USER MOD reduce.3.24.130724 H: found=0, std=0, add=1145, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1148 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 38 HIS : no HE2:sc= 0.138 K(o=-0.62,f=-1.2) USER MOD Set 1.2: A 87 HIS : no HD1:sc= -0.761 K(o=-0.62,f=-0.096) USER MOD Set 2.1: A 59 MET CE :methyl 144:sc= -5.41! (180deg=-6.07!) USER MOD Set 2.2: B 478 MET CE :methyl -136:sc= -3.59! (180deg=-5.48!) USER MOD Set 3.1: A 19 ASN : amide:sc= -0.0659 K(o=-9,f=-10) USER MOD Set 3.2: A 28 THR OG1 : rot 180:sc= -3.13! USER MOD Set 3.3: A 39 THR OG1 : rot 167:sc= -5.8! USER MOD Set 4.1: A 13 SER OG : rot 26:sc= 0.217 USER MOD Set 4.2: A 32 THR OG1 : rot 79:sc= -0.299 USER MOD Set 5.1: A 3 HIS : no HD1:sc= -2.03 K(o=-2,f=-3.6!) USER MOD Set 5.2: A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 11 LYS NZ :NH3+ 141:sc= -0.525 (180deg=-1.31) USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 31 SER OG : rot -170:sc= -0.839 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ 152:sc= -2.44 (180deg=-3.85!) USER MOD Single : A 49 GLN : amide:sc= -2.98 K(o=-3,f=-11!) USER MOD Single : A 51 THR OG1 : rot -161:sc= 0.652 USER MOD Single : A 54 SER OG : rot 67:sc= 1.25 USER MOD Single : A 55 SER OG : rot 180:sc= -0.773 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 MET CE :methyl -118:sc= -3.89! (180deg=-6.62!) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 LYS NZ :NH3+ -121:sc= 1.22 (180deg=-0.878) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 ASN : amide:sc= -0.385 K(o=-0.39,f=-3.7!) USER MOD Single : A 78 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 GLN : amide:sc= -0.0127 X(o=-0.013,f=-0.39) USER MOD Single : A 88 MET CE :methyl -126:sc= -4.55! (180deg=-11.3!) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 92 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 93 ASN : amide:sc= -0.215 K(o=-0.21,f=-1.4!) USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 MET CE :methyl 150:sc= -0.349 (180deg=-1.49!) USER MOD Single : A 99 ASN : amide:sc= -1.75 K(o=-1.8,f=-3.5!) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 105 GLN : amide:sc= -1.59 K(o=-1.6,f=-0.25) USER MOD Single : A 106 GLN : amide:sc=-0.00408 X(o=-0.0041,f=-0.14) USER MOD Single : A 109 SER OG : rot 94:sc= 0.372 USER MOD Single : A 111 TYR OH : rot 45:sc= -1.67! USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= -0.943 (180deg=-0.943) USER MOD Single : B 458 THR OG1 : rot 180:sc= 0.0864 USER MOD Single : B 460 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 462 SER OG : rot -56:sc= -1.77 USER MOD Single : B 465 TYR OH : rot 180:sc= 0 USER MOD Single : B 470 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 477 GLN : amide:sc= -2.25 K(o=-2.3,f=-0.28) USER MOD Single : B 480 THR OG1 : rot 53:sc= 1.09 USER MOD Single : B 488 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 -8.613 14.442 13.760 1.00 0.00 N ATOM 2 CA PRO A 1 -8.517 13.142 13.042 1.00 0.00 C ATOM 3 C PRO A 1 -7.081 12.832 12.619 1.00 0.00 C ATOM 4 O PRO A 1 -6.686 13.101 11.484 1.00 0.00 O ATOM 5 CB PRO A 1 -9.427 13.223 11.820 1.00 0.00 C ATOM 6 CG PRO A 1 -9.872 14.646 11.785 1.00 0.00 C ATOM 7 CD PRO A 1 -9.773 15.157 13.202 1.00 0.00 C ATOM 0 H2 PRO A 1 -7.760 14.987 13.636 1.00 0.00 H new ATOM 0 H3 PRO A 1 -8.729 14.293 14.762 1.00 0.00 H new ATOM 0 HA PRO A 1 -8.827 12.335 13.706 1.00 0.00 H new ATOM 0 HB2 PRO A 1 -8.895 12.950 10.909 1.00 0.00 H new ATOM 0 HB3 PRO A 1 -10.274 12.543 11.909 1.00 0.00 H new ATOM 0 HG2 PRO A 1 -9.244 15.233 11.115 1.00 0.00 H new ATOM 0 HG3 PRO A 1 -10.894 14.725 11.414 1.00 0.00 H new ATOM 0 HD2 PRO A 1 -9.626 16.237 13.227 1.00 0.00 H new ATOM 0 HD3 PRO A 1 -10.681 14.946 13.767 1.00 0.00 H new ATOM 17 N SER A 2 -6.308 12.266 13.539 1.00 0.00 N ATOM 18 CA SER A 2 -4.918 11.921 13.263 1.00 0.00 C ATOM 19 C SER A 2 -4.812 10.524 12.660 1.00 0.00 C ATOM 20 O SER A 2 -3.905 10.242 11.876 1.00 0.00 O ATOM 21 CB SER A 2 -4.087 12.000 14.544 1.00 0.00 C ATOM 22 OG SER A 2 -4.149 13.296 15.114 1.00 0.00 O ATOM 0 H SER A 2 -6.620 12.036 14.482 1.00 0.00 H new ATOM 0 HA SER A 2 -4.529 12.639 12.541 1.00 0.00 H new ATOM 0 HB2 SER A 2 -4.451 11.266 15.263 1.00 0.00 H new ATOM 0 HB3 SER A 2 -3.050 11.745 14.325 1.00 0.00 H new ATOM 0 HG SER A 2 -3.611 13.319 15.933 1.00 0.00 H new ATOM 28 N HIS A 3 -5.744 9.651 13.031 1.00 0.00 N ATOM 29 CA HIS A 3 -5.756 8.281 12.526 1.00 0.00 C ATOM 30 C HIS A 3 -6.994 8.012 11.685 1.00 0.00 C ATOM 31 O HIS A 3 -7.390 6.866 11.480 1.00 0.00 O ATOM 32 CB HIS A 3 -5.661 7.275 13.673 1.00 0.00 C ATOM 33 CG HIS A 3 -4.691 7.671 14.743 1.00 0.00 C ATOM 34 ND1 HIS A 3 -4.803 8.838 15.469 1.00 0.00 N ATOM 35 CD2 HIS A 3 -3.584 7.045 15.210 1.00 0.00 C ATOM 36 CE1 HIS A 3 -3.808 8.914 16.335 1.00 0.00 C ATOM 37 NE2 HIS A 3 -3.055 7.838 16.198 1.00 0.00 N ATOM 0 H HIS A 3 -6.501 9.867 13.680 1.00 0.00 H new ATOM 0 HA HIS A 3 -4.881 8.160 11.887 1.00 0.00 H new ATOM 0 HB2 HIS A 3 -6.648 7.151 14.118 1.00 0.00 H new ATOM 0 HB3 HIS A 3 -5.368 6.305 13.271 1.00 0.00 H new ATOM 0 HD2 HIS A 3 -3.191 6.099 14.869 1.00 0.00 H new ATOM 0 HE1 HIS A 3 -3.639 9.719 17.035 1.00 0.00 H new ATOM 0 HE2 HIS A 3 -2.216 7.630 16.739 1.00 0.00 H new ATOM 46 N SER A 4 -7.594 9.080 11.202 1.00 0.00 N ATOM 47 CA SER A 4 -8.787 8.983 10.373 1.00 0.00 C ATOM 48 C SER A 4 -8.747 10.021 9.267 1.00 0.00 C ATOM 49 O SER A 4 -8.148 11.085 9.422 1.00 0.00 O ATOM 50 CB SER A 4 -10.048 9.162 11.219 1.00 0.00 C ATOM 51 OG SER A 4 -9.806 8.823 12.574 1.00 0.00 O ATOM 0 H SER A 4 -7.275 10.034 11.369 1.00 0.00 H new ATOM 0 HA SER A 4 -8.811 7.991 9.923 1.00 0.00 H new ATOM 0 HB2 SER A 4 -10.389 10.195 11.155 1.00 0.00 H new ATOM 0 HB3 SER A 4 -10.848 8.537 10.822 1.00 0.00 H new ATOM 0 HG SER A 4 -10.627 8.947 13.094 1.00 0.00 H new ATOM 57 N GLY A 5 -9.374 9.702 8.144 1.00 0.00 N ATOM 58 CA GLY A 5 -9.378 10.617 7.029 1.00 0.00 C ATOM 59 C GLY A 5 -10.293 10.172 5.913 1.00 0.00 C ATOM 60 O GLY A 5 -10.853 9.079 5.958 1.00 0.00 O ATOM 0 H GLY A 5 -9.877 8.829 7.988 1.00 0.00 H new ATOM 0 HA2 GLY A 5 -9.687 11.603 7.375 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -8.364 10.718 6.643 1.00 0.00 H new ATOM 64 N ALA A 6 -10.445 11.024 4.909 1.00 0.00 N ATOM 65 CA ALA A 6 -11.298 10.717 3.772 1.00 0.00 C ATOM 66 C ALA A 6 -10.473 10.515 2.508 1.00 0.00 C ATOM 67 O ALA A 6 -9.701 11.388 2.110 1.00 0.00 O ATOM 68 CB ALA A 6 -12.313 11.830 3.564 1.00 0.00 C ATOM 0 H ALA A 6 -9.988 11.934 4.860 1.00 0.00 H new ATOM 0 HA ALA A 6 -11.827 9.788 3.984 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -12.946 11.590 2.710 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -12.930 11.931 4.457 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -11.791 12.768 3.376 1.00 0.00 H new ATOM 74 N ALA A 7 -10.646 9.360 1.879 1.00 0.00 N ATOM 75 CA ALA A 7 -9.926 9.038 0.657 1.00 0.00 C ATOM 76 C ALA A 7 -10.763 8.134 -0.236 1.00 0.00 C ATOM 77 O ALA A 7 -11.600 7.371 0.247 1.00 0.00 O ATOM 78 CB ALA A 7 -8.596 8.379 0.984 1.00 0.00 C ATOM 0 H ALA A 7 -11.282 8.629 2.198 1.00 0.00 H new ATOM 0 HA ALA A 7 -9.730 9.965 0.118 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -8.069 8.144 0.059 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -7.991 9.059 1.584 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -8.773 7.461 1.544 1.00 0.00 H new ATOM 84 N ILE A 8 -10.533 8.222 -1.538 1.00 0.00 N ATOM 85 CA ILE A 8 -11.266 7.411 -2.493 1.00 0.00 C ATOM 86 C ILE A 8 -10.595 6.051 -2.671 1.00 0.00 C ATOM 87 O ILE A 8 -9.415 5.967 -3.008 1.00 0.00 O ATOM 88 CB ILE A 8 -11.386 8.134 -3.860 1.00 0.00 C ATOM 89 CG1 ILE A 8 -12.803 7.979 -4.420 1.00 0.00 C ATOM 90 CG2 ILE A 8 -10.354 7.614 -4.850 1.00 0.00 C ATOM 91 CD1 ILE A 8 -12.863 7.332 -5.790 1.00 0.00 C ATOM 0 H ILE A 8 -9.844 8.848 -1.955 1.00 0.00 H new ATOM 0 HA ILE A 8 -12.270 7.256 -2.099 1.00 0.00 H new ATOM 0 HB ILE A 8 -11.188 9.194 -3.703 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -13.394 7.384 -3.723 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -13.270 8.963 -4.474 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -10.463 8.140 -5.799 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -9.353 7.783 -4.454 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -10.506 6.546 -5.007 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -13.901 7.260 -6.113 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -12.302 7.937 -6.503 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -12.428 6.334 -5.740 1.00 0.00 H new ATOM 103 N PHE A 9 -11.356 4.991 -2.442 1.00 0.00 N ATOM 104 CA PHE A 9 -10.838 3.635 -2.576 1.00 0.00 C ATOM 105 C PHE A 9 -11.576 2.881 -3.674 1.00 0.00 C ATOM 106 O PHE A 9 -12.791 3.010 -3.821 1.00 0.00 O ATOM 107 CB PHE A 9 -10.960 2.884 -1.248 1.00 0.00 C ATOM 108 CG PHE A 9 -9.742 2.076 -0.902 1.00 0.00 C ATOM 109 CD1 PHE A 9 -9.296 1.074 -1.747 1.00 0.00 C ATOM 110 CD2 PHE A 9 -9.044 2.320 0.270 1.00 0.00 C ATOM 111 CE1 PHE A 9 -8.175 0.329 -1.431 1.00 0.00 C ATOM 112 CE2 PHE A 9 -7.923 1.579 0.592 1.00 0.00 C ATOM 113 CZ PHE A 9 -7.488 0.582 -0.260 1.00 0.00 C ATOM 0 H PHE A 9 -12.336 5.043 -2.162 1.00 0.00 H new ATOM 0 HA PHE A 9 -9.785 3.699 -2.849 1.00 0.00 H new ATOM 0 HB2 PHE A 9 -11.149 3.602 -0.450 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -11.825 2.222 -1.292 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -9.830 0.872 -2.664 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -9.380 3.098 0.939 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -7.837 -0.450 -2.099 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -7.388 1.779 1.508 1.00 0.00 H new ATOM 0 HZ PHE A 9 -6.612 0.001 -0.011 1.00 0.00 H new ATOM 123 N GLU A 10 -10.833 2.100 -4.450 1.00 0.00 N ATOM 124 CA GLU A 10 -11.419 1.333 -5.542 1.00 0.00 C ATOM 125 C GLU A 10 -12.142 2.255 -6.519 1.00 0.00 C ATOM 126 O GLU A 10 -13.059 1.833 -7.223 1.00 0.00 O ATOM 127 CB GLU A 10 -12.391 0.286 -4.994 1.00 0.00 C ATOM 128 CG GLU A 10 -11.702 -0.926 -4.388 1.00 0.00 C ATOM 129 CD GLU A 10 -12.528 -2.191 -4.517 1.00 0.00 C ATOM 130 OE1 GLU A 10 -13.362 -2.449 -3.624 1.00 0.00 O ATOM 131 OE2 GLU A 10 -12.341 -2.923 -5.511 1.00 0.00 O ATOM 0 H GLU A 10 -9.826 1.982 -4.343 1.00 0.00 H new ATOM 0 HA GLU A 10 -10.614 0.825 -6.073 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -13.023 0.750 -4.237 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -13.048 -0.044 -5.799 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -10.739 -1.074 -4.877 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -11.499 -0.735 -3.334 1.00 0.00 H new ATOM 138 N LYS A 11 -11.723 3.518 -6.555 1.00 0.00 N ATOM 139 CA LYS A 11 -12.326 4.499 -7.439 1.00 0.00 C ATOM 140 C LYS A 11 -13.782 4.732 -7.065 1.00 0.00 C ATOM 141 O LYS A 11 -14.657 4.819 -7.926 1.00 0.00 O ATOM 142 CB LYS A 11 -12.194 4.049 -8.893 1.00 0.00 C ATOM 143 CG LYS A 11 -10.854 3.395 -9.198 1.00 0.00 C ATOM 144 CD LYS A 11 -9.696 4.362 -8.997 1.00 0.00 C ATOM 145 CE LYS A 11 -9.803 5.564 -9.921 1.00 0.00 C ATOM 146 NZ LYS A 11 -10.483 6.713 -9.262 1.00 0.00 N ATOM 0 H LYS A 11 -10.965 3.882 -5.978 1.00 0.00 H new ATOM 0 HA LYS A 11 -11.798 5.446 -7.327 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -12.995 3.346 -9.123 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -12.328 4.911 -9.547 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -10.718 2.526 -8.554 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -10.851 3.033 -10.226 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -9.679 4.700 -7.961 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -8.754 3.845 -9.179 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -8.806 5.867 -10.240 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -10.353 5.283 -10.819 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -10.015 7.599 -9.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -11.480 6.742 -9.556 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -10.430 6.602 -8.229 1.00 0.00 H new ATOM 160 N VAL A 12 -14.021 4.839 -5.764 1.00 0.00 N ATOM 161 CA VAL A 12 -15.353 5.071 -5.236 1.00 0.00 C ATOM 162 C VAL A 12 -15.278 5.926 -3.971 1.00 0.00 C ATOM 163 O VAL A 12 -14.869 5.449 -2.913 1.00 0.00 O ATOM 164 CB VAL A 12 -16.055 3.731 -4.935 1.00 0.00 C ATOM 165 CG1 VAL A 12 -17.174 3.901 -3.915 1.00 0.00 C ATOM 166 CG2 VAL A 12 -16.589 3.114 -6.218 1.00 0.00 C ATOM 0 H VAL A 12 -13.297 4.767 -5.049 1.00 0.00 H new ATOM 0 HA VAL A 12 -15.936 5.605 -5.986 1.00 0.00 H new ATOM 0 HB VAL A 12 -15.316 3.057 -4.502 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -17.646 2.936 -3.728 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -16.762 4.290 -2.984 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -17.916 4.599 -4.302 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -17.082 2.169 -5.990 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -17.305 3.795 -6.678 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -15.763 2.936 -6.907 1.00 0.00 H new ATOM 176 N SER A 13 -15.661 7.198 -4.100 1.00 0.00 N ATOM 177 CA SER A 13 -15.630 8.150 -2.984 1.00 0.00 C ATOM 178 C SER A 13 -15.985 7.491 -1.654 1.00 0.00 C ATOM 179 O SER A 13 -17.040 6.870 -1.519 1.00 0.00 O ATOM 180 CB SER A 13 -16.592 9.308 -3.257 1.00 0.00 C ATOM 181 OG SER A 13 -17.914 8.837 -3.458 1.00 0.00 O ATOM 0 H SER A 13 -16.000 7.597 -4.975 1.00 0.00 H new ATOM 0 HA SER A 13 -14.609 8.524 -2.906 1.00 0.00 H new ATOM 0 HB2 SER A 13 -16.574 10.005 -2.419 1.00 0.00 H new ATOM 0 HB3 SER A 13 -16.261 9.860 -4.137 1.00 0.00 H new ATOM 0 HG SER A 13 -18.028 7.977 -3.002 1.00 0.00 H new ATOM 187 N GLY A 14 -15.096 7.633 -0.673 1.00 0.00 N ATOM 188 CA GLY A 14 -15.341 7.048 0.633 1.00 0.00 C ATOM 189 C GLY A 14 -14.524 7.686 1.741 1.00 0.00 C ATOM 190 O GLY A 14 -14.026 8.803 1.596 1.00 0.00 O ATOM 0 H GLY A 14 -14.215 8.140 -0.759 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -16.400 7.142 0.872 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -15.117 5.982 0.594 1.00 0.00 H new ATOM 194 N ILE A 15 -14.398 6.969 2.854 1.00 0.00 N ATOM 195 CA ILE A 15 -13.649 7.454 4.010 1.00 0.00 C ATOM 196 C ILE A 15 -12.734 6.370 4.579 1.00 0.00 C ATOM 197 O ILE A 15 -13.036 5.181 4.485 1.00 0.00 O ATOM 198 CB ILE A 15 -14.592 7.948 5.121 1.00 0.00 C ATOM 199 CG1 ILE A 15 -15.480 9.086 4.603 1.00 0.00 C ATOM 200 CG2 ILE A 15 -13.785 8.392 6.330 1.00 0.00 C ATOM 201 CD1 ILE A 15 -14.768 10.416 4.481 1.00 0.00 C ATOM 0 H ILE A 15 -14.808 6.044 2.980 1.00 0.00 H new ATOM 0 HA ILE A 15 -13.039 8.287 3.660 1.00 0.00 H new ATOM 0 HB ILE A 15 -15.242 7.127 5.425 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -15.877 8.807 3.627 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -16.332 9.202 5.273 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -14.461 8.740 7.111 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -13.199 7.553 6.705 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -13.115 9.202 6.043 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -15.463 11.168 4.109 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -14.394 10.720 5.459 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -13.933 10.319 3.787 1.00 0.00 H new ATOM 213 N ILE A 16 -11.620 6.790 5.176 1.00 0.00 N ATOM 214 CA ILE A 16 -10.663 5.852 5.759 1.00 0.00 C ATOM 215 C ILE A 16 -10.601 5.978 7.279 1.00 0.00 C ATOM 216 O ILE A 16 -10.784 7.060 7.836 1.00 0.00 O ATOM 217 CB ILE A 16 -9.229 6.049 5.210 1.00 0.00 C ATOM 218 CG1 ILE A 16 -9.225 6.824 3.887 1.00 0.00 C ATOM 219 CG2 ILE A 16 -8.539 4.703 5.042 1.00 0.00 C ATOM 220 CD1 ILE A 16 -8.407 8.096 3.947 1.00 0.00 C ATOM 0 H ILE A 16 -11.358 7.772 5.269 1.00 0.00 H new ATOM 0 HA ILE A 16 -11.025 4.863 5.478 1.00 0.00 H new ATOM 0 HB ILE A 16 -8.676 6.644 5.937 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -8.831 6.183 3.098 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -10.251 7.071 3.614 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -7.532 4.856 4.655 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -8.484 4.199 6.007 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -9.106 4.088 4.343 1.00 0.00 H new ATOM 0 HD11 ILE A 16 -8.444 8.598 2.980 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -8.814 8.755 4.714 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -7.373 7.852 4.190 1.00 0.00 H new ATOM 232 N ALA A 17 -10.321 4.858 7.936 1.00 0.00 N ATOM 233 CA ALA A 17 -10.204 4.814 9.388 1.00 0.00 C ATOM 234 C ALA A 17 -9.117 3.823 9.795 1.00 0.00 C ATOM 235 O ALA A 17 -9.082 2.699 9.298 1.00 0.00 O ATOM 236 CB ALA A 17 -11.536 4.435 10.018 1.00 0.00 C ATOM 0 H ALA A 17 -10.169 3.959 7.479 1.00 0.00 H new ATOM 0 HA ALA A 17 -9.926 5.805 9.748 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -11.431 4.407 11.103 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -12.290 5.173 9.746 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -11.843 3.453 9.658 1.00 0.00 H new ATOM 242 N ILE A 18 -8.225 4.241 10.688 1.00 0.00 N ATOM 243 CA ILE A 18 -7.142 3.379 11.133 1.00 0.00 C ATOM 244 C ILE A 18 -7.529 2.638 12.413 1.00 0.00 C ATOM 245 O ILE A 18 -7.885 3.255 13.417 1.00 0.00 O ATOM 246 CB ILE A 18 -5.843 4.198 11.352 1.00 0.00 C ATOM 247 CG1 ILE A 18 -4.810 3.867 10.273 1.00 0.00 C ATOM 248 CG2 ILE A 18 -5.264 3.963 12.738 1.00 0.00 C ATOM 249 CD1 ILE A 18 -4.857 4.807 9.086 1.00 0.00 C ATOM 0 H ILE A 18 -8.233 5.168 11.114 1.00 0.00 H new ATOM 0 HA ILE A 18 -6.956 2.641 10.353 1.00 0.00 H new ATOM 0 HB ILE A 18 -6.100 5.255 11.275 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -3.813 3.899 10.713 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -4.973 2.847 9.926 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -4.355 4.552 12.857 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -5.992 4.263 13.492 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -5.030 2.905 12.860 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -4.098 4.514 8.360 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -5.842 4.758 8.622 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -4.664 5.826 9.421 1.00 0.00 H new ATOM 261 N ASN A 19 -7.461 1.313 12.362 1.00 0.00 N ATOM 262 CA ASN A 19 -7.806 0.485 13.505 1.00 0.00 C ATOM 263 C ASN A 19 -6.583 0.214 14.378 1.00 0.00 C ATOM 264 O ASN A 19 -6.221 -0.938 14.618 1.00 0.00 O ATOM 265 CB ASN A 19 -8.419 -0.836 13.036 1.00 0.00 C ATOM 266 CG ASN A 19 -9.928 -0.760 12.907 1.00 0.00 C ATOM 267 OD1 ASN A 19 -10.508 0.326 12.910 1.00 0.00 O ATOM 268 ND2 ASN A 19 -10.571 -1.916 12.793 1.00 0.00 N ATOM 0 H ASN A 19 -7.169 0.790 11.537 1.00 0.00 H new ATOM 0 HA ASN A 19 -8.539 1.026 14.104 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -7.988 -1.112 12.073 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -8.157 -1.625 13.740 1.00 0.00 H new ATOM 0 HD21 ASN A 19 -11.587 -1.928 12.703 1.00 0.00 H new ATOM 0 HD22 ASN A 19 -10.049 -2.792 12.795 1.00 0.00 H new ATOM 275 N GLU A 20 -5.951 1.282 14.856 1.00 0.00 N ATOM 276 CA GLU A 20 -4.774 1.155 15.706 1.00 0.00 C ATOM 277 C GLU A 20 -5.166 0.899 17.162 1.00 0.00 C ATOM 278 O GLU A 20 -4.302 0.783 18.032 1.00 0.00 O ATOM 279 CB GLU A 20 -3.913 2.416 15.615 1.00 0.00 C ATOM 280 CG GLU A 20 -2.853 2.354 14.529 1.00 0.00 C ATOM 281 CD GLU A 20 -1.517 2.904 14.988 1.00 0.00 C ATOM 282 OE1 GLU A 20 -1.331 4.137 14.930 1.00 0.00 O ATOM 283 OE2 GLU A 20 -0.656 2.100 15.406 1.00 0.00 O ATOM 0 H GLU A 20 -6.235 2.244 14.669 1.00 0.00 H new ATOM 0 HA GLU A 20 -4.198 0.300 15.351 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -4.559 3.274 15.431 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -3.427 2.583 16.576 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -2.726 1.320 14.209 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -3.195 2.917 13.660 1.00 0.00 H new ATOM 290 N ASP A 21 -6.469 0.805 17.425 1.00 0.00 N ATOM 291 CA ASP A 21 -6.957 0.556 18.774 1.00 0.00 C ATOM 292 C ASP A 21 -6.781 -0.912 19.133 1.00 0.00 C ATOM 293 O ASP A 21 -6.513 -1.256 20.285 1.00 0.00 O ATOM 294 CB ASP A 21 -8.430 0.952 18.891 1.00 0.00 C ATOM 295 CG ASP A 21 -9.313 0.186 17.924 1.00 0.00 C ATOM 296 OD1 ASP A 21 -9.391 0.590 16.745 1.00 0.00 O ATOM 297 OD2 ASP A 21 -9.925 -0.817 18.346 1.00 0.00 O ATOM 0 H ASP A 21 -7.201 0.898 16.721 1.00 0.00 H new ATOM 0 HA ASP A 21 -6.377 1.162 19.470 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -8.772 0.773 19.910 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -8.532 2.021 18.703 1.00 0.00 H new ATOM 302 N VAL A 22 -6.924 -1.774 18.132 1.00 0.00 N ATOM 303 CA VAL A 22 -6.772 -3.206 18.330 1.00 0.00 C ATOM 304 C VAL A 22 -5.353 -3.528 18.797 1.00 0.00 C ATOM 305 O VAL A 22 -4.481 -2.659 18.781 1.00 0.00 O ATOM 306 CB VAL A 22 -7.092 -3.981 17.031 1.00 0.00 C ATOM 307 CG1 VAL A 22 -5.960 -3.857 16.019 1.00 0.00 C ATOM 308 CG2 VAL A 22 -7.393 -5.442 17.334 1.00 0.00 C ATOM 0 H VAL A 22 -7.145 -1.502 17.174 1.00 0.00 H new ATOM 0 HA VAL A 22 -7.479 -3.519 19.098 1.00 0.00 H new ATOM 0 HB VAL A 22 -7.982 -3.535 16.587 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -6.216 -4.413 15.117 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -5.810 -2.807 15.768 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -5.043 -4.262 16.447 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -7.615 -5.968 16.405 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -6.527 -5.900 17.812 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -8.252 -5.506 18.002 1.00 0.00 H new ATOM 318 N SER A 23 -5.119 -4.772 19.214 1.00 0.00 N ATOM 319 CA SER A 23 -3.795 -5.178 19.681 1.00 0.00 C ATOM 320 C SER A 23 -2.709 -4.699 18.713 1.00 0.00 C ATOM 321 O SER A 23 -1.922 -3.815 19.049 1.00 0.00 O ATOM 322 CB SER A 23 -3.726 -6.697 19.856 1.00 0.00 C ATOM 323 OG SER A 23 -3.966 -7.067 21.203 1.00 0.00 O ATOM 0 H SER A 23 -5.823 -5.510 19.238 1.00 0.00 H new ATOM 0 HA SER A 23 -3.619 -4.712 20.651 1.00 0.00 H new ATOM 0 HB2 SER A 23 -4.461 -7.175 19.208 1.00 0.00 H new ATOM 0 HB3 SER A 23 -2.745 -7.058 19.546 1.00 0.00 H new ATOM 0 HG SER A 23 -3.918 -8.042 21.288 1.00 0.00 H new ATOM 329 N PRO A 24 -2.657 -5.262 17.490 1.00 0.00 N ATOM 330 CA PRO A 24 -1.669 -4.862 16.489 1.00 0.00 C ATOM 331 C PRO A 24 -2.016 -3.504 15.861 1.00 0.00 C ATOM 332 O PRO A 24 -1.806 -2.462 16.482 1.00 0.00 O ATOM 333 CB PRO A 24 -1.741 -6.000 15.467 1.00 0.00 C ATOM 334 CG PRO A 24 -3.152 -6.463 15.540 1.00 0.00 C ATOM 335 CD PRO A 24 -3.555 -6.319 16.983 1.00 0.00 C ATOM 0 HA PRO A 24 -0.670 -4.722 16.902 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -1.486 -5.653 14.465 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -1.045 -6.802 15.713 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -3.794 -5.865 14.893 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -3.242 -7.498 15.210 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -4.603 -6.036 17.080 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -3.425 -7.252 17.531 1.00 0.00 H new ATOM 343 N ALA A 25 -2.551 -3.513 14.636 1.00 0.00 N ATOM 344 CA ALA A 25 -2.923 -2.286 13.946 1.00 0.00 C ATOM 345 C ALA A 25 -3.321 -2.582 12.504 1.00 0.00 C ATOM 346 O ALA A 25 -2.716 -3.428 11.846 1.00 0.00 O ATOM 347 CB ALA A 25 -1.772 -1.303 13.984 1.00 0.00 C ATOM 0 H ALA A 25 -2.735 -4.364 14.104 1.00 0.00 H new ATOM 0 HA ALA A 25 -3.781 -1.845 14.454 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -2.058 -0.388 13.466 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -1.525 -1.071 15.020 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -0.903 -1.741 13.493 1.00 0.00 H new ATOM 353 N GLU A 26 -4.342 -1.886 12.016 1.00 0.00 N ATOM 354 CA GLU A 26 -4.814 -2.085 10.654 1.00 0.00 C ATOM 355 C GLU A 26 -5.474 -0.824 10.105 1.00 0.00 C ATOM 356 O GLU A 26 -5.804 0.094 10.854 1.00 0.00 O ATOM 357 CB GLU A 26 -5.805 -3.253 10.594 1.00 0.00 C ATOM 358 CG GLU A 26 -5.467 -4.396 11.540 1.00 0.00 C ATOM 359 CD GLU A 26 -6.515 -5.492 11.532 1.00 0.00 C ATOM 360 OE1 GLU A 26 -7.547 -5.325 10.847 1.00 0.00 O ATOM 361 OE2 GLU A 26 -6.305 -6.519 12.211 1.00 0.00 O ATOM 0 H GLU A 26 -4.857 -1.181 12.543 1.00 0.00 H new ATOM 0 HA GLU A 26 -3.946 -2.317 10.037 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -6.803 -2.883 10.829 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -5.839 -3.636 9.574 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -4.502 -4.820 11.261 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -5.363 -4.006 12.552 1.00 0.00 H new ATOM 368 N LEU A 27 -5.675 -0.798 8.792 1.00 0.00 N ATOM 369 CA LEU A 27 -6.309 0.328 8.131 1.00 0.00 C ATOM 370 C LEU A 27 -7.647 -0.110 7.545 1.00 0.00 C ATOM 371 O LEU A 27 -7.703 -1.029 6.728 1.00 0.00 O ATOM 372 CB LEU A 27 -5.405 0.876 7.024 1.00 0.00 C ATOM 373 CG LEU A 27 -5.997 2.033 6.218 1.00 0.00 C ATOM 374 CD1 LEU A 27 -4.891 2.898 5.634 1.00 0.00 C ATOM 375 CD2 LEU A 27 -6.902 1.505 5.115 1.00 0.00 C ATOM 0 H LEU A 27 -5.404 -1.553 8.163 1.00 0.00 H new ATOM 0 HA LEU A 27 -6.477 1.119 8.862 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -4.468 1.207 7.472 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -5.161 0.064 6.339 1.00 0.00 H new ATOM 0 HG LEU A 27 -6.596 2.649 6.889 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -5.331 3.716 5.064 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -4.283 3.305 6.442 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -4.265 2.294 4.977 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -7.315 2.342 4.551 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -6.326 0.866 4.446 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -7.715 0.928 5.556 1.00 0.00 H new ATOM 387 N THR A 28 -8.725 0.535 7.976 1.00 0.00 N ATOM 388 CA THR A 28 -10.060 0.189 7.501 1.00 0.00 C ATOM 389 C THR A 28 -10.704 1.352 6.757 1.00 0.00 C ATOM 390 O THR A 28 -10.730 2.477 7.249 1.00 0.00 O ATOM 391 CB THR A 28 -10.947 -0.225 8.676 1.00 0.00 C ATOM 392 OG1 THR A 28 -10.361 -1.294 9.396 1.00 0.00 O ATOM 393 CG2 THR A 28 -12.335 -0.659 8.256 1.00 0.00 C ATOM 0 H THR A 28 -8.701 1.299 8.652 1.00 0.00 H new ATOM 0 HA THR A 28 -9.960 -0.646 6.808 1.00 0.00 H new ATOM 0 HB THR A 28 -11.036 0.666 9.297 1.00 0.00 H new ATOM 0 HG1 THR A 28 -10.943 -1.543 10.144 1.00 0.00 H new ATOM 0 HG21 THR A 28 -12.911 -0.939 9.138 1.00 0.00 H new ATOM 0 HG22 THR A 28 -12.834 0.163 7.743 1.00 0.00 H new ATOM 0 HG23 THR A 28 -12.261 -1.514 7.584 1.00 0.00 H new ATOM 401 N TRP A 29 -11.228 1.067 5.572 1.00 0.00 N ATOM 402 CA TRP A 29 -11.880 2.088 4.759 1.00 0.00 C ATOM 403 C TRP A 29 -13.249 1.619 4.278 1.00 0.00 C ATOM 404 O TRP A 29 -13.429 0.456 3.923 1.00 0.00 O ATOM 405 CB TRP A 29 -11.018 2.465 3.550 1.00 0.00 C ATOM 406 CG TRP A 29 -11.751 3.321 2.557 1.00 0.00 C ATOM 407 CD1 TRP A 29 -11.618 4.668 2.378 1.00 0.00 C ATOM 408 CD2 TRP A 29 -12.742 2.887 1.617 1.00 0.00 C ATOM 409 NE1 TRP A 29 -12.477 5.102 1.397 1.00 0.00 N ATOM 410 CE2 TRP A 29 -13.168 4.024 0.904 1.00 0.00 C ATOM 411 CE3 TRP A 29 -13.312 1.646 1.307 1.00 0.00 C ATOM 412 CZ2 TRP A 29 -14.134 3.955 -0.098 1.00 0.00 C ATOM 413 CZ3 TRP A 29 -14.271 1.583 0.313 1.00 0.00 C ATOM 414 CH2 TRP A 29 -14.672 2.731 -0.379 1.00 0.00 C ATOM 0 H TRP A 29 -11.215 0.138 5.152 1.00 0.00 H new ATOM 0 HA TRP A 29 -12.009 2.967 5.391 1.00 0.00 H new ATOM 0 HB2 TRP A 29 -10.130 2.995 3.894 1.00 0.00 H new ATOM 0 HB3 TRP A 29 -10.675 1.556 3.056 1.00 0.00 H new ATOM 0 HD1 TRP A 29 -10.937 5.301 2.928 1.00 0.00 H new ATOM 0 HE1 TRP A 29 -12.583 6.068 1.086 1.00 0.00 H new ATOM 0 HE3 TRP A 29 -13.008 0.754 1.835 1.00 0.00 H new ATOM 0 HZ2 TRP A 29 -14.447 4.839 -0.634 1.00 0.00 H new ATOM 0 HZ3 TRP A 29 -14.718 0.631 0.067 1.00 0.00 H new ATOM 0 HH2 TRP A 29 -15.422 2.648 -1.151 1.00 0.00 H new ATOM 425 N ARG A 30 -14.204 2.541 4.250 1.00 0.00 N ATOM 426 CA ARG A 30 -15.552 2.231 3.784 1.00 0.00 C ATOM 427 C ARG A 30 -16.070 3.330 2.874 1.00 0.00 C ATOM 428 O ARG A 30 -15.673 4.488 2.994 1.00 0.00 O ATOM 429 CB ARG A 30 -16.524 2.067 4.950 1.00 0.00 C ATOM 430 CG ARG A 30 -16.511 0.683 5.562 1.00 0.00 C ATOM 431 CD ARG A 30 -17.398 0.606 6.795 1.00 0.00 C ATOM 432 NE ARG A 30 -16.714 -0.022 7.923 1.00 0.00 N ATOM 433 CZ ARG A 30 -17.229 -0.107 9.147 1.00 0.00 C ATOM 434 NH1 ARG A 30 -18.430 0.395 9.406 1.00 0.00 N ATOM 435 NH2 ARG A 30 -16.541 -0.696 10.116 1.00 0.00 N ATOM 0 H ARG A 30 -14.071 3.509 4.544 1.00 0.00 H new ATOM 0 HA ARG A 30 -15.490 1.291 3.236 1.00 0.00 H new ATOM 0 HB2 ARG A 30 -16.280 2.798 5.721 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -17.533 2.293 4.605 1.00 0.00 H new ATOM 0 HG2 ARG A 30 -16.849 -0.045 4.824 1.00 0.00 H new ATOM 0 HG3 ARG A 30 -15.490 0.413 5.831 1.00 0.00 H new ATOM 0 HD2 ARG A 30 -17.715 1.610 7.077 1.00 0.00 H new ATOM 0 HD3 ARG A 30 -18.300 0.042 6.558 1.00 0.00 H new ATOM 0 HE ARG A 30 -15.788 -0.418 7.763 1.00 0.00 H new ATOM 0 HH11 ARG A 30 -18.964 0.849 8.665 1.00 0.00 H new ATOM 0 HH12 ARG A 30 -18.819 0.327 10.346 1.00 0.00 H new ATOM 0 HH21 ARG A 30 -15.617 -1.084 9.923 1.00 0.00 H new ATOM 0 HH22 ARG A 30 -16.935 -0.761 11.054 1.00 0.00 H new ATOM 449 N SER A 31 -16.978 2.967 1.977 1.00 0.00 N ATOM 450 CA SER A 31 -17.567 3.943 1.067 1.00 0.00 C ATOM 451 C SER A 31 -18.183 5.091 1.864 1.00 0.00 C ATOM 452 O SER A 31 -18.389 4.971 3.072 1.00 0.00 O ATOM 453 CB SER A 31 -18.631 3.281 0.189 1.00 0.00 C ATOM 454 OG SER A 31 -18.055 2.728 -0.982 1.00 0.00 O ATOM 0 H SER A 31 -17.321 2.013 1.860 1.00 0.00 H new ATOM 0 HA SER A 31 -16.783 4.338 0.421 1.00 0.00 H new ATOM 0 HB2 SER A 31 -19.137 2.498 0.754 1.00 0.00 H new ATOM 0 HB3 SER A 31 -19.388 4.015 -0.086 1.00 0.00 H new ATOM 0 HG SER A 31 -18.766 2.453 -1.598 1.00 0.00 H new ATOM 460 N THR A 32 -18.478 6.199 1.194 1.00 0.00 N ATOM 461 CA THR A 32 -19.070 7.348 1.867 1.00 0.00 C ATOM 462 C THR A 32 -20.437 6.992 2.420 1.00 0.00 C ATOM 463 O THR A 32 -20.869 7.521 3.443 1.00 0.00 O ATOM 464 CB THR A 32 -19.185 8.532 0.919 1.00 0.00 C ATOM 465 OG1 THR A 32 -18.176 8.488 -0.074 1.00 0.00 O ATOM 466 CG2 THR A 32 -19.086 9.869 1.620 1.00 0.00 C ATOM 0 H THR A 32 -18.319 6.326 0.195 1.00 0.00 H new ATOM 0 HA THR A 32 -18.416 7.629 2.693 1.00 0.00 H new ATOM 0 HB THR A 32 -20.175 8.446 0.472 1.00 0.00 H new ATOM 0 HG1 THR A 32 -18.426 7.841 -0.766 1.00 0.00 H new ATOM 0 HG21 THR A 32 -19.176 10.671 0.888 1.00 0.00 H new ATOM 0 HG22 THR A 32 -19.888 9.956 2.353 1.00 0.00 H new ATOM 0 HG23 THR A 32 -18.123 9.945 2.125 1.00 0.00 H new ATOM 474 N ASP A 33 -21.103 6.081 1.733 1.00 0.00 N ATOM 475 CA ASP A 33 -22.421 5.623 2.133 1.00 0.00 C ATOM 476 C ASP A 33 -22.945 4.616 1.119 1.00 0.00 C ATOM 477 O ASP A 33 -24.097 4.684 0.692 1.00 0.00 O ATOM 478 CB ASP A 33 -23.389 6.804 2.262 1.00 0.00 C ATOM 479 CG ASP A 33 -23.579 7.240 3.702 1.00 0.00 C ATOM 480 OD1 ASP A 33 -24.130 6.447 4.494 1.00 0.00 O ATOM 481 OD2 ASP A 33 -23.177 8.374 4.037 1.00 0.00 O ATOM 0 H ASP A 33 -20.747 5.639 0.885 1.00 0.00 H new ATOM 0 HA ASP A 33 -22.344 5.141 3.107 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -23.013 7.644 1.677 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -24.354 6.527 1.838 1.00 0.00 H new ATOM 486 N GLY A 34 -22.080 3.685 0.727 1.00 0.00 N ATOM 487 CA GLY A 34 -22.471 2.683 -0.248 1.00 0.00 C ATOM 488 C GLY A 34 -22.444 1.277 0.311 1.00 0.00 C ATOM 489 O GLY A 34 -22.229 0.315 -0.426 1.00 0.00 O ATOM 0 H GLY A 34 -21.121 3.607 1.065 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -23.475 2.906 -0.609 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -21.804 2.740 -1.108 1.00 0.00 H new ATOM 493 N ASP A 35 -22.661 1.156 1.617 1.00 0.00 N ATOM 494 CA ASP A 35 -22.657 -0.146 2.279 1.00 0.00 C ATOM 495 C ASP A 35 -21.470 -0.983 1.824 1.00 0.00 C ATOM 496 O ASP A 35 -21.544 -2.210 1.752 1.00 0.00 O ATOM 497 CB ASP A 35 -23.964 -0.891 2.003 1.00 0.00 C ATOM 498 CG ASP A 35 -24.461 -1.656 3.215 1.00 0.00 C ATOM 499 OD1 ASP A 35 -25.135 -1.042 4.069 1.00 0.00 O ATOM 500 OD2 ASP A 35 -24.177 -2.868 3.309 1.00 0.00 O ATOM 0 H ASP A 35 -22.842 1.944 2.239 1.00 0.00 H new ATOM 0 HA ASP A 35 -22.568 0.022 3.352 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -24.726 -0.178 1.689 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -23.816 -1.584 1.175 1.00 0.00 H new ATOM 505 N LYS A 36 -20.374 -0.301 1.521 1.00 0.00 N ATOM 506 CA LYS A 36 -19.160 -0.954 1.076 1.00 0.00 C ATOM 507 C LYS A 36 -18.083 -0.852 2.146 1.00 0.00 C ATOM 508 O LYS A 36 -18.137 0.026 3.007 1.00 0.00 O ATOM 509 CB LYS A 36 -18.666 -0.332 -0.231 1.00 0.00 C ATOM 510 CG LYS A 36 -19.525 -0.685 -1.435 1.00 0.00 C ATOM 511 CD LYS A 36 -18.675 -1.079 -2.633 1.00 0.00 C ATOM 512 CE LYS A 36 -19.441 -0.919 -3.936 1.00 0.00 C ATOM 513 NZ LYS A 36 -18.573 -0.411 -5.033 1.00 0.00 N ATOM 0 H LYS A 36 -20.306 0.715 1.578 1.00 0.00 H new ATOM 0 HA LYS A 36 -19.379 -2.007 0.899 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -18.638 0.752 -0.120 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -17.643 -0.660 -0.416 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -20.194 -1.506 -1.177 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -20.152 0.167 -1.698 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -17.776 -0.464 -2.660 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -18.350 -2.114 -2.525 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -19.868 -1.879 -4.226 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -20.274 -0.232 -3.785 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -19.134 -0.316 -5.904 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -18.186 0.517 -4.768 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -17.792 -1.078 -5.195 1.00 0.00 H new ATOM 527 N VAL A 37 -17.110 -1.751 2.095 1.00 0.00 N ATOM 528 CA VAL A 37 -16.034 -1.751 3.069 1.00 0.00 C ATOM 529 C VAL A 37 -14.752 -2.334 2.488 1.00 0.00 C ATOM 530 O VAL A 37 -14.784 -3.180 1.593 1.00 0.00 O ATOM 531 CB VAL A 37 -16.400 -2.560 4.332 1.00 0.00 C ATOM 532 CG1 VAL A 37 -15.590 -2.091 5.532 1.00 0.00 C ATOM 533 CG2 VAL A 37 -17.894 -2.483 4.622 1.00 0.00 C ATOM 0 H VAL A 37 -17.046 -2.486 1.391 1.00 0.00 H new ATOM 0 HA VAL A 37 -15.876 -0.707 3.339 1.00 0.00 H new ATOM 0 HB VAL A 37 -16.150 -3.604 4.142 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -15.866 -2.676 6.409 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -14.527 -2.223 5.328 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -15.795 -1.037 5.720 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -18.121 -3.062 5.517 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -18.181 -1.443 4.780 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -18.450 -2.888 3.777 1.00 0.00 H new ATOM 543 N HIS A 38 -13.629 -1.886 3.027 1.00 0.00 N ATOM 544 CA HIS A 38 -12.318 -2.356 2.606 1.00 0.00 C ATOM 545 C HIS A 38 -11.323 -2.161 3.743 1.00 0.00 C ATOM 546 O HIS A 38 -11.046 -1.034 4.147 1.00 0.00 O ATOM 547 CB HIS A 38 -11.851 -1.603 1.358 1.00 0.00 C ATOM 548 CG HIS A 38 -11.227 -2.489 0.324 1.00 0.00 C ATOM 549 ND1 HIS A 38 -10.051 -2.176 -0.323 1.00 0.00 N ATOM 550 CD2 HIS A 38 -11.622 -3.685 -0.173 1.00 0.00 C ATOM 551 CE1 HIS A 38 -9.750 -3.140 -1.175 1.00 0.00 C ATOM 552 NE2 HIS A 38 -10.687 -4.067 -1.103 1.00 0.00 N ATOM 0 H HIS A 38 -13.600 -1.186 3.769 1.00 0.00 H new ATOM 0 HA HIS A 38 -12.382 -3.416 2.358 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -12.702 -1.086 0.916 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -11.132 -0.839 1.652 1.00 0.00 H new ATOM 0 HD1 HIS A 38 -9.499 -1.332 -0.168 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -12.507 -4.236 0.109 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -8.885 -3.165 -1.821 1.00 0.00 H new ATOM 561 N THR A 39 -10.800 -3.262 4.268 1.00 0.00 N ATOM 562 CA THR A 39 -9.858 -3.201 5.370 1.00 0.00 C ATOM 563 C THR A 39 -8.637 -4.077 5.108 1.00 0.00 C ATOM 564 O THR A 39 -8.757 -5.190 4.598 1.00 0.00 O ATOM 565 CB THR A 39 -10.535 -3.641 6.667 1.00 0.00 C ATOM 566 OG1 THR A 39 -11.736 -2.921 6.875 1.00 0.00 O ATOM 567 CG2 THR A 39 -9.665 -3.450 7.891 1.00 0.00 C ATOM 0 H THR A 39 -11.014 -4.206 3.946 1.00 0.00 H new ATOM 0 HA THR A 39 -9.524 -2.168 5.464 1.00 0.00 H new ATOM 0 HB THR A 39 -10.731 -4.706 6.544 1.00 0.00 H new ATOM 0 HG1 THR A 39 -12.257 -3.352 7.585 1.00 0.00 H new ATOM 0 HG21 THR A 39 -10.206 -3.782 8.777 1.00 0.00 H new ATOM 0 HG22 THR A 39 -8.752 -4.035 7.783 1.00 0.00 H new ATOM 0 HG23 THR A 39 -9.410 -2.395 7.995 1.00 0.00 H new ATOM 575 N VAL A 40 -7.464 -3.570 5.470 1.00 0.00 N ATOM 576 CA VAL A 40 -6.223 -4.312 5.285 1.00 0.00 C ATOM 577 C VAL A 40 -5.411 -4.343 6.578 1.00 0.00 C ATOM 578 O VAL A 40 -5.359 -3.359 7.315 1.00 0.00 O ATOM 579 CB VAL A 40 -5.363 -3.719 4.146 1.00 0.00 C ATOM 580 CG1 VAL A 40 -6.234 -3.344 2.956 1.00 0.00 C ATOM 581 CG2 VAL A 40 -4.568 -2.515 4.631 1.00 0.00 C ATOM 0 H VAL A 40 -7.347 -2.649 5.893 1.00 0.00 H new ATOM 0 HA VAL A 40 -6.499 -5.330 5.009 1.00 0.00 H new ATOM 0 HB VAL A 40 -4.654 -4.483 3.826 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -5.610 -2.928 2.165 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -6.746 -4.232 2.586 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -6.971 -2.602 3.264 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -3.972 -2.118 3.809 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -5.253 -1.746 4.987 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -3.909 -2.818 5.444 1.00 0.00 H new ATOM 591 N VAL A 41 -4.781 -5.479 6.845 1.00 0.00 N ATOM 592 CA VAL A 41 -3.972 -5.644 8.048 1.00 0.00 C ATOM 593 C VAL A 41 -2.493 -5.751 7.698 1.00 0.00 C ATOM 594 O VAL A 41 -2.119 -6.453 6.760 1.00 0.00 O ATOM 595 CB VAL A 41 -4.391 -6.898 8.838 1.00 0.00 C ATOM 596 CG1 VAL A 41 -3.711 -6.928 10.200 1.00 0.00 C ATOM 597 CG2 VAL A 41 -5.905 -6.954 8.986 1.00 0.00 C ATOM 0 H VAL A 41 -4.814 -6.302 6.244 1.00 0.00 H new ATOM 0 HA VAL A 41 -4.137 -4.762 8.667 1.00 0.00 H new ATOM 0 HB VAL A 41 -4.070 -7.779 8.281 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -4.021 -7.822 10.742 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -2.629 -6.941 10.066 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -3.996 -6.043 10.768 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -6.183 -7.846 9.547 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -6.252 -6.068 9.518 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -6.366 -6.987 7.999 1.00 0.00 H new ATOM 607 N LEU A 42 -1.655 -5.049 8.455 1.00 0.00 N ATOM 608 CA LEU A 42 -0.216 -5.062 8.220 1.00 0.00 C ATOM 609 C LEU A 42 0.319 -6.486 8.132 1.00 0.00 C ATOM 610 O LEU A 42 1.266 -6.760 7.395 1.00 0.00 O ATOM 611 CB LEU A 42 0.504 -4.303 9.327 1.00 0.00 C ATOM 612 CG LEU A 42 1.099 -2.965 8.889 1.00 0.00 C ATOM 613 CD1 LEU A 42 0.879 -1.907 9.954 1.00 0.00 C ATOM 614 CD2 LEU A 42 2.581 -3.114 8.580 1.00 0.00 C ATOM 0 H LEU A 42 -1.949 -4.464 9.237 1.00 0.00 H new ATOM 0 HA LEU A 42 -0.028 -4.571 7.265 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -0.195 -4.126 10.144 1.00 0.00 H new ATOM 0 HB3 LEU A 42 1.303 -4.931 9.721 1.00 0.00 H new ATOM 0 HG LEU A 42 0.590 -2.645 7.980 1.00 0.00 H new ATOM 0 HD11 LEU A 42 1.310 -0.962 9.623 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -0.190 -1.779 10.124 1.00 0.00 H new ATOM 0 HD13 LEU A 42 1.359 -2.219 10.882 1.00 0.00 H new ATOM 0 HD21 LEU A 42 2.987 -2.151 8.270 1.00 0.00 H new ATOM 0 HD22 LEU A 42 3.106 -3.459 9.471 1.00 0.00 H new ATOM 0 HD23 LEU A 42 2.714 -3.839 7.777 1.00 0.00 H new ATOM 626 N SER A 43 -0.299 -7.390 8.882 1.00 0.00 N ATOM 627 CA SER A 43 0.108 -8.794 8.885 1.00 0.00 C ATOM 628 C SER A 43 0.331 -9.302 7.459 1.00 0.00 C ATOM 629 O SER A 43 1.126 -10.214 7.232 1.00 0.00 O ATOM 630 CB SER A 43 -0.947 -9.651 9.585 1.00 0.00 C ATOM 631 OG SER A 43 -0.843 -9.539 10.994 1.00 0.00 O ATOM 0 H SER A 43 -1.085 -7.178 9.497 1.00 0.00 H new ATOM 0 HA SER A 43 1.049 -8.872 9.430 1.00 0.00 H new ATOM 0 HB2 SER A 43 -1.942 -9.342 9.265 1.00 0.00 H new ATOM 0 HB3 SER A 43 -0.827 -10.694 9.290 1.00 0.00 H new ATOM 0 HG SER A 43 -1.530 -10.095 11.418 1.00 0.00 H new ATOM 637 N THR A 44 -0.370 -8.695 6.503 1.00 0.00 N ATOM 638 CA THR A 44 -0.244 -9.071 5.100 1.00 0.00 C ATOM 639 C THR A 44 0.478 -7.974 4.324 1.00 0.00 C ATOM 640 O THR A 44 1.058 -8.218 3.269 1.00 0.00 O ATOM 641 CB THR A 44 -1.630 -9.323 4.503 1.00 0.00 C ATOM 642 OG1 THR A 44 -1.542 -10.156 3.360 1.00 0.00 O ATOM 643 CG2 THR A 44 -2.358 -8.058 4.097 1.00 0.00 C ATOM 0 H THR A 44 -1.032 -7.939 6.677 1.00 0.00 H new ATOM 0 HA THR A 44 0.342 -9.988 5.028 1.00 0.00 H new ATOM 0 HB THR A 44 -2.198 -9.803 5.300 1.00 0.00 H new ATOM 0 HG1 THR A 44 -2.439 -10.306 2.995 1.00 0.00 H new ATOM 0 HG21 THR A 44 -3.333 -8.316 3.683 1.00 0.00 H new ATOM 0 HG22 THR A 44 -2.493 -7.419 4.970 1.00 0.00 H new ATOM 0 HG23 THR A 44 -1.773 -7.527 3.346 1.00 0.00 H new ATOM 651 N ILE A 45 0.425 -6.764 4.863 1.00 0.00 N ATOM 652 CA ILE A 45 1.064 -5.609 4.246 1.00 0.00 C ATOM 653 C ILE A 45 2.136 -5.032 5.172 1.00 0.00 C ATOM 654 O ILE A 45 1.848 -4.650 6.304 1.00 0.00 O ATOM 655 CB ILE A 45 0.016 -4.522 3.880 1.00 0.00 C ATOM 656 CG1 ILE A 45 0.638 -3.114 3.881 1.00 0.00 C ATOM 657 CG2 ILE A 45 -1.192 -4.584 4.809 1.00 0.00 C ATOM 658 CD1 ILE A 45 0.606 -2.413 5.226 1.00 0.00 C ATOM 0 H ILE A 45 -0.060 -6.555 5.736 1.00 0.00 H new ATOM 0 HA ILE A 45 1.543 -5.939 3.324 1.00 0.00 H new ATOM 0 HB ILE A 45 -0.327 -4.731 2.867 1.00 0.00 H new ATOM 0 HG12 ILE A 45 1.673 -3.188 3.549 1.00 0.00 H new ATOM 0 HG13 ILE A 45 0.112 -2.498 3.152 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -1.907 -3.811 4.528 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -1.664 -5.563 4.727 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -0.869 -4.422 5.837 1.00 0.00 H new ATOM 0 HD11 ILE A 45 1.065 -1.428 5.134 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -0.428 -2.303 5.554 1.00 0.00 H new ATOM 0 HD13 ILE A 45 1.158 -3.003 5.957 1.00 0.00 H new ATOM 670 N ASP A 46 3.381 -4.985 4.696 1.00 0.00 N ATOM 671 CA ASP A 46 4.476 -4.468 5.513 1.00 0.00 C ATOM 672 C ASP A 46 5.180 -3.285 4.862 1.00 0.00 C ATOM 673 O ASP A 46 6.343 -3.006 5.151 1.00 0.00 O ATOM 674 CB ASP A 46 5.485 -5.576 5.818 1.00 0.00 C ATOM 675 CG ASP A 46 6.027 -5.492 7.231 1.00 0.00 C ATOM 676 OD1 ASP A 46 5.976 -4.393 7.822 1.00 0.00 O ATOM 677 OD2 ASP A 46 6.505 -6.525 7.747 1.00 0.00 O ATOM 0 H ASP A 46 3.653 -5.294 3.763 1.00 0.00 H new ATOM 0 HA ASP A 46 4.036 -4.111 6.444 1.00 0.00 H new ATOM 0 HB2 ASP A 46 5.010 -6.546 5.671 1.00 0.00 H new ATOM 0 HB3 ASP A 46 6.312 -5.515 5.110 1.00 0.00 H new ATOM 682 N LYS A 47 4.463 -2.582 4.004 1.00 0.00 N ATOM 683 CA LYS A 47 5.014 -1.406 3.331 1.00 0.00 C ATOM 684 C LYS A 47 3.909 -0.470 2.856 1.00 0.00 C ATOM 685 O LYS A 47 2.813 -0.908 2.506 1.00 0.00 O ATOM 686 CB LYS A 47 5.902 -1.796 2.143 1.00 0.00 C ATOM 687 CG LYS A 47 6.390 -3.234 2.165 1.00 0.00 C ATOM 688 CD LYS A 47 7.258 -3.539 0.955 1.00 0.00 C ATOM 689 CE LYS A 47 7.729 -4.985 0.955 1.00 0.00 C ATOM 690 NZ LYS A 47 7.370 -5.686 -0.308 1.00 0.00 N ATOM 0 H LYS A 47 3.499 -2.800 3.753 1.00 0.00 H new ATOM 0 HA LYS A 47 5.627 -0.885 4.066 1.00 0.00 H new ATOM 0 HB2 LYS A 47 5.346 -1.629 1.220 1.00 0.00 H new ATOM 0 HB3 LYS A 47 6.767 -1.133 2.119 1.00 0.00 H new ATOM 0 HG2 LYS A 47 6.958 -3.414 3.078 1.00 0.00 H new ATOM 0 HG3 LYS A 47 5.535 -3.910 2.183 1.00 0.00 H new ATOM 0 HD2 LYS A 47 6.695 -3.339 0.043 1.00 0.00 H new ATOM 0 HD3 LYS A 47 8.122 -2.874 0.949 1.00 0.00 H new ATOM 0 HE2 LYS A 47 8.810 -5.015 1.092 1.00 0.00 H new ATOM 0 HE3 LYS A 47 7.286 -5.511 1.801 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 8.059 -6.442 -0.493 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 6.419 -6.098 -0.218 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 7.380 -5.008 -1.096 1.00 0.00 H new ATOM 704 N LEU A 48 4.215 0.823 2.842 1.00 0.00 N ATOM 705 CA LEU A 48 3.264 1.835 2.404 1.00 0.00 C ATOM 706 C LEU A 48 3.964 2.892 1.546 1.00 0.00 C ATOM 707 O LEU A 48 5.012 3.416 1.920 1.00 0.00 O ATOM 708 CB LEU A 48 2.574 2.484 3.614 1.00 0.00 C ATOM 709 CG LEU A 48 3.427 3.441 4.459 1.00 0.00 C ATOM 710 CD1 LEU A 48 4.779 2.825 4.788 1.00 0.00 C ATOM 711 CD2 LEU A 48 3.598 4.782 3.756 1.00 0.00 C ATOM 0 H LEU A 48 5.120 1.195 3.131 1.00 0.00 H new ATOM 0 HA LEU A 48 2.500 1.352 1.794 1.00 0.00 H new ATOM 0 HB2 LEU A 48 1.702 3.031 3.256 1.00 0.00 H new ATOM 0 HB3 LEU A 48 2.208 1.690 4.264 1.00 0.00 H new ATOM 0 HG LEU A 48 2.902 3.616 5.398 1.00 0.00 H new ATOM 0 HD11 LEU A 48 5.362 3.525 5.387 1.00 0.00 H new ATOM 0 HD12 LEU A 48 4.632 1.902 5.349 1.00 0.00 H new ATOM 0 HD13 LEU A 48 5.314 2.606 3.864 1.00 0.00 H new ATOM 0 HD21 LEU A 48 4.206 5.442 4.375 1.00 0.00 H new ATOM 0 HD22 LEU A 48 4.091 4.629 2.796 1.00 0.00 H new ATOM 0 HD23 LEU A 48 2.620 5.235 3.594 1.00 0.00 H new ATOM 723 N GLN A 49 3.381 3.197 0.391 1.00 0.00 N ATOM 724 CA GLN A 49 3.949 4.189 -0.519 1.00 0.00 C ATOM 725 C GLN A 49 3.155 5.490 -0.454 1.00 0.00 C ATOM 726 O GLN A 49 1.928 5.474 -0.359 1.00 0.00 O ATOM 727 CB GLN A 49 3.951 3.657 -1.954 1.00 0.00 C ATOM 728 CG GLN A 49 4.468 2.234 -2.078 1.00 0.00 C ATOM 729 CD GLN A 49 5.816 2.040 -1.410 1.00 0.00 C ATOM 730 OE1 GLN A 49 5.990 2.358 -0.234 1.00 0.00 O ATOM 731 NE2 GLN A 49 6.779 1.517 -2.161 1.00 0.00 N ATOM 0 H GLN A 49 2.514 2.772 0.062 1.00 0.00 H new ATOM 0 HA GLN A 49 4.976 4.386 -0.211 1.00 0.00 H new ATOM 0 HB2 GLN A 49 2.936 3.701 -2.350 1.00 0.00 H new ATOM 0 HB3 GLN A 49 4.564 4.312 -2.574 1.00 0.00 H new ATOM 0 HG2 GLN A 49 3.745 1.549 -1.634 1.00 0.00 H new ATOM 0 HG3 GLN A 49 4.549 1.972 -3.133 1.00 0.00 H new ATOM 0 HE21 GLN A 49 6.590 1.268 -3.132 1.00 0.00 H new ATOM 0 HE22 GLN A 49 7.707 1.365 -1.767 1.00 0.00 H new ATOM 740 N ALA A 50 3.859 6.615 -0.507 1.00 0.00 N ATOM 741 CA ALA A 50 3.214 7.921 -0.454 1.00 0.00 C ATOM 742 C ALA A 50 3.896 8.906 -1.396 1.00 0.00 C ATOM 743 O ALA A 50 5.011 8.666 -1.860 1.00 0.00 O ATOM 744 CB ALA A 50 3.219 8.457 0.971 1.00 0.00 C ATOM 0 H ALA A 50 4.875 6.649 -0.587 1.00 0.00 H new ATOM 0 HA ALA A 50 2.181 7.803 -0.780 1.00 0.00 H new ATOM 0 HB1 ALA A 50 2.734 9.433 0.994 1.00 0.00 H new ATOM 0 HB2 ALA A 50 2.679 7.768 1.621 1.00 0.00 H new ATOM 0 HB3 ALA A 50 4.247 8.554 1.319 1.00 0.00 H new ATOM 750 N THR A 51 3.220 10.015 -1.676 1.00 0.00 N ATOM 751 CA THR A 51 3.763 11.035 -2.566 1.00 0.00 C ATOM 752 C THR A 51 4.760 11.926 -1.828 1.00 0.00 C ATOM 753 O THR A 51 4.833 11.905 -0.599 1.00 0.00 O ATOM 754 CB THR A 51 2.633 11.886 -3.155 1.00 0.00 C ATOM 755 OG1 THR A 51 1.407 11.624 -2.494 1.00 0.00 O ATOM 756 CG2 THR A 51 2.417 11.647 -4.634 1.00 0.00 C ATOM 0 H THR A 51 2.297 10.230 -1.300 1.00 0.00 H new ATOM 0 HA THR A 51 4.287 10.531 -3.379 1.00 0.00 H new ATOM 0 HB THR A 51 2.944 12.920 -3.010 1.00 0.00 H new ATOM 0 HG1 THR A 51 0.662 11.927 -3.054 1.00 0.00 H new ATOM 0 HG21 THR A 51 1.604 12.279 -4.990 1.00 0.00 H new ATOM 0 HG22 THR A 51 3.330 11.889 -5.179 1.00 0.00 H new ATOM 0 HG23 THR A 51 2.162 10.600 -4.800 1.00 0.00 H new ATOM 764 N PRO A 52 5.546 12.722 -2.573 1.00 0.00 N ATOM 765 CA PRO A 52 6.545 13.621 -1.984 1.00 0.00 C ATOM 766 C PRO A 52 5.909 14.778 -1.223 1.00 0.00 C ATOM 767 O PRO A 52 4.824 15.244 -1.572 1.00 0.00 O ATOM 768 CB PRO A 52 7.316 14.140 -3.200 1.00 0.00 C ATOM 769 CG PRO A 52 6.360 14.022 -4.335 1.00 0.00 C ATOM 770 CD PRO A 52 5.524 12.807 -4.045 1.00 0.00 C ATOM 0 HA PRO A 52 7.170 13.110 -1.252 1.00 0.00 H new ATOM 0 HB2 PRO A 52 7.633 15.173 -3.056 1.00 0.00 H new ATOM 0 HB3 PRO A 52 8.216 13.552 -3.378 1.00 0.00 H new ATOM 0 HG2 PRO A 52 5.738 14.914 -4.416 1.00 0.00 H new ATOM 0 HG3 PRO A 52 6.889 13.915 -5.282 1.00 0.00 H new ATOM 0 HD2 PRO A 52 4.509 12.917 -4.426 1.00 0.00 H new ATOM 0 HD3 PRO A 52 5.942 11.912 -4.506 1.00 0.00 H new ATOM 778 N ALA A 53 6.592 15.239 -0.180 1.00 0.00 N ATOM 779 CA ALA A 53 6.096 16.344 0.632 1.00 0.00 C ATOM 780 C ALA A 53 6.125 17.653 -0.149 1.00 0.00 C ATOM 781 O ALA A 53 6.944 18.532 0.121 1.00 0.00 O ATOM 782 CB ALA A 53 6.913 16.469 1.908 1.00 0.00 C ATOM 0 H ALA A 53 7.491 14.864 0.123 1.00 0.00 H new ATOM 0 HA ALA A 53 5.060 16.133 0.898 1.00 0.00 H new ATOM 0 HB1 ALA A 53 6.532 17.298 2.504 1.00 0.00 H new ATOM 0 HB2 ALA A 53 6.837 15.545 2.481 1.00 0.00 H new ATOM 0 HB3 ALA A 53 7.957 16.654 1.655 1.00 0.00 H new ATOM 788 N SER A 54 5.225 17.774 -1.120 1.00 0.00 N ATOM 789 CA SER A 54 5.140 18.975 -1.947 1.00 0.00 C ATOM 790 C SER A 54 4.155 18.776 -3.091 1.00 0.00 C ATOM 791 O SER A 54 3.498 19.719 -3.533 1.00 0.00 O ATOM 792 CB SER A 54 6.517 19.345 -2.504 1.00 0.00 C ATOM 793 OG SER A 54 7.183 20.262 -1.653 1.00 0.00 O ATOM 0 H SER A 54 4.542 17.053 -1.355 1.00 0.00 H new ATOM 0 HA SER A 54 4.784 19.790 -1.318 1.00 0.00 H new ATOM 0 HB2 SER A 54 7.121 18.445 -2.617 1.00 0.00 H new ATOM 0 HB3 SER A 54 6.406 19.781 -3.497 1.00 0.00 H new ATOM 0 HG SER A 54 7.403 19.821 -0.806 1.00 0.00 H new ATOM 799 N SER A 55 4.061 17.543 -3.564 1.00 0.00 N ATOM 800 CA SER A 55 3.157 17.206 -4.658 1.00 0.00 C ATOM 801 C SER A 55 1.712 17.525 -4.288 1.00 0.00 C ATOM 802 O SER A 55 1.408 17.822 -3.132 1.00 0.00 O ATOM 803 CB SER A 55 3.289 15.726 -5.019 1.00 0.00 C ATOM 804 OG SER A 55 4.265 15.531 -6.027 1.00 0.00 O ATOM 0 H SER A 55 4.601 16.755 -3.207 1.00 0.00 H new ATOM 0 HA SER A 55 3.433 17.809 -5.523 1.00 0.00 H new ATOM 0 HB2 SER A 55 3.560 15.155 -4.131 1.00 0.00 H new ATOM 0 HB3 SER A 55 2.327 15.345 -5.362 1.00 0.00 H new ATOM 0 HG SER A 55 4.331 14.576 -6.238 1.00 0.00 H new ATOM 810 N GLU A 56 0.825 17.460 -5.275 1.00 0.00 N ATOM 811 CA GLU A 56 -0.588 17.742 -5.052 1.00 0.00 C ATOM 812 C GLU A 56 -1.404 16.453 -5.019 1.00 0.00 C ATOM 813 O GLU A 56 -2.440 16.381 -4.359 1.00 0.00 O ATOM 814 CB GLU A 56 -1.123 18.669 -6.145 1.00 0.00 C ATOM 815 CG GLU A 56 -2.452 19.318 -5.795 1.00 0.00 C ATOM 816 CD GLU A 56 -3.277 19.655 -7.022 1.00 0.00 C ATOM 817 OE1 GLU A 56 -2.677 19.933 -8.082 1.00 0.00 O ATOM 818 OE2 GLU A 56 -4.522 19.642 -6.923 1.00 0.00 O ATOM 0 H GLU A 56 1.060 17.215 -6.237 1.00 0.00 H new ATOM 0 HA GLU A 56 -0.685 18.236 -4.085 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -0.387 19.449 -6.340 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -1.238 18.101 -7.068 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -3.022 18.647 -5.152 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -2.269 20.228 -5.224 1.00 0.00 H new ATOM 825 N LYS A 57 -0.932 15.439 -5.737 1.00 0.00 N ATOM 826 CA LYS A 57 -1.620 14.155 -5.792 1.00 0.00 C ATOM 827 C LYS A 57 -1.586 13.456 -4.435 1.00 0.00 C ATOM 828 O LYS A 57 -0.836 12.502 -4.235 1.00 0.00 O ATOM 829 CB LYS A 57 -0.987 13.259 -6.859 1.00 0.00 C ATOM 830 CG LYS A 57 -1.786 13.197 -8.151 1.00 0.00 C ATOM 831 CD LYS A 57 -3.142 12.546 -7.938 1.00 0.00 C ATOM 832 CE LYS A 57 -3.091 11.051 -8.204 1.00 0.00 C ATOM 833 NZ LYS A 57 -3.582 10.712 -9.568 1.00 0.00 N ATOM 0 H LYS A 57 -0.075 15.482 -6.289 1.00 0.00 H new ATOM 0 HA LYS A 57 -2.661 14.341 -6.055 1.00 0.00 H new ATOM 0 HB2 LYS A 57 0.017 13.623 -7.079 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -0.880 12.251 -6.459 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -1.923 14.205 -8.544 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -1.226 12.636 -8.900 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -3.475 12.723 -6.915 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -3.876 13.009 -8.597 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -2.067 10.697 -8.089 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -3.694 10.529 -7.461 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -3.531 9.683 -9.710 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -4.568 11.027 -9.670 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -2.991 11.189 -10.278 1.00 0.00 H new ATOM 847 N MET A 58 -2.407 13.938 -3.507 1.00 0.00 N ATOM 848 CA MET A 58 -2.476 13.359 -2.171 1.00 0.00 C ATOM 849 C MET A 58 -3.052 11.948 -2.222 1.00 0.00 C ATOM 850 O MET A 58 -4.269 11.768 -2.226 1.00 0.00 O ATOM 851 CB MET A 58 -3.335 14.238 -1.258 1.00 0.00 C ATOM 852 CG MET A 58 -4.660 14.650 -1.882 1.00 0.00 C ATOM 853 SD MET A 58 -4.658 16.360 -2.456 1.00 0.00 S ATOM 854 CE MET A 58 -4.318 17.230 -0.928 1.00 0.00 C ATOM 0 H MET A 58 -3.034 14.729 -3.656 1.00 0.00 H new ATOM 0 HA MET A 58 -1.464 13.307 -1.770 1.00 0.00 H new ATOM 0 HB2 MET A 58 -3.531 13.701 -0.330 1.00 0.00 H new ATOM 0 HB3 MET A 58 -2.772 15.134 -0.995 1.00 0.00 H new ATOM 0 HG2 MET A 58 -4.883 13.990 -2.720 1.00 0.00 H new ATOM 0 HG3 MET A 58 -5.458 14.517 -1.151 1.00 0.00 H new ATOM 0 HE1 MET A 58 -5.156 17.884 -0.687 1.00 0.00 H new ATOM 0 HE2 MET A 58 -4.177 16.509 -0.123 1.00 0.00 H new ATOM 0 HE3 MET A 58 -3.413 17.827 -1.043 1.00 0.00 H new ATOM 864 N MET A 59 -2.175 10.949 -2.268 1.00 0.00 N ATOM 865 CA MET A 59 -2.613 9.558 -2.324 1.00 0.00 C ATOM 866 C MET A 59 -1.477 8.601 -1.967 1.00 0.00 C ATOM 867 O MET A 59 -0.304 8.911 -2.173 1.00 0.00 O ATOM 868 CB MET A 59 -3.163 9.238 -3.718 1.00 0.00 C ATOM 869 CG MET A 59 -2.414 9.919 -4.849 1.00 0.00 C ATOM 870 SD MET A 59 -1.927 8.779 -6.161 1.00 0.00 S ATOM 871 CE MET A 59 -0.236 9.298 -6.453 1.00 0.00 C ATOM 0 H MET A 59 -1.163 11.075 -2.268 1.00 0.00 H new ATOM 0 HA MET A 59 -3.404 9.422 -1.587 1.00 0.00 H new ATOM 0 HB2 MET A 59 -3.130 8.159 -3.872 1.00 0.00 H new ATOM 0 HB3 MET A 59 -4.211 9.534 -3.760 1.00 0.00 H new ATOM 0 HG2 MET A 59 -3.041 10.704 -5.272 1.00 0.00 H new ATOM 0 HG3 MET A 59 -1.524 10.404 -4.448 1.00 0.00 H new ATOM 0 HE1 MET A 59 0.377 8.427 -6.687 1.00 0.00 H new ATOM 0 HE2 MET A 59 -0.209 9.996 -7.290 1.00 0.00 H new ATOM 0 HE3 MET A 59 0.154 9.787 -5.560 1.00 0.00 H new ATOM 881 N LEU A 60 -1.835 7.435 -1.426 1.00 0.00 N ATOM 882 CA LEU A 60 -0.842 6.433 -1.040 1.00 0.00 C ATOM 883 C LEU A 60 -1.359 5.008 -1.262 1.00 0.00 C ATOM 884 O LEU A 60 -2.565 4.778 -1.341 1.00 0.00 O ATOM 885 CB LEU A 60 -0.441 6.616 0.427 1.00 0.00 C ATOM 886 CG LEU A 60 -1.549 7.133 1.348 1.00 0.00 C ATOM 887 CD1 LEU A 60 -1.224 6.820 2.800 1.00 0.00 C ATOM 888 CD2 LEU A 60 -1.745 8.630 1.155 1.00 0.00 C ATOM 0 H LEU A 60 -2.801 7.163 -1.246 1.00 0.00 H new ATOM 0 HA LEU A 60 0.032 6.578 -1.675 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -0.088 5.659 0.812 1.00 0.00 H new ATOM 0 HB3 LEU A 60 0.400 7.308 0.473 1.00 0.00 H new ATOM 0 HG LEU A 60 -2.479 6.627 1.088 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -2.022 7.195 3.440 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -1.132 5.741 2.928 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -0.284 7.299 3.074 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -2.536 8.982 1.817 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -0.817 9.152 1.389 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -2.022 8.830 0.120 1.00 0.00 H new ATOM 900 N ARG A 61 -0.428 4.056 -1.343 1.00 0.00 N ATOM 901 CA ARG A 61 -0.766 2.645 -1.535 1.00 0.00 C ATOM 902 C ARG A 61 0.073 1.771 -0.608 1.00 0.00 C ATOM 903 O ARG A 61 1.240 2.061 -0.358 1.00 0.00 O ATOM 904 CB ARG A 61 -0.556 2.209 -2.989 1.00 0.00 C ATOM 905 CG ARG A 61 0.883 1.845 -3.321 1.00 0.00 C ATOM 906 CD ARG A 61 1.002 1.229 -4.706 1.00 0.00 C ATOM 907 NE ARG A 61 2.056 0.219 -4.763 1.00 0.00 N ATOM 908 CZ ARG A 61 2.307 -0.533 -5.833 1.00 0.00 C ATOM 909 NH1 ARG A 61 1.584 -0.394 -6.936 1.00 0.00 N ATOM 910 NH2 ARG A 61 3.286 -1.427 -5.798 1.00 0.00 N ATOM 0 H ARG A 61 0.573 4.239 -1.278 1.00 0.00 H new ATOM 0 HA ARG A 61 -1.822 2.522 -1.294 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -1.195 1.351 -3.197 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -0.879 3.014 -3.650 1.00 0.00 H new ATOM 0 HG2 ARG A 61 1.506 2.737 -3.265 1.00 0.00 H new ATOM 0 HG3 ARG A 61 1.262 1.144 -2.577 1.00 0.00 H new ATOM 0 HD2 ARG A 61 0.050 0.777 -4.986 1.00 0.00 H new ATOM 0 HD3 ARG A 61 1.209 2.012 -5.435 1.00 0.00 H new ATOM 0 HE ARG A 61 2.634 0.082 -3.934 1.00 0.00 H new ATOM 0 HH11 ARG A 61 0.830 0.292 -6.969 1.00 0.00 H new ATOM 0 HH12 ARG A 61 1.782 -0.973 -7.752 1.00 0.00 H new ATOM 0 HH21 ARG A 61 3.845 -1.538 -4.952 1.00 0.00 H new ATOM 0 HH22 ARG A 61 3.479 -2.004 -6.617 1.00 0.00 H new ATOM 924 N LEU A 62 -0.525 0.705 -0.105 1.00 0.00 N ATOM 925 CA LEU A 62 0.171 -0.208 0.794 1.00 0.00 C ATOM 926 C LEU A 62 0.453 -1.537 0.115 1.00 0.00 C ATOM 927 O LEU A 62 -0.384 -2.082 -0.605 1.00 0.00 O ATOM 928 CB LEU A 62 -0.613 -0.415 2.091 1.00 0.00 C ATOM 929 CG LEU A 62 -1.730 0.598 2.359 1.00 0.00 C ATOM 930 CD1 LEU A 62 -2.784 -0.002 3.274 1.00 0.00 C ATOM 931 CD2 LEU A 62 -1.159 1.876 2.959 1.00 0.00 C ATOM 0 H LEU A 62 -1.492 0.448 -0.302 1.00 0.00 H new ATOM 0 HA LEU A 62 1.127 0.249 1.050 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -1.049 -1.414 2.075 1.00 0.00 H new ATOM 0 HB3 LEU A 62 0.087 -0.386 2.926 1.00 0.00 H new ATOM 0 HG LEU A 62 -2.204 0.849 1.410 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -3.570 0.732 3.454 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -3.214 -0.886 2.803 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -2.326 -0.282 4.222 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -1.967 2.584 3.143 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -0.658 1.645 3.899 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -0.442 2.315 2.265 1.00 0.00 H new ATOM 943 N ILE A 63 1.662 -2.030 0.335 1.00 0.00 N ATOM 944 CA ILE A 63 2.119 -3.273 -0.258 1.00 0.00 C ATOM 945 C ILE A 63 1.756 -4.480 0.604 1.00 0.00 C ATOM 946 O ILE A 63 1.797 -4.414 1.828 1.00 0.00 O ATOM 947 CB ILE A 63 3.650 -3.223 -0.442 1.00 0.00 C ATOM 948 CG1 ILE A 63 4.007 -2.921 -1.894 1.00 0.00 C ATOM 949 CG2 ILE A 63 4.302 -4.511 0.024 1.00 0.00 C ATOM 950 CD1 ILE A 63 4.303 -1.458 -2.132 1.00 0.00 C ATOM 0 H ILE A 63 2.354 -1.577 0.932 1.00 0.00 H new ATOM 0 HA ILE A 63 1.623 -3.384 -1.222 1.00 0.00 H new ATOM 0 HB ILE A 63 4.038 -2.415 0.179 1.00 0.00 H new ATOM 0 HG12 ILE A 63 4.875 -3.514 -2.181 1.00 0.00 H new ATOM 0 HG13 ILE A 63 3.183 -3.230 -2.538 1.00 0.00 H new ATOM 0 HG21 ILE A 63 5.381 -4.445 -0.118 1.00 0.00 H new ATOM 0 HG22 ILE A 63 4.084 -4.667 1.081 1.00 0.00 H new ATOM 0 HG23 ILE A 63 3.910 -5.347 -0.555 1.00 0.00 H new ATOM 0 HD11 ILE A 63 4.551 -1.303 -3.182 1.00 0.00 H new ATOM 0 HD12 ILE A 63 3.427 -0.863 -1.874 1.00 0.00 H new ATOM 0 HD13 ILE A 63 5.145 -1.152 -1.512 1.00 0.00 H new ATOM 962 N GLY A 64 1.438 -5.592 -0.052 1.00 0.00 N ATOM 963 CA GLY A 64 1.111 -6.809 0.665 1.00 0.00 C ATOM 964 C GLY A 64 2.340 -7.670 0.861 1.00 0.00 C ATOM 965 O GLY A 64 2.323 -8.862 0.564 1.00 0.00 O ATOM 0 H GLY A 64 1.401 -5.671 -1.068 1.00 0.00 H new ATOM 0 HA2 GLY A 64 0.679 -6.559 1.634 1.00 0.00 H new ATOM 0 HA3 GLY A 64 0.355 -7.368 0.114 1.00 0.00 H new ATOM 969 N LYS A 65 3.405 -7.036 1.361 1.00 0.00 N ATOM 970 CA LYS A 65 4.699 -7.674 1.622 1.00 0.00 C ATOM 971 C LYS A 65 5.052 -8.758 0.603 1.00 0.00 C ATOM 972 O LYS A 65 4.201 -9.518 0.148 1.00 0.00 O ATOM 973 CB LYS A 65 4.746 -8.242 3.036 1.00 0.00 C ATOM 974 CG LYS A 65 3.598 -9.181 3.360 1.00 0.00 C ATOM 975 CD LYS A 65 4.062 -10.626 3.459 1.00 0.00 C ATOM 976 CE LYS A 65 3.829 -11.376 2.158 1.00 0.00 C ATOM 977 NZ LYS A 65 3.423 -12.788 2.395 1.00 0.00 N ATOM 0 H LYS A 65 3.391 -6.045 1.601 1.00 0.00 H new ATOM 0 HA LYS A 65 5.451 -6.891 1.521 1.00 0.00 H new ATOM 0 HB2 LYS A 65 5.687 -8.774 3.172 1.00 0.00 H new ATOM 0 HB3 LYS A 65 4.740 -7.417 3.749 1.00 0.00 H new ATOM 0 HG2 LYS A 65 3.138 -8.881 4.302 1.00 0.00 H new ATOM 0 HG3 LYS A 65 2.831 -9.097 2.590 1.00 0.00 H new ATOM 0 HD2 LYS A 65 5.122 -10.652 3.711 1.00 0.00 H new ATOM 0 HD3 LYS A 65 3.530 -11.126 4.269 1.00 0.00 H new ATOM 0 HE2 LYS A 65 3.057 -10.869 1.580 1.00 0.00 H new ATOM 0 HE3 LYS A 65 4.740 -11.356 1.560 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 3.274 -13.264 1.483 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 4.171 -13.280 2.924 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 2.540 -12.808 2.944 1.00 0.00 H new ATOM 991 N VAL A 66 6.329 -8.820 0.250 1.00 0.00 N ATOM 992 CA VAL A 66 6.807 -9.795 -0.708 1.00 0.00 C ATOM 993 C VAL A 66 7.980 -10.595 -0.154 1.00 0.00 C ATOM 994 O VAL A 66 8.638 -10.177 0.799 1.00 0.00 O ATOM 995 CB VAL A 66 7.226 -9.128 -2.021 1.00 0.00 C ATOM 996 CG1 VAL A 66 7.365 -10.161 -3.129 1.00 0.00 C ATOM 997 CG2 VAL A 66 6.237 -8.040 -2.415 1.00 0.00 C ATOM 0 H VAL A 66 7.052 -8.201 0.618 1.00 0.00 H new ATOM 0 HA VAL A 66 5.977 -10.474 -0.903 1.00 0.00 H new ATOM 0 HB VAL A 66 8.199 -8.660 -1.869 1.00 0.00 H new ATOM 0 HG11 VAL A 66 7.663 -9.666 -4.053 1.00 0.00 H new ATOM 0 HG12 VAL A 66 8.122 -10.894 -2.850 1.00 0.00 H new ATOM 0 HG13 VAL A 66 6.410 -10.664 -3.279 1.00 0.00 H new ATOM 0 HG21 VAL A 66 6.555 -7.580 -3.351 1.00 0.00 H new ATOM 0 HG22 VAL A 66 5.247 -8.478 -2.544 1.00 0.00 H new ATOM 0 HG23 VAL A 66 6.199 -7.282 -1.633 1.00 0.00 H new ATOM 1007 N ASP A 67 8.234 -11.748 -0.760 1.00 0.00 N ATOM 1008 CA ASP A 67 9.319 -12.616 -0.344 1.00 0.00 C ATOM 1009 C ASP A 67 10.342 -12.772 -1.456 1.00 0.00 C ATOM 1010 O ASP A 67 10.862 -13.861 -1.690 1.00 0.00 O ATOM 1011 CB ASP A 67 8.779 -13.984 0.085 1.00 0.00 C ATOM 1012 CG ASP A 67 7.496 -13.879 0.888 1.00 0.00 C ATOM 1013 OD1 ASP A 67 6.511 -13.316 0.365 1.00 0.00 O ATOM 1014 OD2 ASP A 67 7.476 -14.361 2.040 1.00 0.00 O ATOM 0 H ASP A 67 7.694 -12.103 -1.549 1.00 0.00 H new ATOM 0 HA ASP A 67 9.814 -12.156 0.512 1.00 0.00 H new ATOM 0 HB2 ASP A 67 8.600 -14.594 -0.801 1.00 0.00 H new ATOM 0 HB3 ASP A 67 9.534 -14.499 0.679 1.00 0.00 H new ATOM 1019 N GLU A 68 10.650 -11.666 -2.126 1.00 0.00 N ATOM 1020 CA GLU A 68 11.639 -11.684 -3.192 1.00 0.00 C ATOM 1021 C GLU A 68 12.978 -12.146 -2.629 1.00 0.00 C ATOM 1022 O GLU A 68 13.793 -12.738 -3.337 1.00 0.00 O ATOM 1023 CB GLU A 68 11.779 -10.296 -3.820 1.00 0.00 C ATOM 1024 CG GLU A 68 10.455 -9.693 -4.262 1.00 0.00 C ATOM 1025 CD GLU A 68 10.625 -8.345 -4.935 1.00 0.00 C ATOM 1026 OE1 GLU A 68 11.241 -7.448 -4.321 1.00 0.00 O ATOM 1027 OE2 GLU A 68 10.144 -8.186 -6.076 1.00 0.00 O ATOM 0 H GLU A 68 10.231 -10.753 -1.950 1.00 0.00 H new ATOM 0 HA GLU A 68 11.314 -12.376 -3.969 1.00 0.00 H new ATOM 0 HB2 GLU A 68 12.252 -9.627 -3.101 1.00 0.00 H new ATOM 0 HB3 GLU A 68 12.445 -10.361 -4.681 1.00 0.00 H new ATOM 0 HG2 GLU A 68 9.959 -10.378 -4.949 1.00 0.00 H new ATOM 0 HG3 GLU A 68 9.803 -9.583 -3.396 1.00 0.00 H new ATOM 1034 N SER A 69 13.186 -11.886 -1.337 1.00 0.00 N ATOM 1035 CA SER A 69 14.412 -12.291 -0.663 1.00 0.00 C ATOM 1036 C SER A 69 14.114 -13.229 0.499 1.00 0.00 C ATOM 1037 O SER A 69 14.964 -13.477 1.355 1.00 0.00 O ATOM 1038 CB SER A 69 15.198 -11.071 -0.179 1.00 0.00 C ATOM 1039 OG SER A 69 15.997 -10.534 -1.219 1.00 0.00 O ATOM 0 H SER A 69 12.519 -11.397 -0.740 1.00 0.00 H new ATOM 0 HA SER A 69 15.025 -12.829 -1.385 1.00 0.00 H new ATOM 0 HB2 SER A 69 14.507 -10.310 0.183 1.00 0.00 H new ATOM 0 HB3 SER A 69 15.831 -11.353 0.662 1.00 0.00 H new ATOM 0 HG SER A 69 16.488 -9.754 -0.885 1.00 0.00 H new ATOM 1045 N LYS A 70 12.905 -13.761 0.498 1.00 0.00 N ATOM 1046 CA LYS A 70 12.467 -14.701 1.524 1.00 0.00 C ATOM 1047 C LYS A 70 12.021 -16.005 0.867 1.00 0.00 C ATOM 1048 O LYS A 70 12.412 -17.094 1.285 1.00 0.00 O ATOM 1049 CB LYS A 70 11.323 -14.103 2.347 1.00 0.00 C ATOM 1050 CG LYS A 70 11.752 -13.626 3.725 1.00 0.00 C ATOM 1051 CD LYS A 70 11.467 -14.672 4.790 1.00 0.00 C ATOM 1052 CE LYS A 70 11.380 -14.050 6.175 1.00 0.00 C ATOM 1053 NZ LYS A 70 12.643 -14.224 6.943 1.00 0.00 N ATOM 0 H LYS A 70 12.199 -13.557 -0.209 1.00 0.00 H new ATOM 0 HA LYS A 70 13.301 -14.905 2.196 1.00 0.00 H new ATOM 0 HB2 LYS A 70 10.891 -13.265 1.799 1.00 0.00 H new ATOM 0 HB3 LYS A 70 10.537 -14.850 2.458 1.00 0.00 H new ATOM 0 HG2 LYS A 70 12.817 -13.395 3.716 1.00 0.00 H new ATOM 0 HG3 LYS A 70 11.228 -12.702 3.971 1.00 0.00 H new ATOM 0 HD2 LYS A 70 10.531 -15.181 4.560 1.00 0.00 H new ATOM 0 HD3 LYS A 70 12.252 -15.428 4.778 1.00 0.00 H new ATOM 0 HE2 LYS A 70 11.155 -12.987 6.082 1.00 0.00 H new ATOM 0 HE3 LYS A 70 10.555 -14.503 6.725 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 12.542 -13.786 7.881 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 12.845 -15.238 7.054 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 13.426 -13.769 6.431 1.00 0.00 H new ATOM 1067 N LYS A 71 11.218 -15.867 -0.183 1.00 0.00 N ATOM 1068 CA LYS A 71 10.716 -17.005 -0.948 1.00 0.00 C ATOM 1069 C LYS A 71 10.131 -18.096 -0.055 1.00 0.00 C ATOM 1070 O LYS A 71 10.163 -18.010 1.172 1.00 0.00 O ATOM 1071 CB LYS A 71 11.834 -17.592 -1.811 1.00 0.00 C ATOM 1072 CG LYS A 71 12.674 -16.539 -2.520 1.00 0.00 C ATOM 1073 CD LYS A 71 12.564 -16.659 -4.031 1.00 0.00 C ATOM 1074 CE LYS A 71 12.746 -15.311 -4.711 1.00 0.00 C ATOM 1075 NZ LYS A 71 14.180 -14.920 -4.796 1.00 0.00 N ATOM 0 H LYS A 71 10.896 -14.963 -0.528 1.00 0.00 H new ATOM 0 HA LYS A 71 9.911 -16.633 -1.582 1.00 0.00 H new ATOM 0 HB2 LYS A 71 12.484 -18.201 -1.183 1.00 0.00 H new ATOM 0 HB3 LYS A 71 11.396 -18.257 -2.555 1.00 0.00 H new ATOM 0 HG2 LYS A 71 12.351 -15.545 -2.209 1.00 0.00 H new ATOM 0 HG3 LYS A 71 13.717 -16.643 -2.221 1.00 0.00 H new ATOM 0 HD2 LYS A 71 13.316 -17.357 -4.397 1.00 0.00 H new ATOM 0 HD3 LYS A 71 11.590 -17.072 -4.294 1.00 0.00 H new ATOM 0 HE2 LYS A 71 12.321 -15.350 -5.714 1.00 0.00 H new ATOM 0 HE3 LYS A 71 12.194 -14.549 -4.160 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 14.323 -14.016 -4.303 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 14.767 -15.654 -4.351 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 14.453 -14.817 -5.794 1.00 0.00 H new ATOM 1089 N ARG A 72 9.603 -19.128 -0.704 1.00 0.00 N ATOM 1090 CA ARG A 72 9.010 -20.264 -0.025 1.00 0.00 C ATOM 1091 C ARG A 72 9.301 -21.532 -0.815 1.00 0.00 C ATOM 1092 O ARG A 72 9.807 -21.461 -1.933 1.00 0.00 O ATOM 1093 CB ARG A 72 7.502 -20.068 0.123 1.00 0.00 C ATOM 1094 CG ARG A 72 7.118 -18.729 0.731 1.00 0.00 C ATOM 1095 CD ARG A 72 6.761 -17.710 -0.341 1.00 0.00 C ATOM 1096 NE ARG A 72 5.450 -17.109 -0.109 1.00 0.00 N ATOM 1097 CZ ARG A 72 4.298 -17.755 -0.274 1.00 0.00 C ATOM 1098 NH1 ARG A 72 4.290 -19.021 -0.674 1.00 0.00 N ATOM 1099 NH2 ARG A 72 3.150 -17.134 -0.040 1.00 0.00 N ATOM 0 H ARG A 72 9.576 -19.196 -1.721 1.00 0.00 H new ATOM 0 HA ARG A 72 9.443 -20.352 0.971 1.00 0.00 H new ATOM 0 HB2 ARG A 72 7.034 -20.160 -0.857 1.00 0.00 H new ATOM 0 HB3 ARG A 72 7.100 -20.868 0.744 1.00 0.00 H new ATOM 0 HG2 ARG A 72 6.270 -18.863 1.403 1.00 0.00 H new ATOM 0 HG3 ARG A 72 7.945 -18.351 1.332 1.00 0.00 H new ATOM 0 HD2 ARG A 72 7.520 -16.928 -0.365 1.00 0.00 H new ATOM 0 HD3 ARG A 72 6.771 -18.193 -1.318 1.00 0.00 H new ATOM 0 HE ARG A 72 5.415 -16.137 0.198 1.00 0.00 H new ATOM 0 HH11 ARG A 72 5.170 -19.504 -0.857 1.00 0.00 H new ATOM 0 HH12 ARG A 72 3.404 -19.511 -0.799 1.00 0.00 H new ATOM 0 HH21 ARG A 72 3.150 -16.161 0.266 1.00 0.00 H new ATOM 0 HH22 ARG A 72 2.267 -17.629 -0.167 1.00 0.00 H new ATOM 1113 N LYS A 73 8.989 -22.691 -0.248 1.00 0.00 N ATOM 1114 CA LYS A 73 9.238 -23.946 -0.941 1.00 0.00 C ATOM 1115 C LYS A 73 8.221 -25.019 -0.569 1.00 0.00 C ATOM 1116 O LYS A 73 7.675 -25.028 0.535 1.00 0.00 O ATOM 1117 CB LYS A 73 10.663 -24.450 -0.673 1.00 0.00 C ATOM 1118 CG LYS A 73 11.322 -23.832 0.550 1.00 0.00 C ATOM 1119 CD LYS A 73 10.469 -24.018 1.792 1.00 0.00 C ATOM 1120 CE LYS A 73 10.505 -22.788 2.684 1.00 0.00 C ATOM 1121 NZ LYS A 73 10.533 -23.149 4.129 1.00 0.00 N ATOM 0 H LYS A 73 8.569 -22.787 0.677 1.00 0.00 H new ATOM 0 HA LYS A 73 9.131 -23.744 -2.007 1.00 0.00 H new ATOM 0 HB2 LYS A 73 10.636 -25.533 -0.550 1.00 0.00 H new ATOM 0 HB3 LYS A 73 11.280 -24.244 -1.548 1.00 0.00 H new ATOM 0 HG2 LYS A 73 12.300 -24.287 0.707 1.00 0.00 H new ATOM 0 HG3 LYS A 73 11.489 -22.769 0.377 1.00 0.00 H new ATOM 0 HD2 LYS A 73 9.440 -24.226 1.500 1.00 0.00 H new ATOM 0 HD3 LYS A 73 10.823 -24.884 2.351 1.00 0.00 H new ATOM 0 HE2 LYS A 73 11.384 -22.190 2.442 1.00 0.00 H new ATOM 0 HE3 LYS A 73 9.632 -22.168 2.482 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 10.557 -22.282 4.703 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 9.682 -23.698 4.366 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 11.379 -23.720 4.328 1.00 0.00 H new ATOM 1135 N ASP A 74 7.977 -25.922 -1.512 1.00 0.00 N ATOM 1136 CA ASP A 74 7.034 -27.014 -1.318 1.00 0.00 C ATOM 1137 C ASP A 74 7.274 -28.107 -2.355 1.00 0.00 C ATOM 1138 O ASP A 74 6.337 -28.607 -2.977 1.00 0.00 O ATOM 1139 CB ASP A 74 5.599 -26.496 -1.420 1.00 0.00 C ATOM 1140 CG ASP A 74 5.035 -26.085 -0.074 1.00 0.00 C ATOM 1141 OD1 ASP A 74 5.493 -26.629 0.953 1.00 0.00 O ATOM 1142 OD2 ASP A 74 4.136 -25.219 -0.047 1.00 0.00 O ATOM 0 H ASP A 74 8.426 -25.917 -2.428 1.00 0.00 H new ATOM 0 HA ASP A 74 7.185 -27.435 -0.324 1.00 0.00 H new ATOM 0 HB2 ASP A 74 5.571 -25.643 -2.098 1.00 0.00 H new ATOM 0 HB3 ASP A 74 4.966 -27.270 -1.855 1.00 0.00 H new ATOM 1147 N ASN A 75 8.544 -28.464 -2.540 1.00 0.00 N ATOM 1148 CA ASN A 75 8.929 -29.490 -3.503 1.00 0.00 C ATOM 1149 C ASN A 75 8.726 -28.998 -4.934 1.00 0.00 C ATOM 1150 O ASN A 75 8.368 -29.772 -5.822 1.00 0.00 O ATOM 1151 CB ASN A 75 8.128 -30.773 -3.271 1.00 0.00 C ATOM 1152 CG ASN A 75 8.201 -31.248 -1.833 1.00 0.00 C ATOM 1153 OD1 ASN A 75 7.615 -30.641 -0.937 1.00 0.00 O ATOM 1154 ND2 ASN A 75 8.923 -32.339 -1.606 1.00 0.00 N ATOM 0 H ASN A 75 9.327 -28.054 -2.031 1.00 0.00 H new ATOM 0 HA ASN A 75 9.988 -29.705 -3.359 1.00 0.00 H new ATOM 0 HB2 ASN A 75 7.086 -30.602 -3.542 1.00 0.00 H new ATOM 0 HB3 ASN A 75 8.504 -31.557 -3.929 1.00 0.00 H new ATOM 0 HD21 ASN A 75 9.009 -32.706 -0.658 1.00 0.00 H new ATOM 0 HD22 ASN A 75 9.392 -32.810 -2.380 1.00 0.00 H new ATOM 1161 N GLU A 76 8.959 -27.706 -5.149 1.00 0.00 N ATOM 1162 CA GLU A 76 8.804 -27.111 -6.473 1.00 0.00 C ATOM 1163 C GLU A 76 10.151 -26.960 -7.171 1.00 0.00 C ATOM 1164 O GLU A 76 10.232 -26.981 -8.399 1.00 0.00 O ATOM 1165 CB GLU A 76 8.115 -25.749 -6.366 1.00 0.00 C ATOM 1166 CG GLU A 76 6.855 -25.770 -5.516 1.00 0.00 C ATOM 1167 CD GLU A 76 6.648 -24.478 -4.750 1.00 0.00 C ATOM 1168 OE1 GLU A 76 7.650 -23.788 -4.468 1.00 0.00 O ATOM 1169 OE2 GLU A 76 5.484 -24.157 -4.430 1.00 0.00 O ATOM 0 H GLU A 76 9.255 -27.052 -4.425 1.00 0.00 H new ATOM 0 HA GLU A 76 8.184 -27.780 -7.070 1.00 0.00 H new ATOM 0 HB2 GLU A 76 8.816 -25.029 -5.944 1.00 0.00 H new ATOM 0 HB3 GLU A 76 7.862 -25.399 -7.367 1.00 0.00 H new ATOM 0 HG2 GLU A 76 5.992 -25.951 -6.157 1.00 0.00 H new ATOM 0 HG3 GLU A 76 6.909 -26.601 -4.812 1.00 0.00 H new ATOM 1176 N GLY A 77 11.203 -26.809 -6.379 1.00 0.00 N ATOM 1177 CA GLY A 77 12.538 -26.657 -6.931 1.00 0.00 C ATOM 1178 C GLY A 77 12.774 -25.289 -7.549 1.00 0.00 C ATOM 1179 O GLY A 77 13.816 -25.052 -8.161 1.00 0.00 O ATOM 0 H GLY A 77 11.157 -26.789 -5.360 1.00 0.00 H new ATOM 0 HA2 GLY A 77 13.272 -26.825 -6.143 1.00 0.00 H new ATOM 0 HA3 GLY A 77 12.702 -27.424 -7.688 1.00 0.00 H new ATOM 1183 N ASN A 78 11.808 -24.387 -7.394 1.00 0.00 N ATOM 1184 CA ASN A 78 11.923 -23.039 -7.945 1.00 0.00 C ATOM 1185 C ASN A 78 11.998 -21.997 -6.832 1.00 0.00 C ATOM 1186 O ASN A 78 12.614 -20.943 -6.993 1.00 0.00 O ATOM 1187 CB ASN A 78 10.732 -22.739 -8.855 1.00 0.00 C ATOM 1188 CG ASN A 78 10.620 -23.721 -10.005 1.00 0.00 C ATOM 1189 OD1 ASN A 78 11.481 -23.767 -10.883 1.00 0.00 O ATOM 1190 ND2 ASN A 78 9.554 -24.512 -10.005 1.00 0.00 N ATOM 0 H ASN A 78 10.938 -24.565 -6.892 1.00 0.00 H new ATOM 0 HA ASN A 78 12.844 -22.989 -8.527 1.00 0.00 H new ATOM 0 HB2 ASN A 78 9.814 -22.766 -8.268 1.00 0.00 H new ATOM 0 HB3 ASN A 78 10.827 -21.728 -9.252 1.00 0.00 H new ATOM 0 HD21 ASN A 78 9.424 -25.193 -10.754 1.00 0.00 H new ATOM 0 HD22 ASN A 78 8.865 -24.439 -9.256 1.00 0.00 H new ATOM 1197 N GLU A 79 11.369 -22.305 -5.703 1.00 0.00 N ATOM 1198 CA GLU A 79 11.355 -21.413 -4.552 1.00 0.00 C ATOM 1199 C GLU A 79 11.030 -19.978 -4.951 1.00 0.00 C ATOM 1200 O GLU A 79 11.917 -19.130 -5.058 1.00 0.00 O ATOM 1201 CB GLU A 79 12.697 -21.479 -3.827 1.00 0.00 C ATOM 1202 CG GLU A 79 12.575 -21.892 -2.373 1.00 0.00 C ATOM 1203 CD GLU A 79 13.809 -22.612 -1.864 1.00 0.00 C ATOM 1204 OE1 GLU A 79 14.581 -23.128 -2.699 1.00 0.00 O ATOM 1205 OE2 GLU A 79 14.002 -22.660 -0.631 1.00 0.00 O ATOM 0 H GLU A 79 10.857 -23.176 -5.561 1.00 0.00 H new ATOM 0 HA GLU A 79 10.566 -21.747 -3.878 1.00 0.00 H new ATOM 0 HB2 GLU A 79 13.347 -22.185 -4.344 1.00 0.00 H new ATOM 0 HB3 GLU A 79 13.179 -20.503 -3.881 1.00 0.00 H new ATOM 0 HG2 GLU A 79 12.398 -21.007 -1.762 1.00 0.00 H new ATOM 0 HG3 GLU A 79 11.707 -22.540 -2.255 1.00 0.00 H new ATOM 1212 N VAL A 80 9.749 -19.722 -5.175 1.00 0.00 N ATOM 1213 CA VAL A 80 9.284 -18.406 -5.568 1.00 0.00 C ATOM 1214 C VAL A 80 8.097 -17.959 -4.722 1.00 0.00 C ATOM 1215 O VAL A 80 7.378 -18.781 -4.155 1.00 0.00 O ATOM 1216 CB VAL A 80 8.896 -18.354 -7.060 1.00 0.00 C ATOM 1217 CG1 VAL A 80 9.838 -17.429 -7.819 1.00 0.00 C ATOM 1218 CG2 VAL A 80 8.892 -19.752 -7.674 1.00 0.00 C ATOM 0 H VAL A 80 9.009 -20.419 -5.089 1.00 0.00 H new ATOM 0 HA VAL A 80 10.118 -17.724 -5.402 1.00 0.00 H new ATOM 0 HB VAL A 80 7.884 -17.955 -7.138 1.00 0.00 H new ATOM 0 HG11 VAL A 80 9.552 -17.402 -8.871 1.00 0.00 H new ATOM 0 HG12 VAL A 80 9.777 -16.424 -7.400 1.00 0.00 H new ATOM 0 HG13 VAL A 80 10.860 -17.798 -7.730 1.00 0.00 H new ATOM 0 HG21 VAL A 80 8.615 -19.686 -8.726 1.00 0.00 H new ATOM 0 HG22 VAL A 80 9.886 -20.190 -7.587 1.00 0.00 H new ATOM 0 HG23 VAL A 80 8.172 -20.378 -7.148 1.00 0.00 H new ATOM 1228 N VAL A 81 7.901 -16.649 -4.644 1.00 0.00 N ATOM 1229 CA VAL A 81 6.808 -16.083 -3.873 1.00 0.00 C ATOM 1230 C VAL A 81 5.642 -15.679 -4.775 1.00 0.00 C ATOM 1231 O VAL A 81 5.848 -15.102 -5.843 1.00 0.00 O ATOM 1232 CB VAL A 81 7.271 -14.856 -3.066 1.00 0.00 C ATOM 1233 CG1 VAL A 81 7.725 -13.738 -3.994 1.00 0.00 C ATOM 1234 CG2 VAL A 81 6.164 -14.374 -2.139 1.00 0.00 C ATOM 0 H VAL A 81 8.490 -15.958 -5.109 1.00 0.00 H new ATOM 0 HA VAL A 81 6.473 -16.858 -3.184 1.00 0.00 H new ATOM 0 HB VAL A 81 8.123 -15.153 -2.454 1.00 0.00 H new ATOM 0 HG11 VAL A 81 8.047 -12.882 -3.402 1.00 0.00 H new ATOM 0 HG12 VAL A 81 8.555 -14.089 -4.607 1.00 0.00 H new ATOM 0 HG13 VAL A 81 6.898 -13.442 -4.639 1.00 0.00 H new ATOM 0 HG21 VAL A 81 6.511 -13.506 -1.578 1.00 0.00 H new ATOM 0 HG22 VAL A 81 5.290 -14.098 -2.729 1.00 0.00 H new ATOM 0 HG23 VAL A 81 5.897 -15.172 -1.446 1.00 0.00 H new ATOM 1244 N PRO A 82 4.397 -15.972 -4.357 1.00 0.00 N ATOM 1245 CA PRO A 82 3.201 -15.629 -5.134 1.00 0.00 C ATOM 1246 C PRO A 82 3.127 -14.139 -5.453 1.00 0.00 C ATOM 1247 O PRO A 82 4.114 -13.416 -5.318 1.00 0.00 O ATOM 1248 CB PRO A 82 2.036 -16.042 -4.222 1.00 0.00 C ATOM 1249 CG PRO A 82 2.636 -16.219 -2.868 1.00 0.00 C ATOM 1250 CD PRO A 82 4.052 -16.654 -3.100 1.00 0.00 C ATOM 0 HA PRO A 82 3.192 -16.131 -6.102 1.00 0.00 H new ATOM 0 HB2 PRO A 82 1.257 -15.279 -4.210 1.00 0.00 H new ATOM 0 HB3 PRO A 82 1.573 -16.965 -4.570 1.00 0.00 H new ATOM 0 HG2 PRO A 82 2.601 -15.289 -2.301 1.00 0.00 H new ATOM 0 HG3 PRO A 82 2.088 -16.965 -2.292 1.00 0.00 H new ATOM 0 HD2 PRO A 82 4.707 -16.353 -2.283 1.00 0.00 H new ATOM 0 HD3 PRO A 82 4.133 -17.737 -3.191 1.00 0.00 H new ATOM 1258 N LYS A 83 1.953 -13.686 -5.880 1.00 0.00 N ATOM 1259 CA LYS A 83 1.754 -12.281 -6.222 1.00 0.00 C ATOM 1260 C LYS A 83 1.269 -11.481 -5.012 1.00 0.00 C ATOM 1261 O LYS A 83 0.186 -11.735 -4.486 1.00 0.00 O ATOM 1262 CB LYS A 83 0.744 -12.155 -7.365 1.00 0.00 C ATOM 1263 CG LYS A 83 1.292 -12.598 -8.711 1.00 0.00 C ATOM 1264 CD LYS A 83 1.114 -14.093 -8.921 1.00 0.00 C ATOM 1265 CE LYS A 83 -0.127 -14.395 -9.744 1.00 0.00 C ATOM 1266 NZ LYS A 83 -0.224 -15.840 -10.093 1.00 0.00 N ATOM 0 H LYS A 83 1.125 -14.270 -5.998 1.00 0.00 H new ATOM 0 HA LYS A 83 2.714 -11.873 -6.540 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -0.138 -12.750 -7.127 1.00 0.00 H new ATOM 0 HB3 LYS A 83 0.418 -11.117 -7.438 1.00 0.00 H new ATOM 0 HG2 LYS A 83 0.785 -12.055 -9.508 1.00 0.00 H new ATOM 0 HG3 LYS A 83 2.350 -12.344 -8.776 1.00 0.00 H new ATOM 0 HD2 LYS A 83 1.993 -14.498 -9.423 1.00 0.00 H new ATOM 0 HD3 LYS A 83 1.041 -14.591 -7.954 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -1.014 -14.096 -9.186 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -0.110 -13.801 -10.658 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -1.084 -16.005 -10.654 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 0.610 -16.120 -10.647 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -0.266 -16.406 -9.221 1.00 0.00 H new ATOM 1280 N PRO A 84 2.066 -10.496 -4.553 1.00 0.00 N ATOM 1281 CA PRO A 84 1.707 -9.660 -3.402 1.00 0.00 C ATOM 1282 C PRO A 84 0.401 -8.905 -3.616 1.00 0.00 C ATOM 1283 O PRO A 84 -0.024 -8.686 -4.750 1.00 0.00 O ATOM 1284 CB PRO A 84 2.871 -8.673 -3.281 1.00 0.00 C ATOM 1285 CG PRO A 84 4.000 -9.311 -4.015 1.00 0.00 C ATOM 1286 CD PRO A 84 3.375 -10.119 -5.116 1.00 0.00 C ATOM 0 HA PRO A 84 1.551 -10.263 -2.508 1.00 0.00 H new ATOM 0 HB2 PRO A 84 2.615 -7.707 -3.715 1.00 0.00 H new ATOM 0 HB3 PRO A 84 3.130 -8.495 -2.237 1.00 0.00 H new ATOM 0 HG2 PRO A 84 4.677 -8.559 -4.419 1.00 0.00 H new ATOM 0 HG3 PRO A 84 4.588 -9.945 -3.351 1.00 0.00 H new ATOM 0 HD2 PRO A 84 3.267 -9.537 -6.032 1.00 0.00 H new ATOM 0 HD3 PRO A 84 3.975 -10.995 -5.363 1.00 0.00 H new ATOM 1294 N GLN A 85 -0.229 -8.509 -2.516 1.00 0.00 N ATOM 1295 CA GLN A 85 -1.479 -7.781 -2.570 1.00 0.00 C ATOM 1296 C GLN A 85 -1.294 -6.335 -2.120 1.00 0.00 C ATOM 1297 O GLN A 85 -1.004 -6.068 -0.955 1.00 0.00 O ATOM 1298 CB GLN A 85 -2.537 -8.466 -1.705 1.00 0.00 C ATOM 1299 CG GLN A 85 -2.586 -9.975 -1.883 1.00 0.00 C ATOM 1300 CD GLN A 85 -3.884 -10.579 -1.385 1.00 0.00 C ATOM 1301 OE1 GLN A 85 -4.969 -10.082 -1.687 1.00 0.00 O ATOM 1302 NE2 GLN A 85 -3.779 -11.658 -0.618 1.00 0.00 N ATOM 0 H GLN A 85 0.114 -8.685 -1.571 1.00 0.00 H new ATOM 0 HA GLN A 85 -1.817 -7.777 -3.606 1.00 0.00 H new ATOM 0 HB2 GLN A 85 -2.340 -8.238 -0.657 1.00 0.00 H new ATOM 0 HB3 GLN A 85 -3.515 -8.049 -1.944 1.00 0.00 H new ATOM 0 HG2 GLN A 85 -2.458 -10.217 -2.938 1.00 0.00 H new ATOM 0 HG3 GLN A 85 -1.751 -10.427 -1.349 1.00 0.00 H new ATOM 0 HE21 GLN A 85 -2.859 -12.036 -0.393 1.00 0.00 H new ATOM 0 HE22 GLN A 85 -4.619 -12.109 -0.254 1.00 0.00 H new ATOM 1311 N ARG A 86 -1.468 -5.406 -3.052 1.00 0.00 N ATOM 1312 CA ARG A 86 -1.322 -3.986 -2.754 1.00 0.00 C ATOM 1313 C ARG A 86 -2.626 -3.243 -3.038 1.00 0.00 C ATOM 1314 O ARG A 86 -3.384 -3.615 -3.934 1.00 0.00 O ATOM 1315 CB ARG A 86 -0.156 -3.399 -3.567 1.00 0.00 C ATOM 1316 CG ARG A 86 -0.305 -1.930 -3.937 1.00 0.00 C ATOM 1317 CD ARG A 86 -0.879 -1.767 -5.336 1.00 0.00 C ATOM 1318 NE ARG A 86 -2.321 -1.531 -5.314 1.00 0.00 N ATOM 1319 CZ ARG A 86 -3.120 -1.729 -6.360 1.00 0.00 C ATOM 1320 NH1 ARG A 86 -2.624 -2.161 -7.512 1.00 0.00 N ATOM 1321 NH2 ARG A 86 -4.421 -1.494 -6.253 1.00 0.00 N ATOM 0 H ARG A 86 -1.711 -5.610 -4.021 1.00 0.00 H new ATOM 0 HA ARG A 86 -1.096 -3.864 -1.695 1.00 0.00 H new ATOM 0 HB2 ARG A 86 0.764 -3.523 -2.996 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -0.043 -3.979 -4.483 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -0.955 -1.435 -3.215 1.00 0.00 H new ATOM 0 HG3 ARG A 86 0.666 -1.438 -3.881 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -0.383 -0.935 -5.836 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -0.667 -2.662 -5.921 1.00 0.00 H new ATOM 0 HE ARG A 86 -2.740 -1.195 -4.447 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -1.624 -2.344 -7.600 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -3.242 -2.311 -8.309 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -4.808 -1.162 -5.370 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -5.034 -1.645 -7.054 1.00 0.00 H new ATOM 1335 N HIS A 87 -2.880 -2.193 -2.264 1.00 0.00 N ATOM 1336 CA HIS A 87 -4.093 -1.397 -2.423 1.00 0.00 C ATOM 1337 C HIS A 87 -3.754 0.077 -2.619 1.00 0.00 C ATOM 1338 O HIS A 87 -2.864 0.611 -1.958 1.00 0.00 O ATOM 1339 CB HIS A 87 -5.004 -1.562 -1.204 1.00 0.00 C ATOM 1340 CG HIS A 87 -5.107 -2.975 -0.717 1.00 0.00 C ATOM 1341 ND1 HIS A 87 -6.166 -3.803 -1.025 1.00 0.00 N ATOM 1342 CD2 HIS A 87 -4.274 -3.706 0.061 1.00 0.00 C ATOM 1343 CE1 HIS A 87 -5.981 -4.981 -0.456 1.00 0.00 C ATOM 1344 NE2 HIS A 87 -4.840 -4.948 0.207 1.00 0.00 N ATOM 0 H HIS A 87 -2.261 -1.873 -1.519 1.00 0.00 H new ATOM 0 HA HIS A 87 -4.616 -1.755 -3.310 1.00 0.00 H new ATOM 0 HB2 HIS A 87 -4.631 -0.934 -0.395 1.00 0.00 H new ATOM 0 HB3 HIS A 87 -6.001 -1.200 -1.455 1.00 0.00 H new ATOM 0 HD2 HIS A 87 -3.339 -3.374 0.487 1.00 0.00 H new ATOM 0 HE1 HIS A 87 -6.649 -5.827 -0.522 1.00 0.00 H new ATOM 0 HE2 HIS A 87 -4.443 -5.721 0.742 1.00 0.00 H new ATOM 1353 N MET A 88 -4.466 0.727 -3.534 1.00 0.00 N ATOM 1354 CA MET A 88 -4.236 2.139 -3.818 1.00 0.00 C ATOM 1355 C MET A 88 -5.528 2.942 -3.681 1.00 0.00 C ATOM 1356 O MET A 88 -6.584 2.531 -4.161 1.00 0.00 O ATOM 1357 CB MET A 88 -3.632 2.297 -5.225 1.00 0.00 C ATOM 1358 CG MET A 88 -4.210 3.444 -6.054 1.00 0.00 C ATOM 1359 SD MET A 88 -5.648 2.950 -7.029 1.00 0.00 S ATOM 1360 CE MET A 88 -5.577 4.129 -8.381 1.00 0.00 C ATOM 0 H MET A 88 -5.206 0.299 -4.091 1.00 0.00 H new ATOM 0 HA MET A 88 -3.528 2.533 -3.089 1.00 0.00 H new ATOM 0 HB2 MET A 88 -2.557 2.446 -5.127 1.00 0.00 H new ATOM 0 HB3 MET A 88 -3.776 1.365 -5.772 1.00 0.00 H new ATOM 0 HG2 MET A 88 -4.491 4.261 -5.389 1.00 0.00 H new ATOM 0 HG3 MET A 88 -3.439 3.828 -6.722 1.00 0.00 H new ATOM 0 HE1 MET A 88 -6.533 4.647 -8.463 1.00 0.00 H new ATOM 0 HE2 MET A 88 -4.786 4.855 -8.190 1.00 0.00 H new ATOM 0 HE3 MET A 88 -5.369 3.602 -9.312 1.00 0.00 H new ATOM 1370 N PHE A 89 -5.424 4.093 -3.028 1.00 0.00 N ATOM 1371 CA PHE A 89 -6.569 4.971 -2.828 1.00 0.00 C ATOM 1372 C PHE A 89 -6.110 6.426 -2.757 1.00 0.00 C ATOM 1373 O PHE A 89 -5.057 6.727 -2.194 1.00 0.00 O ATOM 1374 CB PHE A 89 -7.342 4.571 -1.566 1.00 0.00 C ATOM 1375 CG PHE A 89 -6.583 4.751 -0.283 1.00 0.00 C ATOM 1376 CD1 PHE A 89 -5.343 4.161 -0.095 1.00 0.00 C ATOM 1377 CD2 PHE A 89 -7.125 5.505 0.744 1.00 0.00 C ATOM 1378 CE1 PHE A 89 -4.657 4.324 1.094 1.00 0.00 C ATOM 1379 CE2 PHE A 89 -6.447 5.671 1.934 1.00 0.00 C ATOM 1380 CZ PHE A 89 -5.210 5.079 2.110 1.00 0.00 C ATOM 0 H PHE A 89 -4.553 4.441 -2.626 1.00 0.00 H new ATOM 0 HA PHE A 89 -7.244 4.868 -3.677 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -8.258 5.159 -1.516 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -7.638 3.526 -1.654 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -4.908 3.568 -0.886 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -8.091 5.969 0.612 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -3.690 3.862 1.228 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -6.882 6.262 2.726 1.00 0.00 H new ATOM 0 HZ PHE A 89 -4.677 5.207 3.041 1.00 0.00 H new ATOM 1390 N SER A 90 -6.891 7.320 -3.355 1.00 0.00 N ATOM 1391 CA SER A 90 -6.547 8.739 -3.385 1.00 0.00 C ATOM 1392 C SER A 90 -7.166 9.499 -2.219 1.00 0.00 C ATOM 1393 O SER A 90 -8.291 9.225 -1.812 1.00 0.00 O ATOM 1394 CB SER A 90 -7.003 9.362 -4.706 1.00 0.00 C ATOM 1395 OG SER A 90 -6.676 8.528 -5.804 1.00 0.00 O ATOM 0 H SER A 90 -7.766 7.088 -3.825 1.00 0.00 H new ATOM 0 HA SER A 90 -5.463 8.815 -3.296 1.00 0.00 H new ATOM 0 HB2 SER A 90 -8.080 9.529 -4.680 1.00 0.00 H new ATOM 0 HB3 SER A 90 -6.532 10.337 -4.833 1.00 0.00 H new ATOM 0 HG SER A 90 -6.980 8.948 -6.636 1.00 0.00 H new ATOM 1401 N PHE A 91 -6.422 10.467 -1.693 1.00 0.00 N ATOM 1402 CA PHE A 91 -6.896 11.280 -0.581 1.00 0.00 C ATOM 1403 C PHE A 91 -7.418 12.621 -1.085 1.00 0.00 C ATOM 1404 O PHE A 91 -7.254 12.958 -2.258 1.00 0.00 O ATOM 1405 CB PHE A 91 -5.772 11.508 0.432 1.00 0.00 C ATOM 1406 CG PHE A 91 -5.420 10.283 1.227 1.00 0.00 C ATOM 1407 CD1 PHE A 91 -5.022 9.119 0.591 1.00 0.00 C ATOM 1408 CD2 PHE A 91 -5.484 10.299 2.610 1.00 0.00 C ATOM 1409 CE1 PHE A 91 -4.695 7.992 1.321 1.00 0.00 C ATOM 1410 CE2 PHE A 91 -5.158 9.175 3.345 1.00 0.00 C ATOM 1411 CZ PHE A 91 -4.762 8.021 2.700 1.00 0.00 C ATOM 0 H PHE A 91 -5.486 10.707 -2.021 1.00 0.00 H new ATOM 0 HA PHE A 91 -7.710 10.746 -0.091 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -4.884 11.856 -0.096 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -6.067 12.303 1.117 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -4.967 9.092 -0.487 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -5.792 11.200 3.120 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -4.387 7.090 0.814 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -5.213 9.200 4.423 1.00 0.00 H new ATOM 0 HZ PHE A 91 -4.505 7.142 3.273 1.00 0.00 H new ATOM 1421 N ASN A 92 -8.049 13.382 -0.198 1.00 0.00 N ATOM 1422 CA ASN A 92 -8.594 14.683 -0.566 1.00 0.00 C ATOM 1423 C ASN A 92 -8.068 15.780 0.356 1.00 0.00 C ATOM 1424 O ASN A 92 -8.758 16.765 0.620 1.00 0.00 O ATOM 1425 CB ASN A 92 -10.123 14.648 -0.523 1.00 0.00 C ATOM 1426 CG ASN A 92 -10.720 13.953 -1.733 1.00 0.00 C ATOM 1427 OD1 ASN A 92 -10.853 14.548 -2.802 1.00 0.00 O ATOM 1428 ND2 ASN A 92 -11.084 12.685 -1.569 1.00 0.00 N ATOM 0 H ASN A 92 -8.195 13.122 0.777 1.00 0.00 H new ATOM 0 HA ASN A 92 -8.271 14.909 -1.582 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -10.447 14.136 0.383 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -10.506 15.667 -0.467 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -11.492 12.167 -2.347 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -10.956 12.230 -0.665 1.00 0.00 H new ATOM 1435 N ASN A 93 -6.841 15.606 0.839 1.00 0.00 N ATOM 1436 CA ASN A 93 -6.220 16.584 1.727 1.00 0.00 C ATOM 1437 C ASN A 93 -4.815 16.142 2.125 1.00 0.00 C ATOM 1438 O ASN A 93 -4.562 14.956 2.336 1.00 0.00 O ATOM 1439 CB ASN A 93 -7.079 16.792 2.977 1.00 0.00 C ATOM 1440 CG ASN A 93 -7.324 18.259 3.271 1.00 0.00 C ATOM 1441 OD1 ASN A 93 -7.384 19.085 2.360 1.00 0.00 O ATOM 1442 ND2 ASN A 93 -7.468 18.591 4.548 1.00 0.00 N ATOM 0 H ASN A 93 -6.257 14.796 0.630 1.00 0.00 H new ATOM 0 HA ASN A 93 -6.145 17.529 1.189 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -8.035 16.286 2.846 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -6.588 16.329 3.833 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -7.636 19.563 4.806 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -7.411 17.874 5.271 1.00 0.00 H new ATOM 1449 N ARG A 94 -3.903 17.105 2.222 1.00 0.00 N ATOM 1450 CA ARG A 94 -2.521 16.817 2.592 1.00 0.00 C ATOM 1451 C ARG A 94 -2.429 16.314 4.029 1.00 0.00 C ATOM 1452 O ARG A 94 -1.586 15.477 4.350 1.00 0.00 O ATOM 1453 CB ARG A 94 -1.656 18.068 2.421 1.00 0.00 C ATOM 1454 CG ARG A 94 -1.290 18.362 0.976 1.00 0.00 C ATOM 1455 CD ARG A 94 -0.092 19.293 0.883 1.00 0.00 C ATOM 1456 NE ARG A 94 -0.493 20.680 0.656 1.00 0.00 N ATOM 1457 CZ ARG A 94 0.324 21.622 0.190 1.00 0.00 C ATOM 1458 NH1 ARG A 94 1.587 21.331 -0.100 1.00 0.00 N ATOM 1459 NH2 ARG A 94 -0.122 22.857 0.012 1.00 0.00 N ATOM 0 H ARG A 94 -4.096 18.092 2.050 1.00 0.00 H new ATOM 0 HA ARG A 94 -2.153 16.032 1.931 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -2.187 18.926 2.834 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -0.741 17.949 3.002 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -1.068 17.429 0.459 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -2.143 18.813 0.468 1.00 0.00 H new ATOM 0 HD2 ARG A 94 0.489 19.229 1.803 1.00 0.00 H new ATOM 0 HD3 ARG A 94 0.559 18.966 0.072 1.00 0.00 H new ATOM 0 HE ARG A 94 -1.456 20.942 0.867 1.00 0.00 H new ATOM 0 HH11 ARG A 94 1.935 20.382 0.034 1.00 0.00 H new ATOM 0 HH12 ARG A 94 2.209 22.057 -0.457 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -1.091 23.086 0.232 1.00 0.00 H new ATOM 0 HH22 ARG A 94 0.504 23.579 -0.345 1.00 0.00 H new ATOM 1473 N THR A 95 -3.296 16.833 4.892 1.00 0.00 N ATOM 1474 CA THR A 95 -3.306 16.438 6.293 1.00 0.00 C ATOM 1475 C THR A 95 -3.889 15.041 6.465 1.00 0.00 C ATOM 1476 O THR A 95 -3.441 14.273 7.316 1.00 0.00 O ATOM 1477 CB THR A 95 -4.103 17.444 7.125 1.00 0.00 C ATOM 1478 OG1 THR A 95 -3.804 18.770 6.729 1.00 0.00 O ATOM 1479 CG2 THR A 95 -3.835 17.337 8.611 1.00 0.00 C ATOM 0 H THR A 95 -4.000 17.528 4.644 1.00 0.00 H new ATOM 0 HA THR A 95 -2.274 16.424 6.645 1.00 0.00 H new ATOM 0 HB THR A 95 -5.151 17.204 6.943 1.00 0.00 H new ATOM 0 HG1 THR A 95 -4.325 19.399 7.271 1.00 0.00 H new ATOM 0 HG21 THR A 95 -4.432 18.078 9.143 1.00 0.00 H new ATOM 0 HG22 THR A 95 -4.103 16.339 8.958 1.00 0.00 H new ATOM 0 HG23 THR A 95 -2.777 17.517 8.804 1.00 0.00 H new ATOM 1487 N VAL A 96 -4.889 14.713 5.654 1.00 0.00 N ATOM 1488 CA VAL A 96 -5.522 13.403 5.724 1.00 0.00 C ATOM 1489 C VAL A 96 -4.510 12.300 5.439 1.00 0.00 C ATOM 1490 O VAL A 96 -4.399 11.334 6.194 1.00 0.00 O ATOM 1491 CB VAL A 96 -6.691 13.286 4.729 1.00 0.00 C ATOM 1492 CG1 VAL A 96 -7.385 11.940 4.872 1.00 0.00 C ATOM 1493 CG2 VAL A 96 -7.682 14.421 4.933 1.00 0.00 C ATOM 0 H VAL A 96 -5.277 15.334 4.944 1.00 0.00 H new ATOM 0 HA VAL A 96 -5.912 13.289 6.736 1.00 0.00 H new ATOM 0 HB VAL A 96 -6.288 13.358 3.719 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -8.208 11.878 4.160 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -6.672 11.140 4.673 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -7.773 11.837 5.885 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -8.501 14.321 4.221 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -8.077 14.381 5.948 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -7.179 15.375 4.777 1.00 0.00 H new ATOM 1503 N MET A 97 -3.773 12.452 4.345 1.00 0.00 N ATOM 1504 CA MET A 97 -2.768 11.470 3.963 1.00 0.00 C ATOM 1505 C MET A 97 -1.597 11.490 4.936 1.00 0.00 C ATOM 1506 O MET A 97 -1.074 10.443 5.312 1.00 0.00 O ATOM 1507 CB MET A 97 -2.273 11.734 2.539 1.00 0.00 C ATOM 1508 CG MET A 97 -1.681 13.121 2.346 1.00 0.00 C ATOM 1509 SD MET A 97 0.096 13.166 2.648 1.00 0.00 S ATOM 1510 CE MET A 97 0.685 12.051 1.376 1.00 0.00 C ATOM 0 H MET A 97 -3.853 13.245 3.708 1.00 0.00 H new ATOM 0 HA MET A 97 -3.230 10.483 3.996 1.00 0.00 H new ATOM 0 HB2 MET A 97 -1.521 10.988 2.281 1.00 0.00 H new ATOM 0 HB3 MET A 97 -3.103 11.603 1.845 1.00 0.00 H new ATOM 0 HG2 MET A 97 -1.881 13.459 1.329 1.00 0.00 H new ATOM 0 HG3 MET A 97 -2.178 13.821 3.018 1.00 0.00 H new ATOM 0 HE1 MET A 97 1.687 12.349 1.066 1.00 0.00 H new ATOM 0 HE2 MET A 97 0.714 11.034 1.768 1.00 0.00 H new ATOM 0 HE3 MET A 97 0.013 12.090 0.518 1.00 0.00 H new ATOM 1520 N ASP A 98 -1.192 12.688 5.344 1.00 0.00 N ATOM 1521 CA ASP A 98 -0.081 12.840 6.276 1.00 0.00 C ATOM 1522 C ASP A 98 -0.442 12.297 7.652 1.00 0.00 C ATOM 1523 O ASP A 98 0.366 11.621 8.288 1.00 0.00 O ATOM 1524 CB ASP A 98 0.326 14.310 6.384 1.00 0.00 C ATOM 1525 CG ASP A 98 1.294 14.724 5.293 1.00 0.00 C ATOM 1526 OD1 ASP A 98 2.206 13.932 4.977 1.00 0.00 O ATOM 1527 OD2 ASP A 98 1.140 15.841 4.755 1.00 0.00 O ATOM 0 H ASP A 98 -1.616 13.566 5.045 1.00 0.00 H new ATOM 0 HA ASP A 98 0.761 12.265 5.891 1.00 0.00 H new ATOM 0 HB2 ASP A 98 -0.565 14.936 6.332 1.00 0.00 H new ATOM 0 HB3 ASP A 98 0.783 14.487 7.358 1.00 0.00 H new ATOM 1532 N ASN A 99 -1.654 12.594 8.113 1.00 0.00 N ATOM 1533 CA ASN A 99 -2.097 12.126 9.421 1.00 0.00 C ATOM 1534 C ASN A 99 -2.011 10.606 9.509 1.00 0.00 C ATOM 1535 O ASN A 99 -1.434 10.062 10.450 1.00 0.00 O ATOM 1536 CB ASN A 99 -3.531 12.586 9.693 1.00 0.00 C ATOM 1537 CG ASN A 99 -3.585 13.942 10.367 1.00 0.00 C ATOM 1538 OD1 ASN A 99 -2.565 14.468 10.813 1.00 0.00 O ATOM 1539 ND2 ASN A 99 -4.780 14.517 10.446 1.00 0.00 N ATOM 0 H ASN A 99 -2.341 13.151 7.605 1.00 0.00 H new ATOM 0 HA ASN A 99 -1.438 12.554 10.176 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -4.080 12.629 8.753 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -4.032 11.850 10.322 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -4.878 15.430 10.890 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -5.599 14.045 10.063 1.00 0.00 H new ATOM 1546 N ILE A 100 -2.569 9.921 8.515 1.00 0.00 N ATOM 1547 CA ILE A 100 -2.522 8.469 8.486 1.00 0.00 C ATOM 1548 C ILE A 100 -1.137 7.981 8.078 1.00 0.00 C ATOM 1549 O ILE A 100 -0.638 6.996 8.614 1.00 0.00 O ATOM 1550 CB ILE A 100 -3.584 7.865 7.546 1.00 0.00 C ATOM 1551 CG1 ILE A 100 -4.975 8.011 8.166 1.00 0.00 C ATOM 1552 CG2 ILE A 100 -3.270 6.406 7.244 1.00 0.00 C ATOM 1553 CD1 ILE A 100 -6.070 7.377 7.342 1.00 0.00 C ATOM 0 H ILE A 100 -3.055 10.347 7.726 1.00 0.00 H new ATOM 0 HA ILE A 100 -2.743 8.130 9.498 1.00 0.00 H new ATOM 0 HB ILE A 100 -3.568 8.409 6.602 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -4.971 7.561 9.159 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -5.197 9.070 8.297 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -4.032 6.000 6.579 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -2.294 6.336 6.763 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -3.258 5.836 8.173 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -7.029 7.518 7.841 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -6.101 7.843 6.357 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -5.872 6.311 7.232 1.00 0.00 H new ATOM 1565 N LYS A 101 -0.517 8.676 7.123 1.00 0.00 N ATOM 1566 CA LYS A 101 0.811 8.294 6.657 1.00 0.00 C ATOM 1567 C LYS A 101 1.760 8.199 7.835 1.00 0.00 C ATOM 1568 O LYS A 101 2.443 7.195 8.018 1.00 0.00 O ATOM 1569 CB LYS A 101 1.340 9.299 5.627 1.00 0.00 C ATOM 1570 CG LYS A 101 2.776 9.036 5.194 1.00 0.00 C ATOM 1571 CD LYS A 101 3.637 10.283 5.325 1.00 0.00 C ATOM 1572 CE LYS A 101 5.053 9.938 5.760 1.00 0.00 C ATOM 1573 NZ LYS A 101 6.062 10.824 5.117 1.00 0.00 N ATOM 0 H LYS A 101 -0.910 9.497 6.663 1.00 0.00 H new ATOM 0 HA LYS A 101 0.742 7.320 6.173 1.00 0.00 H new ATOM 0 HB2 LYS A 101 0.696 9.278 4.748 1.00 0.00 H new ATOM 0 HB3 LYS A 101 1.275 10.303 6.046 1.00 0.00 H new ATOM 0 HG2 LYS A 101 3.199 8.236 5.801 1.00 0.00 H new ATOM 0 HG3 LYS A 101 2.788 8.692 4.160 1.00 0.00 H new ATOM 0 HD2 LYS A 101 3.666 10.809 4.370 1.00 0.00 H new ATOM 0 HD3 LYS A 101 3.188 10.962 6.049 1.00 0.00 H new ATOM 0 HE2 LYS A 101 5.131 10.025 6.844 1.00 0.00 H new ATOM 0 HE3 LYS A 101 5.268 8.900 5.507 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 7.014 10.557 5.439 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 6.005 10.722 4.084 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 5.873 11.813 5.379 1.00 0.00 H new ATOM 1587 N MET A 102 1.767 9.243 8.644 1.00 0.00 N ATOM 1588 CA MET A 102 2.607 9.275 9.834 1.00 0.00 C ATOM 1589 C MET A 102 2.236 8.121 10.756 1.00 0.00 C ATOM 1590 O MET A 102 3.087 7.548 11.435 1.00 0.00 O ATOM 1591 CB MET A 102 2.455 10.609 10.567 1.00 0.00 C ATOM 1592 CG MET A 102 1.084 10.831 11.186 1.00 0.00 C ATOM 1593 SD MET A 102 1.123 12.011 12.549 1.00 0.00 S ATOM 1594 CE MET A 102 0.817 10.929 13.943 1.00 0.00 C ATOM 0 H MET A 102 1.202 10.080 8.502 1.00 0.00 H new ATOM 0 HA MET A 102 3.649 9.170 9.531 1.00 0.00 H new ATOM 0 HB2 MET A 102 3.209 10.666 11.352 1.00 0.00 H new ATOM 0 HB3 MET A 102 2.661 11.420 9.868 1.00 0.00 H new ATOM 0 HG2 MET A 102 0.397 11.189 10.419 1.00 0.00 H new ATOM 0 HG3 MET A 102 0.693 9.879 11.545 1.00 0.00 H new ATOM 0 HE1 MET A 102 0.811 11.514 14.863 1.00 0.00 H new ATOM 0 HE2 MET A 102 -0.149 10.439 13.818 1.00 0.00 H new ATOM 0 HE3 MET A 102 1.602 10.175 13.997 1.00 0.00 H new ATOM 1604 N THR A 103 0.951 7.785 10.758 1.00 0.00 N ATOM 1605 CA THR A 103 0.439 6.701 11.570 1.00 0.00 C ATOM 1606 C THR A 103 0.926 5.363 11.025 1.00 0.00 C ATOM 1607 O THR A 103 1.503 4.557 11.751 1.00 0.00 O ATOM 1608 CB THR A 103 -1.096 6.750 11.574 1.00 0.00 C ATOM 1609 OG1 THR A 103 -1.575 7.456 12.703 1.00 0.00 O ATOM 1610 CG2 THR A 103 -1.751 5.391 11.574 1.00 0.00 C ATOM 0 H THR A 103 0.242 8.258 10.197 1.00 0.00 H new ATOM 0 HA THR A 103 0.803 6.809 12.592 1.00 0.00 H new ATOM 0 HB THR A 103 -1.361 7.256 10.646 1.00 0.00 H new ATOM 0 HG1 THR A 103 -2.555 7.476 12.685 1.00 0.00 H new ATOM 0 HG21 THR A 103 -2.835 5.509 11.577 1.00 0.00 H new ATOM 0 HG22 THR A 103 -1.448 4.841 10.683 1.00 0.00 H new ATOM 0 HG23 THR A 103 -1.444 4.839 12.462 1.00 0.00 H new ATOM 1618 N LEU A 104 0.682 5.146 9.737 1.00 0.00 N ATOM 1619 CA LEU A 104 1.078 3.915 9.070 1.00 0.00 C ATOM 1620 C LEU A 104 2.586 3.748 9.070 1.00 0.00 C ATOM 1621 O LEU A 104 3.099 2.635 9.173 1.00 0.00 O ATOM 1622 CB LEU A 104 0.539 3.896 7.638 1.00 0.00 C ATOM 1623 CG LEU A 104 -0.735 3.068 7.438 1.00 0.00 C ATOM 1624 CD1 LEU A 104 -1.785 3.862 6.666 1.00 0.00 C ATOM 1625 CD2 LEU A 104 -0.410 1.764 6.722 1.00 0.00 C ATOM 0 H LEU A 104 0.207 5.815 9.131 1.00 0.00 H new ATOM 0 HA LEU A 104 0.651 3.078 9.622 1.00 0.00 H new ATOM 0 HB2 LEU A 104 0.341 4.922 7.326 1.00 0.00 H new ATOM 0 HB3 LEU A 104 1.315 3.507 6.979 1.00 0.00 H new ATOM 0 HG LEU A 104 -1.149 2.831 8.418 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -2.680 3.253 6.537 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -2.038 4.766 7.220 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -1.388 4.135 5.688 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -1.324 1.186 6.587 1.00 0.00 H new ATOM 0 HD22 LEU A 104 0.029 1.983 5.748 1.00 0.00 H new ATOM 0 HD23 LEU A 104 0.298 1.189 7.318 1.00 0.00 H new ATOM 1637 N GLN A 105 3.290 4.858 8.962 1.00 0.00 N ATOM 1638 CA GLN A 105 4.738 4.840 8.955 1.00 0.00 C ATOM 1639 C GLN A 105 5.271 4.262 10.263 1.00 0.00 C ATOM 1640 O GLN A 105 6.325 3.628 10.290 1.00 0.00 O ATOM 1641 CB GLN A 105 5.250 6.262 8.722 1.00 0.00 C ATOM 1642 CG GLN A 105 6.240 6.764 9.762 1.00 0.00 C ATOM 1643 CD GLN A 105 6.959 8.026 9.325 1.00 0.00 C ATOM 1644 OE1 GLN A 105 8.155 8.188 9.570 1.00 0.00 O ATOM 1645 NE2 GLN A 105 6.234 8.929 8.675 1.00 0.00 N ATOM 0 H GLN A 105 2.879 5.788 8.878 1.00 0.00 H new ATOM 0 HA GLN A 105 5.097 4.200 8.149 1.00 0.00 H new ATOM 0 HB2 GLN A 105 5.722 6.306 7.741 1.00 0.00 H new ATOM 0 HB3 GLN A 105 4.397 6.940 8.696 1.00 0.00 H new ATOM 0 HG2 GLN A 105 5.713 6.956 10.696 1.00 0.00 H new ATOM 0 HG3 GLN A 105 6.974 5.984 9.965 1.00 0.00 H new ATOM 0 HE21 GLN A 105 5.246 8.754 8.493 1.00 0.00 H new ATOM 0 HE22 GLN A 105 6.665 9.797 8.358 1.00 0.00 H new ATOM 1654 N GLN A 106 4.531 4.480 11.345 1.00 0.00 N ATOM 1655 CA GLN A 106 4.930 3.974 12.645 1.00 0.00 C ATOM 1656 C GLN A 106 4.618 2.493 12.756 1.00 0.00 C ATOM 1657 O GLN A 106 5.439 1.705 13.224 1.00 0.00 O ATOM 1658 CB GLN A 106 4.233 4.749 13.765 1.00 0.00 C ATOM 1659 CG GLN A 106 4.970 4.694 15.093 1.00 0.00 C ATOM 1660 CD GLN A 106 4.843 5.981 15.884 1.00 0.00 C ATOM 1661 OE1 GLN A 106 5.135 7.065 15.379 1.00 0.00 O ATOM 1662 NE2 GLN A 106 4.405 5.867 17.133 1.00 0.00 N ATOM 0 H GLN A 106 3.655 5.003 11.344 1.00 0.00 H new ATOM 0 HA GLN A 106 6.006 4.113 12.749 1.00 0.00 H new ATOM 0 HB2 GLN A 106 4.125 5.790 13.462 1.00 0.00 H new ATOM 0 HB3 GLN A 106 3.228 4.350 13.900 1.00 0.00 H new ATOM 0 HG2 GLN A 106 4.580 3.867 15.687 1.00 0.00 H new ATOM 0 HG3 GLN A 106 6.024 4.486 14.911 1.00 0.00 H new ATOM 0 HE21 GLN A 106 4.175 4.948 17.511 1.00 0.00 H new ATOM 0 HE22 GLN A 106 4.299 6.699 17.714 1.00 0.00 H new ATOM 1671 N ILE A 107 3.427 2.120 12.307 1.00 0.00 N ATOM 1672 CA ILE A 107 3.006 0.735 12.340 1.00 0.00 C ATOM 1673 C ILE A 107 3.867 -0.080 11.391 1.00 0.00 C ATOM 1674 O ILE A 107 4.416 -1.116 11.765 1.00 0.00 O ATOM 1675 CB ILE A 107 1.525 0.583 11.955 1.00 0.00 C ATOM 1676 CG1 ILE A 107 0.728 1.823 12.368 1.00 0.00 C ATOM 1677 CG2 ILE A 107 0.944 -0.668 12.601 1.00 0.00 C ATOM 1678 CD1 ILE A 107 -0.766 1.602 12.421 1.00 0.00 C ATOM 0 H ILE A 107 2.738 2.762 11.916 1.00 0.00 H new ATOM 0 HA ILE A 107 3.126 0.370 13.360 1.00 0.00 H new ATOM 0 HB ILE A 107 1.455 0.483 10.872 1.00 0.00 H new ATOM 0 HG12 ILE A 107 1.071 2.153 13.348 1.00 0.00 H new ATOM 0 HG13 ILE A 107 0.941 2.630 11.667 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -0.105 -0.767 12.323 1.00 0.00 H new ATOM 0 HG22 ILE A 107 1.495 -1.544 12.258 1.00 0.00 H new ATOM 0 HG23 ILE A 107 1.026 -0.589 13.685 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -1.260 2.526 12.721 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -1.125 1.302 11.436 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -0.992 0.818 13.144 1.00 0.00 H new ATOM 1690 N ILE A 108 4.016 0.418 10.165 1.00 0.00 N ATOM 1691 CA ILE A 108 4.851 -0.244 9.173 1.00 0.00 C ATOM 1692 C ILE A 108 6.232 -0.465 9.760 1.00 0.00 C ATOM 1693 O ILE A 108 6.869 -1.496 9.540 1.00 0.00 O ATOM 1694 CB ILE A 108 4.944 0.586 7.872 1.00 0.00 C ATOM 1695 CG1 ILE A 108 4.937 -0.335 6.652 1.00 0.00 C ATOM 1696 CG2 ILE A 108 6.178 1.479 7.862 1.00 0.00 C ATOM 1697 CD1 ILE A 108 3.548 -0.684 6.168 1.00 0.00 C ATOM 0 H ILE A 108 3.570 1.275 9.838 1.00 0.00 H new ATOM 0 HA ILE A 108 4.401 -1.203 8.916 1.00 0.00 H new ATOM 0 HB ILE A 108 4.069 1.235 7.829 1.00 0.00 H new ATOM 0 HG12 ILE A 108 5.486 0.145 5.841 1.00 0.00 H new ATOM 0 HG13 ILE A 108 5.469 -1.254 6.897 1.00 0.00 H new ATOM 0 HG21 ILE A 108 6.209 2.047 6.932 1.00 0.00 H new ATOM 0 HG22 ILE A 108 6.136 2.167 8.706 1.00 0.00 H new ATOM 0 HG23 ILE A 108 7.074 0.863 7.941 1.00 0.00 H new ATOM 0 HD11 ILE A 108 3.619 -1.340 5.300 1.00 0.00 H new ATOM 0 HD12 ILE A 108 3.003 -1.192 6.963 1.00 0.00 H new ATOM 0 HD13 ILE A 108 3.019 0.228 5.891 1.00 0.00 H new ATOM 1709 N SER A 109 6.664 0.514 10.541 1.00 0.00 N ATOM 1710 CA SER A 109 7.950 0.447 11.212 1.00 0.00 C ATOM 1711 C SER A 109 7.905 -0.634 12.284 1.00 0.00 C ATOM 1712 O SER A 109 8.887 -1.340 12.514 1.00 0.00 O ATOM 1713 CB SER A 109 8.302 1.798 11.837 1.00 0.00 C ATOM 1714 OG SER A 109 8.986 2.626 10.912 1.00 0.00 O ATOM 0 H SER A 109 6.138 1.368 10.725 1.00 0.00 H new ATOM 0 HA SER A 109 8.720 0.200 10.481 1.00 0.00 H new ATOM 0 HB2 SER A 109 7.392 2.296 12.171 1.00 0.00 H new ATOM 0 HB3 SER A 109 8.923 1.643 12.719 1.00 0.00 H new ATOM 0 HG SER A 109 8.342 3.201 10.449 1.00 0.00 H new ATOM 1720 N ARG A 110 6.746 -0.764 12.931 1.00 0.00 N ATOM 1721 CA ARG A 110 6.562 -1.767 13.972 1.00 0.00 C ATOM 1722 C ARG A 110 6.636 -3.170 13.380 1.00 0.00 C ATOM 1723 O ARG A 110 7.315 -4.046 13.916 1.00 0.00 O ATOM 1724 CB ARG A 110 5.212 -1.577 14.669 1.00 0.00 C ATOM 1725 CG ARG A 110 5.083 -0.257 15.410 1.00 0.00 C ATOM 1726 CD ARG A 110 4.323 -0.427 16.716 1.00 0.00 C ATOM 1727 NE ARG A 110 5.183 -0.921 17.789 1.00 0.00 N ATOM 1728 CZ ARG A 110 4.844 -0.909 19.076 1.00 0.00 C ATOM 1729 NH1 ARG A 110 3.666 -0.429 19.454 1.00 0.00 N ATOM 1730 NH2 ARG A 110 5.685 -1.379 19.987 1.00 0.00 N ATOM 0 H ARG A 110 5.924 -0.187 12.751 1.00 0.00 H new ATOM 0 HA ARG A 110 7.361 -1.645 14.704 1.00 0.00 H new ATOM 0 HB2 ARG A 110 4.418 -1.644 13.926 1.00 0.00 H new ATOM 0 HB3 ARG A 110 5.060 -2.395 15.374 1.00 0.00 H new ATOM 0 HG2 ARG A 110 6.075 0.146 15.614 1.00 0.00 H new ATOM 0 HG3 ARG A 110 4.568 0.468 14.779 1.00 0.00 H new ATOM 0 HD2 ARG A 110 3.889 0.529 17.010 1.00 0.00 H new ATOM 0 HD3 ARG A 110 3.495 -1.120 16.566 1.00 0.00 H new ATOM 0 HE ARG A 110 6.097 -1.297 17.537 1.00 0.00 H new ATOM 0 HH11 ARG A 110 3.015 -0.067 18.757 1.00 0.00 H new ATOM 0 HH12 ARG A 110 3.411 -0.422 20.442 1.00 0.00 H new ATOM 0 HH21 ARG A 110 6.591 -1.750 19.701 1.00 0.00 H new ATOM 0 HH22 ARG A 110 5.426 -1.370 20.973 1.00 0.00 H new ATOM 1744 N TYR A 111 5.933 -3.375 12.271 1.00 0.00 N ATOM 1745 CA TYR A 111 5.919 -4.671 11.605 1.00 0.00 C ATOM 1746 C TYR A 111 7.273 -4.969 10.970 1.00 0.00 C ATOM 1747 O TYR A 111 7.648 -6.129 10.798 1.00 0.00 O ATOM 1748 CB TYR A 111 4.819 -4.709 10.542 1.00 0.00 C ATOM 1749 CG TYR A 111 3.437 -4.935 11.111 1.00 0.00 C ATOM 1750 CD1 TYR A 111 2.691 -3.879 11.623 1.00 0.00 C ATOM 1751 CD2 TYR A 111 2.877 -6.206 11.136 1.00 0.00 C ATOM 1752 CE1 TYR A 111 1.428 -4.084 12.144 1.00 0.00 C ATOM 1753 CE2 TYR A 111 1.614 -6.419 11.653 1.00 0.00 C ATOM 1754 CZ TYR A 111 0.895 -5.356 12.156 1.00 0.00 C ATOM 1755 OH TYR A 111 -0.363 -5.565 12.669 1.00 0.00 O ATOM 0 H TYR A 111 5.366 -2.660 11.815 1.00 0.00 H new ATOM 0 HA TYR A 111 5.715 -5.437 12.353 1.00 0.00 H new ATOM 0 HB2 TYR A 111 4.826 -3.769 9.989 1.00 0.00 H new ATOM 0 HB3 TYR A 111 5.043 -5.501 9.827 1.00 0.00 H new ATOM 0 HD1 TYR A 111 3.106 -2.882 11.613 1.00 0.00 H new ATOM 0 HD2 TYR A 111 3.438 -7.041 10.745 1.00 0.00 H new ATOM 0 HE1 TYR A 111 0.862 -3.254 12.539 1.00 0.00 H new ATOM 0 HE2 TYR A 111 1.192 -7.413 11.663 1.00 0.00 H new ATOM 0 HH TYR A 111 -0.971 -4.871 12.338 1.00 0.00 H new ATOM 1765 N LYS A 112 8.006 -3.913 10.627 1.00 0.00 N ATOM 1766 CA LYS A 112 9.321 -4.062 10.016 1.00 0.00 C ATOM 1767 C LYS A 112 10.392 -4.287 11.079 1.00 0.00 C ATOM 1768 O LYS A 112 11.402 -4.944 10.827 1.00 0.00 O ATOM 1769 CB LYS A 112 9.663 -2.824 9.184 1.00 0.00 C ATOM 1770 CG LYS A 112 8.808 -2.674 7.937 1.00 0.00 C ATOM 1771 CD LYS A 112 9.495 -3.261 6.716 1.00 0.00 C ATOM 1772 CE LYS A 112 9.194 -2.453 5.464 1.00 0.00 C ATOM 1773 NZ LYS A 112 9.066 -3.320 4.261 1.00 0.00 N ATOM 0 H LYS A 112 7.711 -2.946 10.762 1.00 0.00 H new ATOM 0 HA LYS A 112 9.294 -4.934 9.363 1.00 0.00 H new ATOM 0 HB2 LYS A 112 9.545 -1.936 9.804 1.00 0.00 H new ATOM 0 HB3 LYS A 112 10.712 -2.871 8.892 1.00 0.00 H new ATOM 0 HG2 LYS A 112 7.850 -3.170 8.090 1.00 0.00 H new ATOM 0 HG3 LYS A 112 8.597 -1.619 7.764 1.00 0.00 H new ATOM 0 HD2 LYS A 112 10.572 -3.289 6.882 1.00 0.00 H new ATOM 0 HD3 LYS A 112 9.167 -4.291 6.573 1.00 0.00 H new ATOM 0 HE2 LYS A 112 8.270 -1.892 5.607 1.00 0.00 H new ATOM 0 HE3 LYS A 112 9.988 -1.724 5.303 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 8.861 -2.731 3.429 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 9.956 -3.836 4.109 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 8.292 -3.999 4.404 1.00 0.00 H new ATOM 1787 N ASP A 113 10.165 -3.736 12.268 1.00 0.00 N ATOM 1788 CA ASP A 113 11.112 -3.878 13.368 1.00 0.00 C ATOM 1789 C ASP A 113 11.010 -5.263 13.999 1.00 0.00 C ATOM 1790 O ASP A 113 12.020 -5.874 14.347 1.00 0.00 O ATOM 1791 CB ASP A 113 10.862 -2.802 14.426 1.00 0.00 C ATOM 1792 CG ASP A 113 11.890 -2.837 15.540 1.00 0.00 C ATOM 1793 OD1 ASP A 113 12.050 -3.905 16.167 1.00 0.00 O ATOM 1794 OD2 ASP A 113 12.535 -1.796 15.785 1.00 0.00 O ATOM 0 H ASP A 113 9.335 -3.188 12.494 1.00 0.00 H new ATOM 0 HA ASP A 113 12.118 -3.755 12.966 1.00 0.00 H new ATOM 0 HB2 ASP A 113 10.877 -1.820 13.952 1.00 0.00 H new ATOM 0 HB3 ASP A 113 9.867 -2.937 14.849 1.00 0.00 H new ATOM 1799 N ALA A 114 9.782 -5.752 14.144 1.00 0.00 N ATOM 1800 CA ALA A 114 9.547 -7.064 14.734 1.00 0.00 C ATOM 1801 C ALA A 114 10.210 -8.163 13.911 1.00 0.00 C ATOM 1802 O ALA A 114 10.958 -8.984 14.441 1.00 0.00 O ATOM 1803 CB ALA A 114 8.054 -7.325 14.862 1.00 0.00 C ATOM 0 H ALA A 114 8.935 -5.259 13.861 1.00 0.00 H new ATOM 0 HA ALA A 114 9.993 -7.073 15.729 1.00 0.00 H new ATOM 0 HB1 ALA A 114 7.893 -8.308 15.304 1.00 0.00 H new ATOM 0 HB2 ALA A 114 7.605 -6.563 15.499 1.00 0.00 H new ATOM 0 HB3 ALA A 114 7.593 -7.291 13.875 1.00 0.00 H new ATOM 1809 N ASP A 115 9.929 -8.174 12.612 1.00 0.00 N ATOM 1810 CA ASP A 115 10.498 -9.173 11.714 1.00 0.00 C ATOM 1811 C ASP A 115 12.015 -9.035 11.638 1.00 0.00 C ATOM 1812 O ASP A 115 12.640 -9.800 10.874 1.00 0.00 O ATOM 1813 CB ASP A 115 9.891 -9.038 10.317 1.00 0.00 C ATOM 1814 CG ASP A 115 9.681 -10.382 9.646 1.00 0.00 C ATOM 1815 OD1 ASP A 115 10.382 -11.346 10.017 1.00 0.00 O ATOM 1816 OD2 ASP A 115 8.816 -10.469 8.749 1.00 0.00 O ATOM 1817 OXT ASP A 115 12.565 -8.162 12.342 1.00 0.00 O ATOM 0 H ASP A 115 9.311 -7.502 12.157 1.00 0.00 H new ATOM 0 HA ASP A 115 10.261 -10.160 12.111 1.00 0.00 H new ATOM 0 HB2 ASP A 115 8.936 -8.517 10.387 1.00 0.00 H new ATOM 0 HB3 ASP A 115 10.545 -8.424 9.698 1.00 0.00 H new TER 1822 ASP A 115 ATOM 1823 N GLY B 456 11.002 -13.754 -22.657 1.00 0.00 N ATOM 1824 CA GLY B 456 11.535 -14.383 -23.897 1.00 0.00 C ATOM 1825 C GLY B 456 10.458 -15.086 -24.700 1.00 0.00 C ATOM 1826 O GLY B 456 10.284 -14.814 -25.888 1.00 0.00 O ATOM 0 HA2 GLY B 456 12.004 -13.618 -24.516 1.00 0.00 H new ATOM 0 HA3 GLY B 456 12.312 -15.100 -23.632 1.00 0.00 H new ATOM 1832 N PHE B 457 9.735 -15.991 -24.050 1.00 0.00 N ATOM 1833 CA PHE B 457 8.669 -16.736 -24.712 1.00 0.00 C ATOM 1834 C PHE B 457 7.299 -16.230 -24.274 1.00 0.00 C ATOM 1835 O PHE B 457 6.453 -15.900 -25.105 1.00 0.00 O ATOM 1836 CB PHE B 457 8.796 -18.229 -24.406 1.00 0.00 C ATOM 1837 CG PHE B 457 10.121 -18.813 -24.806 1.00 0.00 C ATOM 1838 CD1 PHE B 457 10.496 -18.867 -26.139 1.00 0.00 C ATOM 1839 CD2 PHE B 457 10.992 -19.308 -23.848 1.00 0.00 C ATOM 1840 CE1 PHE B 457 11.714 -19.403 -26.510 1.00 0.00 C ATOM 1841 CE2 PHE B 457 12.211 -19.846 -24.213 1.00 0.00 C ATOM 1842 CZ PHE B 457 12.573 -19.894 -25.545 1.00 0.00 C ATOM 0 H PHE B 457 9.867 -16.227 -23.066 1.00 0.00 H new ATOM 0 HA PHE B 457 8.766 -16.583 -25.787 1.00 0.00 H new ATOM 0 HB2 PHE B 457 8.646 -18.387 -23.338 1.00 0.00 H new ATOM 0 HB3 PHE B 457 8.001 -18.766 -24.922 1.00 0.00 H new ATOM 0 HD1 PHE B 457 9.828 -18.485 -26.897 1.00 0.00 H new ATOM 0 HD2 PHE B 457 10.715 -19.273 -22.805 1.00 0.00 H new ATOM 0 HE1 PHE B 457 11.994 -19.438 -27.552 1.00 0.00 H new ATOM 0 HE2 PHE B 457 12.881 -20.229 -23.457 1.00 0.00 H new ATOM 0 HZ PHE B 457 13.526 -20.314 -25.832 1.00 0.00 H new ATOM 1852 N THR B 458 7.087 -16.171 -22.963 1.00 0.00 N ATOM 1853 CA THR B 458 5.819 -15.705 -22.414 1.00 0.00 C ATOM 1854 C THR B 458 5.560 -14.251 -22.801 1.00 0.00 C ATOM 1855 O THR B 458 6.494 -13.460 -22.935 1.00 0.00 O ATOM 1856 CB THR B 458 5.815 -15.849 -20.891 1.00 0.00 C ATOM 1857 OG1 THR B 458 7.134 -15.784 -20.378 1.00 0.00 O ATOM 1858 CG2 THR B 458 5.201 -17.148 -20.414 1.00 0.00 C ATOM 0 H THR B 458 7.777 -16.440 -22.262 1.00 0.00 H new ATOM 0 HA THR B 458 5.022 -16.320 -22.832 1.00 0.00 H new ATOM 0 HB THR B 458 5.207 -15.022 -20.524 1.00 0.00 H new ATOM 0 HG1 THR B 458 7.111 -15.876 -19.403 1.00 0.00 H new ATOM 0 HG21 THR B 458 5.230 -17.186 -19.325 1.00 0.00 H new ATOM 0 HG22 THR B 458 4.166 -17.207 -20.752 1.00 0.00 H new ATOM 0 HG23 THR B 458 5.764 -17.988 -20.821 1.00 0.00 H new ATOM 1866 N PRO B 459 4.282 -13.877 -22.988 1.00 0.00 N ATOM 1867 CA PRO B 459 3.905 -12.510 -23.362 1.00 0.00 C ATOM 1868 C PRO B 459 4.068 -11.523 -22.209 1.00 0.00 C ATOM 1869 O PRO B 459 3.103 -10.896 -21.774 1.00 0.00 O ATOM 1870 CB PRO B 459 2.431 -12.645 -23.748 1.00 0.00 C ATOM 1871 CG PRO B 459 1.941 -13.809 -22.958 1.00 0.00 C ATOM 1872 CD PRO B 459 3.105 -14.757 -22.850 1.00 0.00 C ATOM 0 HA PRO B 459 4.536 -12.117 -24.159 1.00 0.00 H new ATOM 0 HB2 PRO B 459 1.874 -11.740 -23.507 1.00 0.00 H new ATOM 0 HB3 PRO B 459 2.315 -12.815 -24.818 1.00 0.00 H new ATOM 0 HG2 PRO B 459 1.601 -13.495 -21.971 1.00 0.00 H new ATOM 0 HG3 PRO B 459 1.094 -14.286 -23.451 1.00 0.00 H new ATOM 0 HD2 PRO B 459 3.107 -15.283 -21.895 1.00 0.00 H new ATOM 0 HD3 PRO B 459 3.078 -15.516 -23.632 1.00 0.00 H new ATOM 1880 N HIS B 460 5.298 -11.389 -21.720 1.00 0.00 N ATOM 1881 CA HIS B 460 5.589 -10.477 -20.619 1.00 0.00 C ATOM 1882 C HIS B 460 4.713 -10.779 -19.407 1.00 0.00 C ATOM 1883 O HIS B 460 3.552 -10.377 -19.353 1.00 0.00 O ATOM 1884 CB HIS B 460 5.381 -9.028 -21.063 1.00 0.00 C ATOM 1885 CG HIS B 460 6.249 -8.048 -20.336 1.00 0.00 C ATOM 1886 ND1 HIS B 460 7.487 -7.652 -20.797 1.00 0.00 N ATOM 1887 CD2 HIS B 460 6.052 -7.382 -19.173 1.00 0.00 C ATOM 1888 CE1 HIS B 460 8.014 -6.786 -19.949 1.00 0.00 C ATOM 1889 NE2 HIS B 460 7.163 -6.605 -18.956 1.00 0.00 N ATOM 0 H HIS B 460 6.109 -11.900 -22.069 1.00 0.00 H new ATOM 0 HA HIS B 460 6.631 -10.619 -20.332 1.00 0.00 H new ATOM 0 HB2 HIS B 460 5.579 -8.952 -22.132 1.00 0.00 H new ATOM 0 HB3 HIS B 460 4.336 -8.757 -20.912 1.00 0.00 H new ATOM 0 HD2 HIS B 460 5.183 -7.450 -18.535 1.00 0.00 H new ATOM 0 HE1 HIS B 460 8.977 -6.308 -20.051 1.00 0.00 H new ATOM 0 HE2 HIS B 460 7.308 -5.988 -18.157 1.00 0.00 H new ATOM 1898 N ASP B 461 5.281 -11.489 -18.435 1.00 0.00 N ATOM 1899 CA ASP B 461 4.556 -11.847 -17.219 1.00 0.00 C ATOM 1900 C ASP B 461 3.442 -12.846 -17.518 1.00 0.00 C ATOM 1901 O ASP B 461 3.508 -14.004 -17.106 1.00 0.00 O ATOM 1902 CB ASP B 461 3.972 -10.597 -16.555 1.00 0.00 C ATOM 1903 CG ASP B 461 3.472 -10.869 -15.150 1.00 0.00 C ATOM 1904 OD1 ASP B 461 2.535 -11.681 -15.001 1.00 0.00 O ATOM 1905 OD2 ASP B 461 4.016 -10.269 -14.200 1.00 0.00 O ATOM 0 H ASP B 461 6.242 -11.828 -18.466 1.00 0.00 H new ATOM 0 HA ASP B 461 5.263 -12.315 -16.535 1.00 0.00 H new ATOM 0 HB2 ASP B 461 4.733 -9.817 -16.522 1.00 0.00 H new ATOM 0 HB3 ASP B 461 3.151 -10.216 -17.163 1.00 0.00 H new ATOM 1910 N SER B 462 2.421 -12.391 -18.236 1.00 0.00 N ATOM 1911 CA SER B 462 1.292 -13.246 -18.589 1.00 0.00 C ATOM 1912 C SER B 462 0.546 -13.704 -17.340 1.00 0.00 C ATOM 1913 O SER B 462 0.856 -14.748 -16.768 1.00 0.00 O ATOM 1914 CB SER B 462 1.773 -14.461 -19.387 1.00 0.00 C ATOM 1915 OG SER B 462 3.087 -14.263 -19.878 1.00 0.00 O ATOM 0 H SER B 462 2.351 -11.435 -18.585 1.00 0.00 H new ATOM 0 HA SER B 462 0.607 -12.665 -19.206 1.00 0.00 H new ATOM 0 HB2 SER B 462 1.748 -15.348 -18.754 1.00 0.00 H new ATOM 0 HB3 SER B 462 1.094 -14.644 -20.220 1.00 0.00 H new ATOM 0 HG SER B 462 3.116 -13.443 -20.414 1.00 0.00 H new ATOM 1921 N ALA B 463 -0.440 -12.916 -16.924 1.00 0.00 N ATOM 1922 CA ALA B 463 -1.231 -13.240 -15.743 1.00 0.00 C ATOM 1923 C ALA B 463 -2.383 -12.255 -15.565 1.00 0.00 C ATOM 1924 O ALA B 463 -2.250 -11.252 -14.864 1.00 0.00 O ATOM 1925 CB ALA B 463 -0.348 -13.252 -14.504 1.00 0.00 C ATOM 0 H ALA B 463 -0.710 -12.048 -17.387 1.00 0.00 H new ATOM 0 HA ALA B 463 -1.656 -14.234 -15.883 1.00 0.00 H new ATOM 0 HB1 ALA B 463 -0.951 -13.495 -13.629 1.00 0.00 H new ATOM 0 HB2 ALA B 463 0.436 -14.000 -14.623 1.00 0.00 H new ATOM 0 HB3 ALA B 463 0.105 -12.270 -14.370 1.00 0.00 H new ATOM 1931 N PRO B 464 -3.534 -12.529 -16.202 1.00 0.00 N ATOM 1932 CA PRO B 464 -4.713 -11.662 -16.111 1.00 0.00 C ATOM 1933 C PRO B 464 -5.090 -11.347 -14.667 1.00 0.00 C ATOM 1934 O PRO B 464 -5.844 -12.087 -14.036 1.00 0.00 O ATOM 1935 CB PRO B 464 -5.814 -12.485 -16.782 1.00 0.00 C ATOM 1936 CG PRO B 464 -5.092 -13.391 -17.719 1.00 0.00 C ATOM 1937 CD PRO B 464 -3.777 -13.705 -17.059 1.00 0.00 C ATOM 0 HA PRO B 464 -4.542 -10.693 -16.579 1.00 0.00 H new ATOM 0 HB2 PRO B 464 -6.388 -13.051 -16.048 1.00 0.00 H new ATOM 0 HB3 PRO B 464 -6.518 -11.845 -17.314 1.00 0.00 H new ATOM 0 HG2 PRO B 464 -5.664 -14.301 -17.901 1.00 0.00 H new ATOM 0 HG3 PRO B 464 -4.939 -12.911 -18.686 1.00 0.00 H new ATOM 0 HD2 PRO B 464 -3.830 -14.624 -16.475 1.00 0.00 H new ATOM 0 HD3 PRO B 464 -2.982 -13.839 -17.792 1.00 0.00 H new ATOM 1945 N TYR B 465 -4.558 -10.244 -14.150 1.00 0.00 N ATOM 1946 CA TYR B 465 -4.838 -9.830 -12.780 1.00 0.00 C ATOM 1947 C TYR B 465 -4.889 -8.310 -12.669 1.00 0.00 C ATOM 1948 O TYR B 465 -5.828 -7.749 -12.105 1.00 0.00 O ATOM 1949 CB TYR B 465 -3.776 -10.387 -11.830 1.00 0.00 C ATOM 1950 CG TYR B 465 -4.013 -11.827 -11.433 1.00 0.00 C ATOM 1951 CD1 TYR B 465 -5.174 -12.203 -10.770 1.00 0.00 C ATOM 1952 CD2 TYR B 465 -3.074 -12.810 -11.722 1.00 0.00 C ATOM 1953 CE1 TYR B 465 -5.393 -13.518 -10.405 1.00 0.00 C ATOM 1954 CE2 TYR B 465 -3.287 -14.127 -11.361 1.00 0.00 C ATOM 1955 CZ TYR B 465 -4.447 -14.476 -10.703 1.00 0.00 C ATOM 1956 OH TYR B 465 -4.662 -15.786 -10.342 1.00 0.00 O ATOM 0 H TYR B 465 -3.931 -9.621 -14.659 1.00 0.00 H new ATOM 0 HA TYR B 465 -5.813 -10.229 -12.499 1.00 0.00 H new ATOM 0 HB2 TYR B 465 -2.798 -10.306 -12.304 1.00 0.00 H new ATOM 0 HB3 TYR B 465 -3.746 -9.771 -10.931 1.00 0.00 H new ATOM 0 HD1 TYR B 465 -5.918 -11.456 -10.536 1.00 0.00 H new ATOM 0 HD2 TYR B 465 -2.164 -12.541 -12.237 1.00 0.00 H new ATOM 0 HE1 TYR B 465 -6.301 -13.794 -9.889 1.00 0.00 H new ATOM 0 HE2 TYR B 465 -2.548 -14.879 -11.593 1.00 0.00 H new ATOM 0 HH TYR B 465 -3.900 -16.333 -10.626 1.00 0.00 H new ATOM 1966 N GLY B 466 -3.871 -7.648 -13.211 1.00 0.00 N ATOM 1967 CA GLY B 466 -3.819 -6.199 -13.163 1.00 0.00 C ATOM 1968 C GLY B 466 -4.939 -5.550 -13.953 1.00 0.00 C ATOM 1969 O GLY B 466 -5.474 -6.146 -14.887 1.00 0.00 O ATOM 0 H GLY B 466 -3.082 -8.090 -13.682 1.00 0.00 H new ATOM 0 HA2 GLY B 466 -3.874 -5.871 -12.125 1.00 0.00 H new ATOM 0 HA3 GLY B 466 -2.860 -5.860 -13.554 1.00 0.00 H new ATOM 1973 N ALA B 467 -5.293 -4.326 -13.577 1.00 0.00 N ATOM 1974 CA ALA B 467 -6.356 -3.595 -14.256 1.00 0.00 C ATOM 1975 C ALA B 467 -5.953 -3.239 -15.683 1.00 0.00 C ATOM 1976 O ALA B 467 -4.806 -3.440 -16.083 1.00 0.00 O ATOM 1977 CB ALA B 467 -6.713 -2.338 -13.477 1.00 0.00 C ATOM 0 H ALA B 467 -4.859 -3.819 -12.805 1.00 0.00 H new ATOM 0 HA ALA B 467 -7.233 -4.240 -14.305 1.00 0.00 H new ATOM 0 HB1 ALA B 467 -7.508 -1.802 -13.996 1.00 0.00 H new ATOM 0 HB2 ALA B 467 -7.052 -2.613 -12.478 1.00 0.00 H new ATOM 0 HB3 ALA B 467 -5.835 -1.697 -13.398 1.00 0.00 H new ATOM 1983 N LEU B 468 -6.903 -2.710 -16.446 1.00 0.00 N ATOM 1984 CA LEU B 468 -6.646 -2.325 -17.829 1.00 0.00 C ATOM 1985 C LEU B 468 -6.371 -0.829 -17.937 1.00 0.00 C ATOM 1986 O LEU B 468 -5.572 -0.393 -18.765 1.00 0.00 O ATOM 1987 CB LEU B 468 -7.837 -2.702 -18.714 1.00 0.00 C ATOM 1988 CG LEU B 468 -7.790 -4.117 -19.294 1.00 0.00 C ATOM 1989 CD1 LEU B 468 -8.308 -5.126 -18.281 1.00 0.00 C ATOM 1990 CD2 LEU B 468 -8.596 -4.190 -20.582 1.00 0.00 C ATOM 0 H LEU B 468 -7.858 -2.538 -16.131 1.00 0.00 H new ATOM 0 HA LEU B 468 -5.762 -2.863 -18.171 1.00 0.00 H new ATOM 0 HB2 LEU B 468 -8.752 -2.595 -18.131 1.00 0.00 H new ATOM 0 HB3 LEU B 468 -7.898 -1.990 -19.537 1.00 0.00 H new ATOM 0 HG LEU B 468 -6.753 -4.363 -19.522 1.00 0.00 H new ATOM 0 HD11 LEU B 468 -8.267 -6.127 -18.711 1.00 0.00 H new ATOM 0 HD12 LEU B 468 -7.690 -5.091 -17.384 1.00 0.00 H new ATOM 0 HD13 LEU B 468 -9.339 -4.884 -18.021 1.00 0.00 H new ATOM 0 HD21 LEU B 468 -8.552 -5.203 -20.982 1.00 0.00 H new ATOM 0 HD22 LEU B 468 -9.633 -3.925 -20.378 1.00 0.00 H new ATOM 0 HD23 LEU B 468 -8.181 -3.494 -21.311 1.00 0.00 H new ATOM 2002 N ASP B 469 -7.038 -0.048 -17.093 1.00 0.00 N ATOM 2003 CA ASP B 469 -6.864 1.400 -17.093 1.00 0.00 C ATOM 2004 C ASP B 469 -5.415 1.775 -16.799 1.00 0.00 C ATOM 2005 O ASP B 469 -4.724 1.082 -16.052 1.00 0.00 O ATOM 2006 CB ASP B 469 -7.789 2.045 -16.060 1.00 0.00 C ATOM 2007 CG ASP B 469 -9.254 1.779 -16.348 1.00 0.00 C ATOM 2008 OD1 ASP B 469 -9.639 1.804 -17.536 1.00 0.00 O ATOM 2009 OD2 ASP B 469 -10.016 1.546 -15.387 1.00 0.00 O ATOM 0 H ASP B 469 -7.703 -0.393 -16.401 1.00 0.00 H new ATOM 0 HA ASP B 469 -7.122 1.772 -18.085 1.00 0.00 H new ATOM 0 HB2 ASP B 469 -7.542 1.666 -15.068 1.00 0.00 H new ATOM 0 HB3 ASP B 469 -7.615 3.121 -16.042 1.00 0.00 H new ATOM 2014 N MET B 470 -4.961 2.874 -17.392 1.00 0.00 N ATOM 2015 CA MET B 470 -3.593 3.340 -17.193 1.00 0.00 C ATOM 2016 C MET B 470 -3.493 4.277 -15.989 1.00 0.00 C ATOM 2017 O MET B 470 -2.448 4.882 -15.752 1.00 0.00 O ATOM 2018 CB MET B 470 -3.089 4.053 -18.449 1.00 0.00 C ATOM 2019 CG MET B 470 -1.575 4.158 -18.523 1.00 0.00 C ATOM 2020 SD MET B 470 -1.023 5.677 -19.324 1.00 0.00 S ATOM 2021 CE MET B 470 0.117 5.023 -20.541 1.00 0.00 C ATOM 0 H MET B 470 -5.520 3.458 -18.014 1.00 0.00 H new ATOM 0 HA MET B 470 -2.969 2.468 -16.998 1.00 0.00 H new ATOM 0 HB2 MET B 470 -3.451 3.521 -19.329 1.00 0.00 H new ATOM 0 HB3 MET B 470 -3.516 5.055 -18.484 1.00 0.00 H new ATOM 0 HG2 MET B 470 -1.162 4.112 -17.515 1.00 0.00 H new ATOM 0 HG3 MET B 470 -1.181 3.300 -19.068 1.00 0.00 H new ATOM 0 HE1 MET B 470 0.543 5.844 -21.118 1.00 0.00 H new ATOM 0 HE2 MET B 470 0.917 4.481 -20.036 1.00 0.00 H new ATOM 0 HE3 MET B 470 -0.414 4.346 -21.210 1.00 0.00 H new ATOM 2031 N ALA B 471 -4.580 4.392 -15.230 1.00 0.00 N ATOM 2032 CA ALA B 471 -4.601 5.254 -14.055 1.00 0.00 C ATOM 2033 C ALA B 471 -4.093 4.522 -12.825 1.00 0.00 C ATOM 2034 O ALA B 471 -3.663 5.147 -11.856 1.00 0.00 O ATOM 2035 CB ALA B 471 -6.004 5.791 -13.814 1.00 0.00 C ATOM 0 H ALA B 471 -5.455 3.900 -15.408 1.00 0.00 H new ATOM 0 HA ALA B 471 -3.933 6.094 -14.244 1.00 0.00 H new ATOM 0 HB1 ALA B 471 -6.002 6.433 -12.933 1.00 0.00 H new ATOM 0 HB2 ALA B 471 -6.327 6.367 -14.681 1.00 0.00 H new ATOM 0 HB3 ALA B 471 -6.690 4.959 -13.655 1.00 0.00 H new ATOM 2041 N ASP B 472 -4.133 3.199 -12.868 1.00 0.00 N ATOM 2042 CA ASP B 472 -3.663 2.404 -11.748 1.00 0.00 C ATOM 2043 C ASP B 472 -2.176 2.117 -11.884 1.00 0.00 C ATOM 2044 O ASP B 472 -1.471 1.962 -10.888 1.00 0.00 O ATOM 2045 CB ASP B 472 -4.471 1.106 -11.626 1.00 0.00 C ATOM 2046 CG ASP B 472 -3.817 0.078 -10.719 1.00 0.00 C ATOM 2047 OD1 ASP B 472 -2.729 -0.422 -11.075 1.00 0.00 O ATOM 2048 OD2 ASP B 472 -4.396 -0.230 -9.656 1.00 0.00 O ATOM 0 H ASP B 472 -4.483 2.659 -13.659 1.00 0.00 H new ATOM 0 HA ASP B 472 -3.812 2.975 -10.832 1.00 0.00 H new ATOM 0 HB2 ASP B 472 -5.465 1.339 -11.244 1.00 0.00 H new ATOM 0 HB3 ASP B 472 -4.604 0.674 -12.618 1.00 0.00 H new ATOM 2053 N PHE B 473 -1.703 2.070 -13.118 1.00 0.00 N ATOM 2054 CA PHE B 473 -0.294 1.828 -13.377 1.00 0.00 C ATOM 2055 C PHE B 473 0.471 3.140 -13.304 1.00 0.00 C ATOM 2056 O PHE B 473 1.628 3.176 -12.887 1.00 0.00 O ATOM 2057 CB PHE B 473 -0.102 1.178 -14.749 1.00 0.00 C ATOM 2058 CG PHE B 473 -0.719 -0.187 -14.859 1.00 0.00 C ATOM 2059 CD1 PHE B 473 -2.095 -0.335 -14.931 1.00 0.00 C ATOM 2060 CD2 PHE B 473 0.077 -1.321 -14.890 1.00 0.00 C ATOM 2061 CE1 PHE B 473 -2.666 -1.590 -15.032 1.00 0.00 C ATOM 2062 CE2 PHE B 473 -0.488 -2.578 -14.992 1.00 0.00 C ATOM 2063 CZ PHE B 473 -1.861 -2.713 -15.063 1.00 0.00 C ATOM 0 H PHE B 473 -2.273 2.196 -13.955 1.00 0.00 H new ATOM 0 HA PHE B 473 0.091 1.145 -12.620 1.00 0.00 H new ATOM 0 HB2 PHE B 473 -0.534 1.825 -15.512 1.00 0.00 H new ATOM 0 HB3 PHE B 473 0.965 1.104 -14.961 1.00 0.00 H new ATOM 0 HD1 PHE B 473 -2.728 0.540 -14.908 1.00 0.00 H new ATOM 0 HD2 PHE B 473 1.151 -1.221 -14.834 1.00 0.00 H new ATOM 0 HE1 PHE B 473 -3.740 -1.693 -15.087 1.00 0.00 H new ATOM 0 HE2 PHE B 473 0.143 -3.454 -15.016 1.00 0.00 H new ATOM 0 HZ PHE B 473 -2.305 -3.694 -15.143 1.00 0.00 H new ATOM 2073 N GLU B 474 -0.193 4.222 -13.702 1.00 0.00 N ATOM 2074 CA GLU B 474 0.417 5.540 -13.671 1.00 0.00 C ATOM 2075 C GLU B 474 0.609 6.013 -12.239 1.00 0.00 C ATOM 2076 O GLU B 474 1.578 6.711 -11.940 1.00 0.00 O ATOM 2077 CB GLU B 474 -0.434 6.544 -14.449 1.00 0.00 C ATOM 2078 CG GLU B 474 0.175 7.935 -14.518 1.00 0.00 C ATOM 2079 CD GLU B 474 -0.814 8.983 -14.988 1.00 0.00 C ATOM 2080 OE1 GLU B 474 -1.625 9.448 -14.159 1.00 0.00 O ATOM 2081 OE2 GLU B 474 -0.780 9.338 -16.185 1.00 0.00 O ATOM 0 H GLU B 474 -1.152 4.208 -14.049 1.00 0.00 H new ATOM 0 HA GLU B 474 1.396 5.470 -14.145 1.00 0.00 H new ATOM 0 HB2 GLU B 474 -0.584 6.172 -15.462 1.00 0.00 H new ATOM 0 HB3 GLU B 474 -1.418 6.610 -13.985 1.00 0.00 H new ATOM 0 HG2 GLU B 474 0.551 8.212 -13.533 1.00 0.00 H new ATOM 0 HG3 GLU B 474 1.031 7.920 -15.193 1.00 0.00 H new ATOM 2088 N PHE B 475 -0.304 5.634 -11.344 1.00 0.00 N ATOM 2089 CA PHE B 475 -0.175 6.047 -9.957 1.00 0.00 C ATOM 2090 C PHE B 475 1.034 5.376 -9.322 1.00 0.00 C ATOM 2091 O PHE B 475 1.643 5.921 -8.402 1.00 0.00 O ATOM 2092 CB PHE B 475 -1.464 5.761 -9.159 1.00 0.00 C ATOM 2093 CG PHE B 475 -1.644 4.342 -8.682 1.00 0.00 C ATOM 2094 CD1 PHE B 475 -0.716 3.721 -7.857 1.00 0.00 C ATOM 2095 CD2 PHE B 475 -2.768 3.635 -9.057 1.00 0.00 C ATOM 2096 CE1 PHE B 475 -0.912 2.423 -7.424 1.00 0.00 C ATOM 2097 CE2 PHE B 475 -2.970 2.338 -8.629 1.00 0.00 C ATOM 2098 CZ PHE B 475 -2.041 1.730 -7.812 1.00 0.00 C ATOM 0 H PHE B 475 -1.119 5.057 -11.552 1.00 0.00 H new ATOM 0 HA PHE B 475 -0.021 7.126 -9.933 1.00 0.00 H new ATOM 0 HB2 PHE B 475 -1.485 6.420 -8.291 1.00 0.00 H new ATOM 0 HB3 PHE B 475 -2.319 6.026 -9.781 1.00 0.00 H new ATOM 0 HD1 PHE B 475 0.169 4.258 -7.550 1.00 0.00 H new ATOM 0 HD2 PHE B 475 -3.502 4.104 -9.696 1.00 0.00 H new ATOM 0 HE1 PHE B 475 -0.182 1.951 -6.783 1.00 0.00 H new ATOM 0 HE2 PHE B 475 -3.855 1.800 -8.934 1.00 0.00 H new ATOM 0 HZ PHE B 475 -2.196 0.715 -7.477 1.00 0.00 H new ATOM 2108 N GLU B 476 1.378 4.186 -9.817 1.00 0.00 N ATOM 2109 CA GLU B 476 2.513 3.444 -9.288 1.00 0.00 C ATOM 2110 C GLU B 476 3.821 4.186 -9.506 1.00 0.00 C ATOM 2111 O GLU B 476 4.755 4.049 -8.718 1.00 0.00 O ATOM 2112 CB GLU B 476 2.592 2.055 -9.904 1.00 0.00 C ATOM 2113 CG GLU B 476 1.257 1.339 -9.944 1.00 0.00 C ATOM 2114 CD GLU B 476 1.403 -0.165 -10.070 1.00 0.00 C ATOM 2115 OE1 GLU B 476 2.428 -0.703 -9.600 1.00 0.00 O ATOM 2116 OE2 GLU B 476 0.492 -0.805 -10.636 1.00 0.00 O ATOM 0 H GLU B 476 0.887 3.721 -10.580 1.00 0.00 H new ATOM 0 HA GLU B 476 2.356 3.344 -8.214 1.00 0.00 H new ATOM 0 HB2 GLU B 476 2.983 2.137 -10.918 1.00 0.00 H new ATOM 0 HB3 GLU B 476 3.302 1.453 -9.336 1.00 0.00 H new ATOM 0 HG2 GLU B 476 0.698 1.571 -9.038 1.00 0.00 H new ATOM 0 HG3 GLU B 476 0.673 1.715 -10.784 1.00 0.00 H new ATOM 2123 N GLN B 477 3.888 4.984 -10.563 1.00 0.00 N ATOM 2124 CA GLN B 477 5.100 5.746 -10.838 1.00 0.00 C ATOM 2125 C GLN B 477 5.337 6.753 -9.724 1.00 0.00 C ATOM 2126 O GLN B 477 6.473 6.990 -9.314 1.00 0.00 O ATOM 2127 CB GLN B 477 5.022 6.430 -12.211 1.00 0.00 C ATOM 2128 CG GLN B 477 4.127 7.662 -12.251 1.00 0.00 C ATOM 2129 CD GLN B 477 4.905 8.942 -12.486 1.00 0.00 C ATOM 2130 OE1 GLN B 477 5.031 9.406 -13.620 1.00 0.00 O ATOM 2131 NE2 GLN B 477 5.433 9.520 -11.414 1.00 0.00 N ATOM 0 H GLN B 477 3.132 5.120 -11.234 1.00 0.00 H new ATOM 0 HA GLN B 477 5.948 5.063 -10.870 1.00 0.00 H new ATOM 0 HB2 GLN B 477 6.028 6.717 -12.518 1.00 0.00 H new ATOM 0 HB3 GLN B 477 4.659 5.708 -12.943 1.00 0.00 H new ATOM 0 HG2 GLN B 477 3.385 7.542 -13.041 1.00 0.00 H new ATOM 0 HG3 GLN B 477 3.581 7.741 -11.311 1.00 0.00 H new ATOM 0 HE21 GLN B 477 5.304 9.101 -10.493 1.00 0.00 H new ATOM 0 HE22 GLN B 477 5.968 10.383 -11.511 1.00 0.00 H new ATOM 2140 N MET B 478 4.251 7.298 -9.200 1.00 0.00 N ATOM 2141 CA MET B 478 4.327 8.227 -8.087 1.00 0.00 C ATOM 2142 C MET B 478 4.115 7.450 -6.791 1.00 0.00 C ATOM 2143 O MET B 478 4.133 8.014 -5.697 1.00 0.00 O ATOM 2144 CB MET B 478 3.274 9.327 -8.227 1.00 0.00 C ATOM 2145 CG MET B 478 3.673 10.430 -9.193 1.00 0.00 C ATOM 2146 SD MET B 478 3.031 12.044 -8.708 1.00 0.00 S ATOM 2147 CE MET B 478 1.295 11.666 -8.488 1.00 0.00 C ATOM 0 H MET B 478 3.304 7.111 -9.530 1.00 0.00 H new ATOM 0 HA MET B 478 5.306 8.705 -8.077 1.00 0.00 H new ATOM 0 HB2 MET B 478 2.338 8.882 -8.563 1.00 0.00 H new ATOM 0 HB3 MET B 478 3.085 9.765 -7.247 1.00 0.00 H new ATOM 0 HG2 MET B 478 4.760 10.479 -9.253 1.00 0.00 H new ATOM 0 HG3 MET B 478 3.309 10.183 -10.190 1.00 0.00 H new ATOM 0 HE1 MET B 478 0.691 12.451 -8.944 1.00 0.00 H new ATOM 0 HE2 MET B 478 1.068 10.711 -8.962 1.00 0.00 H new ATOM 0 HE3 MET B 478 1.068 11.606 -7.424 1.00 0.00 H new ATOM 2157 N PHE B 479 3.910 6.138 -6.944 1.00 0.00 N ATOM 2158 CA PHE B 479 3.685 5.246 -5.821 1.00 0.00 C ATOM 2159 C PHE B 479 4.810 4.228 -5.681 1.00 0.00 C ATOM 2160 O PHE B 479 4.654 3.221 -4.989 1.00 0.00 O ATOM 2161 CB PHE B 479 2.353 4.513 -5.988 1.00 0.00 C ATOM 2162 CG PHE B 479 1.190 5.224 -5.355 1.00 0.00 C ATOM 2163 CD1 PHE B 479 1.275 6.563 -5.003 1.00 0.00 C ATOM 2164 CD2 PHE B 479 0.011 4.548 -5.107 1.00 0.00 C ATOM 2165 CE1 PHE B 479 0.206 7.207 -4.417 1.00 0.00 C ATOM 2166 CE2 PHE B 479 -1.063 5.189 -4.523 1.00 0.00 C ATOM 2167 CZ PHE B 479 -0.964 6.518 -4.177 1.00 0.00 C ATOM 0 H PHE B 479 3.897 5.673 -7.852 1.00 0.00 H new ATOM 0 HA PHE B 479 3.659 5.855 -4.917 1.00 0.00 H new ATOM 0 HB2 PHE B 479 2.152 4.381 -7.051 1.00 0.00 H new ATOM 0 HB3 PHE B 479 2.439 3.517 -5.553 1.00 0.00 H new ATOM 0 HD1 PHE B 479 2.189 7.107 -5.190 1.00 0.00 H new ATOM 0 HD2 PHE B 479 -0.071 3.505 -5.373 1.00 0.00 H new ATOM 0 HE1 PHE B 479 0.285 8.250 -4.146 1.00 0.00 H new ATOM 0 HE2 PHE B 479 -1.980 4.649 -4.338 1.00 0.00 H new ATOM 0 HZ PHE B 479 -1.802 7.021 -3.718 1.00 0.00 H new ATOM 2177 N THR B 480 5.946 4.484 -6.325 1.00 0.00 N ATOM 2178 CA THR B 480 7.069 3.572 -6.237 1.00 0.00 C ATOM 2179 C THR B 480 8.272 4.282 -5.631 1.00 0.00 C ATOM 2180 O THR B 480 8.940 5.083 -6.285 1.00 0.00 O ATOM 2181 CB THR B 480 7.420 3.016 -7.620 1.00 0.00 C ATOM 2182 OG1 THR B 480 6.345 2.257 -8.142 1.00 0.00 O ATOM 2183 CG2 THR B 480 8.647 2.129 -7.618 1.00 0.00 C ATOM 0 H THR B 480 6.107 5.307 -6.906 1.00 0.00 H new ATOM 0 HA THR B 480 6.791 2.738 -5.593 1.00 0.00 H new ATOM 0 HB THR B 480 7.625 3.891 -8.237 1.00 0.00 H new ATOM 0 HG1 THR B 480 5.525 2.792 -8.118 1.00 0.00 H new ATOM 0 HG21 THR B 480 8.838 1.770 -8.629 1.00 0.00 H new ATOM 0 HG22 THR B 480 9.507 2.699 -7.267 1.00 0.00 H new ATOM 0 HG23 THR B 480 8.480 1.279 -6.957 1.00 0.00 H new ATOM 2191 N ASP B 481 8.524 3.980 -4.358 1.00 0.00 N ATOM 2192 CA ASP B 481 9.628 4.577 -3.616 1.00 0.00 C ATOM 2193 C ASP B 481 9.686 6.087 -3.830 1.00 0.00 C ATOM 2194 O ASP B 481 10.455 6.579 -4.655 1.00 0.00 O ATOM 2195 CB ASP B 481 10.953 3.935 -4.028 1.00 0.00 C ATOM 2196 CG ASP B 481 11.995 4.001 -2.928 1.00 0.00 C ATOM 2197 OD1 ASP B 481 12.465 5.116 -2.622 1.00 0.00 O ATOM 2198 OD2 ASP B 481 12.340 2.936 -2.373 1.00 0.00 O ATOM 0 H ASP B 481 7.970 3.317 -3.816 1.00 0.00 H new ATOM 0 HA ASP B 481 9.458 4.392 -2.555 1.00 0.00 H new ATOM 0 HB2 ASP B 481 10.780 2.893 -4.299 1.00 0.00 H new ATOM 0 HB3 ASP B 481 11.335 4.436 -4.917 1.00 0.00 H new ATOM 2203 N ALA B 482 8.863 6.815 -3.081 1.00 0.00 N ATOM 2204 CA ALA B 482 8.817 8.268 -3.187 1.00 0.00 C ATOM 2205 C ALA B 482 8.886 8.923 -1.811 1.00 0.00 C ATOM 2206 O ALA B 482 8.345 10.008 -1.602 1.00 0.00 O ATOM 2207 CB ALA B 482 7.553 8.701 -3.915 1.00 0.00 C ATOM 0 H ALA B 482 8.219 6.422 -2.394 1.00 0.00 H new ATOM 0 HA ALA B 482 9.686 8.594 -3.759 1.00 0.00 H new ATOM 0 HB1 ALA B 482 7.530 9.788 -3.988 1.00 0.00 H new ATOM 0 HB2 ALA B 482 7.544 8.270 -4.916 1.00 0.00 H new ATOM 0 HB3 ALA B 482 6.679 8.356 -3.363 1.00 0.00 H new ATOM 2213 N LEU B 483 9.554 8.256 -0.875 1.00 0.00 N ATOM 2214 CA LEU B 483 9.691 8.774 0.481 1.00 0.00 C ATOM 2215 C LEU B 483 11.161 8.906 0.870 1.00 0.00 C ATOM 2216 O LEU B 483 11.561 9.887 1.496 1.00 0.00 O ATOM 2217 CB LEU B 483 8.969 7.862 1.475 1.00 0.00 C ATOM 2218 CG LEU B 483 9.081 6.364 1.183 1.00 0.00 C ATOM 2219 CD1 LEU B 483 8.896 5.557 2.459 1.00 0.00 C ATOM 2220 CD2 LEU B 483 8.061 5.948 0.134 1.00 0.00 C ATOM 0 H LEU B 483 10.008 7.356 -1.031 1.00 0.00 H new ATOM 0 HA LEU B 483 9.236 9.764 0.510 1.00 0.00 H new ATOM 0 HB2 LEU B 483 9.365 8.052 2.472 1.00 0.00 H new ATOM 0 HB3 LEU B 483 7.914 8.135 1.494 1.00 0.00 H new ATOM 0 HG LEU B 483 10.078 6.163 0.791 1.00 0.00 H new ATOM 0 HD11 LEU B 483 8.979 4.494 2.232 1.00 0.00 H new ATOM 0 HD12 LEU B 483 9.665 5.835 3.180 1.00 0.00 H new ATOM 0 HD13 LEU B 483 7.912 5.763 2.880 1.00 0.00 H new ATOM 0 HD21 LEU B 483 8.155 4.880 -0.061 1.00 0.00 H new ATOM 0 HD22 LEU B 483 7.056 6.163 0.498 1.00 0.00 H new ATOM 0 HD23 LEU B 483 8.240 6.502 -0.787 1.00 0.00 H new ATOM 2232 N GLY B 484 11.960 7.912 0.495 1.00 0.00 N ATOM 2233 CA GLY B 484 13.376 7.939 0.815 1.00 0.00 C ATOM 2234 C GLY B 484 14.077 9.158 0.248 1.00 0.00 C ATOM 2235 O GLY B 484 14.031 9.405 -0.957 1.00 0.00 O ATOM 0 H GLY B 484 11.653 7.089 -0.024 1.00 0.00 H new ATOM 0 HA2 GLY B 484 13.501 7.923 1.898 1.00 0.00 H new ATOM 0 HA3 GLY B 484 13.850 7.038 0.426 1.00 0.00 H new ATOM 2239 N ILE B 485 14.728 9.922 1.120 1.00 0.00 N ATOM 2240 CA ILE B 485 15.442 11.121 0.701 1.00 0.00 C ATOM 2241 C ILE B 485 16.684 10.766 -0.109 1.00 0.00 C ATOM 2242 O ILE B 485 17.799 10.761 0.414 1.00 0.00 O ATOM 2243 CB ILE B 485 15.858 11.980 1.911 1.00 0.00 C ATOM 2244 CG1 ILE B 485 14.665 12.202 2.842 1.00 0.00 C ATOM 2245 CG2 ILE B 485 16.429 13.311 1.445 1.00 0.00 C ATOM 2246 CD1 ILE B 485 13.481 12.853 2.162 1.00 0.00 C ATOM 0 H ILE B 485 14.775 9.731 2.121 1.00 0.00 H new ATOM 0 HA ILE B 485 14.757 11.695 0.077 1.00 0.00 H new ATOM 0 HB ILE B 485 16.632 11.449 2.465 1.00 0.00 H new ATOM 0 HG12 ILE B 485 14.354 11.243 3.256 1.00 0.00 H new ATOM 0 HG13 ILE B 485 14.979 12.824 3.680 1.00 0.00 H new ATOM 0 HG21 ILE B 485 16.718 13.906 2.311 1.00 0.00 H new ATOM 0 HG22 ILE B 485 17.303 13.133 0.819 1.00 0.00 H new ATOM 0 HG23 ILE B 485 15.675 13.849 0.870 1.00 0.00 H new ATOM 0 HD11 ILE B 485 12.672 12.980 2.882 1.00 0.00 H new ATOM 0 HD12 ILE B 485 13.776 13.827 1.772 1.00 0.00 H new ATOM 0 HD13 ILE B 485 13.141 12.222 1.341 1.00 0.00 H new ATOM 2258 N ASP B 486 16.485 10.467 -1.389 1.00 0.00 N ATOM 2259 CA ASP B 486 17.589 10.110 -2.271 1.00 0.00 C ATOM 2260 C ASP B 486 18.343 11.354 -2.730 1.00 0.00 C ATOM 2261 O ASP B 486 17.761 12.261 -3.324 1.00 0.00 O ATOM 2262 CB ASP B 486 17.070 9.338 -3.485 1.00 0.00 C ATOM 2263 CG ASP B 486 18.022 8.243 -3.925 1.00 0.00 C ATOM 2264 OD1 ASP B 486 19.124 8.575 -4.412 1.00 0.00 O ATOM 2265 OD2 ASP B 486 17.667 7.055 -3.783 1.00 0.00 O ATOM 0 H ASP B 486 15.569 10.465 -1.838 1.00 0.00 H new ATOM 0 HA ASP B 486 18.277 9.476 -1.712 1.00 0.00 H new ATOM 0 HB2 ASP B 486 16.101 8.899 -3.246 1.00 0.00 H new ATOM 0 HB3 ASP B 486 16.911 10.031 -4.311 1.00 0.00 H new ATOM 2270 N GLU B 487 19.642 11.389 -2.451 1.00 0.00 N ATOM 2271 CA GLU B 487 20.476 12.522 -2.835 1.00 0.00 C ATOM 2272 C GLU B 487 20.725 12.529 -4.340 1.00 0.00 C ATOM 2273 O GLU B 487 20.601 11.500 -5.004 1.00 0.00 O ATOM 2274 CB GLU B 487 21.809 12.478 -2.086 1.00 0.00 C ATOM 2275 CG GLU B 487 22.466 13.840 -1.933 1.00 0.00 C ATOM 2276 CD GLU B 487 23.188 13.994 -0.609 1.00 0.00 C ATOM 2277 OE1 GLU B 487 22.508 14.201 0.418 1.00 0.00 O ATOM 2278 OE2 GLU B 487 24.434 13.906 -0.599 1.00 0.00 O ATOM 0 H GLU B 487 20.140 10.646 -1.961 1.00 0.00 H new ATOM 0 HA GLU B 487 19.947 13.437 -2.568 1.00 0.00 H new ATOM 0 HB2 GLU B 487 21.647 12.049 -1.097 1.00 0.00 H new ATOM 0 HB3 GLU B 487 22.491 11.812 -2.614 1.00 0.00 H new ATOM 0 HG2 GLU B 487 23.174 13.991 -2.748 1.00 0.00 H new ATOM 0 HG3 GLU B 487 21.707 14.617 -2.021 1.00 0.00 H new ATOM 2285 N TYR B 488 21.077 13.695 -4.871 1.00 0.00 N ATOM 2286 CA TYR B 488 21.344 13.835 -6.298 1.00 0.00 C ATOM 2287 C TYR B 488 22.693 14.506 -6.536 1.00 0.00 C ATOM 2288 O TYR B 488 22.779 15.729 -6.647 1.00 0.00 O ATOM 2289 CB TYR B 488 20.233 14.646 -6.968 1.00 0.00 C ATOM 2290 CG TYR B 488 20.257 14.574 -8.478 1.00 0.00 C ATOM 2291 CD1 TYR B 488 19.881 13.414 -9.143 1.00 0.00 C ATOM 2292 CD2 TYR B 488 20.655 15.666 -9.239 1.00 0.00 C ATOM 2293 CE1 TYR B 488 19.901 13.344 -10.523 1.00 0.00 C ATOM 2294 CE2 TYR B 488 20.678 15.604 -10.619 1.00 0.00 C ATOM 2295 CZ TYR B 488 20.300 14.441 -11.256 1.00 0.00 C ATOM 2296 OH TYR B 488 20.321 14.375 -12.631 1.00 0.00 O ATOM 0 H TYR B 488 21.184 14.556 -4.335 1.00 0.00 H new ATOM 0 HA TYR B 488 21.372 12.838 -6.737 1.00 0.00 H new ATOM 0 HB2 TYR B 488 19.267 14.288 -6.611 1.00 0.00 H new ATOM 0 HB3 TYR B 488 20.320 15.688 -6.661 1.00 0.00 H new ATOM 0 HD1 TYR B 488 19.568 12.552 -8.572 1.00 0.00 H new ATOM 0 HD2 TYR B 488 20.951 16.579 -8.744 1.00 0.00 H new ATOM 0 HE1 TYR B 488 19.605 12.434 -11.025 1.00 0.00 H new ATOM 0 HE2 TYR B 488 20.990 16.462 -11.196 1.00 0.00 H new ATOM 0 HH TYR B 488 20.625 15.233 -12.995 1.00 0.00 H new ATOM 2306 N GLY B 489 23.744 13.697 -6.613 1.00 0.00 N ATOM 2307 CA GLY B 489 25.075 14.230 -6.837 1.00 0.00 C ATOM 2308 C GLY B 489 25.931 14.199 -5.587 1.00 0.00 C ATOM 2309 O GLY B 489 25.589 13.534 -4.609 1.00 0.00 O ATOM 0 H GLY B 489 23.698 12.682 -6.524 1.00 0.00 H new ATOM 0 HA2 GLY B 489 25.565 13.656 -7.623 1.00 0.00 H new ATOM 0 HA3 GLY B 489 24.996 15.257 -7.194 1.00 0.00 H new ATOM 2313 N GLY B 490 27.047 14.920 -5.617 1.00 0.00 N ATOM 2314 CA GLY B 490 27.936 14.959 -4.471 1.00 0.00 C ATOM 2315 C GLY B 490 28.797 16.207 -4.447 1.00 0.00 C ATOM 2316 O GLY B 490 29.271 16.580 -3.354 1.00 0.00 O ATOM 2317 OXT GLY B 490 28.997 16.811 -5.522 1.00 0.00 O ATOM 0 H GLY B 490 27.352 15.478 -6.415 1.00 0.00 H new ATOM 0 HA2 GLY B 490 27.346 14.911 -3.556 1.00 0.00 H new ATOM 0 HA3 GLY B 490 28.578 14.078 -4.483 1.00 0.00 H new TER 2321 GLY B 490