625 -2.016 1.00 10.00 H new ATOM 0 HB2 GLU A 77 -6.516 13.668 -4.850 1.00 10.00 H new ATOM 0 HB3 GLU A 77 -7.724 14.518 -3.906 1.00 10.00 H new ATOM 0 HG2 GLU A 77 -4.963 15.657 -4.428 1.00 10.00 H new ATOM 0 HG3 GLU A 77 -6.313 15.916 -5.516 1.00 10.00 H new ATOM 1008 N MET A 78 -6.396 11.986 -1.236 1.00 10.00 N ATOM 1009 CA MET A 78 -7.123 10.890 -0.611 1.00 10.00 C ATOM 1010 C MET A 78 -8.028 11.422 0.490 1.00 10.00 C ATOM 1011 O MET A 78 -7.676 12.377 1.185 1.00 10.00 O ATOM 1012 CB MET A 78 -6.144 9.858 -0.044 1.00 10.00 C ATOM 1013 CG MET A 78 -5.095 9.405 -1.048 1.00 10.00 C ATOM 1014 SD MET A 78 -3.889 8.264 -0.341 1.00 10.00 S ATOM 1015 CE MET A 78 -4.804 6.728 -0.414 1.00 10.00 C ATOM 0 H MET A 78 -5.456 12.130 -0.867 1.00 10.00 H new ATOM 0 HA MET A 78 -7.740 10.403 -1.366 1.00 10.00 H new ATOM 0 HB2 MET A 78 -5.644 10.283 0.826 1.00 10.00 H new ATOM 0 HB3 MET A 78 -6.704 8.989 0.302 1.00 10.00 H new ATOM 0 HG2 MET A 78 -5.591 8.924 -1.891 1.00 10.00 H new ATOM 0 HG3 MET A 78 -4.574 10.279 -1.440 1.00 10.00 H new ATOM 0 HE1 MET A 78 -4.427 6.044 0.346 1.00 10.00 H new ATOM 0 HE2 MET A 78 -5.861 6.925 -0.233 1.00 10.00 H new ATOM 0 HE3 MET A 78 -4.682 6.278 -1.400 1.00 10.00 H new ATOM 1025 N GLU A 79 -9.189 10.805 0.648 1.00 10.00 N ATOM 1026 CA GLU A 79 -10.145 11.223 1.658 1.00 10.00 C ATOM 1027 C GLU A 79 -10.387 10.104 2.663 1.00 10.00 C ATOM 1028 O GLU A 79 -9.834 9.011 2.539 1.00 10.00 O ATOM 1029 CB GLU A 79 -11.464 11.634 0.999 1.00 10.00 C ATOM 1030 CG GLU A 79 -11.883 13.059 1.318 1.00 10.00 C ATOM 1031 CD GLU A 79 -12.008 13.304 2.808 1.00 10.00 C ATOM 1032 OE1 GLU A 79 -12.991 12.832 3.411 1.00 10.00 O ATOM 1033 OE2 GLU A 79 -11.118 13.957 3.388 1.00 10.00 O ATOM 0 H GLU A 79 -9.492 10.009 0.086 1.00 10.00 H new ATOM 0 HA GLU A 79 -9.733 12.081 2.189 1.00 10.00 H new ATOM 0 HB2 GLU A 79 -11.371 11.524 -0.081 1.00 10.00 H new ATOM 0 HB3 GLU A 79 -12.250 10.952 1.322 1.00 10.00 H new ATOM 0 HG2 GLU A 79 -11.154 13.752 0.898 1.00 10.00 H new ATOM 0 HG3 GLU A 79 -12.838 13.271 0.836 1.00 10.00 H new ATOM 1040 N ASP A 80 -11.216 10.384 3.656 1.00 10.00 N ATOM 1041 CA ASP A 80 -11.536 9.408 4.687 1.00 10.00 C ATOM 1042 C ASP A 80 -12.413 8.302 4.117 1.00 10.00 C ATOM 1043 O ASP A 80 -13.359 8.580 3.377 1.00 10.00 O ATOM 1044 CB ASP A 80 -12.248 10.097 5.850 1.00 10.00 C ATOM 1045 CG ASP A 80 -12.341 9.223 7.081 1.00 10.00 C ATOM 1046 OD1 ASP A 80 -13.473 8.864 7.476 1.00 10.00 O ATOM 1047 OD2 ASP A 80 -11.286 8.917 7.675 1.00 10.00 O ATOM 0 H ASP A 80 -11.682 11.284 3.770 1.00 10.00 H new ATOM 0 HA ASP A 80 -10.609 8.963 5.049 1.00 10.00 H new ATOM 0 HB2 ASP A 80 -11.718 11.016 6.101 1.00 10.00 H new ATOM 0 HB3 ASP A 80 -13.252 10.384 5.537 1.00 10.00 H new ATOM 1052 N GLU A 81 -12.069 7.060 4.456 1.00 10.00 N ATOM 1053 CA GLU A 81 -12.791 5.867 4.003 1.00 10.00 C ATOM 1054 C GLU A 81 -12.452 5.527 2.553 1.00 10.00 C ATOM 1055 O GLU A 81 -13.205 4.813 1.888 1.00 10.00 O ATOM 1056 CB GLU A 81 -14.309 6.014 4.164 1.00 10.00 C ATOM 1057 CG GLU A 81 -14.792 5.887 5.598 1.00 10.00 C ATOM 1058 CD GLU A 81 -16.212 5.372 5.674 1.00 10.00 C ATOM 1059 OE1 GLU A 81 -17.152 6.193 5.670 1.00 10.00 O ATOM 1060 OE2 GLU A 81 -16.396 4.140 5.737 1.00 10.00 O ATOM 0 H GLU A 81 -11.274 6.849 5.059 1.00 10.00 H new ATOM 0 HA GLU A 81 -12.462 5.047 4.642 1.00 10.00 H new ATOM 0 HB2 GLU A 81 -14.613 6.985 3.773 1.00 10.00 H new ATOM 0 HB3 GLU A 81 -14.804 5.257 3.556 1.00 10.00 H new ATOM 0 HG2 GLU A 81 -14.132 5.213 6.144 1.00 10.00 H new ATOM 0 HG3 GLU A 81 -14.732 6.859 6.088 1.00 10.00 H new ATOM 1067 N ASP A 82 -11.320 6.030 2.070 1.00 10.00 N ATOM 1068 CA ASP A 82 -10.891 5.749 0.702 1.00 10.00 C ATOM 1069 C ASP A 82 -10.384 4.317 0.610 1.00 10.00 C ATOM 1070 O ASP A 82 -9.838 3.789 1.580 1.00 10.00 O ATOM 1071 CB ASP A 82 -9.807 6.730 0.242 1.00 10.00 C ATOM 1072 CG ASP A 82 -10.285 7.608 -0.898 1.00 10.00 C ATOM 1073 OD1 ASP A 82 -11.110 7.135 -1.706 1.00 10.00 O ATOM 1074 OD2 ASP A 82 -9.849 8.776 -0.992 1.00 10.00 O ATOM 0 H ASP A 82 -10.687 6.629 2.600 1.00 10.00 H new ATOM 0 HA ASP A 82 -11.749 5.874 0.041 1.00 10.00 H new ATOM 0 HB2 ASP A 82 -9.505 7.357 1.081 1.00 10.00 H new ATOM 0 HB3 ASP A 82 -8.924 6.174 -0.074 1.00 10.00 H new ATOM 1079 N THR A 83 -10.565 3.690 -0.542 1.00 10.00 N ATOM 1080 CA THR A 83 -10.152 2.303 -0.725 1.00 10.00 C ATOM 1081 C THR A 83 -8.906 2.168 -1.599 1.00 10.00 C ATOM 1082 O THR A 83 -8.797 2.786 -2.659 1.00 10.00 O ATOM 1083 CB THR A 83 -11.293 1.476 -1.347 1.00 10.00 C ATOM 1084 OG1 THR A 83 -12.560 1.992 -0.915 1.00 10.00 O ATOM 1085 CG2 THR A 83 -11.177 0.010 -0.957 1.00 10.00 C ATOM 0 H THR A 83 -10.994 4.116 -1.364 1.00 10.00 H new ATOM 0 HA THR A 83 -9.909 1.923 0.267 1.00 10.00 H new ATOM 0 HB THR A 83 -11.218 1.552 -2.432 1.00 10.00 H new ATOM 0 HG1 THR A 83 -13.282 1.464 -1.315 1.00 10.00 H new ATOM 0 HG21 THR A 83 -11.994 -0.552 -1.409 1.00 10.00 H new ATOM 0 HG22 THR A 83 -10.225 -0.386 -1.310 1.00 10.00 H new ATOM 0 HG23 THR A 83 -11.229 -0.083 0.128 1.00 10.00 H new ATOM 1093 N ILE A 84 -7.968 1.353 -1.134 1.00 10.00 N ATOM 1094 CA ILE A 84 -6.731 1.086 -1.858 1.00 10.00 C ATOM 1095 C ILE A 84 -6.740 -0.363 -2.339 1.00 10.00 C ATOM 1096 O ILE A 84 -7.101 -1.266 -1.583 1.00 10.00 O ATOM 1097 CB ILE A 84 -5.487 1.332 -0.971 1.00 10.00 C ATOM 1098 CG1 ILE A 84 -5.517 2.749 -0.386 1.00 10.00 C ATOM 1099 CG2 ILE A 84 -4.208 1.113 -1.769 1.00 10.00 C ATOM 1100 CD1 ILE A 84 -4.421 3.015 0.626 1.00 10.00 C ATOM 0 H ILE A 84 -8.043 0.859 -0.245 1.00 10.00 H new ATOM 0 HA ILE A 84 -6.674 1.768 -2.706 1.00 10.00 H new ATOM 0 HB ILE A 84 -5.506 0.617 -0.148 1.00 10.00 H new ATOM 0 HG12 ILE A 84 -5.431 3.470 -1.199 1.00 10.00 H new ATOM 0 HG13 ILE A 84 -6.484 2.916 0.087 1.00 10.00 H new ATOM 0 HG21 ILE A 84 -3.344 1.291 -1.128 1.00 10.00 H new ATOM 0 HG22 ILE A 84 -4.181 0.088 -2.139 1.00 10.00 H new ATOM 0 HG23 ILE A 84 -4.182 1.803 -2.612 1.00 10.00 H new ATOM 0 HD11 ILE A 84 -4.507 4.037 0.995 1.00 10.00 H new ATOM 0 HD12 ILE A 84 -4.518 2.319 1.459 1.00 10.00 H new ATOM 0 HD13 ILE A 84 -3.448 2.881 0.153 1.00 10.00 H new ATOM 1112 N ASP A 85 -6.351 -0.581 -3.589 1.00 10.00 N ATOM 1113 CA ASP A 85 -6.342 -1.924 -4.164 1.00 10.00 C ATOM 1114 C ASP A 85 -4.955 -2.546 -4.101 1.00 10.00 C ATOM 1115 O ASP A 85 -3.954 -1.894 -4.407 1.00 10.00 O ATOM 1116 CB ASP A 85 -6.813 -1.893 -5.622 1.00 10.00 C ATOM 1117 CG ASP A 85 -8.245 -2.363 -5.793 1.00 10.00 C ATOM 1118 OD1 ASP A 85 -8.511 -3.572 -5.619 1.00 10.00 O ATOM 1119 OD2 ASP A 85 -9.110 -1.520 -6.121 1.00 10.00 O ATOM 0 H ASP A 85 -6.038 0.152 -4.225 1.00 10.00 H new ATOM 0 HA ASP A 85 -7.027 -2.532 -3.573 1.00 10.00 H new ATOM 0 HB2 ASP A 85 -6.722 -0.877 -6.006 1.00 10.00 H new ATOM 0 HB3 ASP A 85 -6.156 -2.521 -6.224 1.00 10.00 H new ATOM 1124 N VAL A 86 -4.904 -3.807 -3.695 1.00 10.00 N ATOM 1125 CA VAL A 86 -3.649 -4.537 -3.606 1.00 10.00 C ATOM 1126 C VAL A 86 -3.600 -5.621 -4.674 1.00 10.00 C ATOM 1127 O VAL A 86 -4.522 -6.428 -4.786 1.00 10.00 O ATOM 1128 CB VAL A 86 -3.464 -5.194 -2.222 1.00 10.00 C ATOM 1129 CG1 VAL A 86 -2.059 -5.761 -2.078 1.00 10.00 C ATOM 1130 CG2 VAL A 86 -3.756 -4.201 -1.108 1.00 10.00 C ATOM 0 H VAL A 86 -5.724 -4.348 -3.420 1.00 10.00 H new ATOM 0 HA VAL A 86 -2.845 -3.817 -3.758 1.00 10.00 H new ATOM 0 HB VAL A 86 -4.175 -6.016 -2.141 1.00 10.00 H new ATOM 0 HG11 VAL A 86 -1.951 -6.219 -1.095 1.00 10.00 H new ATOM 0 HG12 VAL A 86 -1.889 -6.512 -2.849 1.00 10.00 H new ATOM 0 HG13 VAL A 86 -1.330 -4.958 -2.186 1.00 10.00 H new ATOM 0 HG21 VAL A 86 -3.619 -4.687 -0.142 1.00 10.00 H new ATOM 0 HG22 VAL A 86 -3.075 -3.354 -1.188 1.00 10.00 H new ATOM 0 HG23 VAL A 86 -4.784 -3.849 -1.194 1.00 10.00 H new ATOM 1140 N PHE A 87 -2.537 -5.635 -5.461 1.00 10.00 N ATOM 1141 CA PHE A 87 -2.382 -6.626 -6.520 1.00 10.00 C ATOM 1142 C PHE A 87 -1.037 -7.332 -6.408 1.00 10.00 C ATOM 1143 O PHE A 87 -0.104 -6.804 -5.811 1.00 10.00 O ATOM 1144 CB PHE A 87 -2.505 -5.961 -7.895 1.00 10.00 C ATOM 1145 CG PHE A 87 -3.896 -5.488 -8.218 1.00 10.00 C ATOM 1146 CD1 PHE A 87 -4.878 -6.388 -8.603 1.00 10.00 C ATOM 1147 CD2 PHE A 87 -4.218 -4.142 -8.138 1.00 10.00 C ATOM 1148 CE1 PHE A 87 -6.157 -5.952 -8.903 1.00 10.00 C ATOM 1149 CE2 PHE A 87 -5.494 -3.702 -8.437 1.00 10.00 C ATOM 1150 CZ PHE A 87 -6.464 -4.608 -8.820 1.00 10.00 C ATOM 0 H PHE A 87 -1.766 -4.971 -5.389 1.00 10.00 H new ATOM 0 HA PHE A 87 -3.175 -7.366 -6.409 1.00 10.00 H new ATOM 0 HB2 PHE A 87 -1.823 -5.112 -7.940 1.00 10.00 H new ATOM 0 HB3 PHE A 87 -2.185 -6.668 -8.660 1.00 10.00 H new ATOM 0 HD1 PHE A 87 -4.643 -7.440 -8.669 1.00 10.00 H new ATOM 0 HD2 PHE A 87 -3.464 -3.429 -7.839 1.00 10.00 H new ATOM 0 HE1 PHE A 87 -6.914 -6.662 -9.202 1.00 10.00 H new ATOM 0 HE2 PHE A 87 -5.732 -2.651 -8.371 1.00 10.00 H new ATOM 0 HZ PHE A 87 -7.461 -4.266 -9.054 1.00 10.00 H new ATOM 1160 N GLN A 88 -0.949 -8.527 -6.970 1.00 10.00 N ATOM 1161 CA GLN A 88 0.289 -9.295 -6.946 1.00 10.00 C ATOM 1162 C GLN A 88 0.884 -9.350 -8.345 1.00 10.00 C ATOM 1163 O GLN A 88 0.148 -9.359 -9.337 1.00 10.00 O ATOM 1164 CB GLN A 88 0.041 -10.718 -6.437 1.00 10.00 C ATOM 1165 CG GLN A 88 -0.366 -10.788 -4.973 1.00 10.00 C ATOM 1166 CD GLN A 88 0.527 -11.705 -4.159 1.00 10.00 C ATOM 1167 OE1 GLN A 88 1.716 -11.851 -4.443 1.00 10.00 O ATOM 1168 NE2 GLN A 88 -0.041 -12.331 -3.141 1.00 10.00 N ATOM 0 H GLN A 88 -1.722 -8.989 -7.450 1.00 10.00 H new ATOM 0 HA GLN A 88 0.986 -8.803 -6.268 1.00 10.00 H new ATOM 0 HB2 GLN A 88 -0.739 -11.179 -7.043 1.00 10.00 H new ATOM 0 HB3 GLN A 88 0.947 -11.307 -6.581 1.00 10.00 H new ATOM 0 HG2 GLN A 88 -0.338 -9.786 -4.544 1.00 10.00 H new ATOM 0 HG3 GLN A 88 -1.397 -11.136 -4.903 1.00 10.00 H new ATOM 0 HE21 GLN A 88 -1.030 -12.183 -2.939 1.00 10.00 H new ATOM 0 HE22 GLN A 88 0.510 -12.962 -2.559 1.00 10.00 H new ATOM 1177 N GLN A 89 2.203 -9.367 -8.435 1.00 10.00 N ATOM 1178 CA GLN A 89 2.859 -9.428 -9.731 1.00 10.00 C ATOM 1179 C GLN A 89 2.794 -10.846 -10.287 1.00 10.00 C ATOM 1180 O GLN A 89 2.630 -11.810 -9.538 1.00 10.00 O ATOM 1181 CB GLN A 89 4.313 -8.965 -9.628 1.00 10.00 C ATOM 1182 CG GLN A 89 4.830 -8.305 -10.897 1.00 10.00 C ATOM 1183 CD GLN A 89 4.135 -6.991 -11.202 1.00 10.00 C ATOM 1184 OE1 GLN A 89 4.553 -5.933 -10.735 1.00 10.00 O ATOM 1185 NE2 GLN A 89 3.078 -7.046 -11.997 1.00 10.00 N ATOM 0 H GLN A 89 2.836 -9.340 -7.635 1.00 10.00 H new ATOM 0 HA GLN A 89 2.335 -8.757 -10.412 1.00 10.00 H new ATOM 0 HB2 GLN A 89 4.405 -8.263 -8.799 1.00 10.00 H new ATOM 0 HB3 GLN A 89 4.943 -9.822 -9.391 1.00 10.00 H new ATOM 0 HG2 GLN A 89 5.901 -8.130 -10.799 1.00 10.00 H new ATOM 0 HG3 GLN A 89 4.694 -8.986 -11.737 1.00 10.00 H new ATOM 0 HE21 GLN A 89 2.762 -7.944 -12.364 1.00 10.00 H new ATOM 0 HE22 GLN A 89 2.579 -6.191 -12.242 1.00 10.00 H new ATOM 1194 N GLN A 90 2.907 -10.964 -11.600 1.00 10.00 N ATOM 1195 CA GLN A 90 2.854 -12.257 -12.264 1.00 10.00 C ATOM 1196 C GLN A 90 4.118 -13.056 -11.982 1.00 10.00 C ATOM 1197 O GLN A 90 5.210 -12.493 -11.890 1.00 10.00 O ATOM 1198 CB GLN A 90 2.679 -12.078 -13.776 1.00 10.00 C ATOM 1199 CG GLN A 90 1.258 -11.728 -14.205 1.00 10.00 C ATOM 1200 CD GLN A 90 0.813 -10.355 -13.736 1.00 10.00 C ATOM 1201 OE1 GLN A 90 1.630 -9.444 -13.569 1.00 10.00 O ATOM 1202 NE2 GLN A 90 -0.484 -10.194 -13.521 1.00 10.00 N ATOM 0 H GLN A 90 3.037 -10.174 -12.231 1.00 10.00 H new ATOM 0 HA GLN A 90 1.997 -12.804 -11.872 1.00 10.00 H new ATOM 0 HB2 GLN A 90 3.353 -11.293 -14.118 1.00 10.00 H new ATOM 0 HB3 GLN A 90 2.981 -12.998 -14.277 1.00 10.00 H new ATOM 0 HG2 GLN A 90 1.192 -11.772 -15.292 1.00 10.00 H new ATOM 0 HG3 GLN A 90 0.572 -12.479 -13.813 1.00 10.00 H new ATOM 0 HE21 GLN A 90 -1.126 -10.972 -13.671 1.00 10.00 H new ATOM 0 HE22 GLN A 90 -0.841 -9.292 -13.206 1.00 10.00 H new ATOM 1247 N ASN B 358 -12.420 -9.052 7.398 1.00 10.00 N ATOM 1248 CA ASN B 358 -11.864 -8.622 8.671 1.00 10.00 C ATOM 1249 C ASN B 358 -11.293 -7.225 8.563 1.00 10.00 C ATOM 1250 O ASN B 358 -10.511 -6.943 7.654 1.00 10.00 O ATOM 1251 CB ASN B 358 -10.783 -9.600 9.147 1.00 10.00 C ATOM 1252 CG ASN B 358 -9.668 -9.793 8.128 1.00 10.00 C ATOM 1253 OD1 ASN B 358 -9.846 -10.473 7.121 1.00 10.00 O ATOM 1254 ND2 ASN B 358 -8.514 -9.201 8.382 1.00 10.00 N ATOM 0 HA ASN B 358 -12.670 -8.610 9.404 1.00 10.00 H new ATOM 0 HB2 ASN B 358 -10.356 -9.235 10.081 1.00 10.00 H new ATOM 0 HB3 ASN B 358 -11.242 -10.565 9.362 1.00 10.00 H new ATOM 0 HD21 ASN B 358 -7.735 -9.302 7.731 1.00 10.00 H new ATOM 0 HD22 ASN B 358 -8.402 -8.644 9.229 1.00 10.00 H new ATOM 1261 N ARG B 359 -11.705 -6.345 9.472 1.00 10.00 N ATOM 1262 CA ARG B 359 -11.208 -4.977 9.478 1.00 10.00 C ATOM 1263 C ARG B 359 -10.581 -4.618 10.829 1.00 10.00 C ATOM 1264 O ARG B 359 -11.224 -4.707 11.876 1.00 10.00 O ATOM 1265 CB ARG B 359 -12.341 -4.000 9.142 1.00 10.00 C ATOM 1266 CG ARG B 359 -13.675 -4.375 9.763 1.00 10.00 C ATOM 1267 CD ARG B 359 -14.835 -3.688 9.057 1.00 10.00 C ATOM 1268 NE ARG B 359 -16.118 -4.346 9.328 1.00 10.00 N ATOM 1269 CZ ARG B 359 -17.304 -3.737 9.234 1.00 10.00 C ATOM 1270 NH1 ARG B 359 -17.375 -2.453 8.923 1.00 10.00 N ATOM 1271 NH2 ARG B 359 -18.425 -4.415 9.461 1.00 10.00 N ATOM 0 H ARG B 359 -12.378 -6.556 10.209 1.00 10.00 H new ATOM 0 HA ARG B 359 -10.432 -4.898 8.717 1.00 10.00 H new ATOM 0 HB2 ARG B 359 -12.061 -3.002 9.480 1.00 10.00 H new ATOM 0 HB3 ARG B 359 -12.456 -3.949 8.059 1.00 10.00 H new ATOM 0 HG2 ARG B 359 -13.808 -5.456 9.715 1.00 10.00 H new ATOM 0 HG3 ARG B 359 -13.676 -4.100 10.818 1.00 10.00 H new ATOM 0 HD2 ARG B 359 -14.888 -2.647 9.377 1.00 10.00 H new ATOM 0 HD3 ARG B 359 -14.652 -3.682 7.983 1.00 10.00 H new ATOM 0 HE ARG B 359 -16.104 -5.328 9.605 1.00 10.00 H new ATOM 0 HH11 ARG B 359 -16.521 -1.921 8.753 1.00 10.00 H new ATOM 0 HH12 ARG B 359 -18.284 -1.995 8.853 1.00 10.00 H new ATOM 0 HH21 ARG B 359 -18.382 -5.404 9.708 1.00 10.00 H new ATOM 0 HH22 ARG B 359 -19.328 -3.946 9.388 1.00 10.00 H new ATOM 1285 N ASP B 360 -9.323 -4.220 10.779 1.00 10.00 N ATOM 1286 CA ASP B 360 -8.558 -3.803 11.950 1.00 10.00 C ATOM 1287 C ASP B 360 -7.931 -2.439 11.674 1.00 10.00 C ATOM 1288 O ASP B 360 -7.514 -2.184 10.547 1.00 10.00 O ATOM 1289 CB ASP B 360 -7.522 -4.854 12.368 1.00 10.00 C ATOM 1290 CG ASP B 360 -6.215 -4.752 11.619 1.00 10.00 C ATOM 1291 OD1 ASP B 360 -6.172 -5.151 10.438 1.00 10.00 O ATOM 1292 OD2 ASP B 360 -5.221 -4.304 12.223 1.00 10.00 O ATOM 0 H ASP B 360 -8.791 -4.175 9.910 1.00 10.00 H new ATOM 0 HA ASP B 360 -9.232 -3.710 12.802 1.00 10.00 H new ATOM 0 HB2 ASP B 360 -7.327 -4.754 13.436 1.00 10.00 H new ATOM 0 HB3 ASP B 360 -7.943 -5.847 12.212 1.00 10.00 H new ATOM 1297 N PRO B 361 -7.875 -1.521 12.652 1.00 10.00 N ATOM 1298 CA PRO B 361 -7.317 -0.200 12.425 1.00 10.00 C ATOM 1299 C PRO B 361 -5.920 -0.029 13.028 1.00 10.00 C ATOM 1300 O PRO B 361 -5.670 -0.295 14.208 1.00 10.00 O ATOM 1301 CB PRO B 361 -8.322 0.678 13.175 1.00 10.00 C ATOM 1302 CG PRO B 361 -8.868 -0.191 14.279 1.00 10.00 C ATOM 1303 CD PRO B 361 -8.446 -1.618 13.993 1.00 10.00 C ATOM 0 HA PRO B 361 -7.186 0.028 11.367 1.00 10.00 H new ATOM 0 HB2 PRO B 361 -7.841 1.569 13.578 1.00 10.00 H new ATOM 0 HB3 PRO B 361 -9.118 1.018 12.512 1.00 10.00 H new ATOM 0 HG2 PRO B 361 -8.486 0.134 15.246 1.00 10.00 H new ATOM 0 HG3 PRO B 361 -9.954 -0.115 14.324 1.00 10.00 H new ATOM 0 HD2 PRO B 361 -7.717 -1.978 14.719 1.00 10.00 H new ATOM 0 HD3 PRO B 361 -9.292 -2.305 14.024 1.00 10.00 H new ATOM 1311 N ILE B 362 -5.020 0.446 12.174 1.00 10.00 N ATOM 1312 CA ILE B 362 -3.618 0.640 12.513 1.00 10.00 C ATOM 1313 C ILE B 362 -3.243 2.112 12.420 1.00 10.00 C ATOM 1314 O ILE B 362 -3.600 2.789 11.460 1.00 10.00 O ATOM 1315 CB ILE B 362 -2.690 -0.171 11.571 1.00 10.00 C ATOM 1316 CG1 ILE B 362 -3.142 -1.628 11.474 1.00 10.00 C ATOM 1317 CG2 ILE B 362 -1.244 -0.110 12.043 1.00 10.00 C ATOM 1318 CD1 ILE B 362 -3.946 -1.930 10.229 1.00 10.00 C ATOM 0 H ILE B 362 -5.248 0.710 11.215 1.00 10.00 H new ATOM 0 HA ILE B 362 -3.483 0.287 13.535 1.00 10.00 H new ATOM 0 HB ILE B 362 -2.755 0.281 10.581 1.00 10.00 H new ATOM 0 HG12 ILE B 362 -2.265 -2.274 11.496 1.00 10.00 H new ATOM 0 HG13 ILE B 362 -3.740 -1.873 12.351 1.00 10.00 H new ATOM 0 HG21 ILE B 362 -0.615 -0.687 11.365 1.00 10.00 H new ATOM 0 HG22 ILE B 362 -0.909 0.927 12.055 1.00 10.00 H new ATOM 0 HG23 ILE B 362 -1.171 -0.527 13.048 1.00 10.00 H new ATOM 0 HD11 ILE B 362 -4.233 -2.982 10.227 1.00 10.00 H new ATOM 0 HD12 ILE B 362 -4.842 -1.310 10.215 1.00 10.00 H new ATOM 0 HD13 ILE B 362 -3.343 -1.717 9.346 1.00 10.00 H new ATOM 1330 N VAL B 363 -2.528 2.599 13.419 1.00 10.00 N ATOM 1331 CA VAL B 363 -2.118 3.993 13.446 1.00 10.00 C ATOM 1332 C VAL B 363 -0.603 4.095 13.332 1.00 10.00 C ATOM 1333 O VAL B 363 0.139 3.440 14.063 1.00 10.00 O ATOM 1334 CB VAL B 363 -2.565 4.685 14.754 1.00 10.00 C ATOM 1335 CG1 VAL B 363 -2.280 6.178 14.714 1.00 10.00 C ATOM 1336 CG2 VAL B 363 -4.038 4.433 15.025 1.00 10.00 C ATOM 0 H VAL B 363 -2.219 2.051 14.222 1.00 10.00 H new ATOM 0 HA VAL B 363 -2.593 4.492 12.601 1.00 10.00 H new ATOM 0 HB VAL B 363 -1.985 4.252 15.569 1.00 10.00 H new ATOM 0 HG11 VAL B 363 -2.606 6.636 15.648 1.00 10.00 H new ATOM 0 HG12 VAL B 363 -1.210 6.341 14.584 1.00 10.00 H new ATOM 0 HG13 VAL B 363 -2.820 6.629 13.881 1.00 10.00 H new ATOM 0 HG21 VAL B 363 -4.328 4.930 15.951 1.00 10.00 H new ATOM 0 HG22 VAL B 363 -4.632 4.826 14.200 1.00 10.00 H new ATOM 0 HG23 VAL B 363 -4.213 3.361 15.119 1.00 10.00 H new ATOM 1346 N ILE B 364 -0.154 4.923 12.404 1.00 10.00 N ATOM 1347 CA ILE B 364 1.264 5.122 12.168 1.00 10.00 C ATOM 1348 C ILE B 364 1.629 6.576 12.421 1.00 10.00 C ATOM 1349 O ILE B 364 0.954 7.485 11.946 1.00 10.00 O ATOM 1350 CB ILE B 364 1.671 4.735 10.725 1.00 10.00 C ATOM 1351 CG1 ILE B 364 1.295 3.279 10.431 1.00 10.00 C ATOM 1352 CG2 ILE B 364 3.165 4.950 10.509 1.00 10.00 C ATOM 1353 CD1 ILE B 364 1.505 2.875 8.986 1.00 10.00 C ATOM 0 H ILE B 364 -0.760 5.474 11.796 1.00 10.00 H new ATOM 0 HA ILE B 364 1.805 4.472 12.856 1.00 10.00 H new ATOM 0 HB ILE B 364 1.127 5.380 10.035 1.00 10.00 H new ATOM 0 HG12 ILE B 364 1.886 2.624 11.072 1.00 10.00 H new ATOM 0 HG13 ILE B 364 0.249 3.123 10.694 1.00 10.00 H new ATOM 0 HG21 ILE B 364 3.429 4.672 9.489 1.00 10.00 H new ATOM 0 HG22 ILE B 364 3.409 5.999 10.674 1.00 10.00 H new ATOM 0 HG23 ILE B 364 3.727 4.333 11.210 1.00 10.00 H new ATOM 0 HD11 ILE B 364 1.217 1.832 8.854 1.00 10.00 H new ATOM 0 HD12 ILE B 364 0.893 3.504 8.340 1.00 10.00 H new ATOM 0 HD13 ILE B 364 2.556 2.998 8.723 1.00 10.00 H new ATOM 1365 N SER B 365 2.688 6.788 13.183 1.00 10.00 N ATOM 1366 CA SER B 365 3.139 8.128 13.505 1.00 10.00 C ATOM 1367 C SER B 365 4.543 8.351 12.962 1.00 10.00 C ATOM 1368 O SER B 365 5.429 7.522 13.166 1.00 10.00 O ATOM 1369 CB SER B 365 3.124 8.332 15.019 1.00 10.00 C ATOM 1370 OG SER B 365 1.896 7.885 15.575 1.00 10.00 O ATOM 0 H SER B 365 3.253 6.044 13.592 1.00 10.00 H new ATOM 0 HA SER B 365 2.465 8.849 13.043 1.00 10.00 H new ATOM 0 HB2 SER B 365 3.953 7.788 15.472 1.00 10.00 H new ATOM 0 HB3 SER B 365 3.271 9.387 15.250 1.00 10.00 H new ATOM 0 HG SER B 365 1.907 8.023 16.545 1.00 10.00 H new