USER MOD reduce.3.24.130724 H: found=0, std=0, add=930, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 766 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 94 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Set 1.2: A 97 ASN : amide:sc= 0 X(o=0,f=-0.05) USER MOD Set 2.1: A 26 MET CE :methyl 154:sc= -6.66! (180deg=-8.29!) USER MOD Set 2.2: A 84 MET CE :methyl 155:sc= -2.06 (180deg=-3.5!) USER MOD Set 2.3: A 88 ASN : amide:sc= -15.1! C(o=-24!,f=-25!) USER MOD Single : A 24 SER OG : rot 28:sc= 0.00149 USER MOD Single : A 25 HIS : no HD1:sc= -2.39 X(o=-2.4,f=-2.4) USER MOD Single : A 27 GLN :FLIP amide:sc= -3.14! C(o=-3.7!,f=-3.1!) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 CYS SG : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 MET CE :methyl -108:sc= -5.22! (180deg=-11!) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 ASN : amide:sc= -0.347 K(o=-0.35,f=-3!) USER MOD Single : A 49 LYS NZ :NH3+ 174:sc= -0.571 (180deg=-0.609) USER MOD Single : A 53 THR OG1 : rot 91:sc= 1.05 USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 THR OG1 : rot 110:sc= -0.192 USER MOD Single : A 73 ASN : amide:sc= 0.305 K(o=0.3,f=-1) USER MOD Single : A 74 GLN : amide:sc= -9.04! C(o=-9!,f=-13!) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 ASN : amide:sc= 0.342 X(o=0.34,f=0) USER MOD Single : A 82 SER OG : rot 179:sc= 1.1 USER MOD Single : A 83 LYS NZ :NH3+ -158:sc= 0.931 (180deg=0.0553!) USER MOD Single : A 85 MET CE :methyl -116:sc= -1.43 (180deg=-4.37!) USER MOD Single : A 86 GLN : amide:sc= -5.06 K(o=-5.1,f=-13!) USER MOD Single : A 90 THR OG1 : rot 107:sc= 0.927 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 MET CE :methyl 170:sc= -8.91! (180deg=-9.49!) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 113 GLN :FLIP amide:sc= -0.119 F(o=-0.78,f=-0.12) USER MOD Single : A 115 ASN :FLIP amide:sc= -1.74 F(o=-3!,f=-1.7) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 LYS NZ :NH3+ 157:sc= -0.0278 (180deg=-0.232) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 24 -7.513 -11.440 -15.124 1.00 0.00 N ATOM 2 CA SER A 24 -8.424 -10.976 -14.093 1.00 0.00 C ATOM 3 C SER A 24 -7.704 -10.914 -12.744 1.00 0.00 C ATOM 4 O SER A 24 -8.246 -10.396 -11.770 1.00 0.00 O ATOM 5 CB SER A 24 -9.655 -11.880 -13.997 1.00 0.00 C ATOM 6 OG SER A 24 -10.465 -11.806 -15.166 1.00 0.00 O ATOM 0 HA SER A 24 -8.762 -9.975 -14.362 1.00 0.00 H new ATOM 0 HB2 SER A 24 -9.336 -12.911 -13.842 1.00 0.00 H new ATOM 0 HB3 SER A 24 -10.247 -11.595 -13.127 1.00 0.00 H new ATOM 0 HG SER A 24 -9.907 -11.569 -15.936 1.00 0.00 H new ATOM 11 N HIS A 25 -6.492 -11.452 -12.732 1.00 0.00 N ATOM 12 CA HIS A 25 -5.692 -11.465 -11.520 1.00 0.00 C ATOM 13 C HIS A 25 -6.502 -12.078 -10.377 1.00 0.00 C ATOM 14 O HIS A 25 -6.568 -13.299 -10.244 1.00 0.00 O ATOM 15 CB HIS A 25 -5.176 -10.061 -11.195 1.00 0.00 C ATOM 16 CG HIS A 25 -3.969 -9.648 -12.003 1.00 0.00 C ATOM 17 ND1 HIS A 25 -3.964 -8.535 -12.826 1.00 0.00 N ATOM 18 CD2 HIS A 25 -2.730 -10.209 -12.106 1.00 0.00 C ATOM 19 CE1 HIS A 25 -2.770 -8.441 -13.393 1.00 0.00 C ATOM 20 NE2 HIS A 25 -2.007 -9.479 -12.946 1.00 0.00 N ATOM 0 H HIS A 25 -6.046 -11.882 -13.542 1.00 0.00 H new ATOM 0 HA HIS A 25 -4.810 -12.088 -11.669 1.00 0.00 H new ATOM 0 HB2 HIS A 25 -5.978 -9.342 -11.365 1.00 0.00 H new ATOM 0 HB3 HIS A 25 -4.925 -10.014 -10.135 1.00 0.00 H new ATOM 0 HD2 HIS A 25 -2.394 -11.097 -11.591 1.00 0.00 H new ATOM 0 HE1 HIS A 25 -2.456 -7.676 -14.088 1.00 0.00 H new ATOM 0 HE2 HIS A 25 -1.040 -9.664 -13.213 1.00 0.00 H new ATOM 27 N MET A 26 -7.098 -11.203 -9.580 1.00 0.00 N ATOM 28 CA MET A 26 -7.901 -11.644 -8.452 1.00 0.00 C ATOM 29 C MET A 26 -9.228 -10.884 -8.394 1.00 0.00 C ATOM 30 O MET A 26 -9.527 -10.081 -9.277 1.00 0.00 O ATOM 31 CB MET A 26 -7.125 -11.417 -7.154 1.00 0.00 C ATOM 32 CG MET A 26 -6.175 -12.583 -6.871 1.00 0.00 C ATOM 33 SD MET A 26 -4.760 -12.494 -7.956 1.00 0.00 S ATOM 34 CE MET A 26 -4.239 -10.814 -7.646 1.00 0.00 C ATOM 0 H MET A 26 -7.041 -10.191 -9.693 1.00 0.00 H new ATOM 0 HA MET A 26 -8.117 -12.705 -8.576 1.00 0.00 H new ATOM 0 HB2 MET A 26 -6.557 -10.489 -7.223 1.00 0.00 H new ATOM 0 HB3 MET A 26 -7.823 -11.302 -6.324 1.00 0.00 H new ATOM 0 HG2 MET A 26 -5.849 -12.553 -5.831 1.00 0.00 H new ATOM 0 HG3 MET A 26 -6.695 -13.530 -7.015 1.00 0.00 H new ATOM 0 HE1 MET A 26 -3.172 -10.721 -7.846 1.00 0.00 H new ATOM 0 HE2 MET A 26 -4.791 -10.136 -8.297 1.00 0.00 H new ATOM 0 HE3 MET A 26 -4.436 -10.558 -6.605 1.00 0.00 H new ATOM 42 N GLN A 27 -9.988 -11.165 -7.346 1.00 0.00 N ATOM 43 CA GLN A 27 -11.276 -10.518 -7.161 1.00 0.00 C ATOM 44 C GLN A 27 -11.909 -10.963 -5.840 1.00 0.00 C ATOM 45 O GLN A 27 -12.208 -12.142 -5.658 1.00 0.00 O ATOM 46 CB GLN A 27 -12.208 -10.805 -8.339 1.00 0.00 C ATOM 47 CG GLN A 27 -12.007 -12.228 -8.863 1.00 0.00 C ATOM 48 CD GLN A 27 -12.637 -13.254 -7.917 1.00 0.00 C ATOM 49 OE1 GLN A 27 -13.910 -13.009 -7.624 1.00 0.00 O flip ATOM 50 NE2 GLN A 27 -12.007 -14.205 -7.484 1.00 0.00 N flip ATOM 0 H GLN A 27 -9.737 -11.832 -6.616 1.00 0.00 H new ATOM 0 HA GLN A 27 -11.117 -9.440 -7.120 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -13.244 -10.671 -8.029 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -12.020 -10.089 -9.139 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -12.451 -12.321 -9.854 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -10.942 -12.433 -8.971 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -11.031 -14.334 -7.750 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -12.457 -14.871 -6.856 1.00 0.00 H new ATOM 57 N LEU A 28 -12.093 -9.995 -4.954 1.00 0.00 N ATOM 58 CA LEU A 28 -12.685 -10.272 -3.656 1.00 0.00 C ATOM 59 C LEU A 28 -13.117 -8.957 -3.006 1.00 0.00 C ATOM 60 O LEU A 28 -13.070 -7.903 -3.638 1.00 0.00 O ATOM 61 CB LEU A 28 -11.726 -11.098 -2.796 1.00 0.00 C ATOM 62 CG LEU A 28 -10.267 -10.637 -2.787 1.00 0.00 C ATOM 63 CD1 LEU A 28 -9.623 -10.826 -4.161 1.00 0.00 C ATOM 64 CD2 LEU A 28 -10.150 -9.193 -2.294 1.00 0.00 C ATOM 0 H LEU A 28 -11.843 -9.018 -5.109 1.00 0.00 H new ATOM 0 HA LEU A 28 -13.582 -10.881 -3.768 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -12.094 -11.094 -1.770 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -11.758 -12.131 -3.142 1.00 0.00 H new ATOM 0 HG LEU A 28 -9.717 -11.263 -2.084 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -8.587 -10.490 -4.126 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -9.654 -11.880 -4.435 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -10.169 -10.242 -4.902 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -9.103 -8.891 -2.298 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -10.719 -8.537 -2.952 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -10.545 -9.121 -1.280 1.00 0.00 H new ATOM 75 N LYS A 29 -13.528 -9.061 -1.751 1.00 0.00 N ATOM 76 CA LYS A 29 -13.968 -7.892 -1.008 1.00 0.00 C ATOM 77 C LYS A 29 -12.760 -7.237 -0.334 1.00 0.00 C ATOM 78 O LYS A 29 -11.765 -7.902 -0.052 1.00 0.00 O ATOM 79 CB LYS A 29 -15.088 -8.266 -0.035 1.00 0.00 C ATOM 80 CG LYS A 29 -15.338 -7.141 0.972 1.00 0.00 C ATOM 81 CD LYS A 29 -16.365 -7.566 2.024 1.00 0.00 C ATOM 82 CE LYS A 29 -17.723 -6.912 1.759 1.00 0.00 C ATOM 83 NZ LYS A 29 -18.779 -7.566 2.563 1.00 0.00 N ATOM 0 H LYS A 29 -13.566 -9.937 -1.230 1.00 0.00 H new ATOM 0 HA LYS A 29 -14.398 -7.151 -1.682 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -16.003 -8.472 -0.590 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -14.824 -9.181 0.495 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -14.402 -6.871 1.461 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -15.693 -6.253 0.450 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -16.472 -8.651 2.016 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -16.011 -7.288 3.017 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -17.676 -5.851 2.004 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -17.967 -6.984 0.699 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -19.694 -7.110 2.371 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -18.834 -8.573 2.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -18.552 -7.475 3.574 1.00 0.00 H new ATOM 93 N PHE A 30 -12.888 -5.940 -0.095 1.00 0.00 N ATOM 94 CA PHE A 30 -11.820 -5.188 0.541 1.00 0.00 C ATOM 95 C PHE A 30 -12.313 -4.515 1.825 1.00 0.00 C ATOM 96 O PHE A 30 -13.421 -4.784 2.285 1.00 0.00 O ATOM 97 CB PHE A 30 -11.381 -4.109 -0.450 1.00 0.00 C ATOM 98 CG PHE A 30 -12.366 -3.883 -1.601 1.00 0.00 C ATOM 99 CD1 PHE A 30 -13.576 -3.314 -1.358 1.00 0.00 C ATOM 100 CD2 PHE A 30 -12.029 -4.254 -2.866 1.00 0.00 C ATOM 101 CE1 PHE A 30 -14.489 -3.105 -2.425 1.00 0.00 C ATOM 102 CE2 PHE A 30 -12.942 -4.045 -3.933 1.00 0.00 C ATOM 103 CZ PHE A 30 -14.153 -3.475 -3.690 1.00 0.00 C ATOM 0 H PHE A 30 -13.715 -5.391 -0.330 1.00 0.00 H new ATOM 0 HA PHE A 30 -11.000 -5.856 0.804 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -11.244 -3.171 0.087 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -10.411 -4.383 -0.864 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -13.843 -3.021 -0.353 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -11.068 -4.707 -3.058 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -15.450 -2.652 -2.232 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -12.675 -4.339 -4.937 1.00 0.00 H new ATOM 0 HZ PHE A 30 -14.848 -3.316 -4.502 1.00 0.00 H new ATOM 112 N ALA A 31 -11.464 -3.652 2.365 1.00 0.00 N ATOM 113 CA ALA A 31 -11.799 -2.938 3.586 1.00 0.00 C ATOM 114 C ALA A 31 -12.715 -1.761 3.248 1.00 0.00 C ATOM 115 O ALA A 31 -13.206 -1.655 2.125 1.00 0.00 O ATOM 116 CB ALA A 31 -10.513 -2.495 4.286 1.00 0.00 C ATOM 0 H ALA A 31 -10.546 -3.431 1.980 1.00 0.00 H new ATOM 0 HA ALA A 31 -12.339 -3.587 4.276 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -10.763 -1.959 5.202 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -9.912 -3.371 4.530 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -9.947 -1.839 3.625 1.00 0.00 H new ATOM 122 N GLU A 32 -12.918 -0.907 4.240 1.00 0.00 N ATOM 123 CA GLU A 32 -13.767 0.259 4.062 1.00 0.00 C ATOM 124 C GLU A 32 -12.920 1.532 4.025 1.00 0.00 C ATOM 125 O GLU A 32 -13.191 2.439 3.241 1.00 0.00 O ATOM 126 CB GLU A 32 -14.827 0.338 5.163 1.00 0.00 C ATOM 127 CG GLU A 32 -15.823 -0.818 5.049 1.00 0.00 C ATOM 128 CD GLU A 32 -17.198 -0.411 5.583 1.00 0.00 C ATOM 129 OE1 GLU A 32 -17.222 0.262 6.636 1.00 0.00 O ATOM 130 OE2 GLU A 32 -18.195 -0.782 4.926 1.00 0.00 O ATOM 0 H GLU A 32 -12.509 -0.999 5.170 1.00 0.00 H new ATOM 0 HA GLU A 32 -14.286 0.164 3.108 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -14.344 0.312 6.140 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -15.357 1.288 5.095 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -15.910 -1.126 4.007 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -15.452 -1.678 5.606 1.00 0.00 H new ATOM 135 N CYS A 33 -11.909 1.558 4.882 1.00 0.00 N ATOM 136 CA CYS A 33 -11.020 2.704 4.956 1.00 0.00 C ATOM 137 C CYS A 33 -10.434 2.950 3.565 1.00 0.00 C ATOM 138 O CYS A 33 -9.954 4.044 3.273 1.00 0.00 O ATOM 139 CB CYS A 33 -9.927 2.506 6.009 1.00 0.00 C ATOM 140 SG CYS A 33 -10.671 2.438 7.679 1.00 0.00 S ATOM 0 H CYS A 33 -11.686 0.803 5.531 1.00 0.00 H new ATOM 0 HA CYS A 33 -11.583 3.582 5.272 1.00 0.00 H new ATOM 0 HB2 CYS A 33 -9.380 1.585 5.808 1.00 0.00 H new ATOM 0 HB3 CYS A 33 -9.207 3.323 5.956 1.00 0.00 H new ATOM 0 HG CYS A 33 -9.735 2.267 8.565 1.00 0.00 H new ATOM 145 N LEU A 34 -10.494 1.913 2.741 1.00 0.00 N ATOM 146 CA LEU A 34 -9.976 2.002 1.387 1.00 0.00 C ATOM 147 C LEU A 34 -10.815 3.001 0.589 1.00 0.00 C ATOM 148 O LEU A 34 -10.435 3.396 -0.512 1.00 0.00 O ATOM 149 CB LEU A 34 -9.901 0.613 0.749 1.00 0.00 C ATOM 150 CG LEU A 34 -9.234 -0.476 1.590 1.00 0.00 C ATOM 151 CD1 LEU A 34 -8.762 -1.636 0.711 1.00 0.00 C ATOM 152 CD2 LEU A 34 -8.096 0.102 2.434 1.00 0.00 C ATOM 0 H LEU A 34 -10.894 1.007 2.986 1.00 0.00 H new ATOM 0 HA LEU A 34 -8.953 2.379 1.395 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -10.914 0.290 0.509 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -9.362 0.697 -0.195 1.00 0.00 H new ATOM 0 HG LEU A 34 -9.976 -0.876 2.281 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -8.291 -2.397 1.334 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -9.616 -2.070 0.192 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -8.041 -1.269 -0.020 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -7.639 -0.694 3.022 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -7.346 0.545 1.779 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -8.491 0.867 3.103 1.00 0.00 H new ATOM 163 N GLU A 35 -11.940 3.382 1.176 1.00 0.00 N ATOM 164 CA GLU A 35 -12.837 4.328 0.533 1.00 0.00 C ATOM 165 C GLU A 35 -12.533 5.751 1.004 1.00 0.00 C ATOM 166 O GLU A 35 -13.396 6.626 0.945 1.00 0.00 O ATOM 167 CB GLU A 35 -14.299 3.964 0.797 1.00 0.00 C ATOM 168 CG GLU A 35 -14.536 2.466 0.593 1.00 0.00 C ATOM 169 CD GLU A 35 -15.881 2.211 -0.091 1.00 0.00 C ATOM 170 OE1 GLU A 35 -16.907 2.578 0.521 1.00 0.00 O ATOM 171 OE2 GLU A 35 -15.851 1.656 -1.211 1.00 0.00 O ATOM 0 H GLU A 35 -12.251 3.053 2.090 1.00 0.00 H new ATOM 0 HA GLU A 35 -12.674 4.279 -0.544 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -14.569 4.243 1.815 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -14.946 4.533 0.129 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -13.732 2.046 -0.011 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -14.511 1.956 1.556 1.00 0.00 H new ATOM 176 N LYS A 36 -11.304 5.940 1.462 1.00 0.00 N ATOM 177 CA LYS A 36 -10.876 7.241 1.943 1.00 0.00 C ATOM 178 C LYS A 36 -10.210 8.009 0.799 1.00 0.00 C ATOM 179 O LYS A 36 -9.866 9.181 0.951 1.00 0.00 O ATOM 180 CB LYS A 36 -9.989 7.091 3.181 1.00 0.00 C ATOM 181 CG LYS A 36 -10.825 6.758 4.417 1.00 0.00 C ATOM 182 CD LYS A 36 -10.802 7.912 5.421 1.00 0.00 C ATOM 183 CE LYS A 36 -10.969 7.396 6.853 1.00 0.00 C ATOM 184 NZ LYS A 36 -11.269 8.515 7.774 1.00 0.00 N ATOM 0 H LYS A 36 -10.591 5.212 1.510 1.00 0.00 H new ATOM 0 HA LYS A 36 -11.735 7.829 2.265 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -9.253 6.305 3.013 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -9.435 8.015 3.350 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -11.853 6.550 4.120 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -10.440 5.854 4.888 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -9.861 8.456 5.334 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -11.601 8.617 5.189 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -11.773 6.661 6.890 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -10.059 6.889 7.172 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -11.379 8.149 8.741 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -10.489 9.202 7.751 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -12.150 8.982 7.478 1.00 0.00 H new ATOM 194 N LYS A 37 -10.049 7.319 -0.320 1.00 0.00 N ATOM 195 CA LYS A 37 -9.431 7.922 -1.489 1.00 0.00 C ATOM 196 C LYS A 37 -8.077 8.517 -1.095 1.00 0.00 C ATOM 197 O LYS A 37 -7.726 8.544 0.083 1.00 0.00 O ATOM 198 CB LYS A 37 -10.381 8.930 -2.138 1.00 0.00 C ATOM 199 CG LYS A 37 -11.578 8.223 -2.775 1.00 0.00 C ATOM 200 CD LYS A 37 -12.861 8.499 -1.988 1.00 0.00 C ATOM 201 CE LYS A 37 -13.957 9.050 -2.902 1.00 0.00 C ATOM 202 NZ LYS A 37 -15.296 8.706 -2.371 1.00 0.00 N ATOM 0 H LYS A 37 -10.336 6.348 -0.442 1.00 0.00 H new ATOM 0 HA LYS A 37 -9.238 7.166 -2.250 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -10.730 9.641 -1.389 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -9.847 9.503 -2.896 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -11.699 8.561 -3.804 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -11.393 7.149 -2.812 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -13.206 7.580 -1.514 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -12.656 9.212 -1.190 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -13.859 10.132 -2.985 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -13.841 8.641 -3.906 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -16.029 9.087 -3.003 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -15.392 7.672 -2.314 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -15.409 9.117 -1.422 1.00 0.00 H new ATOM 212 N VAL A 38 -7.354 8.979 -2.104 1.00 0.00 N ATOM 213 CA VAL A 38 -6.047 9.574 -1.877 1.00 0.00 C ATOM 214 C VAL A 38 -5.743 10.568 -2.999 1.00 0.00 C ATOM 215 O VAL A 38 -6.653 11.042 -3.677 1.00 0.00 O ATOM 216 CB VAL A 38 -4.989 8.476 -1.749 1.00 0.00 C ATOM 217 CG1 VAL A 38 -5.415 7.421 -0.724 1.00 0.00 C ATOM 218 CG2 VAL A 38 -4.697 7.834 -3.106 1.00 0.00 C ATOM 0 H VAL A 38 -7.648 8.954 -3.080 1.00 0.00 H new ATOM 0 HA VAL A 38 -6.037 10.129 -0.939 1.00 0.00 H new ATOM 0 HB VAL A 38 -4.069 8.938 -1.392 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -4.646 6.652 -0.652 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -5.549 7.893 0.250 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -6.354 6.966 -1.039 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -3.942 7.057 -2.986 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -5.611 7.393 -3.504 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -4.330 8.593 -3.796 1.00 0.00 H new ATOM 228 N ASP A 39 -4.459 10.855 -3.160 1.00 0.00 N ATOM 229 CA ASP A 39 -4.024 11.785 -4.188 1.00 0.00 C ATOM 230 C ASP A 39 -2.494 11.840 -4.204 1.00 0.00 C ATOM 231 O ASP A 39 -1.887 12.548 -3.402 1.00 0.00 O ATOM 232 CB ASP A 39 -4.544 13.196 -3.909 1.00 0.00 C ATOM 233 CG ASP A 39 -4.852 14.029 -5.157 1.00 0.00 C ATOM 234 OD1 ASP A 39 -4.641 13.491 -6.264 1.00 0.00 O ATOM 235 OD2 ASP A 39 -5.290 15.186 -4.973 1.00 0.00 O ATOM 0 H ASP A 39 -3.707 10.460 -2.596 1.00 0.00 H new ATOM 0 HA ASP A 39 -4.415 11.439 -5.145 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -5.450 13.121 -3.307 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -3.806 13.727 -3.309 1.00 0.00 H new ATOM 239 N MET A 40 -1.917 11.084 -5.126 1.00 0.00 N ATOM 240 CA MET A 40 -0.470 11.039 -5.257 1.00 0.00 C ATOM 241 C MET A 40 0.087 12.405 -5.661 1.00 0.00 C ATOM 242 O MET A 40 1.251 12.707 -5.398 1.00 0.00 O ATOM 243 CB MET A 40 -0.086 9.999 -6.312 1.00 0.00 C ATOM 244 CG MET A 40 -0.678 8.629 -5.972 1.00 0.00 C ATOM 245 SD MET A 40 0.278 7.856 -4.678 1.00 0.00 S ATOM 246 CE MET A 40 -0.456 8.628 -3.247 1.00 0.00 C ATOM 0 H MET A 40 -2.424 10.498 -5.789 1.00 0.00 H new ATOM 0 HA MET A 40 -0.045 10.766 -4.291 1.00 0.00 H new ATOM 0 HB2 MET A 40 -0.442 10.320 -7.291 1.00 0.00 H new ATOM 0 HB3 MET A 40 1.000 9.924 -6.376 1.00 0.00 H new ATOM 0 HG2 MET A 40 -1.714 8.740 -5.653 1.00 0.00 H new ATOM 0 HG3 MET A 40 -0.684 7.996 -6.859 1.00 0.00 H new ATOM 0 HE1 MET A 40 0.246 9.344 -2.820 1.00 0.00 H new ATOM 0 HE2 MET A 40 -1.369 9.146 -3.541 1.00 0.00 H new ATOM 0 HE3 MET A 40 -0.694 7.866 -2.505 1.00 0.00 H new ATOM 254 N SER A 41 -0.769 13.195 -6.292 1.00 0.00 N ATOM 255 CA SER A 41 -0.377 14.522 -6.734 1.00 0.00 C ATOM 256 C SER A 41 -0.236 15.455 -5.529 1.00 0.00 C ATOM 257 O SER A 41 0.210 16.593 -5.670 1.00 0.00 O ATOM 258 CB SER A 41 -1.387 15.092 -7.732 1.00 0.00 C ATOM 259 OG SER A 41 -0.761 15.544 -8.929 1.00 0.00 O ATOM 0 H SER A 41 -1.733 12.941 -6.508 1.00 0.00 H new ATOM 0 HA SER A 41 0.586 14.443 -7.239 1.00 0.00 H new ATOM 0 HB2 SER A 41 -2.126 14.328 -7.976 1.00 0.00 H new ATOM 0 HB3 SER A 41 -1.925 15.920 -7.270 1.00 0.00 H new ATOM 0 HG SER A 41 -1.440 15.899 -9.540 1.00 0.00 H new ATOM 264 N LYS A 42 -0.624 14.938 -4.373 1.00 0.00 N ATOM 265 CA LYS A 42 -0.546 15.710 -3.145 1.00 0.00 C ATOM 266 C LYS A 42 0.418 15.023 -2.175 1.00 0.00 C ATOM 267 O LYS A 42 1.180 15.689 -1.476 1.00 0.00 O ATOM 268 CB LYS A 42 -1.943 15.936 -2.564 1.00 0.00 C ATOM 269 CG LYS A 42 -2.975 16.129 -3.679 1.00 0.00 C ATOM 270 CD LYS A 42 -2.775 17.471 -4.386 1.00 0.00 C ATOM 271 CE LYS A 42 -4.113 18.184 -4.596 1.00 0.00 C ATOM 272 NZ LYS A 42 -3.899 19.522 -5.190 1.00 0.00 N ATOM 0 H LYS A 42 -0.993 13.994 -4.261 1.00 0.00 H new ATOM 0 HA LYS A 42 -0.144 16.703 -3.346 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -2.226 15.085 -1.945 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -1.934 16.812 -1.916 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -2.891 15.317 -4.402 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -3.980 16.081 -3.261 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -2.111 18.102 -3.795 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -2.289 17.310 -5.348 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -4.751 17.588 -5.248 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -4.633 18.281 -3.643 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -4.817 19.992 -5.326 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -3.308 20.094 -4.554 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -3.422 19.422 -6.109 1.00 0.00 H new ATOM 282 N VAL A 43 0.353 13.700 -2.166 1.00 0.00 N ATOM 283 CA VAL A 43 1.211 12.915 -1.294 1.00 0.00 C ATOM 284 C VAL A 43 2.248 12.173 -2.139 1.00 0.00 C ATOM 285 O VAL A 43 1.999 11.862 -3.303 1.00 0.00 O ATOM 286 CB VAL A 43 0.363 11.978 -0.430 1.00 0.00 C ATOM 287 CG1 VAL A 43 -1.005 11.731 -1.071 1.00 0.00 C ATOM 288 CG2 VAL A 43 1.095 10.660 -0.170 1.00 0.00 C ATOM 0 H VAL A 43 -0.280 13.152 -2.748 1.00 0.00 H new ATOM 0 HA VAL A 43 1.755 13.565 -0.608 1.00 0.00 H new ATOM 0 HB VAL A 43 0.199 12.464 0.532 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -1.588 11.062 -0.438 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -1.532 12.679 -1.180 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -0.870 11.276 -2.052 1.00 0.00 H new ATOM 0 HG21 VAL A 43 0.471 10.013 0.446 1.00 0.00 H new ATOM 0 HG22 VAL A 43 1.304 10.166 -1.119 1.00 0.00 H new ATOM 0 HG23 VAL A 43 2.032 10.861 0.349 1.00 0.00 H new ATOM 298 N ASN A 44 3.390 11.910 -1.521 1.00 0.00 N ATOM 299 CA ASN A 44 4.467 11.211 -2.201 1.00 0.00 C ATOM 300 C ASN A 44 4.301 9.704 -1.995 1.00 0.00 C ATOM 301 O ASN A 44 4.161 9.241 -0.864 1.00 0.00 O ATOM 302 CB ASN A 44 5.831 11.618 -1.640 1.00 0.00 C ATOM 303 CG ASN A 44 6.558 12.563 -2.597 1.00 0.00 C ATOM 304 OD1 ASN A 44 6.080 12.892 -3.670 1.00 0.00 O ATOM 305 ND2 ASN A 44 7.739 12.982 -2.151 1.00 0.00 N ATOM 0 H ASN A 44 3.593 12.169 -0.555 1.00 0.00 H new ATOM 0 HA ASN A 44 4.421 11.470 -3.259 1.00 0.00 H new ATOM 0 HB2 ASN A 44 5.700 12.104 -0.673 1.00 0.00 H new ATOM 0 HB3 ASN A 44 6.438 10.729 -1.470 1.00 0.00 H new ATOM 0 HD21 ASN A 44 8.302 13.617 -2.717 1.00 0.00 H new ATOM 0 HD22 ASN A 44 8.082 12.669 -1.243 1.00 0.00 H new ATOM 311 N LEU A 45 4.320 8.981 -3.105 1.00 0.00 N ATOM 312 CA LEU A 45 4.173 7.537 -3.060 1.00 0.00 C ATOM 313 C LEU A 45 5.555 6.892 -2.936 1.00 0.00 C ATOM 314 O LEU A 45 5.685 5.792 -2.401 1.00 0.00 O ATOM 315 CB LEU A 45 3.369 7.042 -4.264 1.00 0.00 C ATOM 316 CG LEU A 45 4.173 6.360 -5.373 1.00 0.00 C ATOM 317 CD1 LEU A 45 5.284 7.277 -5.889 1.00 0.00 C ATOM 318 CD2 LEU A 45 4.717 5.009 -4.904 1.00 0.00 C ATOM 0 H LEU A 45 4.435 9.369 -4.041 1.00 0.00 H new ATOM 0 HA LEU A 45 3.602 7.239 -2.181 1.00 0.00 H new ATOM 0 HB2 LEU A 45 2.613 6.342 -3.908 1.00 0.00 H new ATOM 0 HB3 LEU A 45 2.839 7.891 -4.696 1.00 0.00 H new ATOM 0 HG LEU A 45 3.502 6.165 -6.210 1.00 0.00 H new ATOM 0 HD11 LEU A 45 5.840 6.768 -6.676 1.00 0.00 H new ATOM 0 HD12 LEU A 45 4.845 8.191 -6.288 1.00 0.00 H new ATOM 0 HD13 LEU A 45 5.960 7.526 -5.071 1.00 0.00 H new ATOM 0 HD21 LEU A 45 5.284 4.545 -5.711 1.00 0.00 H new ATOM 0 HD22 LEU A 45 5.367 5.158 -4.042 1.00 0.00 H new ATOM 0 HD23 LEU A 45 3.887 4.360 -4.624 1.00 0.00 H new ATOM 329 N GLU A 46 6.553 7.604 -3.441 1.00 0.00 N ATOM 330 CA GLU A 46 7.920 7.114 -3.393 1.00 0.00 C ATOM 331 C GLU A 46 8.341 6.854 -1.945 1.00 0.00 C ATOM 332 O GLU A 46 9.047 5.887 -1.665 1.00 0.00 O ATOM 333 CB GLU A 46 8.877 8.094 -4.076 1.00 0.00 C ATOM 334 CG GLU A 46 9.465 7.488 -5.350 1.00 0.00 C ATOM 335 CD GLU A 46 10.894 6.994 -5.115 1.00 0.00 C ATOM 336 OE1 GLU A 46 11.651 7.739 -4.457 1.00 0.00 O ATOM 337 OE2 GLU A 46 11.196 5.880 -5.597 1.00 0.00 O ATOM 0 H GLU A 46 6.442 8.516 -3.885 1.00 0.00 H new ATOM 0 HA GLU A 46 7.967 6.171 -3.938 1.00 0.00 H new ATOM 0 HB2 GLU A 46 8.348 9.016 -4.318 1.00 0.00 H new ATOM 0 HB3 GLU A 46 9.682 8.359 -3.390 1.00 0.00 H new ATOM 0 HG2 GLU A 46 8.841 6.659 -5.684 1.00 0.00 H new ATOM 0 HG3 GLU A 46 9.460 8.232 -6.146 1.00 0.00 H new ATOM 342 N VAL A 47 7.888 7.735 -1.064 1.00 0.00 N ATOM 343 CA VAL A 47 8.210 7.613 0.348 1.00 0.00 C ATOM 344 C VAL A 47 7.494 6.390 0.925 1.00 0.00 C ATOM 345 O VAL A 47 7.721 6.019 2.076 1.00 0.00 O ATOM 346 CB VAL A 47 7.860 8.911 1.077 1.00 0.00 C ATOM 347 CG1 VAL A 47 8.750 10.062 0.606 1.00 0.00 C ATOM 348 CG2 VAL A 47 6.379 9.255 0.905 1.00 0.00 C ATOM 0 H VAL A 47 7.301 8.535 -1.301 1.00 0.00 H new ATOM 0 HA VAL A 47 9.280 7.458 0.485 1.00 0.00 H new ATOM 0 HB VAL A 47 8.046 8.758 2.140 1.00 0.00 H new ATOM 0 HG11 VAL A 47 8.480 10.973 1.140 1.00 0.00 H new ATOM 0 HG12 VAL A 47 9.794 9.820 0.806 1.00 0.00 H new ATOM 0 HG13 VAL A 47 8.611 10.215 -0.464 1.00 0.00 H new ATOM 0 HG21 VAL A 47 6.157 10.182 1.433 1.00 0.00 H new ATOM 0 HG22 VAL A 47 6.155 9.378 -0.155 1.00 0.00 H new ATOM 0 HG23 VAL A 47 5.769 8.450 1.314 1.00 0.00 H new ATOM 358 N ILE A 48 6.642 5.799 0.100 1.00 0.00 N ATOM 359 CA ILE A 48 5.892 4.625 0.514 1.00 0.00 C ATOM 360 C ILE A 48 6.379 3.408 -0.274 1.00 0.00 C ATOM 361 O ILE A 48 5.961 2.283 -0.007 1.00 0.00 O ATOM 362 CB ILE A 48 4.389 4.879 0.387 1.00 0.00 C ATOM 363 CG1 ILE A 48 4.092 6.376 0.281 1.00 0.00 C ATOM 364 CG2 ILE A 48 3.623 4.223 1.538 1.00 0.00 C ATOM 365 CD1 ILE A 48 4.255 7.065 1.637 1.00 0.00 C ATOM 0 H ILE A 48 6.454 6.111 -0.853 1.00 0.00 H new ATOM 0 HA ILE A 48 6.069 4.412 1.568 1.00 0.00 H new ATOM 0 HB ILE A 48 4.042 4.416 -0.537 1.00 0.00 H new ATOM 0 HG12 ILE A 48 4.763 6.833 -0.446 1.00 0.00 H new ATOM 0 HG13 ILE A 48 3.076 6.524 -0.086 1.00 0.00 H new ATOM 0 HG21 ILE A 48 2.557 4.419 1.424 1.00 0.00 H new ATOM 0 HG22 ILE A 48 3.798 3.147 1.525 1.00 0.00 H new ATOM 0 HG23 ILE A 48 3.968 4.635 2.486 1.00 0.00 H new ATOM 0 HD11 ILE A 48 4.038 8.128 1.533 1.00 0.00 H new ATOM 0 HD12 ILE A 48 3.565 6.622 2.355 1.00 0.00 H new ATOM 0 HD13 ILE A 48 5.278 6.936 1.990 1.00 0.00 H new ATOM 376 N LYS A 49 7.256 3.676 -1.231 1.00 0.00 N ATOM 377 CA LYS A 49 7.805 2.616 -2.060 1.00 0.00 C ATOM 378 C LYS A 49 8.513 1.592 -1.170 1.00 0.00 C ATOM 379 O LYS A 49 8.299 0.389 -1.312 1.00 0.00 O ATOM 380 CB LYS A 49 8.701 3.201 -3.154 1.00 0.00 C ATOM 381 CG LYS A 49 8.260 2.720 -4.538 1.00 0.00 C ATOM 382 CD LYS A 49 6.742 2.823 -4.697 1.00 0.00 C ATOM 383 CE LYS A 49 6.092 1.438 -4.663 1.00 0.00 C ATOM 384 NZ LYS A 49 4.672 1.543 -4.261 1.00 0.00 N ATOM 0 H LYS A 49 7.600 4.611 -1.451 1.00 0.00 H new ATOM 0 HA LYS A 49 7.006 2.089 -2.581 1.00 0.00 H new ATOM 0 HB2 LYS A 49 8.665 4.290 -3.115 1.00 0.00 H new ATOM 0 HB3 LYS A 49 9.736 2.909 -2.976 1.00 0.00 H new ATOM 0 HG2 LYS A 49 8.751 3.316 -5.307 1.00 0.00 H new ATOM 0 HG3 LYS A 49 8.575 1.687 -4.685 1.00 0.00 H new ATOM 0 HD2 LYS A 49 6.330 3.442 -3.899 1.00 0.00 H new ATOM 0 HD3 LYS A 49 6.504 3.317 -5.639 1.00 0.00 H new ATOM 0 HE2 LYS A 49 6.165 0.971 -5.645 1.00 0.00 H new ATOM 0 HE3 LYS A 49 6.628 0.795 -3.964 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 4.219 0.610 -4.341 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 4.613 1.873 -3.277 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 4.184 2.219 -4.883 1.00 0.00 H new ATOM 394 N PRO A 50 9.361 2.120 -0.249 1.00 0.00 N ATOM 395 CA PRO A 50 10.100 1.265 0.665 1.00 0.00 C ATOM 396 C PRO A 50 9.188 0.720 1.766 1.00 0.00 C ATOM 397 O PRO A 50 9.440 -0.354 2.311 1.00 0.00 O ATOM 398 CB PRO A 50 11.222 2.139 1.201 1.00 0.00 C ATOM 399 CG PRO A 50 10.798 3.574 0.931 1.00 0.00 C ATOM 400 CD PRO A 50 9.637 3.540 -0.051 1.00 0.00 C ATOM 0 HA PRO A 50 10.503 0.377 0.177 1.00 0.00 H new ATOM 0 HB2 PRO A 50 11.373 1.970 2.267 1.00 0.00 H new ATOM 0 HB3 PRO A 50 12.166 1.911 0.705 1.00 0.00 H new ATOM 0 HG2 PRO A 50 10.500 4.065 1.858 1.00 0.00 H new ATOM 0 HG3 PRO A 50 11.629 4.147 0.520 1.00 0.00 H new ATOM 0 HD2 PRO A 50 8.766 4.061 0.347 1.00 0.00 H new ATOM 0 HD3 PRO A 50 9.898 4.027 -0.990 1.00 0.00 H new ATOM 405 N TRP A 51 8.147 1.485 2.060 1.00 0.00 N ATOM 406 CA TRP A 51 7.197 1.092 3.086 1.00 0.00 C ATOM 407 C TRP A 51 6.332 -0.038 2.523 1.00 0.00 C ATOM 408 O TRP A 51 6.084 -1.033 3.202 1.00 0.00 O ATOM 409 CB TRP A 51 6.376 2.292 3.562 1.00 0.00 C ATOM 410 CG TRP A 51 5.459 1.988 4.749 1.00 0.00 C ATOM 411 CD1 TRP A 51 5.650 2.300 6.038 1.00 0.00 C ATOM 412 CD2 TRP A 51 4.193 1.298 4.703 1.00 0.00 C ATOM 413 NE1 TRP A 51 4.603 1.861 6.824 1.00 0.00 N ATOM 414 CE2 TRP A 51 3.689 1.232 5.986 1.00 0.00 C ATOM 415 CE3 TRP A 51 3.496 0.746 3.613 1.00 0.00 C ATOM 416 CZ2 TRP A 51 2.468 0.624 6.300 1.00 0.00 C ATOM 417 CZ3 TRP A 51 2.278 0.141 3.944 1.00 0.00 C ATOM 418 CH2 TRP A 51 1.757 0.067 5.230 1.00 0.00 C ATOM 0 H TRP A 51 7.941 2.375 1.606 1.00 0.00 H new ATOM 0 HA TRP A 51 7.716 0.725 3.971 1.00 0.00 H new ATOM 0 HB2 TRP A 51 7.056 3.098 3.839 1.00 0.00 H new ATOM 0 HB3 TRP A 51 5.770 2.657 2.732 1.00 0.00 H new ATOM 0 HD1 TRP A 51 6.514 2.828 6.415 1.00 0.00 H new ATOM 0 HE1 TRP A 51 4.516 1.977 7.834 1.00 0.00 H new ATOM 0 HE3 TRP A 51 3.871 0.786 2.601 1.00 0.00 H new ATOM 0 HZ2 TRP A 51 2.095 0.587 7.313 1.00 0.00 H new ATOM 0 HZ3 TRP A 51 1.702 -0.299 3.143 1.00 0.00 H new ATOM 0 HH2 TRP A 51 0.808 -0.418 5.404 1.00 0.00 H new ATOM 428 N ILE A 52 5.897 0.154 1.286 1.00 0.00 N ATOM 429 CA ILE A 52 5.067 -0.836 0.623 1.00 0.00 C ATOM 430 C ILE A 52 5.910 -2.072 0.303 1.00 0.00 C ATOM 431 O ILE A 52 5.531 -3.192 0.642 1.00 0.00 O ATOM 432 CB ILE A 52 4.379 -0.228 -0.601 1.00 0.00 C ATOM 433 CG1 ILE A 52 3.042 0.409 -0.219 1.00 0.00 C ATOM 434 CG2 ILE A 52 4.222 -1.264 -1.715 1.00 0.00 C ATOM 435 CD1 ILE A 52 2.928 1.828 -0.783 1.00 0.00 C ATOM 0 H ILE A 52 6.104 0.981 0.726 1.00 0.00 H new ATOM 0 HA ILE A 52 4.263 -1.160 1.283 1.00 0.00 H new ATOM 0 HB ILE A 52 5.016 0.567 -0.989 1.00 0.00 H new ATOM 0 HG12 ILE A 52 2.223 -0.203 -0.597 1.00 0.00 H new ATOM 0 HG13 ILE A 52 2.945 0.437 0.866 1.00 0.00 H new ATOM 0 HG21 ILE A 52 3.730 -0.805 -2.572 1.00 0.00 H new ATOM 0 HG22 ILE A 52 5.205 -1.629 -2.013 1.00 0.00 H new ATOM 0 HG23 ILE A 52 3.619 -2.097 -1.354 1.00 0.00 H new ATOM 0 HD11 ILE A 52 1.968 2.257 -0.496 1.00 0.00 H new ATOM 0 HD12 ILE A 52 3.734 2.444 -0.385 1.00 0.00 H new ATOM 0 HD13 ILE A 52 3.000 1.794 -1.870 1.00 0.00 H new ATOM 446 N THR A 53 7.038 -1.827 -0.347 1.00 0.00 N ATOM 447 CA THR A 53 7.939 -2.906 -0.716 1.00 0.00 C ATOM 448 C THR A 53 8.378 -3.683 0.526 1.00 0.00 C ATOM 449 O THR A 53 8.477 -4.909 0.493 1.00 0.00 O ATOM 450 CB THR A 53 9.106 -2.301 -1.498 1.00 0.00 C ATOM 451 OG1 THR A 53 8.485 -1.662 -2.610 1.00 0.00 O ATOM 452 CG2 THR A 53 10.001 -3.367 -2.133 1.00 0.00 C ATOM 0 H THR A 53 7.349 -0.897 -0.628 1.00 0.00 H new ATOM 0 HA THR A 53 7.442 -3.634 -1.357 1.00 0.00 H new ATOM 0 HB THR A 53 9.702 -1.676 -0.833 1.00 0.00 H new ATOM 0 HG1 THR A 53 8.283 -0.731 -2.381 1.00 0.00 H new ATOM 0 HG21 THR A 53 10.813 -2.884 -2.676 1.00 0.00 H new ATOM 0 HG22 THR A 53 10.415 -4.006 -1.353 1.00 0.00 H new ATOM 0 HG23 THR A 53 9.413 -3.972 -2.823 1.00 0.00 H new ATOM 460 N LYS A 54 8.630 -2.939 1.593 1.00 0.00 N ATOM 461 CA LYS A 54 9.056 -3.542 2.843 1.00 0.00 C ATOM 462 C LYS A 54 7.864 -4.241 3.500 1.00 0.00 C ATOM 463 O LYS A 54 8.025 -5.277 4.144 1.00 0.00 O ATOM 464 CB LYS A 54 9.727 -2.500 3.740 1.00 0.00 C ATOM 465 CG LYS A 54 10.260 -3.142 5.024 1.00 0.00 C ATOM 466 CD LYS A 54 10.078 -2.206 6.221 1.00 0.00 C ATOM 467 CE LYS A 54 8.983 -2.721 7.156 1.00 0.00 C ATOM 468 NZ LYS A 54 7.953 -1.680 7.373 1.00 0.00 N ATOM 0 H LYS A 54 8.547 -1.923 1.617 1.00 0.00 H new ATOM 0 HA LYS A 54 9.812 -4.305 2.658 1.00 0.00 H new ATOM 0 HB2 LYS A 54 10.546 -2.024 3.200 1.00 0.00 H new ATOM 0 HB3 LYS A 54 9.012 -1.716 3.991 1.00 0.00 H new ATOM 0 HG2 LYS A 54 9.738 -4.081 5.209 1.00 0.00 H new ATOM 0 HG3 LYS A 54 11.316 -3.383 4.903 1.00 0.00 H new ATOM 0 HD2 LYS A 54 11.017 -2.121 6.767 1.00 0.00 H new ATOM 0 HD3 LYS A 54 9.822 -1.206 5.870 1.00 0.00 H new ATOM 0 HE2 LYS A 54 8.523 -3.613 6.730 1.00 0.00 H new ATOM 0 HE3 LYS A 54 9.420 -3.013 8.111 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 7.217 -2.047 8.010 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 8.393 -0.840 7.800 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 7.524 -1.421 6.462 1.00 0.00 H new ATOM 478 N ARG A 55 6.695 -3.647 3.314 1.00 0.00 N ATOM 479 CA ARG A 55 5.476 -4.200 3.880 1.00 0.00 C ATOM 480 C ARG A 55 5.073 -5.473 3.133 1.00 0.00 C ATOM 481 O ARG A 55 4.811 -6.504 3.751 1.00 0.00 O ATOM 482 CB ARG A 55 4.328 -3.191 3.809 1.00 0.00 C ATOM 483 CG ARG A 55 4.212 -2.399 5.113 1.00 0.00 C ATOM 484 CD ARG A 55 3.713 -3.291 6.252 1.00 0.00 C ATOM 485 NE ARG A 55 3.921 -2.615 7.552 1.00 0.00 N ATOM 486 CZ ARG A 55 3.645 -3.170 8.741 1.00 0.00 C ATOM 487 NH1 ARG A 55 3.148 -4.413 8.800 1.00 0.00 N ATOM 488 NH2 ARG A 55 3.866 -2.482 9.869 1.00 0.00 N ATOM 0 H ARG A 55 6.566 -2.788 2.779 1.00 0.00 H new ATOM 0 HA ARG A 55 5.674 -4.435 4.926 1.00 0.00 H new ATOM 0 HB2 ARG A 55 4.492 -2.506 2.977 1.00 0.00 H new ATOM 0 HB3 ARG A 55 3.392 -3.713 3.612 1.00 0.00 H new ATOM 0 HG2 ARG A 55 5.183 -1.977 5.375 1.00 0.00 H new ATOM 0 HG3 ARG A 55 3.528 -1.562 4.975 1.00 0.00 H new ATOM 0 HD2 ARG A 55 2.655 -3.514 6.114 1.00 0.00 H new ATOM 0 HD3 ARG A 55 4.244 -4.243 6.239 1.00 0.00 H new ATOM 0 HE ARG A 55 4.298 -1.667 7.543 1.00 0.00 H new ATOM 0 HH11 ARG A 55 2.980 -4.936 7.941 1.00 0.00 H new ATOM 0 HH12 ARG A 55 2.938 -4.836 9.704 1.00 0.00 H new ATOM 0 HH21 ARG A 55 4.244 -1.536 9.823 1.00 0.00 H new ATOM 0 HH22 ARG A 55 3.656 -2.904 10.773 1.00 0.00 H new ATOM 499 N VAL A 56 5.038 -5.360 1.813 1.00 0.00 N ATOM 500 CA VAL A 56 4.673 -6.489 0.975 1.00 0.00 C ATOM 501 C VAL A 56 5.692 -7.614 1.168 1.00 0.00 C ATOM 502 O VAL A 56 5.324 -8.786 1.235 1.00 0.00 O ATOM 503 CB VAL A 56 4.547 -6.040 -0.483 1.00 0.00 C ATOM 504 CG1 VAL A 56 3.359 -5.094 -0.664 1.00 0.00 C ATOM 505 CG2 VAL A 56 5.844 -5.392 -0.970 1.00 0.00 C ATOM 0 H VAL A 56 5.256 -4.504 1.304 1.00 0.00 H new ATOM 0 HA VAL A 56 3.698 -6.880 1.266 1.00 0.00 H new ATOM 0 HB VAL A 56 4.366 -6.925 -1.093 1.00 0.00 H new ATOM 0 HG11 VAL A 56 3.292 -4.790 -1.709 1.00 0.00 H new ATOM 0 HG12 VAL A 56 2.440 -5.604 -0.375 1.00 0.00 H new ATOM 0 HG13 VAL A 56 3.497 -4.213 -0.038 1.00 0.00 H new ATOM 0 HG21 VAL A 56 5.728 -5.082 -2.009 1.00 0.00 H new ATOM 0 HG22 VAL A 56 6.069 -4.521 -0.354 1.00 0.00 H new ATOM 0 HG23 VAL A 56 6.660 -6.110 -0.895 1.00 0.00 H new ATOM 515 N THR A 57 6.954 -7.218 1.253 1.00 0.00 N ATOM 516 CA THR A 57 8.029 -8.177 1.437 1.00 0.00 C ATOM 517 C THR A 57 7.953 -8.802 2.831 1.00 0.00 C ATOM 518 O THR A 57 8.183 -10.000 2.993 1.00 0.00 O ATOM 519 CB THR A 57 9.354 -7.463 1.163 1.00 0.00 C ATOM 520 OG1 THR A 57 9.257 -7.064 -0.203 1.00 0.00 O ATOM 521 CG2 THR A 57 10.549 -8.416 1.189 1.00 0.00 C ATOM 0 H THR A 57 7.256 -6.245 1.198 1.00 0.00 H new ATOM 0 HA THR A 57 7.941 -9.008 0.737 1.00 0.00 H new ATOM 0 HB THR A 57 9.502 -6.676 1.903 1.00 0.00 H new ATOM 0 HG1 THR A 57 9.168 -6.089 -0.254 1.00 0.00 H new ATOM 0 HG21 THR A 57 11.464 -7.858 0.989 1.00 0.00 H new ATOM 0 HG22 THR A 57 10.618 -8.886 2.170 1.00 0.00 H new ATOM 0 HG23 THR A 57 10.418 -9.184 0.427 1.00 0.00 H new ATOM 529 N GLU A 58 7.628 -7.963 3.804 1.00 0.00 N ATOM 530 CA GLU A 58 7.518 -8.417 5.180 1.00 0.00 C ATOM 531 C GLU A 58 6.246 -9.246 5.365 1.00 0.00 C ATOM 532 O GLU A 58 6.199 -10.137 6.212 1.00 0.00 O ATOM 533 CB GLU A 58 7.551 -7.237 6.152 1.00 0.00 C ATOM 534 CG GLU A 58 8.990 -6.814 6.454 1.00 0.00 C ATOM 535 CD GLU A 58 9.150 -6.431 7.927 1.00 0.00 C ATOM 536 OE1 GLU A 58 8.461 -5.477 8.344 1.00 0.00 O ATOM 537 OE2 GLU A 58 9.962 -7.103 8.602 1.00 0.00 O ATOM 0 H GLU A 58 7.437 -6.971 3.666 1.00 0.00 H new ATOM 0 HA GLU A 58 8.376 -9.051 5.402 1.00 0.00 H new ATOM 0 HB2 GLU A 58 7.003 -6.396 5.727 1.00 0.00 H new ATOM 0 HB3 GLU A 58 7.047 -7.511 7.079 1.00 0.00 H new ATOM 0 HG2 GLU A 58 9.671 -7.629 6.210 1.00 0.00 H new ATOM 0 HG3 GLU A 58 9.265 -5.969 5.823 1.00 0.00 H new ATOM 542 N ILE A 59 5.245 -8.923 4.559 1.00 0.00 N ATOM 543 CA ILE A 59 3.976 -9.626 4.624 1.00 0.00 C ATOM 544 C ILE A 59 4.216 -11.123 4.415 1.00 0.00 C ATOM 545 O ILE A 59 3.697 -11.949 5.165 1.00 0.00 O ATOM 546 CB ILE A 59 2.976 -9.020 3.638 1.00 0.00 C ATOM 547 CG1 ILE A 59 2.362 -7.735 4.198 1.00 0.00 C ATOM 548 CG2 ILE A 59 1.907 -10.041 3.243 1.00 0.00 C ATOM 549 CD1 ILE A 59 1.955 -6.784 3.072 1.00 0.00 C ATOM 0 H ILE A 59 5.288 -8.184 3.858 1.00 0.00 H new ATOM 0 HA ILE A 59 3.526 -9.509 5.610 1.00 0.00 H new ATOM 0 HB ILE A 59 3.515 -8.750 2.730 1.00 0.00 H new ATOM 0 HG12 ILE A 59 1.490 -7.979 4.805 1.00 0.00 H new ATOM 0 HG13 ILE A 59 3.079 -7.241 4.854 1.00 0.00 H new ATOM 0 HG21 ILE A 59 1.209 -9.584 2.541 1.00 0.00 H new ATOM 0 HG22 ILE A 59 2.382 -10.902 2.773 1.00 0.00 H new ATOM 0 HG23 ILE A 59 1.367 -10.365 4.133 1.00 0.00 H new ATOM 0 HD11 ILE A 59 1.522 -5.879 3.499 1.00 0.00 H new ATOM 0 HD12 ILE A 59 2.833 -6.522 2.482 1.00 0.00 H new ATOM 0 HD13 ILE A 59 1.220 -7.272 2.432 1.00 0.00 H new ATOM 560 N LEU A 60 4.999 -11.426 3.392 1.00 0.00 N ATOM 561 CA LEU A 60 5.314 -12.809 3.074 1.00 0.00 C ATOM 562 C LEU A 60 6.696 -13.154 3.632 1.00 0.00 C ATOM 563 O LEU A 60 6.876 -14.201 4.252 1.00 0.00 O ATOM 564 CB LEU A 60 5.179 -13.058 1.570 1.00 0.00 C ATOM 565 CG LEU A 60 4.868 -11.829 0.713 1.00 0.00 C ATOM 566 CD1 LEU A 60 6.150 -11.079 0.345 1.00 0.00 C ATOM 567 CD2 LEU A 60 4.056 -12.216 -0.525 1.00 0.00 C ATOM 0 H LEU A 60 5.426 -10.738 2.771 1.00 0.00 H new ATOM 0 HA LEU A 60 4.600 -13.481 3.550 1.00 0.00 H new ATOM 0 HB2 LEU A 60 6.107 -13.502 1.210 1.00 0.00 H new ATOM 0 HB3 LEU A 60 4.391 -13.795 1.413 1.00 0.00 H new ATOM 0 HG LEU A 60 4.254 -11.148 1.302 1.00 0.00 H new ATOM 0 HD11 LEU A 60 5.901 -10.210 -0.264 1.00 0.00 H new ATOM 0 HD12 LEU A 60 6.654 -10.752 1.254 1.00 0.00 H new ATOM 0 HD13 LEU A 60 6.809 -11.740 -0.218 1.00 0.00 H new ATOM 0 HD21 LEU A 60 3.848 -11.325 -1.117 1.00 0.00 H new ATOM 0 HD22 LEU A 60 4.624 -12.926 -1.126 1.00 0.00 H new ATOM 0 HD23 LEU A 60 3.116 -12.673 -0.215 1.00 0.00 H new ATOM 578 N GLY A 61 7.639 -12.254 3.391 1.00 0.00 N ATOM 579 CA GLY A 61 8.999 -12.450 3.862 1.00 0.00 C ATOM 580 C GLY A 61 10.001 -12.327 2.712 1.00 0.00 C ATOM 581 O GLY A 61 11.209 -12.290 2.938 1.00 0.00 O ATOM 0 H GLY A 61 7.487 -11.387 2.875 1.00 0.00 H new ATOM 0 HA2 GLY A 61 9.231 -11.713 4.631 1.00 0.00 H new ATOM 0 HA3 GLY A 61 9.089 -13.433 4.324 1.00 0.00 H new ATOM 585 N PHE A 62 9.460 -12.266 1.504 1.00 0.00 N ATOM 586 CA PHE A 62 10.291 -12.146 0.318 1.00 0.00 C ATOM 587 C PHE A 62 9.829 -10.983 -0.562 1.00 0.00 C ATOM 588 O PHE A 62 8.658 -10.607 -0.533 1.00 0.00 O ATOM 589 CB PHE A 62 10.144 -13.452 -0.464 1.00 0.00 C ATOM 590 CG PHE A 62 8.711 -13.983 -0.525 1.00 0.00 C ATOM 591 CD1 PHE A 62 7.832 -13.467 -1.426 1.00 0.00 C ATOM 592 CD2 PHE A 62 8.314 -14.971 0.322 1.00 0.00 C ATOM 593 CE1 PHE A 62 6.501 -13.960 -1.481 1.00 0.00 C ATOM 594 CE2 PHE A 62 6.983 -15.463 0.266 1.00 0.00 C ATOM 595 CZ PHE A 62 6.106 -14.948 -0.635 1.00 0.00 C ATOM 0 H PHE A 62 8.457 -12.297 1.321 1.00 0.00 H new ATOM 0 HA PHE A 62 11.325 -11.958 0.606 1.00 0.00 H new ATOM 0 HB2 PHE A 62 10.507 -13.298 -1.480 1.00 0.00 H new ATOM 0 HB3 PHE A 62 10.782 -14.210 -0.009 1.00 0.00 H new ATOM 0 HD1 PHE A 62 8.146 -12.683 -2.099 1.00 0.00 H new ATOM 0 HD2 PHE A 62 9.011 -15.381 1.037 1.00 0.00 H new ATOM 0 HE1 PHE A 62 5.803 -13.550 -2.195 1.00 0.00 H new ATOM 0 HE2 PHE A 62 6.668 -16.246 0.939 1.00 0.00 H new ATOM 0 HZ PHE A 62 5.094 -15.324 -0.679 1.00 0.00 H new ATOM 604 N GLU A 63 10.772 -10.446 -1.322 1.00 0.00 N ATOM 605 CA GLU A 63 10.475 -9.334 -2.208 1.00 0.00 C ATOM 606 C GLU A 63 9.570 -9.794 -3.353 1.00 0.00 C ATOM 607 O GLU A 63 10.007 -10.525 -4.241 1.00 0.00 O ATOM 608 CB GLU A 63 11.761 -8.704 -2.747 1.00 0.00 C ATOM 609 CG GLU A 63 11.543 -7.232 -3.104 1.00 0.00 C ATOM 610 CD GLU A 63 12.877 -6.520 -3.334 1.00 0.00 C ATOM 611 OE1 GLU A 63 13.388 -6.624 -4.470 1.00 0.00 O ATOM 612 OE2 GLU A 63 13.356 -5.887 -2.368 1.00 0.00 O ATOM 0 H GLU A 63 11.742 -10.760 -1.342 1.00 0.00 H new ATOM 0 HA GLU A 63 9.946 -8.571 -1.636 1.00 0.00 H new ATOM 0 HB2 GLU A 63 12.551 -8.788 -2.001 1.00 0.00 H new ATOM 0 HB3 GLU A 63 12.096 -9.250 -3.629 1.00 0.00 H new ATOM 0 HG2 GLU A 63 10.928 -7.159 -4.001 1.00 0.00 H new ATOM 0 HG3 GLU A 63 10.996 -6.737 -2.302 1.00 0.00 H new ATOM 617 N ASP A 64 8.324 -9.348 -3.295 1.00 0.00 N ATOM 618 CA ASP A 64 7.353 -9.704 -4.316 1.00 0.00 C ATOM 619 C ASP A 64 7.733 -9.028 -5.634 1.00 0.00 C ATOM 620 O ASP A 64 8.911 -8.790 -5.897 1.00 0.00 O ATOM 621 CB ASP A 64 5.950 -9.232 -3.930 1.00 0.00 C ATOM 622 CG ASP A 64 5.690 -9.139 -2.425 1.00 0.00 C ATOM 623 OD1 ASP A 64 6.553 -8.556 -1.734 1.00 0.00 O ATOM 624 OD2 ASP A 64 4.633 -9.653 -1.999 1.00 0.00 O ATOM 0 H ASP A 64 7.964 -8.743 -2.557 1.00 0.00 H new ATOM 0 HA ASP A 64 7.354 -10.789 -4.417 1.00 0.00 H new ATOM 0 HB2 ASP A 64 5.778 -8.252 -4.374 1.00 0.00 H new ATOM 0 HB3 ASP A 64 5.221 -9.913 -4.368 1.00 0.00 H new ATOM 628 N ASP A 65 6.714 -8.738 -6.429 1.00 0.00 N ATOM 629 CA ASP A 65 6.927 -8.093 -7.714 1.00 0.00 C ATOM 630 C ASP A 65 5.575 -7.691 -8.308 1.00 0.00 C ATOM 631 O ASP A 65 5.352 -6.522 -8.616 1.00 0.00 O ATOM 632 CB ASP A 65 7.613 -9.042 -8.699 1.00 0.00 C ATOM 633 CG ASP A 65 8.919 -8.518 -9.299 1.00 0.00 C ATOM 634 OD1 ASP A 65 9.404 -7.484 -8.788 1.00 0.00 O ATOM 635 OD2 ASP A 65 9.404 -9.162 -10.253 1.00 0.00 O ATOM 0 H ASP A 65 5.738 -8.938 -6.209 1.00 0.00 H new ATOM 0 HA ASP A 65 7.560 -7.221 -7.553 1.00 0.00 H new ATOM 0 HB2 ASP A 65 7.817 -9.984 -8.190 1.00 0.00 H new ATOM 0 HB3 ASP A 65 6.920 -9.262 -9.511 1.00 0.00 H new ATOM 639 N VAL A 66 4.709 -8.683 -8.452 1.00 0.00 N ATOM 640 CA VAL A 66 3.386 -8.447 -9.004 1.00 0.00 C ATOM 641 C VAL A 66 2.601 -7.532 -8.062 1.00 0.00 C ATOM 642 O VAL A 66 1.875 -6.648 -8.513 1.00 0.00 O ATOM 643 CB VAL A 66 2.683 -9.781 -9.265 1.00 0.00 C ATOM 644 CG1 VAL A 66 1.722 -10.127 -8.126 1.00 0.00 C ATOM 645 CG2 VAL A 66 1.954 -9.763 -10.610 1.00 0.00 C ATOM 0 H VAL A 66 4.898 -9.652 -8.196 1.00 0.00 H new ATOM 0 HA VAL A 66 3.458 -7.939 -9.966 1.00 0.00 H new ATOM 0 HB VAL A 66 3.446 -10.558 -9.308 1.00 0.00 H new ATOM 0 HG11 VAL A 66 1.236 -11.080 -8.337 1.00 0.00 H new ATOM 0 HG12 VAL A 66 2.278 -10.202 -7.191 1.00 0.00 H new ATOM 0 HG13 VAL A 66 0.967 -9.346 -8.037 1.00 0.00 H new ATOM 0 HG21 VAL A 66 1.463 -10.723 -10.771 1.00 0.00 H new ATOM 0 HG22 VAL A 66 1.207 -8.969 -10.608 1.00 0.00 H new ATOM 0 HG23 VAL A 66 2.672 -9.584 -11.411 1.00 0.00 H new ATOM 655 N VAL A 67 2.775 -7.776 -6.771 1.00 0.00 N ATOM 656 CA VAL A 67 2.092 -6.984 -5.762 1.00 0.00 C ATOM 657 C VAL A 67 2.722 -5.593 -5.699 1.00 0.00 C ATOM 658 O VAL A 67 2.015 -4.589 -5.624 1.00 0.00 O ATOM 659 CB VAL A 67 2.118 -7.715 -4.418 1.00 0.00 C ATOM 660 CG1 VAL A 67 2.232 -9.227 -4.618 1.00 0.00 C ATOM 661 CG2 VAL A 67 3.251 -7.192 -3.533 1.00 0.00 C ATOM 0 H VAL A 67 3.379 -8.510 -6.401 1.00 0.00 H new ATOM 0 HA VAL A 67 1.042 -6.853 -6.025 1.00 0.00 H new ATOM 0 HB VAL A 67 1.175 -7.515 -3.909 1.00 0.00 H new ATOM 0 HG11 VAL A 67 2.248 -9.722 -3.647 1.00 0.00 H new ATOM 0 HG12 VAL A 67 1.377 -9.583 -5.193 1.00 0.00 H new ATOM 0 HG13 VAL A 67 3.152 -9.454 -5.157 1.00 0.00 H new ATOM 0 HG21 VAL A 67 3.248 -7.728 -2.584 1.00 0.00 H new ATOM 0 HG22 VAL A 67 4.206 -7.348 -4.035 1.00 0.00 H new ATOM 0 HG23 VAL A 67 3.107 -6.127 -3.349 1.00 0.00 H new ATOM 671 N ILE A 68 4.047 -5.575 -5.731 1.00 0.00 N ATOM 672 CA ILE A 68 4.781 -4.323 -5.678 1.00 0.00 C ATOM 673 C ILE A 68 4.421 -3.473 -6.897 1.00 0.00 C ATOM 674 O ILE A 68 4.089 -2.297 -6.763 1.00 0.00 O ATOM 675 CB ILE A 68 6.281 -4.587 -5.533 1.00 0.00 C ATOM 676 CG1 ILE A 68 6.570 -5.454 -4.306 1.00 0.00 C ATOM 677 CG2 ILE A 68 7.070 -3.276 -5.506 1.00 0.00 C ATOM 678 CD1 ILE A 68 7.988 -6.027 -4.360 1.00 0.00 C ATOM 0 H ILE A 68 4.631 -6.409 -5.793 1.00 0.00 H new ATOM 0 HA ILE A 68 4.495 -3.751 -4.795 1.00 0.00 H new ATOM 0 HB ILE A 68 6.614 -5.145 -6.408 1.00 0.00 H new ATOM 0 HG12 ILE A 68 6.448 -4.860 -3.400 1.00 0.00 H new ATOM 0 HG13 ILE A 68 5.847 -6.268 -4.253 1.00 0.00 H new ATOM 0 HG21 ILE A 68 8.133 -3.493 -5.402 1.00 0.00 H new ATOM 0 HG22 ILE A 68 6.900 -2.730 -6.434 1.00 0.00 H new ATOM 0 HG23 ILE A 68 6.740 -2.670 -4.663 1.00 0.00 H new ATOM 0 HD11 ILE A 68 8.167 -6.639 -3.476 1.00 0.00 H new ATOM 0 HD12 ILE A 68 8.099 -6.640 -5.254 1.00 0.00 H new ATOM 0 HD13 ILE A 68 8.710 -5.210 -4.388 1.00 0.00 H new ATOM 689 N GLU A 69 4.499 -4.103 -8.061 1.00 0.00 N ATOM 690 CA GLU A 69 4.185 -3.419 -9.304 1.00 0.00 C ATOM 691 C GLU A 69 2.767 -2.849 -9.253 1.00 0.00 C ATOM 692 O GLU A 69 2.530 -1.724 -9.692 1.00 0.00 O ATOM 693 CB GLU A 69 4.357 -4.355 -10.503 1.00 0.00 C ATOM 694 CG GLU A 69 5.653 -4.049 -11.256 1.00 0.00 C ATOM 695 CD GLU A 69 5.446 -4.157 -12.768 1.00 0.00 C ATOM 696 OE1 GLU A 69 4.326 -3.830 -13.214 1.00 0.00 O ATOM 697 OE2 GLU A 69 6.415 -4.566 -13.445 1.00 0.00 O ATOM 0 H GLU A 69 4.775 -5.079 -8.169 1.00 0.00 H new ATOM 0 HA GLU A 69 4.884 -2.591 -9.427 1.00 0.00 H new ATOM 0 HB2 GLU A 69 4.366 -5.390 -10.162 1.00 0.00 H new ATOM 0 HB3 GLU A 69 3.507 -4.249 -11.177 1.00 0.00 H new ATOM 0 HG2 GLU A 69 5.997 -3.046 -11.003 1.00 0.00 H new ATOM 0 HG3 GLU A 69 6.433 -4.742 -10.942 1.00 0.00 H new ATOM 702 N PHE A 70 1.859 -3.651 -8.714 1.00 0.00 N ATOM 703 CA PHE A 70 0.470 -3.240 -8.600 1.00 0.00 C ATOM 704 C PHE A 70 0.347 -1.943 -7.796 1.00 0.00 C ATOM 705 O PHE A 70 -0.360 -1.022 -8.204 1.00 0.00 O ATOM 706 CB PHE A 70 -0.267 -4.357 -7.859 1.00 0.00 C ATOM 707 CG PHE A 70 -0.870 -5.421 -8.778 1.00 0.00 C ATOM 708 CD1 PHE A 70 -1.595 -5.047 -9.867 1.00 0.00 C ATOM 709 CD2 PHE A 70 -0.680 -6.740 -8.508 1.00 0.00 C ATOM 710 CE1 PHE A 70 -2.155 -6.035 -10.720 1.00 0.00 C ATOM 711 CE2 PHE A 70 -1.240 -7.728 -9.361 1.00 0.00 C ATOM 712 CZ PHE A 70 -1.965 -7.354 -10.449 1.00 0.00 C ATOM 0 H PHE A 70 2.059 -4.583 -8.352 1.00 0.00 H new ATOM 0 HA PHE A 70 0.051 -3.064 -9.591 1.00 0.00 H new ATOM 0 HB2 PHE A 70 0.425 -4.838 -7.168 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -1.063 -3.917 -7.258 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -1.745 -3.999 -10.083 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -0.103 -7.037 -7.645 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -2.732 -5.739 -11.584 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -1.090 -8.776 -9.146 1.00 0.00 H new ATOM 0 HZ PHE A 70 -2.390 -8.105 -11.098 1.00 0.00 H new ATOM 721 N ILE A 71 1.045 -1.913 -6.671 1.00 0.00 N ATOM 722 CA ILE A 71 1.022 -0.745 -5.808 1.00 0.00 C ATOM 723 C ILE A 71 1.800 0.392 -6.474 1.00 0.00 C ATOM 724 O ILE A 71 1.350 1.537 -6.479 1.00 0.00 O ATOM 725 CB ILE A 71 1.531 -1.102 -4.409 1.00 0.00 C ATOM 726 CG1 ILE A 71 0.684 -2.212 -3.784 1.00 0.00 C ATOM 727 CG2 ILE A 71 1.597 0.139 -3.517 1.00 0.00 C ATOM 728 CD1 ILE A 71 1.555 -3.402 -3.378 1.00 0.00 C ATOM 0 H ILE A 71 1.630 -2.679 -6.337 1.00 0.00 H new ATOM 0 HA ILE A 71 -0.001 -0.394 -5.670 1.00 0.00 H new ATOM 0 HB ILE A 71 2.547 -1.486 -4.503 1.00 0.00 H new ATOM 0 HG12 ILE A 71 0.159 -1.826 -2.910 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -0.076 -2.538 -4.494 1.00 0.00 H new ATOM 0 HG21 ILE A 71 1.962 -0.142 -2.529 1.00 0.00 H new ATOM 0 HG22 ILE A 71 2.274 0.869 -3.959 1.00 0.00 H new ATOM 0 HG23 ILE A 71 0.602 0.575 -3.426 1.00 0.00 H new ATOM 0 HD11 ILE A 71 0.929 -4.177 -2.936 1.00 0.00 H new ATOM 0 HD12 ILE A 71 2.060 -3.801 -4.258 1.00 0.00 H new ATOM 0 HD13 ILE A 71 2.298 -3.077 -2.650 1.00 0.00 H new ATOM 739 N PHE A 72 2.953 0.036 -7.019 1.00 0.00 N ATOM 740 CA PHE A 72 3.798 1.012 -7.686 1.00 0.00 C ATOM 741 C PHE A 72 3.098 1.595 -8.916 1.00 0.00 C ATOM 742 O PHE A 72 3.059 2.810 -9.094 1.00 0.00 O ATOM 743 CB PHE A 72 5.062 0.276 -8.135 1.00 0.00 C ATOM 744 CG PHE A 72 6.348 1.090 -7.971 1.00 0.00 C ATOM 745 CD1 PHE A 72 6.310 2.447 -8.065 1.00 0.00 C ATOM 746 CD2 PHE A 72 7.527 0.457 -7.730 1.00 0.00 C ATOM 747 CE1 PHE A 72 7.503 3.202 -7.913 1.00 0.00 C ATOM 748 CE2 PHE A 72 8.719 1.213 -7.577 1.00 0.00 C ATOM 749 CZ PHE A 72 8.682 2.570 -7.672 1.00 0.00 C ATOM 0 H PHE A 72 3.322 -0.915 -7.013 1.00 0.00 H new ATOM 0 HA PHE A 72 4.024 1.834 -7.007 1.00 0.00 H new ATOM 0 HB2 PHE A 72 5.154 -0.648 -7.564 1.00 0.00 H new ATOM 0 HB3 PHE A 72 4.953 -0.005 -9.182 1.00 0.00 H new ATOM 0 HD1 PHE A 72 5.373 2.949 -8.255 1.00 0.00 H new ATOM 0 HD2 PHE A 72 7.557 -0.620 -7.655 1.00 0.00 H new ATOM 0 HE1 PHE A 72 7.474 4.279 -7.989 1.00 0.00 H new ATOM 0 HE2 PHE A 72 9.656 0.711 -7.385 1.00 0.00 H new ATOM 0 HZ PHE A 72 9.589 3.145 -7.556 1.00 0.00 H new ATOM 758 N ASN A 73 2.561 0.698 -9.731 1.00 0.00 N ATOM 759 CA ASN A 73 1.864 1.108 -10.938 1.00 0.00 C ATOM 760 C ASN A 73 0.613 1.902 -10.555 1.00 0.00 C ATOM 761 O ASN A 73 0.283 2.896 -11.199 1.00 0.00 O ATOM 762 CB ASN A 73 1.421 -0.106 -11.757 1.00 0.00 C ATOM 763 CG ASN A 73 2.573 -0.642 -12.610 1.00 0.00 C ATOM 764 OD1 ASN A 73 2.597 -0.507 -13.823 1.00 0.00 O ATOM 765 ND2 ASN A 73 3.524 -1.256 -11.911 1.00 0.00 N ATOM 0 H ASN A 73 2.595 -0.310 -9.579 1.00 0.00 H new ATOM 0 HA ASN A 73 2.547 1.715 -11.532 1.00 0.00 H new ATOM 0 HB2 ASN A 73 1.064 -0.889 -11.089 1.00 0.00 H new ATOM 0 HB3 ASN A 73 0.585 0.170 -12.400 1.00 0.00 H new ATOM 0 HD21 ASN A 73 4.335 -1.648 -12.389 1.00 0.00 H new ATOM 0 HD22 ASN A 73 3.442 -1.334 -10.897 1.00 0.00 H new ATOM 771 N GLN A 74 -0.050 1.432 -9.508 1.00 0.00 N ATOM 772 CA GLN A 74 -1.257 2.085 -9.031 1.00 0.00 C ATOM 773 C GLN A 74 -0.911 3.415 -8.360 1.00 0.00 C ATOM 774 O GLN A 74 -1.630 4.401 -8.519 1.00 0.00 O ATOM 775 CB GLN A 74 -2.033 1.175 -8.078 1.00 0.00 C ATOM 776 CG GLN A 74 -2.849 0.138 -8.852 1.00 0.00 C ATOM 777 CD GLN A 74 -2.084 -0.356 -10.081 1.00 0.00 C ATOM 778 OE1 GLN A 74 -1.748 0.398 -10.980 1.00 0.00 O ATOM 779 NE2 GLN A 74 -1.829 -1.661 -10.071 1.00 0.00 N ATOM 0 H GLN A 74 0.226 0.606 -8.977 1.00 0.00 H new ATOM 0 HA GLN A 74 -1.899 2.289 -9.888 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -1.339 0.669 -7.407 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -2.697 1.775 -7.456 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -3.083 -0.705 -8.202 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -3.799 0.575 -9.162 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -2.139 -2.235 -9.287 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -1.324 -2.088 -10.847 1.00 0.00 H new ATOM 786 N LEU A 75 0.191 3.402 -7.625 1.00 0.00 N ATOM 787 CA LEU A 75 0.642 4.595 -6.929 1.00 0.00 C ATOM 788 C LEU A 75 1.340 5.526 -7.923 1.00 0.00 C ATOM 789 O LEU A 75 1.746 6.631 -7.563 1.00 0.00 O ATOM 790 CB LEU A 75 1.508 4.219 -5.726 1.00 0.00 C ATOM 791 CG LEU A 75 0.769 3.618 -4.529 1.00 0.00 C ATOM 792 CD1 LEU A 75 1.659 3.609 -3.284 1.00 0.00 C ATOM 793 CD2 LEU A 75 -0.555 4.343 -4.282 1.00 0.00 C ATOM 0 H LEU A 75 0.786 2.583 -7.496 1.00 0.00 H new ATOM 0 HA LEU A 75 -0.208 5.142 -6.521 1.00 0.00 H new ATOM 0 HB2 LEU A 75 2.264 3.506 -6.056 1.00 0.00 H new ATOM 0 HB3 LEU A 75 2.036 5.112 -5.391 1.00 0.00 H new ATOM 0 HG LEU A 75 0.529 2.580 -4.761 1.00 0.00 H new ATOM 0 HD11 LEU A 75 1.110 3.177 -2.447 1.00 0.00 H new ATOM 0 HD12 LEU A 75 2.551 3.014 -3.479 1.00 0.00 H new ATOM 0 HD13 LEU A 75 1.951 4.630 -3.038 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -1.060 3.896 -3.426 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -0.361 5.396 -4.080 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -1.189 4.254 -5.164 1.00 0.00 H new ATOM 804 N GLU A 76 1.457 5.047 -9.152 1.00 0.00 N ATOM 805 CA GLU A 76 2.099 5.823 -10.199 1.00 0.00 C ATOM 806 C GLU A 76 1.091 6.774 -10.850 1.00 0.00 C ATOM 807 O GLU A 76 1.453 7.578 -11.707 1.00 0.00 O ATOM 808 CB GLU A 76 2.742 4.909 -11.244 1.00 0.00 C ATOM 809 CG GLU A 76 4.179 4.555 -10.852 1.00 0.00 C ATOM 810 CD GLU A 76 5.173 5.068 -11.895 1.00 0.00 C ATOM 811 OE1 GLU A 76 4.969 4.742 -13.084 1.00 0.00 O ATOM 812 OE2 GLU A 76 6.117 5.776 -11.480 1.00 0.00 O ATOM 0 H GLU A 76 1.118 4.131 -9.447 1.00 0.00 H new ATOM 0 HA GLU A 76 2.892 6.418 -9.747 1.00 0.00 H new ATOM 0 HB2 GLU A 76 2.154 3.997 -11.346 1.00 0.00 H new ATOM 0 HB3 GLU A 76 2.737 5.402 -12.216 1.00 0.00 H new ATOM 0 HG2 GLU A 76 4.412 4.988 -9.879 1.00 0.00 H new ATOM 0 HG3 GLU A 76 4.277 3.474 -10.752 1.00 0.00 H new ATOM 817 N VAL A 77 -0.155 6.651 -10.416 1.00 0.00 N ATOM 818 CA VAL A 77 -1.217 7.487 -10.945 1.00 0.00 C ATOM 819 C VAL A 77 -1.559 8.576 -9.925 1.00 0.00 C ATOM 820 O VAL A 77 -0.850 8.749 -8.936 1.00 0.00 O ATOM 821 CB VAL A 77 -2.423 6.626 -11.325 1.00 0.00 C ATOM 822 CG1 VAL A 77 -1.986 5.386 -12.108 1.00 0.00 C ATOM 823 CG2 VAL A 77 -3.231 6.235 -10.085 1.00 0.00 C ATOM 0 H VAL A 77 -0.452 5.984 -9.704 1.00 0.00 H new ATOM 0 HA VAL A 77 -0.890 7.986 -11.858 1.00 0.00 H new ATOM 0 HB VAL A 77 -3.069 7.221 -11.971 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -2.862 4.791 -12.366 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -1.475 5.693 -13.020 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -1.309 4.789 -11.496 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -4.082 5.623 -10.383 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -2.598 5.668 -9.402 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -3.588 7.135 -9.585 1.00 0.00 H new ATOM 833 N LYS A 78 -2.646 9.282 -10.201 1.00 0.00 N ATOM 834 CA LYS A 78 -3.090 10.349 -9.321 1.00 0.00 C ATOM 835 C LYS A 78 -4.238 9.838 -8.448 1.00 0.00 C ATOM 836 O LYS A 78 -4.533 10.418 -7.403 1.00 0.00 O ATOM 837 CB LYS A 78 -3.440 11.600 -10.129 1.00 0.00 C ATOM 838 CG LYS A 78 -2.237 12.081 -10.944 1.00 0.00 C ATOM 839 CD LYS A 78 -2.245 11.468 -12.346 1.00 0.00 C ATOM 840 CE LYS A 78 -0.830 11.396 -12.921 1.00 0.00 C ATOM 841 NZ LYS A 78 -0.860 11.543 -14.392 1.00 0.00 N ATOM 0 H LYS A 78 -3.233 9.135 -11.023 1.00 0.00 H new ATOM 0 HA LYS A 78 -2.286 10.648 -8.648 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -4.274 11.384 -10.797 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -3.768 12.392 -9.456 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -2.255 13.168 -11.018 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -1.314 11.812 -10.431 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -2.677 10.468 -12.307 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -2.879 12.063 -13.003 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -0.213 12.181 -12.484 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -0.371 10.444 -12.654 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 0.109 11.492 -14.766 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -1.432 10.779 -14.806 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -1.279 12.462 -14.641 1.00 0.00 H new ATOM 851 N ASN A 79 -4.854 8.760 -8.908 1.00 0.00 N ATOM 852 CA ASN A 79 -5.964 8.166 -8.182 1.00 0.00 C ATOM 853 C ASN A 79 -5.907 6.644 -8.328 1.00 0.00 C ATOM 854 O ASN A 79 -6.449 6.087 -9.282 1.00 0.00 O ATOM 855 CB ASN A 79 -7.306 8.644 -8.740 1.00 0.00 C ATOM 856 CG ASN A 79 -8.075 9.458 -7.697 1.00 0.00 C ATOM 857 OD1 ASN A 79 -9.162 9.103 -7.273 1.00 0.00 O ATOM 858 ND2 ASN A 79 -7.451 10.566 -7.308 1.00 0.00 N ATOM 0 H ASN A 79 -4.606 8.282 -9.774 1.00 0.00 H new ATOM 0 HA ASN A 79 -5.881 8.464 -7.137 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -7.138 9.252 -9.629 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -7.902 7.785 -9.048 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -7.882 11.177 -6.614 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -6.542 10.805 -7.703 1.00 0.00 H new ATOM 864 N PRO A 80 -5.227 5.998 -7.343 1.00 0.00 N ATOM 865 CA PRO A 80 -5.092 4.551 -7.352 1.00 0.00 C ATOM 866 C PRO A 80 -6.401 3.874 -6.941 1.00 0.00 C ATOM 867 O PRO A 80 -7.223 4.475 -6.250 1.00 0.00 O ATOM 868 CB PRO A 80 -3.946 4.256 -6.399 1.00 0.00 C ATOM 869 CG PRO A 80 -3.788 5.501 -5.540 1.00 0.00 C ATOM 870 CD PRO A 80 -4.572 6.624 -6.199 1.00 0.00 C ATOM 0 HA PRO A 80 -4.878 4.156 -8.345 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -4.164 3.382 -5.785 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -3.028 4.040 -6.946 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -4.158 5.318 -4.531 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -2.736 5.772 -5.450 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -5.301 7.054 -5.512 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -3.914 7.434 -6.514 1.00 0.00 H new ATOM 875 N ASP A 81 -6.554 2.636 -7.383 1.00 0.00 N ATOM 876 CA ASP A 81 -7.750 1.871 -7.069 1.00 0.00 C ATOM 877 C ASP A 81 -7.455 0.928 -5.901 1.00 0.00 C ATOM 878 O ASP A 81 -7.180 -0.253 -6.106 1.00 0.00 O ATOM 879 CB ASP A 81 -8.190 1.021 -8.263 1.00 0.00 C ATOM 880 CG ASP A 81 -9.380 0.099 -7.995 1.00 0.00 C ATOM 881 OD1 ASP A 81 -10.324 0.569 -7.324 1.00 0.00 O ATOM 882 OD2 ASP A 81 -9.321 -1.056 -8.469 1.00 0.00 O ATOM 0 H ASP A 81 -5.870 2.142 -7.956 1.00 0.00 H new ATOM 0 HA ASP A 81 -8.543 2.575 -6.815 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -8.443 1.685 -9.089 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -7.345 0.414 -8.589 1.00 0.00 H new ATOM 886 N SER A 82 -7.522 1.486 -4.700 1.00 0.00 N ATOM 887 CA SER A 82 -7.266 0.710 -3.499 1.00 0.00 C ATOM 888 C SER A 82 -7.930 -0.664 -3.612 1.00 0.00 C ATOM 889 O SER A 82 -7.467 -1.632 -3.012 1.00 0.00 O ATOM 890 CB SER A 82 -7.768 1.442 -2.253 1.00 0.00 C ATOM 891 OG SER A 82 -9.063 2.004 -2.449 1.00 0.00 O ATOM 0 H SER A 82 -7.750 2.466 -4.534 1.00 0.00 H new ATOM 0 HA SER A 82 -6.189 0.578 -3.400 1.00 0.00 H new ATOM 0 HB2 SER A 82 -7.797 0.749 -1.412 1.00 0.00 H new ATOM 0 HB3 SER A 82 -7.066 2.233 -1.990 1.00 0.00 H new ATOM 0 HG SER A 82 -9.354 2.451 -1.627 1.00 0.00 H new ATOM 896 N LYS A 83 -9.007 -0.704 -4.384 1.00 0.00 N ATOM 897 CA LYS A 83 -9.739 -1.942 -4.583 1.00 0.00 C ATOM 898 C LYS A 83 -8.839 -2.953 -5.297 1.00 0.00 C ATOM 899 O LYS A 83 -8.726 -4.100 -4.868 1.00 0.00 O ATOM 900 CB LYS A 83 -11.059 -1.673 -5.309 1.00 0.00 C ATOM 901 CG LYS A 83 -11.874 -0.598 -4.585 1.00 0.00 C ATOM 902 CD LYS A 83 -11.924 -0.870 -3.081 1.00 0.00 C ATOM 903 CE LYS A 83 -12.852 0.121 -2.376 1.00 0.00 C ATOM 904 NZ LYS A 83 -13.516 -0.521 -1.219 1.00 0.00 N ATOM 0 H LYS A 83 -9.389 0.102 -4.879 1.00 0.00 H new ATOM 0 HA LYS A 83 -10.013 -2.381 -3.624 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -10.857 -1.354 -6.332 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -11.639 -2.594 -5.371 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -11.433 0.382 -4.767 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -12.887 -0.571 -4.987 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -12.270 -1.888 -2.903 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -10.921 -0.797 -2.661 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -12.281 0.987 -2.040 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -13.603 0.486 -3.077 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -14.385 0.000 -0.984 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -13.756 -1.504 -1.458 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -12.874 -0.511 -0.401 1.00 0.00 H new ATOM 914 N MET A 84 -8.222 -2.491 -6.374 1.00 0.00 N ATOM 915 CA MET A 84 -7.336 -3.339 -7.151 1.00 0.00 C ATOM 916 C MET A 84 -6.096 -3.725 -6.342 1.00 0.00 C ATOM 917 O MET A 84 -5.602 -4.846 -6.453 1.00 0.00 O ATOM 918 CB MET A 84 -6.908 -2.603 -8.423 1.00 0.00 C ATOM 919 CG MET A 84 -7.564 -3.220 -9.660 1.00 0.00 C ATOM 920 SD MET A 84 -6.560 -4.558 -10.281 1.00 0.00 S ATOM 921 CE MET A 84 -7.092 -5.873 -9.197 1.00 0.00 C ATOM 0 H MET A 84 -8.319 -1.539 -6.727 1.00 0.00 H new ATOM 0 HA MET A 84 -7.874 -4.250 -7.412 1.00 0.00 H new ATOM 0 HB2 MET A 84 -7.182 -1.551 -8.348 1.00 0.00 H new ATOM 0 HB3 MET A 84 -5.823 -2.644 -8.524 1.00 0.00 H new ATOM 0 HG2 MET A 84 -8.559 -3.587 -9.409 1.00 0.00 H new ATOM 0 HG3 MET A 84 -7.690 -2.461 -10.432 1.00 0.00 H new ATOM 0 HE1 MET A 84 -6.933 -6.834 -9.686 1.00 0.00 H new ATOM 0 HE2 MET A 84 -6.517 -5.837 -8.272 1.00 0.00 H new ATOM 0 HE3 MET A 84 -8.151 -5.752 -8.970 1.00 0.00 H new ATOM 929 N MET A 85 -5.629 -2.774 -5.546 1.00 0.00 N ATOM 930 CA MET A 85 -4.457 -3.000 -4.719 1.00 0.00 C ATOM 931 C MET A 85 -4.702 -4.131 -3.718 1.00 0.00 C ATOM 932 O MET A 85 -3.925 -5.084 -3.650 1.00 0.00 O ATOM 933 CB MET A 85 -4.111 -1.716 -3.963 1.00 0.00 C ATOM 934 CG MET A 85 -2.634 -1.355 -4.141 1.00 0.00 C ATOM 935 SD MET A 85 -2.318 0.272 -3.481 1.00 0.00 S ATOM 936 CE MET A 85 -2.916 1.276 -4.830 1.00 0.00 C ATOM 0 H MET A 85 -6.042 -1.845 -5.457 1.00 0.00 H new ATOM 0 HA MET A 85 -3.628 -3.286 -5.366 1.00 0.00 H new ATOM 0 HB2 MET A 85 -4.735 -0.898 -4.324 1.00 0.00 H new ATOM 0 HB3 MET A 85 -4.333 -1.843 -2.903 1.00 0.00 H new ATOM 0 HG2 MET A 85 -2.008 -2.090 -3.634 1.00 0.00 H new ATOM 0 HG3 MET A 85 -2.369 -1.385 -5.198 1.00 0.00 H new ATOM 0 HE1 MET A 85 -2.089 1.844 -5.256 1.00 0.00 H new ATOM 0 HE2 MET A 85 -3.348 0.634 -5.597 1.00 0.00 H new ATOM 0 HE3 MET A 85 -3.677 1.964 -4.462 1.00 0.00 H new ATOM 944 N GLN A 86 -5.784 -3.991 -2.967 1.00 0.00 N ATOM 945 CA GLN A 86 -6.140 -4.989 -1.973 1.00 0.00 C ATOM 946 C GLN A 86 -6.519 -6.305 -2.655 1.00 0.00 C ATOM 947 O GLN A 86 -6.259 -7.382 -2.121 1.00 0.00 O ATOM 948 CB GLN A 86 -7.276 -4.490 -1.077 1.00 0.00 C ATOM 949 CG GLN A 86 -6.920 -4.655 0.401 1.00 0.00 C ATOM 950 CD GLN A 86 -8.100 -5.232 1.187 1.00 0.00 C ATOM 951 OE1 GLN A 86 -8.701 -4.578 2.024 1.00 0.00 O ATOM 952 NE2 GLN A 86 -8.396 -6.490 0.873 1.00 0.00 N ATOM 0 H GLN A 86 -6.426 -3.201 -3.027 1.00 0.00 H new ATOM 0 HA GLN A 86 -5.272 -5.167 -1.338 1.00 0.00 H new ATOM 0 HB2 GLN A 86 -7.479 -3.441 -1.291 1.00 0.00 H new ATOM 0 HB3 GLN A 86 -8.189 -5.043 -1.299 1.00 0.00 H new ATOM 0 HG2 GLN A 86 -6.056 -5.312 0.500 1.00 0.00 H new ATOM 0 HG3 GLN A 86 -6.636 -3.690 0.820 1.00 0.00 H new ATOM 0 HE21 GLN A 86 -7.852 -6.980 0.163 1.00 0.00 H new ATOM 0 HE22 GLN A 86 -9.167 -6.965 1.343 1.00 0.00 H new ATOM 959 N ILE A 87 -7.126 -6.174 -3.825 1.00 0.00 N ATOM 960 CA ILE A 87 -7.543 -7.340 -4.586 1.00 0.00 C ATOM 961 C ILE A 87 -6.305 -8.071 -5.111 1.00 0.00 C ATOM 962 O ILE A 87 -6.259 -9.300 -5.112 1.00 0.00 O ATOM 963 CB ILE A 87 -8.532 -6.939 -5.683 1.00 0.00 C ATOM 964 CG1 ILE A 87 -9.953 -6.832 -5.127 1.00 0.00 C ATOM 965 CG2 ILE A 87 -8.452 -7.901 -6.871 1.00 0.00 C ATOM 966 CD1 ILE A 87 -10.759 -5.775 -5.884 1.00 0.00 C ATOM 0 H ILE A 87 -7.339 -5.279 -4.265 1.00 0.00 H new ATOM 0 HA ILE A 87 -8.080 -8.040 -3.946 1.00 0.00 H new ATOM 0 HB ILE A 87 -8.254 -5.951 -6.049 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -10.451 -7.798 -5.204 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -9.915 -6.576 -4.068 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -9.165 -7.594 -7.636 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -7.444 -7.884 -7.286 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -8.690 -8.911 -6.538 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -11.765 -5.719 -5.469 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -10.271 -4.805 -5.785 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -10.816 -6.047 -6.938 1.00 0.00 H new ATOM 977 N ASN A 88 -5.332 -7.283 -5.544 1.00 0.00 N ATOM 978 CA ASN A 88 -4.097 -7.839 -6.071 1.00 0.00 C ATOM 979 C ASN A 88 -3.261 -8.396 -4.916 1.00 0.00 C ATOM 980 O ASN A 88 -2.684 -9.475 -5.028 1.00 0.00 O ATOM 981 CB ASN A 88 -3.269 -6.767 -6.781 1.00 0.00 C ATOM 982 CG ASN A 88 -3.761 -6.554 -8.214 1.00 0.00 C ATOM 983 OD1 ASN A 88 -4.023 -7.488 -8.953 1.00 0.00 O ATOM 984 ND2 ASN A 88 -3.871 -5.276 -8.564 1.00 0.00 N ATOM 0 H ASN A 88 -5.374 -6.264 -5.541 1.00 0.00 H new ATOM 0 HA ASN A 88 -4.356 -8.623 -6.782 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -3.331 -5.829 -6.228 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -2.220 -7.062 -6.793 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -4.191 -5.029 -9.500 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -3.635 -4.542 -7.896 1.00 0.00 H new ATOM 990 N LEU A 89 -3.221 -7.631 -3.835 1.00 0.00 N ATOM 991 CA LEU A 89 -2.465 -8.035 -2.661 1.00 0.00 C ATOM 992 C LEU A 89 -2.983 -9.386 -2.166 1.00 0.00 C ATOM 993 O LEU A 89 -2.197 -10.276 -1.843 1.00 0.00 O ATOM 994 CB LEU A 89 -2.500 -6.935 -1.598 1.00 0.00 C ATOM 995 CG LEU A 89 -1.580 -5.737 -1.841 1.00 0.00 C ATOM 996 CD1 LEU A 89 -1.418 -4.903 -0.569 1.00 0.00 C ATOM 997 CD2 LEU A 89 -0.231 -6.189 -2.406 1.00 0.00 C ATOM 0 H LEU A 89 -3.699 -6.734 -3.747 1.00 0.00 H new ATOM 0 HA LEU A 89 -1.413 -8.170 -2.912 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -3.524 -6.570 -1.515 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -2.240 -7.378 -0.637 1.00 0.00 H new ATOM 0 HG LEU A 89 -2.045 -5.095 -2.589 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -0.759 -4.058 -0.769 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -2.393 -4.535 -0.248 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -0.986 -5.521 0.219 1.00 0.00 H new ATOM 0 HD21 LEU A 89 0.405 -5.319 -2.570 1.00 0.00 H new ATOM 0 HD22 LEU A 89 0.252 -6.863 -1.699 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -0.388 -6.707 -3.352 1.00 0.00 H new ATOM 1008 N THR A 90 -4.303 -9.498 -2.120 1.00 0.00 N ATOM 1009 CA THR A 90 -4.935 -10.726 -1.669 1.00 0.00 C ATOM 1010 C THR A 90 -4.513 -11.899 -2.555 1.00 0.00 C ATOM 1011 O THR A 90 -4.587 -13.055 -2.137 1.00 0.00 O ATOM 1012 CB THR A 90 -6.447 -10.497 -1.643 1.00 0.00 C ATOM 1013 OG1 THR A 90 -6.610 -9.339 -0.829 1.00 0.00 O ATOM 1014 CG2 THR A 90 -7.193 -11.596 -0.882 1.00 0.00 C ATOM 0 H THR A 90 -4.952 -8.758 -2.388 1.00 0.00 H new ATOM 0 HA THR A 90 -4.614 -10.989 -0.661 1.00 0.00 H new ATOM 0 HB THR A 90 -6.823 -10.444 -2.665 1.00 0.00 H new ATOM 0 HG1 THR A 90 -6.843 -8.573 -1.393 1.00 0.00 H new ATOM 0 HG21 THR A 90 -8.262 -11.385 -0.894 1.00 0.00 H new ATOM 0 HG22 THR A 90 -7.008 -12.559 -1.359 1.00 0.00 H new ATOM 0 HG23 THR A 90 -6.841 -11.628 0.149 1.00 0.00 H new ATOM 1022 N GLY A 91 -4.078 -11.563 -3.760 1.00 0.00 N ATOM 1023 CA GLY A 91 -3.643 -12.575 -4.708 1.00 0.00 C ATOM 1024 C GLY A 91 -2.311 -13.192 -4.279 1.00 0.00 C ATOM 1025 O GLY A 91 -2.003 -14.327 -4.640 1.00 0.00 O ATOM 0 H GLY A 91 -4.017 -10.604 -4.102 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -4.401 -13.355 -4.786 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -3.540 -12.131 -5.698 1.00 0.00 H new ATOM 1029 N PHE A 92 -1.555 -12.417 -3.515 1.00 0.00 N ATOM 1030 CA PHE A 92 -0.262 -12.872 -3.034 1.00 0.00 C ATOM 1031 C PHE A 92 -0.273 -13.046 -1.514 1.00 0.00 C ATOM 1032 O PHE A 92 0.227 -14.043 -0.996 1.00 0.00 O ATOM 1033 CB PHE A 92 0.759 -11.794 -3.404 1.00 0.00 C ATOM 1034 CG PHE A 92 1.735 -12.214 -4.505 1.00 0.00 C ATOM 1035 CD1 PHE A 92 1.262 -12.695 -5.686 1.00 0.00 C ATOM 1036 CD2 PHE A 92 3.076 -12.106 -4.303 1.00 0.00 C ATOM 1037 CE1 PHE A 92 2.169 -13.084 -6.708 1.00 0.00 C ATOM 1038 CE2 PHE A 92 3.981 -12.495 -5.324 1.00 0.00 C ATOM 1039 CZ PHE A 92 3.509 -12.976 -6.505 1.00 0.00 C ATOM 0 H PHE A 92 -1.814 -11.476 -3.217 1.00 0.00 H new ATOM 0 HA PHE A 92 -0.017 -13.835 -3.482 1.00 0.00 H new ATOM 0 HB2 PHE A 92 0.227 -10.899 -3.726 1.00 0.00 H new ATOM 0 HB3 PHE A 92 1.326 -11.524 -2.513 1.00 0.00 H new ATOM 0 HD1 PHE A 92 0.198 -12.781 -5.847 1.00 0.00 H new ATOM 0 HD2 PHE A 92 3.452 -11.724 -3.365 1.00 0.00 H new ATOM 0 HE1 PHE A 92 1.794 -13.466 -7.646 1.00 0.00 H new ATOM 0 HE2 PHE A 92 5.045 -12.409 -5.163 1.00 0.00 H new ATOM 0 HZ PHE A 92 4.198 -13.272 -7.282 1.00 0.00 H new ATOM 1048 N LEU A 93 -0.849 -12.061 -0.842 1.00 0.00 N ATOM 1049 CA LEU A 93 -0.932 -12.092 0.608 1.00 0.00 C ATOM 1050 C LEU A 93 -1.847 -13.240 1.037 1.00 0.00 C ATOM 1051 O LEU A 93 -2.181 -14.108 0.231 1.00 0.00 O ATOM 1052 CB LEU A 93 -1.363 -10.727 1.151 1.00 0.00 C ATOM 1053 CG LEU A 93 -0.599 -9.519 0.607 1.00 0.00 C ATOM 1054 CD1 LEU A 93 -0.696 -8.332 1.567 1.00 0.00 C ATOM 1055 CD2 LEU A 93 0.853 -9.884 0.292 1.00 0.00 C ATOM 0 H LEU A 93 -1.263 -11.236 -1.275 1.00 0.00 H new ATOM 0 HA LEU A 93 0.049 -12.286 1.041 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -2.422 -10.590 0.934 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -1.258 -10.740 2.236 1.00 0.00 H new ATOM 0 HG LEU A 93 -1.065 -9.215 -0.330 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -0.144 -7.486 1.157 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -1.742 -8.054 1.698 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -0.271 -8.609 2.532 1.00 0.00 H new ATOM 0 HD21 LEU A 93 1.373 -9.007 -0.093 1.00 0.00 H new ATOM 0 HD22 LEU A 93 1.347 -10.229 1.200 1.00 0.00 H new ATOM 0 HD23 LEU A 93 0.875 -10.676 -0.456 1.00 0.00 H new ATOM 1066 N ASN A 94 -2.227 -13.210 2.307 1.00 0.00 N ATOM 1067 CA ASN A 94 -3.097 -14.238 2.853 1.00 0.00 C ATOM 1068 C ASN A 94 -4.551 -13.768 2.766 1.00 0.00 C ATOM 1069 O ASN A 94 -5.470 -14.527 3.069 1.00 0.00 O ATOM 1070 CB ASN A 94 -2.774 -14.509 4.323 1.00 0.00 C ATOM 1071 CG ASN A 94 -1.459 -15.278 4.463 1.00 0.00 C ATOM 1072 OD1 ASN A 94 -1.397 -16.486 4.307 1.00 0.00 O ATOM 1073 ND2 ASN A 94 -0.414 -14.512 4.766 1.00 0.00 N ATOM 0 H ASN A 94 -1.948 -12.490 2.973 1.00 0.00 H new ATOM 0 HA ASN A 94 -2.944 -15.151 2.277 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -2.707 -13.565 4.864 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -3.584 -15.080 4.778 1.00 0.00 H new ATOM 0 HD21 ASN A 94 0.509 -14.931 4.882 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -0.536 -13.506 4.883 1.00 0.00 H new ATOM 1079 N GLY A 95 -4.712 -12.520 2.354 1.00 0.00 N ATOM 1080 CA GLY A 95 -6.038 -11.940 2.225 1.00 0.00 C ATOM 1081 C GLY A 95 -6.316 -10.950 3.357 1.00 0.00 C ATOM 1082 O GLY A 95 -6.648 -9.792 3.107 1.00 0.00 O ATOM 0 H GLY A 95 -3.946 -11.894 2.105 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -6.125 -11.433 1.264 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -6.788 -12.731 2.237 1.00 0.00 H new ATOM 1086 N LYS A 96 -6.172 -11.441 4.579 1.00 0.00 N ATOM 1087 CA LYS A 96 -6.404 -10.614 5.750 1.00 0.00 C ATOM 1088 C LYS A 96 -5.284 -9.579 5.868 1.00 0.00 C ATOM 1089 O LYS A 96 -5.503 -8.476 6.368 1.00 0.00 O ATOM 1090 CB LYS A 96 -6.569 -11.486 6.998 1.00 0.00 C ATOM 1091 CG LYS A 96 -7.978 -11.347 7.580 1.00 0.00 C ATOM 1092 CD LYS A 96 -8.174 -9.970 8.217 1.00 0.00 C ATOM 1093 CE LYS A 96 -8.486 -10.096 9.709 1.00 0.00 C ATOM 1094 NZ LYS A 96 -7.670 -9.141 10.492 1.00 0.00 N ATOM 0 H LYS A 96 -5.897 -12.402 4.783 1.00 0.00 H new ATOM 0 HA LYS A 96 -7.339 -10.063 5.648 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -6.377 -12.529 6.746 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -5.832 -11.198 7.747 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -8.717 -11.496 6.793 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -8.146 -12.124 8.326 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -7.274 -9.370 8.079 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -8.987 -9.445 7.715 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -9.545 -9.906 9.882 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -8.286 -11.114 10.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -7.894 -9.240 11.503 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -6.661 -9.341 10.340 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -7.881 -8.170 10.184 1.00 0.00 H new ATOM 1104 N ASN A 97 -4.108 -9.970 5.400 1.00 0.00 N ATOM 1105 CA ASN A 97 -2.953 -9.090 5.446 1.00 0.00 C ATOM 1106 C ASN A 97 -3.162 -7.931 4.471 1.00 0.00 C ATOM 1107 O ASN A 97 -2.678 -6.823 4.705 1.00 0.00 O ATOM 1108 CB ASN A 97 -1.679 -9.831 5.035 1.00 0.00 C ATOM 1109 CG ASN A 97 -0.956 -10.401 6.257 1.00 0.00 C ATOM 1110 OD1 ASN A 97 -0.991 -11.588 6.533 1.00 0.00 O ATOM 1111 ND2 ASN A 97 -0.303 -9.489 6.972 1.00 0.00 N ATOM 0 H ASN A 97 -3.930 -10.885 4.987 1.00 0.00 H new ATOM 0 HA ASN A 97 -2.845 -8.728 6.468 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -1.930 -10.639 4.347 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -1.016 -9.151 4.500 1.00 0.00 H new ATOM 0 HD21 ASN A 97 0.210 -9.768 7.808 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -0.315 -8.511 6.684 1.00 0.00 H new ATOM 1117 N ALA A 98 -3.882 -8.223 3.398 1.00 0.00 N ATOM 1118 CA ALA A 98 -4.161 -7.218 2.387 1.00 0.00 C ATOM 1119 C ALA A 98 -5.006 -6.102 3.003 1.00 0.00 C ATOM 1120 O ALA A 98 -4.747 -4.922 2.771 1.00 0.00 O ATOM 1121 CB ALA A 98 -4.847 -7.876 1.188 1.00 0.00 C ATOM 0 H ALA A 98 -4.281 -9.142 3.207 1.00 0.00 H new ATOM 0 HA ALA A 98 -3.235 -6.769 2.026 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -5.056 -7.122 0.429 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -4.193 -8.640 0.769 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -5.781 -8.335 1.510 1.00 0.00 H new ATOM 1127 N ARG A 99 -6.002 -6.515 3.773 1.00 0.00 N ATOM 1128 CA ARG A 99 -6.888 -5.564 4.424 1.00 0.00 C ATOM 1129 C ARG A 99 -6.120 -4.749 5.466 1.00 0.00 C ATOM 1130 O ARG A 99 -6.337 -3.546 5.603 1.00 0.00 O ATOM 1131 CB ARG A 99 -8.057 -6.278 5.105 1.00 0.00 C ATOM 1132 CG ARG A 99 -9.298 -6.278 4.210 1.00 0.00 C ATOM 1133 CD ARG A 99 -10.261 -7.398 4.606 1.00 0.00 C ATOM 1134 NE ARG A 99 -9.628 -8.715 4.375 1.00 0.00 N ATOM 1135 CZ ARG A 99 -10.301 -9.873 4.315 1.00 0.00 C ATOM 1136 NH1 ARG A 99 -11.632 -9.882 4.468 1.00 0.00 N ATOM 1137 NH2 ARG A 99 -9.644 -11.020 4.100 1.00 0.00 N ATOM 0 H ARG A 99 -6.215 -7.495 3.961 1.00 0.00 H new ATOM 0 HA ARG A 99 -7.281 -4.898 3.656 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -7.774 -7.304 5.340 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -8.286 -5.787 6.051 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -9.804 -5.315 4.284 1.00 0.00 H new ATOM 0 HG3 ARG A 99 -9.000 -6.402 3.169 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -10.537 -7.297 5.656 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -11.180 -7.320 4.026 1.00 0.00 H new ATOM 0 HE ARG A 99 -8.616 -8.744 4.254 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -12.133 -9.008 4.630 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -12.145 -10.763 4.422 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -8.631 -11.013 3.982 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -10.157 -11.901 4.055 1.00 0.00 H new ATOM 1148 N GLU A 100 -5.236 -5.437 6.174 1.00 0.00 N ATOM 1149 CA GLU A 100 -4.434 -4.792 7.200 1.00 0.00 C ATOM 1150 C GLU A 100 -3.355 -3.917 6.558 1.00 0.00 C ATOM 1151 O GLU A 100 -3.058 -2.831 7.053 1.00 0.00 O ATOM 1152 CB GLU A 100 -3.812 -5.827 8.141 1.00 0.00 C ATOM 1153 CG GLU A 100 -4.245 -5.581 9.588 1.00 0.00 C ATOM 1154 CD GLU A 100 -3.227 -4.707 10.324 1.00 0.00 C ATOM 1155 OE1 GLU A 100 -2.784 -3.713 9.710 1.00 0.00 O ATOM 1156 OE2 GLU A 100 -2.915 -5.055 11.483 1.00 0.00 O ATOM 0 H GLU A 100 -5.058 -6.434 6.057 1.00 0.00 H new ATOM 0 HA GLU A 100 -5.086 -4.153 7.795 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -4.110 -6.829 7.834 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -2.725 -5.782 8.070 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -5.222 -5.098 9.602 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -4.353 -6.534 10.106 1.00 0.00 H new ATOM 1161 N PHE A 101 -2.800 -4.422 5.467 1.00 0.00 N ATOM 1162 CA PHE A 101 -1.761 -3.700 4.753 1.00 0.00 C ATOM 1163 C PHE A 101 -2.307 -2.402 4.156 1.00 0.00 C ATOM 1164 O PHE A 101 -1.721 -1.336 4.336 1.00 0.00 O ATOM 1165 CB PHE A 101 -1.285 -4.609 3.618 1.00 0.00 C ATOM 1166 CG PHE A 101 -0.470 -3.886 2.542 1.00 0.00 C ATOM 1167 CD1 PHE A 101 -1.106 -3.208 1.548 1.00 0.00 C ATOM 1168 CD2 PHE A 101 0.889 -3.920 2.579 1.00 0.00 C ATOM 1169 CE1 PHE A 101 -0.351 -2.537 0.551 1.00 0.00 C ATOM 1170 CE2 PHE A 101 1.644 -3.249 1.582 1.00 0.00 C ATOM 1171 CZ PHE A 101 1.008 -2.572 0.588 1.00 0.00 C ATOM 0 H PHE A 101 -3.050 -5.323 5.060 1.00 0.00 H new ATOM 0 HA PHE A 101 -0.951 -3.442 5.435 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -0.680 -5.412 4.039 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -2.153 -5.074 3.151 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -2.185 -3.181 1.518 1.00 0.00 H new ATOM 0 HD2 PHE A 101 1.394 -4.458 3.368 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -0.856 -1.998 -0.237 1.00 0.00 H new ATOM 0 HE2 PHE A 101 2.723 -3.276 1.612 1.00 0.00 H new ATOM 0 HZ PHE A 101 1.582 -2.062 -0.172 1.00 0.00 H new ATOM 1180 N MET A 102 -3.425 -2.534 3.457 1.00 0.00 N ATOM 1181 CA MET A 102 -4.058 -1.384 2.832 1.00 0.00 C ATOM 1182 C MET A 102 -4.527 -0.377 3.884 1.00 0.00 C ATOM 1183 O MET A 102 -4.576 0.823 3.622 1.00 0.00 O ATOM 1184 CB MET A 102 -5.255 -1.849 2.000 1.00 0.00 C ATOM 1185 CG MET A 102 -4.909 -1.880 0.511 1.00 0.00 C ATOM 1186 SD MET A 102 -6.055 -0.863 -0.404 1.00 0.00 S ATOM 1187 CE MET A 102 -4.922 0.313 -1.124 1.00 0.00 C ATOM 0 H MET A 102 -3.909 -3.420 3.309 1.00 0.00 H new ATOM 0 HA MET A 102 -3.326 -0.895 2.189 1.00 0.00 H new ATOM 0 HB2 MET A 102 -5.565 -2.842 2.326 1.00 0.00 H new ATOM 0 HB3 MET A 102 -6.100 -1.181 2.167 1.00 0.00 H new ATOM 0 HG2 MET A 102 -3.891 -1.522 0.358 1.00 0.00 H new ATOM 0 HG3 MET A 102 -4.945 -2.905 0.142 1.00 0.00 H new ATOM 0 HE1 MET A 102 -5.445 0.914 -1.867 1.00 0.00 H new ATOM 0 HE2 MET A 102 -4.528 0.964 -0.343 1.00 0.00 H new ATOM 0 HE3 MET A 102 -4.100 -0.220 -1.602 1.00 0.00 H new ATOM 1195 N GLY A 103 -4.860 -0.904 5.053 1.00 0.00 N ATOM 1196 CA GLY A 103 -5.324 -0.066 6.147 1.00 0.00 C ATOM 1197 C GLY A 103 -4.146 0.564 6.892 1.00 0.00 C ATOM 1198 O GLY A 103 -4.312 1.087 7.993 1.00 0.00 O ATOM 0 H GLY A 103 -4.818 -1.900 5.267 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -5.975 0.718 5.759 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -5.920 -0.662 6.839 1.00 0.00 H new ATOM 1202 N GLU A 104 -2.982 0.493 6.263 1.00 0.00 N ATOM 1203 CA GLU A 104 -1.777 1.050 6.852 1.00 0.00 C ATOM 1204 C GLU A 104 -1.064 1.958 5.847 1.00 0.00 C ATOM 1205 O GLU A 104 -0.399 2.917 6.234 1.00 0.00 O ATOM 1206 CB GLU A 104 -0.846 -0.058 7.346 1.00 0.00 C ATOM 1207 CG GLU A 104 -1.342 -0.641 8.671 1.00 0.00 C ATOM 1208 CD GLU A 104 -0.285 -0.487 9.768 1.00 0.00 C ATOM 1209 OE1 GLU A 104 0.303 0.614 9.840 1.00 0.00 O ATOM 1210 OE2 GLU A 104 -0.089 -1.475 10.508 1.00 0.00 O ATOM 0 H GLU A 104 -2.848 0.058 5.350 1.00 0.00 H new ATOM 0 HA GLU A 104 -2.063 1.651 7.715 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -0.785 -0.848 6.597 1.00 0.00 H new ATOM 0 HB3 GLU A 104 0.161 0.338 7.473 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -2.260 -0.138 8.973 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -1.585 -1.696 8.540 1.00 0.00 H new ATOM 1215 N LEU A 105 -1.228 1.622 4.576 1.00 0.00 N ATOM 1216 CA LEU A 105 -0.609 2.395 3.512 1.00 0.00 C ATOM 1217 C LEU A 105 -1.623 3.399 2.960 1.00 0.00 C ATOM 1218 O LEU A 105 -1.266 4.527 2.627 1.00 0.00 O ATOM 1219 CB LEU A 105 -0.021 1.466 2.448 1.00 0.00 C ATOM 1220 CG LEU A 105 -0.407 1.777 1.000 1.00 0.00 C ATOM 1221 CD1 LEU A 105 -1.876 1.436 0.739 1.00 0.00 C ATOM 1222 CD2 LEU A 105 -0.083 3.230 0.646 1.00 0.00 C ATOM 0 H LEU A 105 -1.780 0.825 4.259 1.00 0.00 H new ATOM 0 HA LEU A 105 0.231 2.971 3.899 1.00 0.00 H new ATOM 0 HB2 LEU A 105 1.066 1.496 2.528 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -0.329 0.445 2.674 1.00 0.00 H new ATOM 0 HG LEU A 105 0.191 1.145 0.343 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -2.124 1.666 -0.297 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -2.042 0.375 0.925 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -2.510 2.024 1.403 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -0.367 3.425 -0.388 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -0.637 3.898 1.306 1.00 0.00 H new ATOM 0 HD23 LEU A 105 0.986 3.404 0.768 1.00 0.00 H new ATOM 1233 N TRP A 106 -2.868 2.951 2.881 1.00 0.00 N ATOM 1234 CA TRP A 106 -3.935 3.796 2.375 1.00 0.00 C ATOM 1235 C TRP A 106 -4.044 5.018 3.289 1.00 0.00 C ATOM 1236 O TRP A 106 -4.186 6.143 2.813 1.00 0.00 O ATOM 1237 CB TRP A 106 -5.246 3.015 2.261 1.00 0.00 C ATOM 1238 CG TRP A 106 -6.259 3.636 1.298 1.00 0.00 C ATOM 1239 CD1 TRP A 106 -7.459 4.158 1.586 1.00 0.00 C ATOM 1240 CD2 TRP A 106 -6.111 3.779 -0.131 1.00 0.00 C ATOM 1241 NE1 TRP A 106 -8.094 4.626 0.454 1.00 0.00 N ATOM 1242 CE2 TRP A 106 -7.247 4.388 -0.624 1.00 0.00 C ATOM 1243 CE3 TRP A 106 -5.053 3.408 -0.977 1.00 0.00 C ATOM 1244 CZ2 TRP A 106 -7.434 4.679 -1.981 1.00 0.00 C ATOM 1245 CZ3 TRP A 106 -5.254 3.705 -2.330 1.00 0.00 C ATOM 1246 CH2 TRP A 106 -6.392 4.317 -2.844 1.00 0.00 C ATOM 0 H TRP A 106 -3.161 2.014 3.159 1.00 0.00 H new ATOM 0 HA TRP A 106 -3.711 4.137 1.364 1.00 0.00 H new ATOM 0 HB2 TRP A 106 -5.024 1.999 1.933 1.00 0.00 H new ATOM 0 HB3 TRP A 106 -5.699 2.940 3.250 1.00 0.00 H new ATOM 0 HD1 TRP A 106 -7.877 4.206 2.581 1.00 0.00 H new ATOM 0 HE1 TRP A 106 -9.014 5.065 0.415 1.00 0.00 H new ATOM 0 HE3 TRP A 106 -4.155 2.931 -0.612 1.00 0.00 H new ATOM 0 HZ2 TRP A 106 -8.333 5.157 -2.342 1.00 0.00 H new ATOM 0 HZ3 TRP A 106 -4.470 3.440 -3.024 1.00 0.00 H new ATOM 0 HH2 TRP A 106 -6.472 4.512 -3.903 1.00 0.00 H new ATOM 1256 N PRO A 107 -3.975 4.748 4.620 1.00 0.00 N ATOM 1257 CA PRO A 107 -4.065 5.812 5.606 1.00 0.00 C ATOM 1258 C PRO A 107 -2.764 6.616 5.665 1.00 0.00 C ATOM 1259 O PRO A 107 -2.773 7.795 6.013 1.00 0.00 O ATOM 1260 CB PRO A 107 -4.388 5.110 6.914 1.00 0.00 C ATOM 1261 CG PRO A 107 -4.011 3.652 6.710 1.00 0.00 C ATOM 1262 CD PRO A 107 -3.809 3.427 5.220 1.00 0.00 C ATOM 0 HA PRO A 107 -4.833 6.546 5.363 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -3.827 5.546 7.740 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -5.445 5.209 7.159 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -3.100 3.413 7.259 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -4.795 2.998 7.092 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -2.820 3.019 5.012 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -4.536 2.718 4.824 1.00 0.00 H new ATOM 1267 N LEU A 108 -1.675 5.944 5.319 1.00 0.00 N ATOM 1268 CA LEU A 108 -0.369 6.582 5.328 1.00 0.00 C ATOM 1269 C LEU A 108 -0.390 7.792 4.393 1.00 0.00 C ATOM 1270 O LEU A 108 0.133 8.852 4.732 1.00 0.00 O ATOM 1271 CB LEU A 108 0.725 5.566 4.994 1.00 0.00 C ATOM 1272 CG LEU A 108 1.884 5.475 5.990 1.00 0.00 C ATOM 1273 CD1 LEU A 108 1.811 4.178 6.799 1.00 0.00 C ATOM 1274 CD2 LEU A 108 3.230 5.634 5.280 1.00 0.00 C ATOM 0 H LEU A 108 -1.670 4.965 5.031 1.00 0.00 H new ATOM 0 HA LEU A 108 -0.134 6.954 6.325 1.00 0.00 H new ATOM 0 HB2 LEU A 108 0.265 4.581 4.911 1.00 0.00 H new ATOM 0 HB3 LEU A 108 1.133 5.811 4.013 1.00 0.00 H new ATOM 0 HG LEU A 108 1.794 6.300 6.697 1.00 0.00 H new ATOM 0 HD11 LEU A 108 2.646 4.138 7.499 1.00 0.00 H new ATOM 0 HD12 LEU A 108 0.872 4.146 7.352 1.00 0.00 H new ATOM 0 HD13 LEU A 108 1.863 3.324 6.123 1.00 0.00 H new ATOM 0 HD21 LEU A 108 4.037 5.565 6.010 1.00 0.00 H new ATOM 0 HD22 LEU A 108 3.345 4.845 4.537 1.00 0.00 H new ATOM 0 HD23 LEU A 108 3.269 6.605 4.787 1.00 0.00 H new ATOM 1285 N LEU A 109 -1.000 7.593 3.233 1.00 0.00 N ATOM 1286 CA LEU A 109 -1.096 8.656 2.246 1.00 0.00 C ATOM 1287 C LEU A 109 -2.095 9.709 2.732 1.00 0.00 C ATOM 1288 O LEU A 109 -1.935 10.896 2.454 1.00 0.00 O ATOM 1289 CB LEU A 109 -1.431 8.079 0.870 1.00 0.00 C ATOM 1290 CG LEU A 109 -0.648 6.831 0.456 1.00 0.00 C ATOM 1291 CD1 LEU A 109 -1.470 5.959 -0.495 1.00 0.00 C ATOM 1292 CD2 LEU A 109 0.710 7.207 -0.139 1.00 0.00 C ATOM 0 H LEU A 109 -1.432 6.712 2.955 1.00 0.00 H new ATOM 0 HA LEU A 109 -0.135 9.158 2.131 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -2.494 7.840 0.847 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -1.262 8.854 0.122 1.00 0.00 H new ATOM 0 HG LEU A 109 -0.453 6.238 1.350 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -0.891 5.079 -0.774 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -2.389 5.646 0.001 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -1.717 6.530 -1.390 1.00 0.00 H new ATOM 0 HD21 LEU A 109 1.245 6.302 -0.425 1.00 0.00 H new ATOM 0 HD22 LEU A 109 0.561 7.833 -1.019 1.00 0.00 H new ATOM 0 HD23 LEU A 109 1.293 7.755 0.602 1.00 0.00 H new ATOM 1303 N LEU A 110 -3.102 9.234 3.450 1.00 0.00 N ATOM 1304 CA LEU A 110 -4.128 10.120 3.976 1.00 0.00 C ATOM 1305 C LEU A 110 -3.464 11.240 4.780 1.00 0.00 C ATOM 1306 O LEU A 110 -3.829 12.407 4.644 1.00 0.00 O ATOM 1307 CB LEU A 110 -5.165 9.325 4.772 1.00 0.00 C ATOM 1308 CG LEU A 110 -6.355 8.788 3.973 1.00 0.00 C ATOM 1309 CD1 LEU A 110 -5.992 8.615 2.498 1.00 0.00 C ATOM 1310 CD2 LEU A 110 -6.889 7.493 4.589 1.00 0.00 C ATOM 0 H LEU A 110 -3.230 8.249 3.680 1.00 0.00 H new ATOM 0 HA LEU A 110 -4.678 10.593 3.162 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -4.662 8.483 5.247 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -5.546 9.961 5.571 1.00 0.00 H new ATOM 0 HG LEU A 110 -7.159 9.523 4.022 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -6.855 8.232 1.953 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -5.697 9.578 2.081 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -5.164 7.911 2.407 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -7.734 7.132 4.002 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -6.101 6.740 4.592 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -7.213 7.683 5.612 1.00 0.00 H new ATOM 1321 N SER A 111 -2.499 10.847 5.598 1.00 0.00 N ATOM 1322 CA SER A 111 -1.780 11.804 6.422 1.00 0.00 C ATOM 1323 C SER A 111 -0.731 12.535 5.583 1.00 0.00 C ATOM 1324 O SER A 111 -0.449 13.708 5.820 1.00 0.00 O ATOM 1325 CB SER A 111 -1.117 11.113 7.616 1.00 0.00 C ATOM 1326 OG SER A 111 -1.665 11.549 8.857 1.00 0.00 O ATOM 0 H SER A 111 -2.198 9.879 5.708 1.00 0.00 H new ATOM 0 HA SER A 111 -2.497 12.529 6.807 1.00 0.00 H new ATOM 0 HB2 SER A 111 -1.240 10.034 7.525 1.00 0.00 H new ATOM 0 HB3 SER A 111 -0.046 11.314 7.602 1.00 0.00 H new ATOM 0 HG SER A 111 -1.217 11.084 9.594 1.00 0.00 H new ATOM 1331 N ALA A 112 -0.183 11.811 4.618 1.00 0.00 N ATOM 1332 CA ALA A 112 0.829 12.377 3.741 1.00 0.00 C ATOM 1333 C ALA A 112 0.207 13.503 2.913 1.00 0.00 C ATOM 1334 O ALA A 112 0.783 14.585 2.798 1.00 0.00 O ATOM 1335 CB ALA A 112 1.423 11.270 2.867 1.00 0.00 C ATOM 0 H ALA A 112 -0.420 10.838 4.424 1.00 0.00 H new ATOM 0 HA ALA A 112 1.645 12.807 4.322 1.00 0.00 H new ATOM 0 HB1 ALA A 112 2.182 11.694 2.209 1.00 0.00 H new ATOM 0 HB2 ALA A 112 1.877 10.509 3.502 1.00 0.00 H new ATOM 0 HB3 ALA A 112 0.634 10.818 2.266 1.00 0.00 H new ATOM 1341 N GLN A 113 -0.960 13.212 2.357 1.00 0.00 N ATOM 1342 CA GLN A 113 -1.666 14.187 1.544 1.00 0.00 C ATOM 1343 C GLN A 113 -2.004 15.426 2.373 1.00 0.00 C ATOM 1344 O GLN A 113 -2.345 16.472 1.824 1.00 0.00 O ATOM 1345 CB GLN A 113 -2.926 13.577 0.928 1.00 0.00 C ATOM 1346 CG GLN A 113 -3.935 13.193 2.012 1.00 0.00 C ATOM 1347 CD GLN A 113 -5.330 12.991 1.417 1.00 0.00 C ATOM 1348 OE1 GLN A 113 -5.429 11.931 0.618 1.00 0.00 O flip ATOM 1349 NE2 GLN A 113 -6.255 13.745 1.667 1.00 0.00 N flip ATOM 0 H GLN A 113 -1.434 12.314 2.454 1.00 0.00 H new ATOM 0 HA GLN A 113 -1.012 14.490 0.726 1.00 0.00 H new ATOM 0 HB2 GLN A 113 -3.380 14.290 0.239 1.00 0.00 H new ATOM 0 HB3 GLN A 113 -2.660 12.695 0.345 1.00 0.00 H new ATOM 0 HG2 GLN A 113 -3.611 12.278 2.507 1.00 0.00 H new ATOM 0 HG3 GLN A 113 -3.970 13.972 2.773 1.00 0.00 H new ATOM 0 HE21 GLN A 113 -6.111 14.540 2.289 1.00 0.00 H new ATOM 0 HE22 GLN A 113 -7.173 13.580 1.254 1.00 0.00 H new ATOM 1356 N GLU A 114 -1.900 15.267 3.685 1.00 0.00 N ATOM 1357 CA GLU A 114 -2.191 16.360 4.597 1.00 0.00 C ATOM 1358 C GLU A 114 -0.916 17.149 4.904 1.00 0.00 C ATOM 1359 O GLU A 114 -0.972 18.203 5.535 1.00 0.00 O ATOM 1360 CB GLU A 114 -2.839 15.844 5.883 1.00 0.00 C ATOM 1361 CG GLU A 114 -4.223 15.254 5.601 1.00 0.00 C ATOM 1362 CD GLU A 114 -5.303 15.986 6.399 1.00 0.00 C ATOM 1363 OE1 GLU A 114 -5.159 17.219 6.552 1.00 0.00 O ATOM 1364 OE2 GLU A 114 -6.249 15.298 6.840 1.00 0.00 O ATOM 0 H GLU A 114 -1.618 14.397 4.138 1.00 0.00 H new ATOM 0 HA GLU A 114 -2.903 17.030 4.114 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -2.202 15.085 6.336 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -2.926 16.658 6.602 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -4.442 15.324 4.536 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -4.230 14.195 5.859 1.00 0.00 H new ATOM 1369 N ASN A 115 0.202 16.609 4.444 1.00 0.00 N ATOM 1370 CA ASN A 115 1.488 17.249 4.661 1.00 0.00 C ATOM 1371 C ASN A 115 1.767 18.224 3.517 1.00 0.00 C ATOM 1372 O ASN A 115 0.852 18.620 2.795 1.00 0.00 O ATOM 1373 CB ASN A 115 2.618 16.218 4.690 1.00 0.00 C ATOM 1374 CG ASN A 115 3.408 16.307 5.997 1.00 0.00 C ATOM 1375 OD1 ASN A 115 2.818 15.707 7.027 1.00 0.00 O flip ATOM 1376 ND2 ASN A 115 4.482 16.882 6.066 1.00 0.00 N flip ATOM 0 H ASN A 115 0.244 15.734 3.921 1.00 0.00 H new ATOM 0 HA ASN A 115 1.449 17.768 5.618 1.00 0.00 H new ATOM 0 HB2 ASN A 115 2.204 15.216 4.579 1.00 0.00 H new ATOM 0 HB3 ASN A 115 3.287 16.382 3.845 1.00 0.00 H new ATOM 0 HD21 ASN A 115 4.879 17.322 5.236 1.00 0.00 H new ATOM 0 HD22 ASN A 115 4.983 16.922 6.954 1.00 0.00 H new ATOM 1382 N ILE A 116 3.035 18.586 3.386 1.00 0.00 N ATOM 1383 CA ILE A 116 3.445 19.509 2.341 1.00 0.00 C ATOM 1384 C ILE A 116 4.318 18.767 1.326 1.00 0.00 C ATOM 1385 O ILE A 116 4.115 18.892 0.119 1.00 0.00 O ATOM 1386 CB ILE A 116 4.120 20.740 2.949 1.00 0.00 C ATOM 1387 CG1 ILE A 116 3.865 21.984 2.094 1.00 0.00 C ATOM 1388 CG2 ILE A 116 5.614 20.494 3.169 1.00 0.00 C ATOM 1389 CD1 ILE A 116 4.782 22.005 0.870 1.00 0.00 C ATOM 0 H ILE A 116 3.792 18.257 3.986 1.00 0.00 H new ATOM 0 HA ILE A 116 2.576 19.885 1.801 1.00 0.00 H new ATOM 0 HB ILE A 116 3.676 20.924 3.927 1.00 0.00 H new ATOM 0 HG12 ILE A 116 2.824 22.002 1.773 1.00 0.00 H new ATOM 0 HG13 ILE A 116 4.030 22.881 2.692 1.00 0.00 H new ATOM 0 HG21 ILE A 116 6.070 21.385 3.602 1.00 0.00 H new ATOM 0 HG22 ILE A 116 5.748 19.652 3.847 1.00 0.00 H new ATOM 0 HG23 ILE A 116 6.090 20.270 2.214 1.00 0.00 H new ATOM 0 HD11 ILE A 116 4.580 22.899 0.280 1.00 0.00 H new ATOM 0 HD12 ILE A 116 5.822 22.012 1.195 1.00 0.00 H new ATOM 0 HD13 ILE A 116 4.598 21.119 0.262 1.00 0.00 H new ATOM 1400 N ALA A 117 5.271 18.012 1.853 1.00 0.00 N ATOM 1401 CA ALA A 117 6.175 17.251 1.008 1.00 0.00 C ATOM 1402 C ALA A 117 5.533 15.906 0.663 1.00 0.00 C ATOM 1403 O ALA A 117 6.166 15.054 0.041 1.00 0.00 O ATOM 1404 CB ALA A 117 7.522 17.090 1.717 1.00 0.00 C ATOM 0 H ALA A 117 5.437 17.911 2.854 1.00 0.00 H new ATOM 0 HA ALA A 117 6.360 17.777 0.072 1.00 0.00 H new ATOM 0 HB1 ALA A 117 8.201 16.519 1.083 1.00 0.00 H new ATOM 0 HB2 ALA A 117 7.950 18.073 1.913 1.00 0.00 H new ATOM 0 HB3 ALA A 117 7.376 16.563 2.660 1.00 0.00 H new ATOM 1410 N GLY A 118 4.286 15.757 1.083 1.00 0.00 N ATOM 1411 CA GLY A 118 3.551 14.529 0.826 1.00 0.00 C ATOM 1412 C GLY A 118 4.180 13.349 1.568 1.00 0.00 C ATOM 1413 O GLY A 118 4.311 12.260 1.010 1.00 0.00 O ATOM 0 H GLY A 118 3.765 16.466 1.600 1.00 0.00 H new ATOM 0 HA2 GLY A 118 2.514 14.649 1.139 1.00 0.00 H new ATOM 0 HA3 GLY A 118 3.539 14.325 -0.245 1.00 0.00 H new ATOM 1417 N ILE A 119 4.554 13.604 2.813 1.00 0.00 N ATOM 1418 CA ILE A 119 5.166 12.576 3.637 1.00 0.00 C ATOM 1419 C ILE A 119 4.307 12.347 4.882 1.00 0.00 C ATOM 1420 O ILE A 119 3.842 13.301 5.503 1.00 0.00 O ATOM 1421 CB ILE A 119 6.620 12.936 3.950 1.00 0.00 C ATOM 1422 CG1 ILE A 119 7.570 12.335 2.912 1.00 0.00 C ATOM 1423 CG2 ILE A 119 6.992 12.521 5.376 1.00 0.00 C ATOM 1424 CD1 ILE A 119 7.512 13.117 1.598 1.00 0.00 C ATOM 0 H ILE A 119 4.445 14.509 3.271 1.00 0.00 H new ATOM 0 HA ILE A 119 5.205 11.629 3.098 1.00 0.00 H new ATOM 0 HB ILE A 119 6.724 14.019 3.892 1.00 0.00 H new ATOM 0 HG12 ILE A 119 8.589 12.342 3.299 1.00 0.00 H new ATOM 0 HG13 ILE A 119 7.305 11.293 2.731 1.00 0.00 H new ATOM 0 HG21 ILE A 119 8.030 12.788 5.573 1.00 0.00 H new ATOM 0 HG22 ILE A 119 6.344 13.035 6.085 1.00 0.00 H new ATOM 0 HG23 ILE A 119 6.867 11.444 5.486 1.00 0.00 H new ATOM 0 HD11 ILE A 119 8.196 12.669 0.878 1.00 0.00 H new ATOM 0 HD12 ILE A 119 6.497 13.087 1.201 1.00 0.00 H new ATOM 0 HD13 ILE A 119 7.801 14.152 1.778 1.00 0.00 H new ATOM 1435 N PRO A 120 4.119 11.042 5.218 1.00 0.00 N ATOM 1436 CA PRO A 120 3.323 10.675 6.378 1.00 0.00 C ATOM 1437 C PRO A 120 4.094 10.934 7.674 1.00 0.00 C ATOM 1438 O PRO A 120 5.317 10.802 7.711 1.00 0.00 O ATOM 1439 CB PRO A 120 2.981 9.209 6.173 1.00 0.00 C ATOM 1440 CG PRO A 120 3.978 8.687 5.150 1.00 0.00 C ATOM 1441 CD PRO A 120 4.655 9.887 4.506 1.00 0.00 C ATOM 0 HA PRO A 120 2.416 11.272 6.472 1.00 0.00 H new ATOM 0 HB2 PRO A 120 3.056 8.656 7.109 1.00 0.00 H new ATOM 0 HB3 PRO A 120 1.958 9.093 5.816 1.00 0.00 H new ATOM 0 HG2 PRO A 120 4.716 8.044 5.630 1.00 0.00 H new ATOM 0 HG3 PRO A 120 3.472 8.084 4.396 1.00 0.00 H new ATOM 0 HD2 PRO A 120 5.739 9.830 4.604 1.00 0.00 H new ATOM 0 HD3 PRO A 120 4.434 9.941 3.440 1.00 0.00 H new ATOM 1446 N SER A 121 3.346 11.298 8.706 1.00 0.00 N ATOM 1447 CA SER A 121 3.944 11.576 10.002 1.00 0.00 C ATOM 1448 C SER A 121 4.693 10.342 10.508 1.00 0.00 C ATOM 1449 O SER A 121 5.515 10.440 11.418 1.00 0.00 O ATOM 1450 CB SER A 121 2.884 12.008 11.016 1.00 0.00 C ATOM 1451 OG SER A 121 2.020 10.933 11.375 1.00 0.00 O ATOM 0 H SER A 121 2.332 11.407 8.671 1.00 0.00 H new ATOM 0 HA SER A 121 4.650 12.398 9.884 1.00 0.00 H new ATOM 0 HB2 SER A 121 3.373 12.394 11.910 1.00 0.00 H new ATOM 0 HB3 SER A 121 2.294 12.824 10.598 1.00 0.00 H new ATOM 0 HG SER A 121 1.358 11.248 12.025 1.00 0.00 H new ATOM 1456 N ALA A 122 4.381 9.209 9.898 1.00 0.00 N ATOM 1457 CA ALA A 122 5.013 7.956 10.276 1.00 0.00 C ATOM 1458 C ALA A 122 6.526 8.075 10.082 1.00 0.00 C ATOM 1459 O ALA A 122 7.299 7.446 10.803 1.00 0.00 O ATOM 1460 CB ALA A 122 4.408 6.812 9.461 1.00 0.00 C ATOM 0 H ALA A 122 3.698 9.132 9.144 1.00 0.00 H new ATOM 0 HA ALA A 122 4.832 7.736 11.328 1.00 0.00 H new ATOM 0 HB1 ALA A 122 4.882 5.873 9.745 1.00 0.00 H new ATOM 0 HB2 ALA A 122 3.338 6.752 9.657 1.00 0.00 H new ATOM 0 HB3 ALA A 122 4.572 6.995 8.399 1.00 0.00 H new ATOM 1466 N PHE A 123 6.903 8.885 9.103 1.00 0.00 N ATOM 1467 CA PHE A 123 8.309 9.094 8.804 1.00 0.00 C ATOM 1468 C PHE A 123 8.820 10.386 9.445 1.00 0.00 C ATOM 1469 O PHE A 123 9.932 10.426 9.967 1.00 0.00 O ATOM 1470 CB PHE A 123 8.430 9.209 7.283 1.00 0.00 C ATOM 1471 CG PHE A 123 7.792 8.050 6.518 1.00 0.00 C ATOM 1472 CD1 PHE A 123 7.575 6.860 7.141 1.00 0.00 C ATOM 1473 CD2 PHE A 123 7.439 8.208 5.213 1.00 0.00 C ATOM 1474 CE1 PHE A 123 6.982 5.783 6.430 1.00 0.00 C ATOM 1475 CE2 PHE A 123 6.846 7.131 4.503 1.00 0.00 C ATOM 1476 CZ PHE A 123 6.630 5.942 5.126 1.00 0.00 C ATOM 0 H PHE A 123 6.259 9.404 8.507 1.00 0.00 H new ATOM 0 HA PHE A 123 8.900 8.267 9.198 1.00 0.00 H new ATOM 0 HB2 PHE A 123 7.966 10.142 6.962 1.00 0.00 H new ATOM 0 HB3 PHE A 123 9.485 9.269 7.017 1.00 0.00 H new ATOM 0 HD1 PHE A 123 7.854 6.734 8.177 1.00 0.00 H new ATOM 0 HD2 PHE A 123 7.610 9.152 4.718 1.00 0.00 H new ATOM 0 HE1 PHE A 123 6.811 4.838 6.925 1.00 0.00 H new ATOM 0 HE2 PHE A 123 6.566 7.256 3.467 1.00 0.00 H new ATOM 0 HZ PHE A 123 6.179 5.123 4.585 1.00 0.00 H new ATOM 1485 N LEU A 124 7.981 11.410 9.384 1.00 0.00 N ATOM 1486 CA LEU A 124 8.335 12.700 9.952 1.00 0.00 C ATOM 1487 C LEU A 124 8.890 12.497 11.364 1.00 0.00 C ATOM 1488 O LEU A 124 10.067 12.750 11.613 1.00 0.00 O ATOM 1489 CB LEU A 124 7.141 13.655 9.893 1.00 0.00 C ATOM 1490 CG LEU A 124 6.558 13.916 8.503 1.00 0.00 C ATOM 1491 CD1 LEU A 124 5.317 14.808 8.587 1.00 0.00 C ATOM 1492 CD2 LEU A 124 7.618 14.495 7.564 1.00 0.00 C ATOM 0 H LEU A 124 7.058 11.373 8.951 1.00 0.00 H new ATOM 0 HA LEU A 124 9.123 13.172 9.365 1.00 0.00 H new ATOM 0 HB2 LEU A 124 6.350 13.255 10.528 1.00 0.00 H new ATOM 0 HB3 LEU A 124 7.443 14.610 10.323 1.00 0.00 H new ATOM 0 HG LEU A 124 6.241 12.962 8.081 1.00 0.00 H new ATOM 0 HD11 LEU A 124 4.923 14.978 7.585 1.00 0.00 H new ATOM 0 HD12 LEU A 124 4.558 14.319 9.198 1.00 0.00 H new ATOM 0 HD13 LEU A 124 5.585 15.763 9.038 1.00 0.00 H new ATOM 0 HD21 LEU A 124 7.178 14.671 6.583 1.00 0.00 H new ATOM 0 HD22 LEU A 124 7.988 15.436 7.970 1.00 0.00 H new ATOM 0 HD23 LEU A 124 8.444 13.790 7.470 1.00 0.00 H new ATOM 1503 N GLU A 125 8.016 12.042 12.249 1.00 0.00 N ATOM 1504 CA GLU A 125 8.405 11.801 13.628 1.00 0.00 C ATOM 1505 C GLU A 125 9.645 10.906 13.683 1.00 0.00 C ATOM 1506 O GLU A 125 10.727 11.361 14.049 1.00 0.00 O ATOM 1507 CB GLU A 125 7.251 11.188 14.424 1.00 0.00 C ATOM 1508 CG GLU A 125 7.695 10.825 15.843 1.00 0.00 C ATOM 1509 CD GLU A 125 7.913 12.081 16.688 1.00 0.00 C ATOM 1510 OE1 GLU A 125 9.013 12.664 16.564 1.00 0.00 O ATOM 1511 OE2 GLU A 125 6.976 12.431 17.438 1.00 0.00 O ATOM 0 H GLU A 125 7.040 11.834 12.038 1.00 0.00 H new ATOM 0 HA GLU A 125 8.652 12.758 14.087 1.00 0.00 H new ATOM 0 HB2 GLU A 125 6.420 11.892 14.468 1.00 0.00 H new ATOM 0 HB3 GLU A 125 6.886 10.296 13.914 1.00 0.00 H new ATOM 0 HG2 GLU A 125 6.942 10.193 16.313 1.00 0.00 H new ATOM 0 HG3 GLU A 125 8.617 10.245 15.802 1.00 0.00 H new ATOM 1516 N LEU A 126 9.445 9.650 13.311 1.00 0.00 N ATOM 1517 CA LEU A 126 10.533 8.688 13.314 1.00 0.00 C ATOM 1518 C LEU A 126 11.610 9.140 12.327 1.00 0.00 C ATOM 1519 O LEU A 126 11.528 10.235 11.773 1.00 0.00 O ATOM 1520 CB LEU A 126 10.002 7.278 13.040 1.00 0.00 C ATOM 1521 CG LEU A 126 9.411 6.540 14.243 1.00 0.00 C ATOM 1522 CD1 LEU A 126 8.230 5.662 13.822 1.00 0.00 C ATOM 1523 CD2 LEU A 126 10.488 5.737 14.977 1.00 0.00 C ATOM 0 H LEU A 126 8.546 9.277 13.006 1.00 0.00 H new ATOM 0 HA LEU A 126 10.999 8.644 14.298 1.00 0.00 H new ATOM 0 HB2 LEU A 126 9.237 7.343 12.267 1.00 0.00 H new ATOM 0 HB3 LEU A 126 10.816 6.677 12.634 1.00 0.00 H new ATOM 0 HG LEU A 126 9.028 7.282 14.944 1.00 0.00 H new ATOM 0 HD11 LEU A 126 7.829 5.149 14.696 1.00 0.00 H new ATOM 0 HD12 LEU A 126 7.453 6.285 13.378 1.00 0.00 H new ATOM 0 HD13 LEU A 126 8.566 4.926 13.091 1.00 0.00 H new ATOM 0 HD21 LEU A 126 10.042 5.222 15.828 1.00 0.00 H new ATOM 0 HD22 LEU A 126 10.923 5.004 14.297 1.00 0.00 H new ATOM 0 HD23 LEU A 126 11.268 6.412 15.330 1.00 0.00 H new ATOM 1534 N LYS A 127 12.595 8.275 12.136 1.00 0.00 N ATOM 1535 CA LYS A 127 13.688 8.572 11.225 1.00 0.00 C ATOM 1536 C LYS A 127 13.483 7.799 9.922 1.00 0.00 C ATOM 1537 O LYS A 127 13.294 6.584 9.940 1.00 0.00 O ATOM 1538 CB LYS A 127 15.035 8.300 11.898 1.00 0.00 C ATOM 1539 CG LYS A 127 15.709 9.607 12.323 1.00 0.00 C ATOM 1540 CD LYS A 127 15.819 9.695 13.847 1.00 0.00 C ATOM 1541 CE LYS A 127 17.165 10.289 14.265 1.00 0.00 C ATOM 1542 NZ LYS A 127 17.623 9.692 15.539 1.00 0.00 N ATOM 0 H LYS A 127 12.659 7.367 12.597 1.00 0.00 H new ATOM 0 HA LYS A 127 13.695 9.632 10.969 1.00 0.00 H new ATOM 0 HB2 LYS A 127 14.888 7.662 12.770 1.00 0.00 H new ATOM 0 HB3 LYS A 127 15.685 7.757 11.212 1.00 0.00 H new ATOM 0 HG2 LYS A 127 16.702 9.670 11.879 1.00 0.00 H new ATOM 0 HG3 LYS A 127 15.137 10.455 11.946 1.00 0.00 H new ATOM 0 HD2 LYS A 127 15.009 10.310 14.239 1.00 0.00 H new ATOM 0 HD3 LYS A 127 15.705 8.702 14.282 1.00 0.00 H new ATOM 0 HE2 LYS A 127 17.906 10.110 13.486 1.00 0.00 H new ATOM 0 HE3 LYS A 127 17.074 11.370 14.375 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 18.538 10.107 15.808 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 16.923 9.885 16.284 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 17.730 8.664 15.422 1.00 0.00 H new ATOM 1552 N LYS A 128 13.530 8.534 8.820 1.00 0.00 N ATOM 1553 CA LYS A 128 13.352 7.932 7.510 1.00 0.00 C ATOM 1554 C LYS A 128 14.446 6.886 7.282 1.00 0.00 C ATOM 1555 O LYS A 128 15.623 7.228 7.172 1.00 0.00 O ATOM 1556 CB LYS A 128 13.298 9.012 6.428 1.00 0.00 C ATOM 1557 CG LYS A 128 12.654 8.474 5.148 1.00 0.00 C ATOM 1558 CD LYS A 128 13.712 8.196 4.078 1.00 0.00 C ATOM 1559 CE LYS A 128 13.236 8.667 2.702 1.00 0.00 C ATOM 1560 NZ LYS A 128 13.175 10.145 2.652 1.00 0.00 N ATOM 0 H LYS A 128 13.689 9.541 8.808 1.00 0.00 H new ATOM 0 HA LYS A 128 12.396 7.411 7.456 1.00 0.00 H new ATOM 0 HB2 LYS A 128 12.731 9.869 6.792 1.00 0.00 H new ATOM 0 HB3 LYS A 128 14.306 9.366 6.211 1.00 0.00 H new ATOM 0 HG2 LYS A 128 12.106 7.558 5.369 1.00 0.00 H new ATOM 0 HG3 LYS A 128 11.930 9.195 4.770 1.00 0.00 H new ATOM 0 HD2 LYS A 128 14.641 8.703 4.339 1.00 0.00 H new ATOM 0 HD3 LYS A 128 13.930 7.129 4.046 1.00 0.00 H new ATOM 0 HE2 LYS A 128 13.913 8.299 1.931 1.00 0.00 H new ATOM 0 HE3 LYS A 128 12.252 8.249 2.488 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 13.238 10.462 1.663 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 12.276 10.469 3.063 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 13.968 10.544 3.194 1.00 0.00 H new ATOM 1570 N GLU A 129 14.019 5.635 7.218 1.00 0.00 N ATOM 1571 CA GLU A 129 14.946 4.537 7.004 1.00 0.00 C ATOM 1572 C GLU A 129 15.536 4.608 5.594 1.00 0.00 C ATOM 1573 O GLU A 129 14.809 4.802 4.621 1.00 0.00 O ATOM 1574 CB GLU A 129 14.266 3.188 7.247 1.00 0.00 C ATOM 1575 CG GLU A 129 15.297 2.060 7.325 1.00 0.00 C ATOM 1576 CD GLU A 129 15.050 1.017 6.232 1.00 0.00 C ATOM 1577 OE1 GLU A 129 14.897 1.442 5.066 1.00 0.00 O ATOM 1578 OE2 GLU A 129 15.022 -0.180 6.587 1.00 0.00 O ATOM 0 H GLU A 129 13.042 5.356 7.311 1.00 0.00 H new ATOM 0 HA GLU A 129 15.760 4.630 7.723 1.00 0.00 H new ATOM 0 HB2 GLU A 129 13.694 3.227 8.174 1.00 0.00 H new ATOM 0 HB3 GLU A 129 13.558 2.984 6.444 1.00 0.00 H new ATOM 0 HG2 GLU A 129 16.301 2.472 7.220 1.00 0.00 H new ATOM 0 HG3 GLU A 129 15.248 1.585 8.305 1.00 0.00 H new ATOM 1583 N GLU A 130 16.850 4.445 5.528 1.00 0.00 N ATOM 1584 CA GLU A 130 17.546 4.488 4.253 1.00 0.00 C ATOM 1585 C GLU A 130 17.369 5.859 3.598 1.00 0.00 C ATOM 1586 O GLU A 130 16.343 6.512 3.783 1.00 0.00 O ATOM 1587 CB GLU A 130 17.063 3.370 3.327 1.00 0.00 C ATOM 1588 CG GLU A 130 17.885 3.332 2.037 1.00 0.00 C ATOM 1589 CD GLU A 130 19.329 2.910 2.321 1.00 0.00 C ATOM 1590 OE1 GLU A 130 20.088 3.776 2.808 1.00 0.00 O ATOM 1591 OE2 GLU A 130 19.640 1.733 2.044 1.00 0.00 O ATOM 0 H GLU A 130 17.450 4.283 6.337 1.00 0.00 H new ATOM 0 HA GLU A 130 18.609 4.329 4.435 1.00 0.00 H new ATOM 0 HB2 GLU A 130 17.139 2.411 3.839 1.00 0.00 H new ATOM 0 HB3 GLU A 130 16.010 3.521 3.087 1.00 0.00 H new ATOM 0 HG2 GLU A 130 17.431 2.636 1.332 1.00 0.00 H new ATOM 0 HG3 GLU A 130 17.875 4.315 1.566 1.00 0.00 H new ATOM 1596 N ILE A 131 18.384 6.254 2.843 1.00 0.00 N ATOM 1597 CA ILE A 131 18.353 7.536 2.159 1.00 0.00 C ATOM 1598 C ILE A 131 17.646 7.373 0.812 1.00 0.00 C ATOM 1599 O ILE A 131 17.811 6.356 0.140 1.00 0.00 O ATOM 1600 CB ILE A 131 19.764 8.117 2.047 1.00 0.00 C ATOM 1601 CG1 ILE A 131 20.366 8.366 3.431 1.00 0.00 C ATOM 1602 CG2 ILE A 131 19.770 9.380 1.183 1.00 0.00 C ATOM 1603 CD1 ILE A 131 21.056 7.108 3.963 1.00 0.00 C ATOM 0 H ILE A 131 19.233 5.709 2.690 1.00 0.00 H new ATOM 0 HA ILE A 131 17.779 8.262 2.735 1.00 0.00 H new ATOM 0 HB ILE A 131 20.397 7.383 1.548 1.00 0.00 H new ATOM 0 HG12 ILE A 131 21.084 9.184 3.377 1.00 0.00 H new ATOM 0 HG13 ILE A 131 19.582 8.675 4.122 1.00 0.00 H new ATOM 0 HG21 ILE A 131 20.785 9.773 1.120 1.00 0.00 H new ATOM 0 HG22 ILE A 131 19.411 9.138 0.182 1.00 0.00 H new ATOM 0 HG23 ILE A 131 19.118 10.130 1.631 1.00 0.00 H new ATOM 0 HD11 ILE A 131 21.475 7.312 4.948 1.00 0.00 H new ATOM 0 HD12 ILE A 131 20.330 6.299 4.038 1.00 0.00 H new ATOM 0 HD13 ILE A 131 21.855 6.816 3.282 1.00 0.00 H new ATOM 1614 N LYS A 132 16.873 8.389 0.458 1.00 0.00 N ATOM 1615 CA LYS A 132 16.141 8.371 -0.797 1.00 0.00 C ATOM 1616 C LYS A 132 17.081 7.941 -1.925 1.00 0.00 C ATOM 1617 O LYS A 132 18.184 8.471 -2.054 1.00 0.00 O ATOM 1618 CB LYS A 132 15.463 9.722 -1.041 1.00 0.00 C ATOM 1619 CG LYS A 132 16.499 10.809 -1.338 1.00 0.00 C ATOM 1620 CD LYS A 132 16.412 11.265 -2.796 1.00 0.00 C ATOM 1621 CE LYS A 132 17.569 12.200 -3.148 1.00 0.00 C ATOM 1622 NZ LYS A 132 18.012 11.975 -4.542 1.00 0.00 N ATOM 0 H LYS A 132 16.738 9.230 1.019 1.00 0.00 H new ATOM 0 HA LYS A 132 15.335 7.638 -0.758 1.00 0.00 H new ATOM 0 HB2 LYS A 132 14.768 9.639 -1.877 1.00 0.00 H new ATOM 0 HB3 LYS A 132 14.877 10.002 -0.166 1.00 0.00 H new ATOM 0 HG2 LYS A 132 16.338 11.660 -0.677 1.00 0.00 H new ATOM 0 HG3 LYS A 132 17.500 10.429 -1.131 1.00 0.00 H new ATOM 0 HD2 LYS A 132 16.429 10.396 -3.454 1.00 0.00 H new ATOM 0 HD3 LYS A 132 15.464 11.775 -2.965 1.00 0.00 H new ATOM 0 HE2 LYS A 132 17.257 13.237 -3.022 1.00 0.00 H new ATOM 0 HE3 LYS A 132 18.401 12.032 -2.464 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 18.798 12.618 -4.764 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 18.329 10.990 -4.651 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 17.221 12.158 -5.192 1.00 0.00 H new ATOM 1632 N GLN A 133 16.609 6.987 -2.714 1.00 0.00 N ATOM 1633 CA GLN A 133 17.395 6.481 -3.827 1.00 0.00 C ATOM 1634 C GLN A 133 16.516 6.331 -5.070 1.00 0.00 C ATOM 1635 O GLN A 133 15.290 6.382 -4.979 1.00 0.00 O ATOM 1636 CB GLN A 133 18.065 5.154 -3.465 1.00 0.00 C ATOM 1637 CG GLN A 133 17.024 4.051 -3.260 1.00 0.00 C ATOM 1638 CD GLN A 133 17.698 2.695 -3.039 1.00 0.00 C ATOM 1639 OE1 GLN A 133 18.392 2.469 -2.062 1.00 0.00 O ATOM 1640 NE2 GLN A 133 17.457 1.808 -4.001 1.00 0.00 N ATOM 0 H GLN A 133 15.693 6.551 -2.605 1.00 0.00 H new ATOM 0 HA GLN A 133 18.184 7.200 -4.048 1.00 0.00 H new ATOM 0 HB2 GLN A 133 18.756 4.864 -4.256 1.00 0.00 H new ATOM 0 HB3 GLN A 133 18.654 5.276 -2.556 1.00 0.00 H new ATOM 0 HG2 GLN A 133 16.396 4.293 -2.402 1.00 0.00 H new ATOM 0 HG3 GLN A 133 16.369 3.998 -4.130 1.00 0.00 H new ATOM 0 HE21 GLN A 133 16.866 2.062 -4.793 1.00 0.00 H new ATOM 0 HE22 GLN A 133 17.863 0.874 -3.947 1.00 0.00 H new ATOM 1647 N ARG A 134 17.176 6.147 -6.204 1.00 0.00 N ATOM 1648 CA ARG A 134 16.471 5.989 -7.464 1.00 0.00 C ATOM 1649 C ARG A 134 17.370 5.298 -8.492 1.00 0.00 C ATOM 1650 O ARG A 134 18.541 5.039 -8.223 1.00 0.00 O ATOM 1651 CB ARG A 134 16.021 7.342 -8.017 1.00 0.00 C ATOM 1652 CG ARG A 134 14.501 7.390 -8.181 1.00 0.00 C ATOM 1653 CD ARG A 134 14.068 6.713 -9.483 1.00 0.00 C ATOM 1654 NE ARG A 134 13.204 7.626 -10.265 1.00 0.00 N ATOM 1655 CZ ARG A 134 12.506 7.256 -11.347 1.00 0.00 C ATOM 1656 NH1 ARG A 134 12.564 5.990 -11.781 1.00 0.00 N ATOM 1657 NH2 ARG A 134 11.748 8.152 -11.994 1.00 0.00 N ATOM 0 H ARG A 134 18.193 6.104 -6.276 1.00 0.00 H new ATOM 0 HA ARG A 134 15.590 5.376 -7.276 1.00 0.00 H new ATOM 0 HB2 ARG A 134 16.343 8.138 -7.346 1.00 0.00 H new ATOM 0 HB3 ARG A 134 16.500 7.523 -8.979 1.00 0.00 H new ATOM 0 HG2 ARG A 134 14.025 6.896 -7.334 1.00 0.00 H new ATOM 0 HG3 ARG A 134 14.164 8.427 -8.176 1.00 0.00 H new ATOM 0 HD2 ARG A 134 14.945 6.438 -10.069 1.00 0.00 H new ATOM 0 HD3 ARG A 134 13.531 5.791 -9.262 1.00 0.00 H new ATOM 0 HE ARG A 134 13.136 8.597 -9.961 1.00 0.00 H new ATOM 0 HH11 ARG A 134 13.140 5.308 -11.288 1.00 0.00 H new ATOM 0 HH12 ARG A 134 12.033 5.708 -12.605 1.00 0.00 H new ATOM 0 HH21 ARG A 134 11.703 9.116 -11.663 1.00 0.00 H new ATOM 0 HH22 ARG A 134 11.217 7.870 -12.818 1.00 0.00 H new TER 1668 ARG A 134